USER MOD reduce.3.24.130724 H: found=0, std=0, add=1242, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1246 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 THR OG1 : rot 71:sc= 0.0564 USER MOD Set 1.2: B 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 82 THR OG1 : rot 72:sc= 0.0579 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.8!) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 19 SER OG : rot -114:sc= 1.63 USER MOD Single : A 25 LYS NZ :NH3+ 149:sc= -0.919 (180deg=-1.69) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= 0.439! (180deg=0.279!) USER MOD Single : A 29 SER OG : rot -81:sc= 0.454 USER MOD Single : A 30 LYS NZ :NH3+ -155:sc= 0.415! (180deg=-0.395) USER MOD Single : A 31 LYS NZ :NH3+ -152:sc= -0.212 (180deg=-0.949) USER MOD Single : A 34 LYS NZ :NH3+ -177:sc= -2.52 (180deg=-2.72) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 39 THR OG1 : rot 125:sc= 1.24 USER MOD Single : A 42 SER OG : rot 79:sc= 0.204 USER MOD Single : A 43 SER OG : rot 180:sc= -0.0172 USER MOD Single : A 48 GLN : amide:sc= -2.55 K(o=-2.6,f=-5.8!) USER MOD Single : A 49 LYS NZ :NH3+ -124:sc= -1.13 (180deg=-2.06) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 MET CE :methyl -175:sc= -0.252 (180deg=-0.384) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -6.21! K(o=-6.2!,f=-2) USER MOD Single : A 72 GLN : amide:sc= -2.18 K(o=-2.2,f=-5.8!) USER MOD Single : A 85 CYS SG : rot 180:sc= -2.05! USER MOD Single : A 86 ASN : amide:sc= -1.85! C(o=-1.9!,f=-7!) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 ASN : amide:sc= -1.14 K(o=-1.1,f=-2.8!) USER MOD Single : B 16 HIS : no HD1:sc= 0 X(o=0,f=-0.0028) USER MOD Single : B 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 19 SER OG : rot -110:sc= 1.71 USER MOD Single : B 25 LYS NZ :NH3+ 149:sc= -1.57 (180deg=-2.26!) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ -179:sc= 0.718! (180deg=0.545!) USER MOD Single : B 29 SER OG : rot -75:sc= 0.446 USER MOD Single : B 30 LYS NZ :NH3+ -156:sc= 0.51 (180deg=-0.268) USER MOD Single : B 31 LYS NZ :NH3+ -150:sc= -0.2 (180deg=-0.989) USER MOD Single : B 34 LYS NZ :NH3+ -176:sc= -2.45 (180deg=-2.57) USER MOD Single : B 38 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : B 39 THR OG1 : rot 124:sc= 1.26 USER MOD Single : B 42 SER OG : rot 77:sc= 0.203 USER MOD Single : B 43 SER OG : rot 180:sc= -0.0119 USER MOD Single : B 48 GLN : amide:sc= -2.55 K(o=-2.5,f=-5.5!) USER MOD Single : B 49 LYS NZ :NH3+ -117:sc= -1.29 (180deg=-2.29) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 MET CE :methyl -176:sc= -0.228 (180deg=-0.322) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 ASN : amide:sc= -6.13! K(o=-6.1!,f=-2) USER MOD Single : B 72 GLN : amide:sc= -2.03 K(o=-2,f=-5.8!) USER MOD Single : B 85 CYS SG : rot 180:sc= -2.08! USER MOD Single : B 86 ASN : amide:sc= -2.05! C(o=-2!,f=-7.4!) USER MOD ----------------------------------------------------------------- ATOM 21 N GLU A 3 59.116 0.458 -8.133 1.00 0.00 N ATOM 22 CA GLU A 3 59.120 -0.619 -7.104 1.00 0.00 C ATOM 23 C GLU A 3 60.278 -0.406 -6.127 1.00 0.00 C ATOM 24 O GLU A 3 60.121 -0.538 -4.928 1.00 0.00 O ATOM 25 CB GLU A 3 59.292 -1.976 -7.796 1.00 0.00 C ATOM 26 CG GLU A 3 58.034 -2.301 -8.602 1.00 0.00 C ATOM 27 CD GLU A 3 58.208 -3.657 -9.292 1.00 0.00 C ATOM 28 OE1 GLU A 3 58.734 -3.676 -10.393 1.00 0.00 O ATOM 29 OE2 GLU A 3 57.813 -4.652 -8.706 1.00 0.00 O ATOM 0 HA GLU A 3 58.178 -0.594 -6.556 1.00 0.00 H new ATOM 0 HB2 GLU A 3 60.162 -1.954 -8.453 1.00 0.00 H new ATOM 0 HB3 GLU A 3 59.473 -2.754 -7.054 1.00 0.00 H new ATOM 0 HG2 GLU A 3 57.164 -2.324 -7.946 1.00 0.00 H new ATOM 0 HG3 GLU A 3 57.853 -1.523 -9.344 1.00 0.00 H new ATOM 36 N LEU A 4 61.444 -0.088 -6.622 1.00 0.00 N ATOM 37 CA LEU A 4 62.598 0.113 -5.703 1.00 0.00 C ATOM 38 C LEU A 4 62.386 1.396 -4.893 1.00 0.00 C ATOM 39 O LEU A 4 62.688 1.451 -3.723 1.00 0.00 O ATOM 40 CB LEU A 4 63.908 0.212 -6.521 1.00 0.00 C ATOM 41 CG LEU A 4 65.123 -0.333 -5.732 1.00 0.00 C ATOM 42 CD1 LEU A 4 65.151 0.238 -4.311 1.00 0.00 C ATOM 43 CD2 LEU A 4 65.085 -1.869 -5.677 1.00 0.00 C ATOM 0 H LEU A 4 61.645 0.040 -7.614 1.00 0.00 H new ATOM 0 HA LEU A 4 62.672 -0.734 -5.021 1.00 0.00 H new ATOM 0 HB2 LEU A 4 63.799 -0.346 -7.451 1.00 0.00 H new ATOM 0 HB3 LEU A 4 64.089 1.252 -6.793 1.00 0.00 H new ATOM 0 HG LEU A 4 66.029 -0.019 -6.251 1.00 0.00 H new ATOM 0 HD11 LEU A 4 66.014 -0.159 -3.776 1.00 0.00 H new ATOM 0 HD12 LEU A 4 65.222 1.325 -4.357 1.00 0.00 H new ATOM 0 HD13 LEU A 4 64.238 -0.044 -3.787 1.00 0.00 H new ATOM 0 HD21 LEU A 4 65.947 -2.235 -5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 4 64.169 -2.193 -5.183 1.00 0.00 H new ATOM 0 HD23 LEU A 4 65.113 -2.270 -6.690 1.00 0.00 H new ATOM 55 N GLU A 5 61.883 2.429 -5.513 1.00 0.00 N ATOM 56 CA GLU A 5 61.666 3.712 -4.782 1.00 0.00 C ATOM 57 C GLU A 5 60.702 3.498 -3.609 1.00 0.00 C ATOM 58 O GLU A 5 60.884 4.049 -2.543 1.00 0.00 O ATOM 59 CB GLU A 5 61.083 4.753 -5.747 1.00 0.00 C ATOM 60 CG GLU A 5 60.877 6.093 -5.031 1.00 0.00 C ATOM 61 CD GLU A 5 62.225 6.632 -4.548 1.00 0.00 C ATOM 62 OE1 GLU A 5 62.894 7.288 -5.329 1.00 0.00 O ATOM 63 OE2 GLU A 5 62.567 6.378 -3.404 1.00 0.00 O ATOM 0 H GLU A 5 61.612 2.440 -6.496 1.00 0.00 H new ATOM 0 HA GLU A 5 62.620 4.066 -4.391 1.00 0.00 H new ATOM 0 HB2 GLU A 5 61.754 4.887 -6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 5 60.133 4.397 -6.145 1.00 0.00 H new ATOM 0 HG2 GLU A 5 60.409 6.809 -5.707 1.00 0.00 H new ATOM 0 HG3 GLU A 5 60.202 5.964 -4.185 1.00 0.00 H new ATOM 70 N THR A 6 59.675 2.715 -3.794 1.00 0.00 N ATOM 71 CA THR A 6 58.706 2.492 -2.680 1.00 0.00 C ATOM 72 C THR A 6 59.430 1.876 -1.483 1.00 0.00 C ATOM 73 O THR A 6 59.186 2.225 -0.344 1.00 0.00 O ATOM 74 CB THR A 6 57.600 1.546 -3.152 1.00 0.00 C ATOM 75 OG1 THR A 6 56.926 2.126 -4.260 1.00 0.00 O ATOM 76 CG2 THR A 6 56.608 1.309 -2.013 1.00 0.00 C ATOM 0 H THR A 6 59.464 2.222 -4.662 1.00 0.00 H new ATOM 0 HA THR A 6 58.269 3.445 -2.383 1.00 0.00 H new ATOM 0 HB THR A 6 58.038 0.594 -3.451 1.00 0.00 H new ATOM 0 HG1 THR A 6 56.218 1.521 -4.565 1.00 0.00 H new ATOM 0 HG21 THR A 6 55.821 0.635 -2.351 1.00 0.00 H new ATOM 0 HG22 THR A 6 57.128 0.864 -1.165 1.00 0.00 H new ATOM 0 HG23 THR A 6 56.167 2.259 -1.711 1.00 0.00 H new ATOM 84 N ALA A 7 60.322 0.965 -1.734 1.00 0.00 N ATOM 85 CA ALA A 7 61.073 0.322 -0.622 1.00 0.00 C ATOM 86 C ALA A 7 62.010 1.348 0.027 1.00 0.00 C ATOM 87 O ALA A 7 62.222 1.343 1.224 1.00 0.00 O ATOM 88 CB ALA A 7 61.890 -0.843 -1.177 1.00 0.00 C ATOM 0 H ALA A 7 60.566 0.635 -2.668 1.00 0.00 H new ATOM 0 HA ALA A 7 60.374 -0.047 0.128 1.00 0.00 H new ATOM 0 HB1 ALA A 7 62.443 -1.318 -0.367 1.00 0.00 H new ATOM 0 HB2 ALA A 7 61.221 -1.571 -1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 7 62.590 -0.472 -1.925 1.00 0.00 H new ATOM 94 N MET A 8 62.581 2.218 -0.760 1.00 0.00 N ATOM 95 CA MET A 8 63.517 3.238 -0.209 1.00 0.00 C ATOM 96 C MET A 8 62.783 4.105 0.816 1.00 0.00 C ATOM 97 O MET A 8 63.321 4.453 1.848 1.00 0.00 O ATOM 98 CB MET A 8 64.035 4.119 -1.349 1.00 0.00 C ATOM 99 CG MET A 8 65.246 4.923 -0.869 1.00 0.00 C ATOM 100 SD MET A 8 66.702 3.846 -0.832 1.00 0.00 S ATOM 101 CE MET A 8 67.957 5.148 -0.747 1.00 0.00 C ATOM 0 H MET A 8 62.438 2.266 -1.769 1.00 0.00 H new ATOM 0 HA MET A 8 64.356 2.739 0.276 1.00 0.00 H new ATOM 0 HB2 MET A 8 64.312 3.500 -2.203 1.00 0.00 H new ATOM 0 HB3 MET A 8 63.248 4.794 -1.686 1.00 0.00 H new ATOM 0 HG2 MET A 8 65.422 5.769 -1.533 1.00 0.00 H new ATOM 0 HG3 MET A 8 65.056 5.331 0.124 1.00 0.00 H new ATOM 0 HE1 MET A 8 68.948 4.696 -0.715 1.00 0.00 H new ATOM 0 HE2 MET A 8 67.878 5.788 -1.626 1.00 0.00 H new ATOM 0 HE3 MET A 8 67.801 5.745 0.151 1.00 0.00 H new ATOM 111 N GLU A 9 61.557 4.454 0.541 1.00 0.00 N ATOM 112 CA GLU A 9 60.785 5.293 1.499 1.00 0.00 C ATOM 113 C GLU A 9 60.678 4.549 2.832 1.00 0.00 C ATOM 114 O GLU A 9 60.773 5.132 3.894 1.00 0.00 O ATOM 115 CB GLU A 9 59.384 5.569 0.934 1.00 0.00 C ATOM 116 CG GLU A 9 58.766 6.780 1.642 1.00 0.00 C ATOM 117 CD GLU A 9 58.529 6.449 3.117 1.00 0.00 C ATOM 118 OE1 GLU A 9 58.244 5.299 3.409 1.00 0.00 O ATOM 119 OE2 GLU A 9 58.626 7.355 3.930 1.00 0.00 O ATOM 0 H GLU A 9 61.055 4.194 -0.308 1.00 0.00 H new ATOM 0 HA GLU A 9 61.293 6.245 1.652 1.00 0.00 H new ATOM 0 HB2 GLU A 9 59.445 5.755 -0.138 1.00 0.00 H new ATOM 0 HB3 GLU A 9 58.749 4.694 1.070 1.00 0.00 H new ATOM 0 HG2 GLU A 9 59.428 7.642 1.554 1.00 0.00 H new ATOM 0 HG3 GLU A 9 57.825 7.051 1.164 1.00 0.00 H new ATOM 126 N THR A 10 60.469 3.264 2.776 1.00 0.00 N ATOM 127 CA THR A 10 60.343 2.466 4.028 1.00 0.00 C ATOM 128 C THR A 10 61.632 2.590 4.850 1.00 0.00 C ATOM 129 O THR A 10 61.596 2.676 6.061 1.00 0.00 O ATOM 130 CB THR A 10 60.105 0.994 3.678 1.00 0.00 C ATOM 131 OG1 THR A 10 58.909 0.874 2.920 1.00 0.00 O ATOM 132 CG2 THR A 10 59.971 0.181 4.967 1.00 0.00 C ATOM 0 H THR A 10 60.379 2.729 1.912 1.00 0.00 H new ATOM 0 HA THR A 10 59.502 2.843 4.610 1.00 0.00 H new ATOM 0 HB THR A 10 60.946 0.619 3.094 1.00 0.00 H new ATOM 0 HG1 THR A 10 58.758 -0.068 2.695 1.00 0.00 H new ATOM 0 HG21 THR A 10 59.802 -0.867 4.720 1.00 0.00 H new ATOM 0 HG22 THR A 10 60.886 0.273 5.552 1.00 0.00 H new ATOM 0 HG23 THR A 10 59.130 0.557 5.549 1.00 0.00 H new ATOM 140 N LEU A 11 62.770 2.581 4.210 1.00 0.00 N ATOM 141 CA LEU A 11 64.050 2.680 4.970 1.00 0.00 C ATOM 142 C LEU A 11 64.085 3.987 5.762 1.00 0.00 C ATOM 143 O LEU A 11 64.535 4.018 6.890 1.00 0.00 O ATOM 144 CB LEU A 11 65.235 2.634 3.997 1.00 0.00 C ATOM 145 CG LEU A 11 65.238 1.304 3.232 1.00 0.00 C ATOM 146 CD1 LEU A 11 66.352 1.327 2.179 1.00 0.00 C ATOM 147 CD2 LEU A 11 65.473 0.133 4.203 1.00 0.00 C ATOM 0 H LEU A 11 62.869 2.510 3.197 1.00 0.00 H new ATOM 0 HA LEU A 11 64.119 1.841 5.662 1.00 0.00 H new ATOM 0 HB2 LEU A 11 65.172 3.466 3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 11 66.170 2.749 4.545 1.00 0.00 H new ATOM 0 HG LEU A 11 64.272 1.171 2.745 1.00 0.00 H new ATOM 0 HD11 LEU A 11 66.357 0.383 1.634 1.00 0.00 H new ATOM 0 HD12 LEU A 11 66.178 2.147 1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 11 67.315 1.467 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 11 65.473 -0.805 3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 11 66.434 0.260 4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 11 64.678 0.114 4.949 1.00 0.00 H new ATOM 159 N ILE A 12 63.621 5.067 5.203 1.00 0.00 N ATOM 160 CA ILE A 12 63.646 6.347 5.964 1.00 0.00 C ATOM 161 C ILE A 12 62.819 6.195 7.245 1.00 0.00 C ATOM 162 O ILE A 12 63.186 6.674 8.300 1.00 0.00 O ATOM 163 CB ILE A 12 63.042 7.469 5.115 1.00 0.00 C ATOM 164 CG1 ILE A 12 63.923 7.719 3.888 1.00 0.00 C ATOM 165 CG2 ILE A 12 62.960 8.749 5.949 1.00 0.00 C ATOM 166 CD1 ILE A 12 63.196 8.655 2.921 1.00 0.00 C ATOM 0 H ILE A 12 63.229 5.121 4.263 1.00 0.00 H new ATOM 0 HA ILE A 12 64.678 6.592 6.213 1.00 0.00 H new ATOM 0 HB ILE A 12 62.043 7.178 4.790 1.00 0.00 H new ATOM 0 HG12 ILE A 12 64.873 8.159 4.192 1.00 0.00 H new ATOM 0 HG13 ILE A 12 64.153 6.775 3.394 1.00 0.00 H new ATOM 0 HG21 ILE A 12 62.530 9.549 5.346 1.00 0.00 H new ATOM 0 HG22 ILE A 12 62.331 8.575 6.822 1.00 0.00 H new ATOM 0 HG23 ILE A 12 63.960 9.036 6.274 1.00 0.00 H new ATOM 0 HD11 ILE A 12 63.823 8.834 2.047 1.00 0.00 H new ATOM 0 HD12 ILE A 12 62.258 8.197 2.607 1.00 0.00 H new ATOM 0 HD13 ILE A 12 62.989 9.602 3.418 1.00 0.00 H new ATOM 178 N ASN A 13 61.693 5.547 7.149 1.00 0.00 N ATOM 179 CA ASN A 13 60.810 5.369 8.338 1.00 0.00 C ATOM 180 C ASN A 13 61.515 4.567 9.439 1.00 0.00 C ATOM 181 O ASN A 13 61.362 4.838 10.609 1.00 0.00 O ATOM 182 CB ASN A 13 59.544 4.629 7.910 1.00 0.00 C ATOM 183 CG ASN A 13 58.721 5.530 6.988 1.00 0.00 C ATOM 184 OD1 ASN A 13 58.404 5.154 5.878 1.00 0.00 O ATOM 185 ND2 ASN A 13 58.365 6.714 7.403 1.00 0.00 N ATOM 0 H ASN A 13 61.341 5.128 6.288 1.00 0.00 H new ATOM 0 HA ASN A 13 60.563 6.353 8.736 1.00 0.00 H new ATOM 0 HB2 ASN A 13 59.805 3.704 7.396 1.00 0.00 H new ATOM 0 HB3 ASN A 13 58.957 4.352 8.786 1.00 0.00 H new ATOM 0 HD21 ASN A 13 57.820 7.325 6.795 1.00 0.00 H new ATOM 0 HD22 ASN A 13 58.632 7.029 8.336 1.00 0.00 H new ATOM 192 N VAL A 14 62.249 3.556 9.088 1.00 0.00 N ATOM 193 CA VAL A 14 62.912 2.732 10.138 1.00 0.00 C ATOM 194 C VAL A 14 64.049 3.506 10.829 1.00 0.00 C ATOM 195 O VAL A 14 64.222 3.407 12.029 1.00 0.00 O ATOM 196 CB VAL A 14 63.461 1.463 9.515 1.00 0.00 C ATOM 197 CG1 VAL A 14 64.020 0.567 10.620 1.00 0.00 C ATOM 198 CG2 VAL A 14 62.339 0.725 8.775 1.00 0.00 C ATOM 0 H VAL A 14 62.421 3.262 8.127 1.00 0.00 H new ATOM 0 HA VAL A 14 62.168 2.483 10.894 1.00 0.00 H new ATOM 0 HB VAL A 14 64.252 1.714 8.808 1.00 0.00 H new ATOM 0 HG11 VAL A 14 64.417 -0.348 10.180 1.00 0.00 H new ATOM 0 HG12 VAL A 14 64.817 1.092 11.146 1.00 0.00 H new ATOM 0 HG13 VAL A 14 63.225 0.317 11.323 1.00 0.00 H new ATOM 0 HG21 VAL A 14 62.736 -0.187 8.328 1.00 0.00 H new ATOM 0 HG22 VAL A 14 61.546 0.469 9.478 1.00 0.00 H new ATOM 0 HG23 VAL A 14 61.936 1.367 7.992 1.00 0.00 H new ATOM 208 N PHE A 15 64.833 4.270 10.105 1.00 0.00 N ATOM 209 CA PHE A 15 65.944 5.019 10.777 1.00 0.00 C ATOM 210 C PHE A 15 65.331 5.838 11.906 1.00 0.00 C ATOM 211 O PHE A 15 65.897 5.997 12.968 1.00 0.00 O ATOM 212 CB PHE A 15 66.629 5.998 9.806 1.00 0.00 C ATOM 213 CG PHE A 15 67.096 5.325 8.523 1.00 0.00 C ATOM 214 CD1 PHE A 15 67.623 4.022 8.522 1.00 0.00 C ATOM 215 CD2 PHE A 15 67.013 6.037 7.319 1.00 0.00 C ATOM 216 CE1 PHE A 15 68.055 3.446 7.320 1.00 0.00 C ATOM 217 CE2 PHE A 15 67.444 5.456 6.121 1.00 0.00 C ATOM 218 CZ PHE A 15 67.963 4.160 6.123 1.00 0.00 C ATOM 0 H PHE A 15 64.755 4.406 9.097 1.00 0.00 H new ATOM 0 HA PHE A 15 66.685 4.304 11.135 1.00 0.00 H new ATOM 0 HB2 PHE A 15 65.936 6.802 9.558 1.00 0.00 H new ATOM 0 HB3 PHE A 15 67.484 6.457 10.303 1.00 0.00 H new ATOM 0 HD1 PHE A 15 67.695 3.466 9.445 1.00 0.00 H new ATOM 0 HD2 PHE A 15 66.614 7.041 7.316 1.00 0.00 H new ATOM 0 HE1 PHE A 15 68.461 2.445 7.319 1.00 0.00 H new ATOM 0 HE2 PHE A 15 67.375 6.009 5.196 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.293 3.709 5.199 1.00 0.00 H new ATOM 228 N HIS A 16 64.168 6.350 11.662 1.00 0.00 N ATOM 229 CA HIS A 16 63.462 7.170 12.675 1.00 0.00 C ATOM 230 C HIS A 16 63.209 6.348 13.943 1.00 0.00 C ATOM 231 O HIS A 16 63.304 6.853 15.043 1.00 0.00 O ATOM 232 CB HIS A 16 62.127 7.598 12.079 1.00 0.00 C ATOM 233 CG HIS A 16 61.366 8.436 13.068 1.00 0.00 C ATOM 234 ND1 HIS A 16 61.816 9.677 13.494 1.00 0.00 N ATOM 235 CD2 HIS A 16 60.177 8.221 13.722 1.00 0.00 C ATOM 236 CE1 HIS A 16 60.908 10.159 14.365 1.00 0.00 C ATOM 237 NE2 HIS A 16 59.894 9.311 14.537 1.00 0.00 N ATOM 0 H HIS A 16 63.663 6.233 10.783 1.00 0.00 H new ATOM 0 HA HIS A 16 64.068 8.037 12.940 1.00 0.00 H new ATOM 0 HB2 HIS A 16 62.294 8.164 11.163 1.00 0.00 H new ATOM 0 HB3 HIS A 16 61.542 6.719 11.809 1.00 0.00 H new ATOM 0 HD2 HIS A 16 59.558 7.342 13.619 1.00 0.00 H new ATOM 0 HE1 HIS A 16 60.991 11.114 14.862 1.00 0.00 H new ATOM 0 HE2 HIS A 16 59.081 9.436 15.140 1.00 0.00 H new ATOM 246 N ALA A 17 62.856 5.101 13.806 1.00 0.00 N ATOM 247 CA ALA A 17 62.568 4.280 15.019 1.00 0.00 C ATOM 248 C ALA A 17 63.791 4.224 15.951 1.00 0.00 C ATOM 249 O ALA A 17 63.686 4.519 17.125 1.00 0.00 O ATOM 250 CB ALA A 17 62.188 2.861 14.588 1.00 0.00 C ATOM 0 H ALA A 17 62.754 4.616 12.915 1.00 0.00 H new ATOM 0 HA ALA A 17 61.744 4.741 15.563 1.00 0.00 H new ATOM 0 HB1 ALA A 17 61.977 2.257 15.470 1.00 0.00 H new ATOM 0 HB2 ALA A 17 61.303 2.898 13.953 1.00 0.00 H new ATOM 0 HB3 ALA A 17 63.014 2.416 14.033 1.00 0.00 H new ATOM 256 N HIS A 18 64.944 3.840 15.462 1.00 0.00 N ATOM 257 CA HIS A 18 66.139 3.770 16.370 1.00 0.00 C ATOM 258 C HIS A 18 66.668 5.178 16.684 1.00 0.00 C ATOM 259 O HIS A 18 67.065 5.466 17.795 1.00 0.00 O ATOM 260 CB HIS A 18 67.263 2.964 15.706 1.00 0.00 C ATOM 261 CG HIS A 18 66.874 1.513 15.625 1.00 0.00 C ATOM 262 ND1 HIS A 18 66.874 0.684 16.738 1.00 0.00 N ATOM 263 CD2 HIS A 18 66.489 0.724 14.569 1.00 0.00 C ATOM 264 CE1 HIS A 18 66.499 -0.543 16.330 1.00 0.00 C ATOM 265 NE2 HIS A 18 66.255 -0.569 15.019 1.00 0.00 N ATOM 0 H HIS A 18 65.112 3.575 14.491 1.00 0.00 H new ATOM 0 HA HIS A 18 65.826 3.284 17.294 1.00 0.00 H new ATOM 0 HB2 HIS A 18 67.460 3.353 14.707 1.00 0.00 H new ATOM 0 HB3 HIS A 18 68.185 3.071 16.277 1.00 0.00 H new ATOM 0 HD2 HIS A 18 66.384 1.057 13.547 1.00 0.00 H new ATOM 0 HE1 HIS A 18 66.407 -1.399 16.982 1.00 0.00 H new ATOM 0 HE2 HIS A 18 65.958 -1.371 14.463 1.00 0.00 H new ATOM 274 N SER A 19 66.702 6.048 15.707 1.00 0.00 N ATOM 275 CA SER A 19 67.240 7.429 15.937 1.00 0.00 C ATOM 276 C SER A 19 66.132 8.386 16.385 1.00 0.00 C ATOM 277 O SER A 19 66.375 9.553 16.617 1.00 0.00 O ATOM 278 CB SER A 19 67.843 7.955 14.635 1.00 0.00 C ATOM 279 OG SER A 19 68.906 7.103 14.227 1.00 0.00 O ATOM 0 H SER A 19 66.380 5.864 14.757 1.00 0.00 H new ATOM 0 HA SER A 19 67.996 7.376 16.720 1.00 0.00 H new ATOM 0 HB2 SER A 19 67.079 7.998 13.859 1.00 0.00 H new ATOM 0 HB3 SER A 19 68.211 8.971 14.777 1.00 0.00 H new ATOM 0 HG SER A 19 69.754 7.593 14.273 1.00 0.00 H new ATOM 285 N GLY A 20 64.920 7.924 16.487 1.00 0.00 N ATOM 286 CA GLY A 20 63.812 8.837 16.893 1.00 0.00 C ATOM 287 C GLY A 20 64.016 9.358 18.324 1.00 0.00 C ATOM 288 O GLY A 20 63.099 9.868 18.935 1.00 0.00 O ATOM 0 H GLY A 20 64.646 6.958 16.308 1.00 0.00 H new ATOM 0 HA2 GLY A 20 63.759 9.678 16.201 1.00 0.00 H new ATOM 0 HA3 GLY A 20 62.860 8.309 16.828 1.00 0.00 H new ATOM 348 N LYS A 25 69.332 12.424 16.068 1.00 0.00 N ATOM 349 CA LYS A 25 68.445 12.090 14.922 1.00 0.00 C ATOM 350 C LYS A 25 69.261 11.374 13.847 1.00 0.00 C ATOM 351 O LYS A 25 68.749 10.544 13.122 1.00 0.00 O ATOM 352 CB LYS A 25 67.832 13.376 14.366 1.00 0.00 C ATOM 353 CG LYS A 25 66.891 13.043 13.202 1.00 0.00 C ATOM 354 CD LYS A 25 65.930 14.213 12.965 1.00 0.00 C ATOM 355 CE LYS A 25 66.722 15.518 12.821 1.00 0.00 C ATOM 356 NZ LYS A 25 67.881 15.307 11.908 1.00 0.00 N ATOM 0 HA LYS A 25 67.640 11.432 15.249 1.00 0.00 H new ATOM 0 HB2 LYS A 25 67.284 13.897 15.151 1.00 0.00 H new ATOM 0 HB3 LYS A 25 68.620 14.048 14.027 1.00 0.00 H new ATOM 0 HG2 LYS A 25 67.469 12.846 12.299 1.00 0.00 H new ATOM 0 HG3 LYS A 25 66.328 12.137 13.424 1.00 0.00 H new ATOM 0 HD2 LYS A 25 65.340 14.034 12.066 1.00 0.00 H new ATOM 0 HD3 LYS A 25 65.229 14.293 13.796 1.00 0.00 H new ATOM 0 HE2 LYS A 25 66.077 16.304 12.429 1.00 0.00 H new ATOM 0 HE3 LYS A 25 67.073 15.851 13.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 68.090 16.191 11.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 68.713 15.021 12.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 67.650 14.562 11.221 1.00 0.00 H new ATOM 370 N TYR A 26 70.530 11.671 13.747 1.00 0.00 N ATOM 371 CA TYR A 26 71.376 10.978 12.732 1.00 0.00 C ATOM 372 C TYR A 26 71.231 9.471 12.950 1.00 0.00 C ATOM 373 O TYR A 26 70.420 9.033 13.743 1.00 0.00 O ATOM 374 CB TYR A 26 72.841 11.375 12.921 1.00 0.00 C ATOM 375 CG TYR A 26 72.986 12.870 12.768 1.00 0.00 C ATOM 376 CD1 TYR A 26 73.223 13.427 11.507 1.00 0.00 C ATOM 377 CD2 TYR A 26 72.889 13.698 13.894 1.00 0.00 C ATOM 378 CE1 TYR A 26 73.364 14.814 11.371 1.00 0.00 C ATOM 379 CE2 TYR A 26 73.027 15.083 13.757 1.00 0.00 C ATOM 380 CZ TYR A 26 73.266 15.642 12.496 1.00 0.00 C ATOM 381 OH TYR A 26 73.406 17.009 12.363 1.00 0.00 O ATOM 0 H TYR A 26 71.015 12.360 14.321 1.00 0.00 H new ATOM 0 HA TYR A 26 71.061 11.256 11.726 1.00 0.00 H new ATOM 0 HB2 TYR A 26 73.188 11.065 13.907 1.00 0.00 H new ATOM 0 HB3 TYR A 26 73.464 10.862 12.188 1.00 0.00 H new ATOM 0 HD1 TYR A 26 73.297 12.788 10.639 1.00 0.00 H new ATOM 0 HD2 TYR A 26 72.708 13.267 14.867 1.00 0.00 H new ATOM 0 HE1 TYR A 26 73.548 15.245 10.398 1.00 0.00 H new ATOM 0 HE2 TYR A 26 72.949 15.722 14.624 1.00 0.00 H new ATOM 0 HH TYR A 26 73.309 17.435 13.240 1.00 0.00 H new ATOM 391 N LYS A 27 71.995 8.658 12.276 1.00 0.00 N ATOM 392 CA LYS A 27 71.840 7.196 12.500 1.00 0.00 C ATOM 393 C LYS A 27 72.292 6.859 13.918 1.00 0.00 C ATOM 394 O LYS A 27 71.482 6.687 14.795 1.00 0.00 O ATOM 395 CB LYS A 27 72.650 6.383 11.466 1.00 0.00 C ATOM 396 CG LYS A 27 72.830 4.909 11.910 1.00 0.00 C ATOM 397 CD LYS A 27 71.469 4.259 12.207 1.00 0.00 C ATOM 398 CE LYS A 27 70.548 4.356 10.981 1.00 0.00 C ATOM 399 NZ LYS A 27 69.537 3.265 11.037 1.00 0.00 N ATOM 0 H LYS A 27 72.703 8.934 11.596 1.00 0.00 H new ATOM 0 HA LYS A 27 70.791 6.928 12.376 1.00 0.00 H new ATOM 0 HB2 LYS A 27 72.143 6.413 10.501 1.00 0.00 H new ATOM 0 HB3 LYS A 27 73.628 6.843 11.327 1.00 0.00 H new ATOM 0 HG2 LYS A 27 73.343 4.349 11.128 1.00 0.00 H new ATOM 0 HG3 LYS A 27 73.460 4.866 12.798 1.00 0.00 H new ATOM 0 HD2 LYS A 27 71.611 3.214 12.481 1.00 0.00 H new ATOM 0 HD3 LYS A 27 71.002 4.752 13.060 1.00 0.00 H new ATOM 0 HE2 LYS A 27 70.052 5.326 10.961 1.00 0.00 H new ATOM 0 HE3 LYS A 27 71.134 4.278 10.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 68.769 3.469 10.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 69.986 2.362 10.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 69.149 3.201 12.000 1.00 0.00 H new ATOM 413 N LEU A 28 73.569 6.739 14.142 1.00 0.00 N ATOM 414 CA LEU A 28 74.056 6.366 15.519 1.00 0.00 C ATOM 415 C LEU A 28 75.599 6.426 15.516 1.00 0.00 C ATOM 416 O LEU A 28 76.216 6.646 14.498 1.00 0.00 O ATOM 417 CB LEU A 28 73.592 4.902 15.818 1.00 0.00 C ATOM 418 CG LEU A 28 72.782 4.716 17.138 1.00 0.00 C ATOM 419 CD1 LEU A 28 73.397 5.456 18.336 1.00 0.00 C ATOM 420 CD2 LEU A 28 71.326 5.170 16.973 1.00 0.00 C ATOM 0 H LEU A 28 74.300 6.880 13.444 1.00 0.00 H new ATOM 0 HA LEU A 28 73.660 7.044 16.275 1.00 0.00 H new ATOM 0 HB2 LEU A 28 72.982 4.554 14.985 1.00 0.00 H new ATOM 0 HB3 LEU A 28 74.472 4.260 15.858 1.00 0.00 H new ATOM 0 HG LEU A 28 72.817 3.647 17.346 1.00 0.00 H new ATOM 0 HD11 LEU A 28 72.785 5.285 19.222 1.00 0.00 H new ATOM 0 HD12 LEU A 28 74.406 5.084 18.514 1.00 0.00 H new ATOM 0 HD13 LEU A 28 73.437 6.524 18.123 1.00 0.00 H new ATOM 0 HD21 LEU A 28 70.791 5.026 17.912 1.00 0.00 H new ATOM 0 HD22 LEU A 28 71.303 6.225 16.700 1.00 0.00 H new ATOM 0 HD23 LEU A 28 70.848 4.582 16.190 1.00 0.00 H new ATOM 432 N SER A 29 76.227 6.181 16.630 1.00 0.00 N ATOM 433 CA SER A 29 77.710 6.165 16.654 1.00 0.00 C ATOM 434 C SER A 29 78.155 4.922 15.882 1.00 0.00 C ATOM 435 O SER A 29 77.448 3.935 15.846 1.00 0.00 O ATOM 436 CB SER A 29 78.189 6.085 18.103 1.00 0.00 C ATOM 437 OG SER A 29 79.608 6.018 18.130 1.00 0.00 O ATOM 0 H SER A 29 75.775 5.991 17.525 1.00 0.00 H new ATOM 0 HA SER A 29 78.127 7.066 16.204 1.00 0.00 H new ATOM 0 HB2 SER A 29 77.845 6.957 18.660 1.00 0.00 H new ATOM 0 HB3 SER A 29 77.764 5.208 18.590 1.00 0.00 H new ATOM 0 HG SER A 29 79.895 5.096 17.961 1.00 0.00 H new ATOM 443 N LYS A 30 79.289 4.946 15.236 1.00 0.00 N ATOM 444 CA LYS A 30 79.687 3.730 14.456 1.00 0.00 C ATOM 445 C LYS A 30 79.665 2.494 15.378 1.00 0.00 C ATOM 446 O LYS A 30 79.254 1.426 14.979 1.00 0.00 O ATOM 447 CB LYS A 30 81.104 3.903 13.852 1.00 0.00 C ATOM 448 CG LYS A 30 81.368 5.387 13.519 1.00 0.00 C ATOM 449 CD LYS A 30 82.303 5.514 12.301 1.00 0.00 C ATOM 450 CE LYS A 30 83.515 4.576 12.440 1.00 0.00 C ATOM 451 NZ LYS A 30 84.668 5.157 11.696 1.00 0.00 N ATOM 0 H LYS A 30 79.943 5.728 15.211 1.00 0.00 H new ATOM 0 HA LYS A 30 78.977 3.594 13.640 1.00 0.00 H new ATOM 0 HB2 LYS A 30 81.853 3.543 14.557 1.00 0.00 H new ATOM 0 HB3 LYS A 30 81.198 3.299 12.950 1.00 0.00 H new ATOM 0 HG2 LYS A 30 80.424 5.892 13.313 1.00 0.00 H new ATOM 0 HG3 LYS A 30 81.815 5.884 14.380 1.00 0.00 H new ATOM 0 HD2 LYS A 30 81.755 5.274 11.390 1.00 0.00 H new ATOM 0 HD3 LYS A 30 82.645 6.545 12.205 1.00 0.00 H new ATOM 0 HE2 LYS A 30 83.772 4.447 13.491 1.00 0.00 H new ATOM 0 HE3 LYS A 30 83.273 3.588 12.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 85.321 4.397 11.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 84.322 5.643 10.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 85.166 5.837 12.304 1.00 0.00 H new ATOM 465 N LYS A 31 80.109 2.607 16.598 1.00 0.00 N ATOM 466 CA LYS A 31 80.104 1.403 17.486 1.00 0.00 C ATOM 467 C LYS A 31 78.661 0.904 17.698 1.00 0.00 C ATOM 468 O LYS A 31 78.359 -0.262 17.494 1.00 0.00 O ATOM 469 CB LYS A 31 80.738 1.769 18.836 1.00 0.00 C ATOM 470 CG LYS A 31 80.766 0.554 19.778 1.00 0.00 C ATOM 471 CD LYS A 31 81.656 -0.555 19.188 1.00 0.00 C ATOM 472 CE LYS A 31 82.119 -1.496 20.305 1.00 0.00 C ATOM 473 NZ LYS A 31 82.999 -0.750 21.248 1.00 0.00 N ATOM 0 H LYS A 31 80.470 3.464 17.017 1.00 0.00 H new ATOM 0 HA LYS A 31 80.680 0.606 17.017 1.00 0.00 H new ATOM 0 HB2 LYS A 31 81.753 2.135 18.678 1.00 0.00 H new ATOM 0 HB3 LYS A 31 80.175 2.580 19.299 1.00 0.00 H new ATOM 0 HG2 LYS A 31 81.144 0.852 20.756 1.00 0.00 H new ATOM 0 HG3 LYS A 31 79.754 0.177 19.928 1.00 0.00 H new ATOM 0 HD2 LYS A 31 81.103 -1.115 18.434 1.00 0.00 H new ATOM 0 HD3 LYS A 31 82.519 -0.115 18.689 1.00 0.00 H new ATOM 0 HE2 LYS A 31 81.257 -1.899 20.836 1.00 0.00 H new ATOM 0 HE3 LYS A 31 82.657 -2.344 19.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 83.669 -1.409 21.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 83.526 -0.020 20.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 82.417 -0.299 21.983 1.00 0.00 H new ATOM 487 N GLU A 32 77.758 1.769 18.089 1.00 0.00 N ATOM 488 CA GLU A 32 76.345 1.302 18.292 1.00 0.00 C ATOM 489 C GLU A 32 75.783 0.895 16.946 1.00 0.00 C ATOM 490 O GLU A 32 75.088 -0.091 16.825 1.00 0.00 O ATOM 491 CB GLU A 32 75.461 2.413 18.876 1.00 0.00 C ATOM 492 CG GLU A 32 74.033 1.872 19.119 1.00 0.00 C ATOM 493 CD GLU A 32 74.070 0.839 20.247 1.00 0.00 C ATOM 494 OE1 GLU A 32 75.029 0.850 21.003 1.00 0.00 O ATOM 495 OE2 GLU A 32 73.141 0.053 20.337 1.00 0.00 O ATOM 0 H GLU A 32 77.928 2.758 18.274 1.00 0.00 H new ATOM 0 HA GLU A 32 76.352 0.468 18.993 1.00 0.00 H new ATOM 0 HB2 GLU A 32 75.887 2.775 19.812 1.00 0.00 H new ATOM 0 HB3 GLU A 32 75.427 3.261 18.192 1.00 0.00 H new ATOM 0 HG2 GLU A 32 73.361 2.690 19.381 1.00 0.00 H new ATOM 0 HG3 GLU A 32 73.643 1.419 18.208 1.00 0.00 H new ATOM 502 N LEU A 33 76.093 1.650 15.930 1.00 0.00 N ATOM 503 CA LEU A 33 75.595 1.330 14.568 1.00 0.00 C ATOM 504 C LEU A 33 75.774 -0.164 14.327 1.00 0.00 C ATOM 505 O LEU A 33 74.902 -0.810 13.810 1.00 0.00 O ATOM 506 CB LEU A 33 76.417 2.164 13.571 1.00 0.00 C ATOM 507 CG LEU A 33 76.585 1.458 12.202 1.00 0.00 C ATOM 508 CD1 LEU A 33 76.899 2.489 11.108 1.00 0.00 C ATOM 509 CD2 LEU A 33 77.699 0.373 12.248 1.00 0.00 C ATOM 0 H LEU A 33 76.677 2.484 15.988 1.00 0.00 H new ATOM 0 HA LEU A 33 74.538 1.568 14.449 1.00 0.00 H new ATOM 0 HB2 LEU A 33 75.931 3.128 13.422 1.00 0.00 H new ATOM 0 HB3 LEU A 33 77.401 2.365 13.995 1.00 0.00 H new ATOM 0 HG LEU A 33 75.644 0.960 11.969 1.00 0.00 H new ATOM 0 HD11 LEU A 33 77.015 1.980 10.151 1.00 0.00 H new ATOM 0 HD12 LEU A 33 76.082 3.208 11.040 1.00 0.00 H new ATOM 0 HD13 LEU A 33 77.823 3.012 11.355 1.00 0.00 H new ATOM 0 HD21 LEU A 33 77.787 -0.100 11.270 1.00 0.00 H new ATOM 0 HD22 LEU A 33 78.649 0.838 12.513 1.00 0.00 H new ATOM 0 HD23 LEU A 33 77.443 -0.380 12.993 1.00 0.00 H new ATOM 521 N LYS A 34 76.880 -0.714 14.733 1.00 0.00 N ATOM 522 CA LYS A 34 77.094 -2.175 14.542 1.00 0.00 C ATOM 523 C LYS A 34 76.008 -2.936 15.274 1.00 0.00 C ATOM 524 O LYS A 34 75.499 -3.922 14.794 1.00 0.00 O ATOM 525 CB LYS A 34 78.446 -2.582 15.100 1.00 0.00 C ATOM 526 CG LYS A 34 78.779 -4.022 14.661 1.00 0.00 C ATOM 527 CD LYS A 34 79.211 -4.069 13.164 1.00 0.00 C ATOM 528 CE LYS A 34 78.530 -5.244 12.450 1.00 0.00 C ATOM 529 NZ LYS A 34 77.054 -5.028 12.453 1.00 0.00 N ATOM 0 H LYS A 34 77.646 -0.217 15.189 1.00 0.00 H new ATOM 0 HA LYS A 34 77.062 -2.404 13.477 1.00 0.00 H new ATOM 0 HB2 LYS A 34 79.217 -1.897 14.747 1.00 0.00 H new ATOM 0 HB3 LYS A 34 78.435 -2.517 16.188 1.00 0.00 H new ATOM 0 HG2 LYS A 34 79.579 -4.420 15.286 1.00 0.00 H new ATOM 0 HG3 LYS A 34 77.909 -4.661 14.811 1.00 0.00 H new ATOM 0 HD2 LYS A 34 78.946 -3.133 12.672 1.00 0.00 H new ATOM 0 HD3 LYS A 34 80.294 -4.170 13.094 1.00 0.00 H new ATOM 0 HE2 LYS A 34 78.896 -5.325 11.427 1.00 0.00 H new ATOM 0 HE3 LYS A 34 78.774 -6.181 12.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 76.583 -5.845 12.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 76.721 -4.919 13.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 76.828 -4.168 11.913 1.00 0.00 H new ATOM 543 N ASP A 35 75.649 -2.495 16.434 1.00 0.00 N ATOM 544 CA ASP A 35 74.589 -3.216 17.175 1.00 0.00 C ATOM 545 C ASP A 35 73.312 -3.219 16.327 1.00 0.00 C ATOM 546 O ASP A 35 72.535 -4.151 16.363 1.00 0.00 O ATOM 547 CB ASP A 35 74.315 -2.507 18.502 1.00 0.00 C ATOM 548 CG ASP A 35 73.327 -3.334 19.324 1.00 0.00 C ATOM 549 OD1 ASP A 35 72.645 -4.160 18.738 1.00 0.00 O ATOM 550 OD2 ASP A 35 73.271 -3.132 20.526 1.00 0.00 O ATOM 0 H ASP A 35 76.037 -1.675 16.901 1.00 0.00 H new ATOM 0 HA ASP A 35 74.908 -4.239 17.375 1.00 0.00 H new ATOM 0 HB2 ASP A 35 75.245 -2.375 19.055 1.00 0.00 H new ATOM 0 HB3 ASP A 35 73.909 -1.512 18.319 1.00 0.00 H new ATOM 555 N LEU A 36 73.082 -2.170 15.582 1.00 0.00 N ATOM 556 CA LEU A 36 71.846 -2.093 14.752 1.00 0.00 C ATOM 557 C LEU A 36 71.917 -3.042 13.533 1.00 0.00 C ATOM 558 O LEU A 36 71.036 -3.852 13.322 1.00 0.00 O ATOM 559 CB LEU A 36 71.660 -0.647 14.256 1.00 0.00 C ATOM 560 CG LEU A 36 70.983 0.201 15.339 1.00 0.00 C ATOM 561 CD1 LEU A 36 71.770 0.084 16.644 1.00 0.00 C ATOM 562 CD2 LEU A 36 70.955 1.662 14.885 1.00 0.00 C ATOM 0 H LEU A 36 73.700 -1.361 15.513 1.00 0.00 H new ATOM 0 HA LEU A 36 71.003 -2.399 15.371 1.00 0.00 H new ATOM 0 HB2 LEU A 36 72.627 -0.216 13.998 1.00 0.00 H new ATOM 0 HB3 LEU A 36 71.056 -0.641 13.349 1.00 0.00 H new ATOM 0 HG LEU A 36 69.965 -0.152 15.501 1.00 0.00 H new ATOM 0 HD11 LEU A 36 71.289 0.687 17.414 1.00 0.00 H new ATOM 0 HD12 LEU A 36 71.795 -0.958 16.962 1.00 0.00 H new ATOM 0 HD13 LEU A 36 72.788 0.440 16.488 1.00 0.00 H new ATOM 0 HD21 LEU A 36 70.475 2.272 15.650 1.00 0.00 H new ATOM 0 HD22 LEU A 36 71.975 2.014 14.728 1.00 0.00 H new ATOM 0 HD23 LEU A 36 70.396 1.743 13.953 1.00 0.00 H new ATOM 574 N LEU A 37 72.929 -2.915 12.704 1.00 0.00 N ATOM 575 CA LEU A 37 73.009 -3.776 11.474 1.00 0.00 C ATOM 576 C LEU A 37 73.055 -5.257 11.826 1.00 0.00 C ATOM 577 O LEU A 37 72.377 -6.076 11.240 1.00 0.00 O ATOM 578 CB LEU A 37 74.288 -3.443 10.657 1.00 0.00 C ATOM 579 CG LEU A 37 74.802 -2.029 10.968 1.00 0.00 C ATOM 580 CD1 LEU A 37 75.934 -1.659 9.991 1.00 0.00 C ATOM 581 CD2 LEU A 37 73.660 -0.983 10.901 1.00 0.00 C ATOM 0 H LEU A 37 73.699 -2.257 12.823 1.00 0.00 H new ATOM 0 HA LEU A 37 72.114 -3.568 10.888 1.00 0.00 H new ATOM 0 HB2 LEU A 37 75.066 -4.172 10.884 1.00 0.00 H new ATOM 0 HB3 LEU A 37 74.073 -3.527 9.592 1.00 0.00 H new ATOM 0 HG LEU A 37 75.191 -2.023 11.986 1.00 0.00 H new ATOM 0 HD11 LEU A 37 76.295 -0.655 10.216 1.00 0.00 H new ATOM 0 HD12 LEU A 37 76.753 -2.371 10.096 1.00 0.00 H new ATOM 0 HD13 LEU A 37 75.557 -1.688 8.969 1.00 0.00 H new ATOM 0 HD21 LEU A 37 74.059 0.006 11.126 1.00 0.00 H new ATOM 0 HD22 LEU A 37 73.227 -0.981 9.901 1.00 0.00 H new ATOM 0 HD23 LEU A 37 72.890 -1.238 11.629 1.00 0.00 H new ATOM 593 N GLN A 38 73.880 -5.601 12.742 1.00 0.00 N ATOM 594 CA GLN A 38 74.019 -7.021 13.111 1.00 0.00 C ATOM 595 C GLN A 38 72.756 -7.489 13.819 1.00 0.00 C ATOM 596 O GLN A 38 72.506 -8.670 13.956 1.00 0.00 O ATOM 597 CB GLN A 38 75.233 -7.165 14.036 1.00 0.00 C ATOM 598 CG GLN A 38 75.271 -8.565 14.641 1.00 0.00 C ATOM 599 CD GLN A 38 76.599 -8.765 15.372 1.00 0.00 C ATOM 600 OE1 GLN A 38 77.311 -7.816 15.633 1.00 0.00 O ATOM 601 NE2 GLN A 38 76.966 -9.969 15.716 1.00 0.00 N ATOM 0 H GLN A 38 74.475 -4.956 13.262 1.00 0.00 H new ATOM 0 HA GLN A 38 74.163 -7.633 12.220 1.00 0.00 H new ATOM 0 HB2 GLN A 38 76.150 -6.978 13.477 1.00 0.00 H new ATOM 0 HB3 GLN A 38 75.185 -6.419 14.829 1.00 0.00 H new ATOM 0 HG2 GLN A 38 74.439 -8.697 15.332 1.00 0.00 H new ATOM 0 HG3 GLN A 38 75.157 -9.315 13.858 1.00 0.00 H new ATOM 0 HE21 GLN A 38 76.369 -10.766 15.497 1.00 0.00 H new ATOM 0 HE22 GLN A 38 77.850 -10.113 16.204 1.00 0.00 H new ATOM 610 N THR A 39 71.966 -6.571 14.283 1.00 0.00 N ATOM 611 CA THR A 39 70.719 -6.961 15.003 1.00 0.00 C ATOM 612 C THR A 39 69.625 -7.286 13.985 1.00 0.00 C ATOM 613 O THR A 39 68.815 -8.169 14.186 1.00 0.00 O ATOM 614 CB THR A 39 70.306 -5.802 15.917 1.00 0.00 C ATOM 615 OG1 THR A 39 71.071 -5.859 17.112 1.00 0.00 O ATOM 616 CG2 THR A 39 68.811 -5.875 16.264 1.00 0.00 C ATOM 0 H THR A 39 72.124 -5.567 14.198 1.00 0.00 H new ATOM 0 HA THR A 39 70.883 -7.850 15.612 1.00 0.00 H new ATOM 0 HB THR A 39 70.489 -4.864 15.393 1.00 0.00 H new ATOM 0 HG1 THR A 39 71.530 -5.004 17.248 1.00 0.00 H new ATOM 0 HG21 THR A 39 68.547 -5.040 16.913 1.00 0.00 H new ATOM 0 HG22 THR A 39 68.222 -5.823 15.348 1.00 0.00 H new ATOM 0 HG23 THR A 39 68.602 -6.814 16.777 1.00 0.00 H new ATOM 624 N GLU A 40 69.591 -6.570 12.900 1.00 0.00 N ATOM 625 CA GLU A 40 68.546 -6.819 11.863 1.00 0.00 C ATOM 626 C GLU A 40 69.040 -7.870 10.858 1.00 0.00 C ATOM 627 O GLU A 40 68.305 -8.312 10.000 1.00 0.00 O ATOM 628 CB GLU A 40 68.236 -5.501 11.145 1.00 0.00 C ATOM 629 CG GLU A 40 69.505 -4.966 10.487 1.00 0.00 C ATOM 630 CD GLU A 40 69.286 -3.524 10.031 1.00 0.00 C ATOM 631 OE1 GLU A 40 69.065 -2.680 10.884 1.00 0.00 O ATOM 632 OE2 GLU A 40 69.340 -3.288 8.836 1.00 0.00 O ATOM 0 H GLU A 40 70.244 -5.818 12.682 1.00 0.00 H new ATOM 0 HA GLU A 40 67.640 -7.198 12.337 1.00 0.00 H new ATOM 0 HB2 GLU A 40 67.463 -5.658 10.393 1.00 0.00 H new ATOM 0 HB3 GLU A 40 67.847 -4.771 11.855 1.00 0.00 H new ATOM 0 HG2 GLU A 40 70.337 -5.012 11.190 1.00 0.00 H new ATOM 0 HG3 GLU A 40 69.774 -5.590 9.634 1.00 0.00 H new ATOM 639 N LEU A 41 70.282 -8.272 10.959 1.00 0.00 N ATOM 640 CA LEU A 41 70.847 -9.294 10.012 1.00 0.00 C ATOM 641 C LEU A 41 71.125 -10.594 10.765 1.00 0.00 C ATOM 642 O LEU A 41 72.028 -11.335 10.434 1.00 0.00 O ATOM 643 CB LEU A 41 72.162 -8.752 9.431 1.00 0.00 C ATOM 644 CG LEU A 41 71.878 -7.735 8.309 1.00 0.00 C ATOM 645 CD1 LEU A 41 73.080 -6.796 8.156 1.00 0.00 C ATOM 646 CD2 LEU A 41 71.645 -8.465 6.977 1.00 0.00 C ATOM 0 H LEU A 41 70.939 -7.935 11.663 1.00 0.00 H new ATOM 0 HA LEU A 41 70.134 -9.489 9.211 1.00 0.00 H new ATOM 0 HB2 LEU A 41 72.747 -8.278 10.220 1.00 0.00 H new ATOM 0 HB3 LEU A 41 72.761 -9.575 9.041 1.00 0.00 H new ATOM 0 HG LEU A 41 70.986 -7.165 8.569 1.00 0.00 H new ATOM 0 HD11 LEU A 41 72.880 -6.076 7.362 1.00 0.00 H new ATOM 0 HD12 LEU A 41 73.249 -6.266 9.093 1.00 0.00 H new ATOM 0 HD13 LEU A 41 73.966 -7.378 7.903 1.00 0.00 H new ATOM 0 HD21 LEU A 41 71.445 -7.735 6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 41 72.533 -9.042 6.718 1.00 0.00 H new ATOM 0 HD23 LEU A 41 70.791 -9.136 7.074 1.00 0.00 H new ATOM 658 N SER A 42 70.368 -10.867 11.781 1.00 0.00 N ATOM 659 CA SER A 42 70.596 -12.106 12.570 1.00 0.00 C ATOM 660 C SER A 42 70.451 -13.347 11.692 1.00 0.00 C ATOM 661 O SER A 42 71.209 -14.290 11.803 1.00 0.00 O ATOM 662 CB SER A 42 69.532 -12.177 13.647 1.00 0.00 C ATOM 663 OG SER A 42 69.664 -11.065 14.521 1.00 0.00 O ATOM 0 H SER A 42 69.596 -10.284 12.104 1.00 0.00 H new ATOM 0 HA SER A 42 71.602 -12.078 12.988 1.00 0.00 H new ATOM 0 HB2 SER A 42 68.541 -12.180 13.194 1.00 0.00 H new ATOM 0 HB3 SER A 42 69.629 -13.107 14.208 1.00 0.00 H new ATOM 0 HG SER A 42 69.267 -10.272 14.104 1.00 0.00 H new ATOM 669 N SER A 43 69.482 -13.357 10.830 1.00 0.00 N ATOM 670 CA SER A 43 69.284 -14.547 9.954 1.00 0.00 C ATOM 671 C SER A 43 70.341 -14.542 8.871 1.00 0.00 C ATOM 672 O SER A 43 70.852 -15.567 8.479 1.00 0.00 O ATOM 673 CB SER A 43 67.889 -14.499 9.331 1.00 0.00 C ATOM 674 OG SER A 43 67.813 -13.396 8.437 1.00 0.00 O ATOM 0 H SER A 43 68.817 -12.597 10.690 1.00 0.00 H new ATOM 0 HA SER A 43 69.373 -15.461 10.542 1.00 0.00 H new ATOM 0 HB2 SER A 43 67.683 -15.428 8.799 1.00 0.00 H new ATOM 0 HB3 SER A 43 67.133 -14.403 10.110 1.00 0.00 H new ATOM 0 HG SER A 43 66.920 -13.363 8.034 1.00 0.00 H new ATOM 680 N PHE A 44 70.704 -13.397 8.398 1.00 0.00 N ATOM 681 CA PHE A 44 71.768 -13.367 7.362 1.00 0.00 C ATOM 682 C PHE A 44 73.020 -13.979 7.981 1.00 0.00 C ATOM 683 O PHE A 44 73.732 -14.737 7.354 1.00 0.00 O ATOM 684 CB PHE A 44 72.022 -11.931 6.891 1.00 0.00 C ATOM 685 CG PHE A 44 71.004 -11.558 5.833 1.00 0.00 C ATOM 686 CD1 PHE A 44 69.676 -11.308 6.196 1.00 0.00 C ATOM 687 CD2 PHE A 44 71.389 -11.479 4.487 1.00 0.00 C ATOM 688 CE1 PHE A 44 68.733 -10.975 5.216 1.00 0.00 C ATOM 689 CE2 PHE A 44 70.445 -11.148 3.507 1.00 0.00 C ATOM 690 CZ PHE A 44 69.118 -10.894 3.872 1.00 0.00 C ATOM 0 H PHE A 44 70.322 -12.492 8.673 1.00 0.00 H new ATOM 0 HA PHE A 44 71.469 -13.937 6.482 1.00 0.00 H new ATOM 0 HB2 PHE A 44 71.955 -11.243 7.734 1.00 0.00 H new ATOM 0 HB3 PHE A 44 73.031 -11.843 6.487 1.00 0.00 H new ATOM 0 HD1 PHE A 44 69.378 -11.372 7.232 1.00 0.00 H new ATOM 0 HD2 PHE A 44 72.414 -11.673 4.206 1.00 0.00 H new ATOM 0 HE1 PHE A 44 67.708 -10.781 5.497 1.00 0.00 H new ATOM 0 HE2 PHE A 44 70.741 -11.089 2.470 1.00 0.00 H new ATOM 0 HZ PHE A 44 68.391 -10.635 3.117 1.00 0.00 H new ATOM 700 N LEU A 45 73.271 -13.678 9.225 1.00 0.00 N ATOM 701 CA LEU A 45 74.454 -14.258 9.917 1.00 0.00 C ATOM 702 C LEU A 45 74.292 -15.787 9.969 1.00 0.00 C ATOM 703 O LEU A 45 75.111 -16.484 10.537 1.00 0.00 O ATOM 704 CB LEU A 45 74.550 -13.688 11.354 1.00 0.00 C ATOM 705 CG LEU A 45 75.519 -12.494 11.409 1.00 0.00 C ATOM 706 CD1 LEU A 45 74.911 -11.295 10.680 1.00 0.00 C ATOM 707 CD2 LEU A 45 75.772 -12.122 12.872 1.00 0.00 C ATOM 0 H LEU A 45 72.703 -13.051 9.795 1.00 0.00 H new ATOM 0 HA LEU A 45 75.365 -14.001 9.377 1.00 0.00 H new ATOM 0 HB2 LEU A 45 73.562 -13.375 11.692 1.00 0.00 H new ATOM 0 HB3 LEU A 45 74.888 -14.468 12.037 1.00 0.00 H new ATOM 0 HG LEU A 45 76.457 -12.767 10.926 1.00 0.00 H new ATOM 0 HD11 LEU A 45 75.603 -10.454 10.723 1.00 0.00 H new ATOM 0 HD12 LEU A 45 74.725 -11.558 9.639 1.00 0.00 H new ATOM 0 HD13 LEU A 45 73.971 -11.017 11.158 1.00 0.00 H new ATOM 0 HD21 LEU A 45 76.458 -11.276 12.919 1.00 0.00 H new ATOM 0 HD22 LEU A 45 74.829 -11.851 13.347 1.00 0.00 H new ATOM 0 HD23 LEU A 45 76.209 -12.973 13.394 1.00 0.00 H new ATOM 719 N ASP A 46 73.241 -16.316 9.392 1.00 0.00 N ATOM 720 CA ASP A 46 73.044 -17.793 9.433 1.00 0.00 C ATOM 721 C ASP A 46 74.237 -18.481 8.755 1.00 0.00 C ATOM 722 O ASP A 46 74.711 -19.504 9.206 1.00 0.00 O ATOM 723 CB ASP A 46 71.758 -18.183 8.686 1.00 0.00 C ATOM 724 CG ASP A 46 70.531 -17.883 9.553 1.00 0.00 C ATOM 725 OD1 ASP A 46 70.682 -17.807 10.761 1.00 0.00 O ATOM 726 OD2 ASP A 46 69.459 -17.733 8.990 1.00 0.00 O ATOM 0 H ASP A 46 72.518 -15.792 8.899 1.00 0.00 H new ATOM 0 HA ASP A 46 72.965 -18.108 10.474 1.00 0.00 H new ATOM 0 HB2 ASP A 46 71.693 -17.632 7.748 1.00 0.00 H new ATOM 0 HB3 ASP A 46 71.783 -19.243 8.433 1.00 0.00 H new ATOM 731 N VAL A 47 74.719 -17.927 7.666 1.00 0.00 N ATOM 732 CA VAL A 47 75.877 -18.546 6.941 1.00 0.00 C ATOM 733 C VAL A 47 76.880 -17.455 6.528 1.00 0.00 C ATOM 734 O VAL A 47 76.712 -16.777 5.536 1.00 0.00 O ATOM 735 CB VAL A 47 75.356 -19.279 5.695 1.00 0.00 C ATOM 736 CG1 VAL A 47 74.757 -20.628 6.101 1.00 0.00 C ATOM 737 CG2 VAL A 47 74.269 -18.441 5.015 1.00 0.00 C ATOM 0 H VAL A 47 74.359 -17.070 7.247 1.00 0.00 H new ATOM 0 HA VAL A 47 76.382 -19.255 7.597 1.00 0.00 H new ATOM 0 HB VAL A 47 76.186 -19.435 5.006 1.00 0.00 H new ATOM 0 HG11 VAL A 47 74.389 -21.144 5.214 1.00 0.00 H new ATOM 0 HG12 VAL A 47 75.523 -21.236 6.583 1.00 0.00 H new ATOM 0 HG13 VAL A 47 73.932 -20.466 6.795 1.00 0.00 H new ATOM 0 HG21 VAL A 47 73.904 -18.966 4.132 1.00 0.00 H new ATOM 0 HG22 VAL A 47 73.444 -18.282 5.710 1.00 0.00 H new ATOM 0 HG23 VAL A 47 74.684 -17.478 4.718 1.00 0.00 H new ATOM 747 N GLN A 48 77.931 -17.294 7.284 1.00 0.00 N ATOM 748 CA GLN A 48 78.950 -16.268 6.948 1.00 0.00 C ATOM 749 C GLN A 48 79.657 -16.681 5.661 1.00 0.00 C ATOM 750 O GLN A 48 80.339 -17.685 5.604 1.00 0.00 O ATOM 751 CB GLN A 48 79.971 -16.182 8.087 1.00 0.00 C ATOM 752 CG GLN A 48 81.007 -15.098 7.780 1.00 0.00 C ATOM 753 CD GLN A 48 82.021 -15.027 8.924 1.00 0.00 C ATOM 754 OE1 GLN A 48 83.082 -14.453 8.776 1.00 0.00 O ATOM 755 NE2 GLN A 48 81.741 -15.595 10.066 1.00 0.00 N ATOM 0 H GLN A 48 78.126 -17.835 8.126 1.00 0.00 H new ATOM 0 HA GLN A 48 78.474 -15.297 6.813 1.00 0.00 H new ATOM 0 HB2 GLN A 48 79.464 -15.957 9.025 1.00 0.00 H new ATOM 0 HB3 GLN A 48 80.467 -17.144 8.216 1.00 0.00 H new ATOM 0 HG2 GLN A 48 81.515 -15.320 6.842 1.00 0.00 H new ATOM 0 HG3 GLN A 48 80.515 -14.134 7.655 1.00 0.00 H new ATOM 0 HE21 GLN A 48 80.851 -16.077 10.191 1.00 0.00 H new ATOM 0 HE22 GLN A 48 82.412 -15.557 10.833 1.00 0.00 H new ATOM 764 N LYS A 49 79.493 -15.913 4.630 1.00 0.00 N ATOM 765 CA LYS A 49 80.144 -16.238 3.324 1.00 0.00 C ATOM 766 C LYS A 49 81.513 -15.552 3.235 1.00 0.00 C ATOM 767 O LYS A 49 82.541 -16.190 3.364 1.00 0.00 O ATOM 768 CB LYS A 49 79.251 -15.760 2.166 1.00 0.00 C ATOM 769 CG LYS A 49 77.808 -16.321 2.314 1.00 0.00 C ATOM 770 CD LYS A 49 77.584 -17.543 1.397 1.00 0.00 C ATOM 771 CE LYS A 49 78.394 -18.758 1.886 1.00 0.00 C ATOM 772 NZ LYS A 49 79.739 -18.752 1.240 1.00 0.00 N ATOM 0 H LYS A 49 78.931 -15.062 4.629 1.00 0.00 H new ATOM 0 HA LYS A 49 80.281 -17.317 3.254 1.00 0.00 H new ATOM 0 HB2 LYS A 49 79.222 -14.671 2.149 1.00 0.00 H new ATOM 0 HB3 LYS A 49 79.676 -16.083 1.216 1.00 0.00 H new ATOM 0 HG2 LYS A 49 77.631 -16.605 3.351 1.00 0.00 H new ATOM 0 HG3 LYS A 49 77.086 -15.542 2.069 1.00 0.00 H new ATOM 0 HD2 LYS A 49 76.524 -17.794 1.373 1.00 0.00 H new ATOM 0 HD3 LYS A 49 77.876 -17.294 0.377 1.00 0.00 H new ATOM 0 HE2 LYS A 49 78.500 -18.726 2.970 1.00 0.00 H new ATOM 0 HE3 LYS A 49 77.867 -19.681 1.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 79.890 -19.653 0.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 79.793 -17.968 0.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 80.473 -18.631 1.967 1.00 0.00 H new ATOM 786 N ASP A 50 81.543 -14.258 3.009 1.00 0.00 N ATOM 787 CA ASP A 50 82.852 -13.537 2.905 1.00 0.00 C ATOM 788 C ASP A 50 83.187 -12.866 4.243 1.00 0.00 C ATOM 789 O ASP A 50 82.638 -11.836 4.604 1.00 0.00 O ATOM 790 CB ASP A 50 82.771 -12.476 1.805 1.00 0.00 C ATOM 791 CG ASP A 50 84.154 -11.860 1.592 1.00 0.00 C ATOM 792 OD1 ASP A 50 85.026 -12.122 2.403 1.00 0.00 O ATOM 793 OD2 ASP A 50 84.317 -11.135 0.624 1.00 0.00 O ATOM 0 H ASP A 50 80.717 -13.671 2.892 1.00 0.00 H new ATOM 0 HA ASP A 50 83.635 -14.255 2.659 1.00 0.00 H new ATOM 0 HB2 ASP A 50 82.413 -12.924 0.878 1.00 0.00 H new ATOM 0 HB3 ASP A 50 82.055 -11.703 2.082 1.00 0.00 H new ATOM 798 N ALA A 51 84.099 -13.444 4.971 1.00 0.00 N ATOM 799 CA ALA A 51 84.501 -12.869 6.282 1.00 0.00 C ATOM 800 C ALA A 51 85.370 -11.643 6.038 1.00 0.00 C ATOM 801 O ALA A 51 85.583 -10.843 6.913 1.00 0.00 O ATOM 802 CB ALA A 51 85.301 -13.905 7.072 1.00 0.00 C ATOM 0 H ALA A 51 84.588 -14.300 4.710 1.00 0.00 H new ATOM 0 HA ALA A 51 83.613 -12.590 6.848 1.00 0.00 H new ATOM 0 HB1 ALA A 51 85.595 -13.482 8.033 1.00 0.00 H new ATOM 0 HB2 ALA A 51 84.687 -14.790 7.238 1.00 0.00 H new ATOM 0 HB3 ALA A 51 86.193 -14.182 6.510 1.00 0.00 H new ATOM 808 N ASP A 52 85.878 -11.506 4.850 1.00 0.00 N ATOM 809 CA ASP A 52 86.736 -10.338 4.519 1.00 0.00 C ATOM 810 C ASP A 52 85.871 -9.079 4.463 1.00 0.00 C ATOM 811 O ASP A 52 86.272 -8.021 4.895 1.00 0.00 O ATOM 812 CB ASP A 52 87.413 -10.561 3.161 1.00 0.00 C ATOM 813 CG ASP A 52 88.516 -9.520 2.961 1.00 0.00 C ATOM 814 OD1 ASP A 52 88.404 -8.447 3.530 1.00 0.00 O ATOM 815 OD2 ASP A 52 89.456 -9.813 2.240 1.00 0.00 O ATOM 0 H ASP A 52 85.734 -12.162 4.083 1.00 0.00 H new ATOM 0 HA ASP A 52 87.503 -10.220 5.284 1.00 0.00 H new ATOM 0 HB2 ASP A 52 87.834 -11.565 3.114 1.00 0.00 H new ATOM 0 HB3 ASP A 52 86.678 -10.485 2.360 1.00 0.00 H new ATOM 820 N ALA A 53 84.684 -9.185 3.920 1.00 0.00 N ATOM 821 CA ALA A 53 83.795 -7.984 3.833 1.00 0.00 C ATOM 822 C ALA A 53 83.374 -7.560 5.240 1.00 0.00 C ATOM 823 O ALA A 53 83.516 -6.415 5.623 1.00 0.00 O ATOM 824 CB ALA A 53 82.555 -8.319 3.004 1.00 0.00 C ATOM 0 H ALA A 53 84.293 -10.045 3.535 1.00 0.00 H new ATOM 0 HA ALA A 53 84.336 -7.167 3.354 1.00 0.00 H new ATOM 0 HB1 ALA A 53 81.910 -7.442 2.943 1.00 0.00 H new ATOM 0 HB2 ALA A 53 82.858 -8.617 2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 53 82.011 -9.137 3.477 1.00 0.00 H new ATOM 830 N VAL A 54 82.878 -8.476 6.017 1.00 0.00 N ATOM 831 CA VAL A 54 82.470 -8.122 7.418 1.00 0.00 C ATOM 832 C VAL A 54 83.710 -7.602 8.149 1.00 0.00 C ATOM 833 O VAL A 54 83.640 -6.707 8.963 1.00 0.00 O ATOM 834 CB VAL A 54 81.889 -9.391 8.117 1.00 0.00 C ATOM 835 CG1 VAL A 54 82.434 -9.561 9.551 1.00 0.00 C ATOM 836 CG2 VAL A 54 80.345 -9.316 8.186 1.00 0.00 C ATOM 0 H VAL A 54 82.734 -9.451 5.754 1.00 0.00 H new ATOM 0 HA VAL A 54 81.699 -7.352 7.426 1.00 0.00 H new ATOM 0 HB VAL A 54 82.199 -10.247 7.518 1.00 0.00 H new ATOM 0 HG11 VAL A 54 82.004 -10.456 10.000 1.00 0.00 H new ATOM 0 HG12 VAL A 54 83.519 -9.657 9.519 1.00 0.00 H new ATOM 0 HG13 VAL A 54 82.164 -8.690 10.148 1.00 0.00 H new ATOM 0 HG21 VAL A 54 79.959 -10.210 8.677 1.00 0.00 H new ATOM 0 HG22 VAL A 54 80.049 -8.434 8.753 1.00 0.00 H new ATOM 0 HG23 VAL A 54 79.938 -9.252 7.177 1.00 0.00 H new ATOM 846 N ASP A 55 84.836 -8.177 7.867 1.00 0.00 N ATOM 847 CA ASP A 55 86.098 -7.751 8.539 1.00 0.00 C ATOM 848 C ASP A 55 86.381 -6.270 8.249 1.00 0.00 C ATOM 849 O ASP A 55 86.808 -5.535 9.117 1.00 0.00 O ATOM 850 CB ASP A 55 87.253 -8.618 8.012 1.00 0.00 C ATOM 851 CG ASP A 55 88.571 -8.209 8.680 1.00 0.00 C ATOM 852 OD1 ASP A 55 88.658 -7.090 9.157 1.00 0.00 O ATOM 853 OD2 ASP A 55 89.477 -9.027 8.697 1.00 0.00 O ATOM 0 H ASP A 55 84.944 -8.934 7.192 1.00 0.00 H new ATOM 0 HA ASP A 55 86.000 -7.877 9.617 1.00 0.00 H new ATOM 0 HB2 ASP A 55 87.047 -9.670 8.211 1.00 0.00 H new ATOM 0 HB3 ASP A 55 87.336 -8.508 6.931 1.00 0.00 H new ATOM 858 N LYS A 56 86.146 -5.824 7.047 1.00 0.00 N ATOM 859 CA LYS A 56 86.405 -4.388 6.720 1.00 0.00 C ATOM 860 C LYS A 56 85.429 -3.505 7.485 1.00 0.00 C ATOM 861 O LYS A 56 85.769 -2.442 7.962 1.00 0.00 O ATOM 862 CB LYS A 56 86.232 -4.155 5.224 1.00 0.00 C ATOM 863 CG LYS A 56 87.375 -4.836 4.482 1.00 0.00 C ATOM 864 CD LYS A 56 87.212 -4.609 2.979 1.00 0.00 C ATOM 865 CE LYS A 56 88.356 -5.292 2.231 1.00 0.00 C ATOM 866 NZ LYS A 56 88.298 -4.922 0.790 1.00 0.00 N ATOM 0 H LYS A 56 85.787 -6.387 6.276 1.00 0.00 H new ATOM 0 HA LYS A 56 87.426 -4.138 7.007 1.00 0.00 H new ATOM 0 HB2 LYS A 56 85.275 -4.554 4.889 1.00 0.00 H new ATOM 0 HB3 LYS A 56 86.226 -3.087 5.007 1.00 0.00 H new ATOM 0 HG2 LYS A 56 88.331 -4.437 4.820 1.00 0.00 H new ATOM 0 HG3 LYS A 56 87.380 -5.904 4.701 1.00 0.00 H new ATOM 0 HD2 LYS A 56 86.255 -5.007 2.642 1.00 0.00 H new ATOM 0 HD3 LYS A 56 87.207 -3.541 2.761 1.00 0.00 H new ATOM 0 HE2 LYS A 56 89.313 -4.991 2.656 1.00 0.00 H new ATOM 0 HE3 LYS A 56 88.283 -6.374 2.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 89.077 -5.387 0.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 87.389 -5.230 0.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 88.388 -3.890 0.693 1.00 0.00 H new ATOM 880 N ILE A 57 84.215 -3.941 7.597 1.00 0.00 N ATOM 881 CA ILE A 57 83.198 -3.140 8.320 1.00 0.00 C ATOM 882 C ILE A 57 83.649 -2.934 9.763 1.00 0.00 C ATOM 883 O ILE A 57 83.508 -1.863 10.329 1.00 0.00 O ATOM 884 CB ILE A 57 81.875 -3.913 8.272 1.00 0.00 C ATOM 885 CG1 ILE A 57 81.334 -3.883 6.833 1.00 0.00 C ATOM 886 CG2 ILE A 57 80.858 -3.306 9.242 1.00 0.00 C ATOM 887 CD1 ILE A 57 80.116 -4.813 6.683 1.00 0.00 C ATOM 0 H ILE A 57 83.878 -4.825 7.216 1.00 0.00 H new ATOM 0 HA ILE A 57 83.070 -2.160 7.860 1.00 0.00 H new ATOM 0 HB ILE A 57 82.047 -4.946 8.576 1.00 0.00 H new ATOM 0 HG12 ILE A 57 81.053 -2.864 6.567 1.00 0.00 H new ATOM 0 HG13 ILE A 57 82.117 -4.189 6.140 1.00 0.00 H new ATOM 0 HG21 ILE A 57 79.926 -3.870 9.192 1.00 0.00 H new ATOM 0 HG22 ILE A 57 81.253 -3.348 10.257 1.00 0.00 H new ATOM 0 HG23 ILE A 57 80.669 -2.268 8.969 1.00 0.00 H new ATOM 0 HD11 ILE A 57 79.752 -4.774 5.656 1.00 0.00 H new ATOM 0 HD12 ILE A 57 80.406 -5.835 6.926 1.00 0.00 H new ATOM 0 HD13 ILE A 57 79.326 -4.490 7.360 1.00 0.00 H new ATOM 899 N MET A 58 84.206 -3.940 10.356 1.00 0.00 N ATOM 900 CA MET A 58 84.684 -3.803 11.750 1.00 0.00 C ATOM 901 C MET A 58 85.807 -2.764 11.800 1.00 0.00 C ATOM 902 O MET A 58 85.960 -2.052 12.772 1.00 0.00 O ATOM 903 CB MET A 58 85.188 -5.160 12.258 1.00 0.00 C ATOM 904 CG MET A 58 83.998 -6.046 12.664 1.00 0.00 C ATOM 905 SD MET A 58 82.710 -5.974 11.389 1.00 0.00 S ATOM 906 CE MET A 58 81.411 -6.861 12.291 1.00 0.00 C ATOM 0 H MET A 58 84.352 -4.857 9.934 1.00 0.00 H new ATOM 0 HA MET A 58 83.866 -3.473 12.390 1.00 0.00 H new ATOM 0 HB2 MET A 58 85.771 -5.654 11.481 1.00 0.00 H new ATOM 0 HB3 MET A 58 85.851 -5.015 13.111 1.00 0.00 H new ATOM 0 HG2 MET A 58 84.330 -7.075 12.800 1.00 0.00 H new ATOM 0 HG3 MET A 58 83.594 -5.712 13.620 1.00 0.00 H new ATOM 0 HE1 MET A 58 80.549 -7.005 11.640 1.00 0.00 H new ATOM 0 HE2 MET A 58 81.789 -7.832 12.612 1.00 0.00 H new ATOM 0 HE3 MET A 58 81.113 -6.280 13.164 1.00 0.00 H new ATOM 916 N LYS A 59 86.607 -2.680 10.769 1.00 0.00 N ATOM 917 CA LYS A 59 87.725 -1.695 10.788 1.00 0.00 C ATOM 918 C LYS A 59 87.204 -0.262 10.918 1.00 0.00 C ATOM 919 O LYS A 59 87.766 0.520 11.642 1.00 0.00 O ATOM 920 CB LYS A 59 88.564 -1.816 9.512 1.00 0.00 C ATOM 921 CG LYS A 59 89.344 -3.132 9.535 1.00 0.00 C ATOM 922 CD LYS A 59 90.183 -3.254 8.261 1.00 0.00 C ATOM 923 CE LYS A 59 90.959 -4.571 8.292 1.00 0.00 C ATOM 924 NZ LYS A 59 91.806 -4.681 7.069 1.00 0.00 N ATOM 0 H LYS A 59 86.535 -3.245 9.923 1.00 0.00 H new ATOM 0 HA LYS A 59 88.345 -1.919 11.656 1.00 0.00 H new ATOM 0 HB2 LYS A 59 87.918 -1.780 8.635 1.00 0.00 H new ATOM 0 HB3 LYS A 59 89.253 -0.974 9.436 1.00 0.00 H new ATOM 0 HG2 LYS A 59 89.990 -3.168 10.412 1.00 0.00 H new ATOM 0 HG3 LYS A 59 88.655 -3.973 9.611 1.00 0.00 H new ATOM 0 HD2 LYS A 59 89.539 -3.219 7.383 1.00 0.00 H new ATOM 0 HD3 LYS A 59 90.873 -2.414 8.184 1.00 0.00 H new ATOM 0 HE2 LYS A 59 91.583 -4.616 9.184 1.00 0.00 H new ATOM 0 HE3 LYS A 59 90.267 -5.412 8.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 92.333 -5.577 7.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 91.200 -4.657 6.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 92.476 -3.886 7.038 1.00 0.00 H new ATOM 938 N GLU A 60 86.150 0.098 10.228 1.00 0.00 N ATOM 939 CA GLU A 60 85.634 1.496 10.335 1.00 0.00 C ATOM 940 C GLU A 60 85.240 1.801 11.777 1.00 0.00 C ATOM 941 O GLU A 60 85.488 2.875 12.287 1.00 0.00 O ATOM 942 CB GLU A 60 84.406 1.657 9.434 1.00 0.00 C ATOM 943 CG GLU A 60 84.837 1.615 7.967 1.00 0.00 C ATOM 944 CD GLU A 60 85.617 2.887 7.628 1.00 0.00 C ATOM 945 OE1 GLU A 60 85.237 3.938 8.118 1.00 0.00 O ATOM 946 OE2 GLU A 60 86.577 2.789 6.882 1.00 0.00 O ATOM 0 H GLU A 60 85.628 -0.512 9.599 1.00 0.00 H new ATOM 0 HA GLU A 60 86.417 2.187 10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 60 83.688 0.862 9.635 1.00 0.00 H new ATOM 0 HB3 GLU A 60 83.905 2.601 9.650 1.00 0.00 H new ATOM 0 HG2 GLU A 60 85.456 0.737 7.784 1.00 0.00 H new ATOM 0 HG3 GLU A 60 83.962 1.529 7.322 1.00 0.00 H new ATOM 953 N LEU A 61 84.635 0.861 12.438 1.00 0.00 N ATOM 954 CA LEU A 61 84.222 1.086 13.849 1.00 0.00 C ATOM 955 C LEU A 61 85.478 1.235 14.706 1.00 0.00 C ATOM 956 O LEU A 61 85.472 1.842 15.758 1.00 0.00 O ATOM 957 CB LEU A 61 83.421 -0.125 14.331 1.00 0.00 C ATOM 958 CG LEU A 61 82.412 -0.551 13.259 1.00 0.00 C ATOM 959 CD1 LEU A 61 81.630 -1.748 13.776 1.00 0.00 C ATOM 960 CD2 LEU A 61 81.446 0.606 12.940 1.00 0.00 C ATOM 0 H LEU A 61 84.407 -0.059 12.062 1.00 0.00 H new ATOM 0 HA LEU A 61 83.610 1.984 13.926 1.00 0.00 H new ATOM 0 HB2 LEU A 61 84.096 -0.951 14.555 1.00 0.00 H new ATOM 0 HB3 LEU A 61 82.899 0.120 15.256 1.00 0.00 H new ATOM 0 HG LEU A 61 82.943 -0.816 12.345 1.00 0.00 H new ATOM 0 HD11 LEU A 61 80.907 -2.063 13.023 1.00 0.00 H new ATOM 0 HD12 LEU A 61 82.317 -2.568 13.985 1.00 0.00 H new ATOM 0 HD13 LEU A 61 81.105 -1.472 14.690 1.00 0.00 H new ATOM 0 HD21 LEU A 61 80.736 0.287 12.177 1.00 0.00 H new ATOM 0 HD22 LEU A 61 80.905 0.888 13.843 1.00 0.00 H new ATOM 0 HD23 LEU A 61 82.012 1.462 12.574 1.00 0.00 H new ATOM 972 N ASP A 62 86.551 0.666 14.247 1.00 0.00 N ATOM 973 CA ASP A 62 87.836 0.734 14.998 1.00 0.00 C ATOM 974 C ASP A 62 88.499 2.084 14.737 1.00 0.00 C ATOM 975 O ASP A 62 89.212 2.611 15.568 1.00 0.00 O ATOM 976 CB ASP A 62 88.757 -0.394 14.523 1.00 0.00 C ATOM 977 CG ASP A 62 89.972 -0.494 15.448 1.00 0.00 C ATOM 978 OD1 ASP A 62 90.187 0.430 16.213 1.00 0.00 O ATOM 979 OD2 ASP A 62 90.663 -1.498 15.377 1.00 0.00 O ATOM 0 H ASP A 62 86.596 0.148 13.370 1.00 0.00 H new ATOM 0 HA ASP A 62 87.648 0.623 16.066 1.00 0.00 H new ATOM 0 HB2 ASP A 62 88.215 -1.340 14.515 1.00 0.00 H new ATOM 0 HB3 ASP A 62 89.082 -0.205 13.500 1.00 0.00 H new ATOM 984 N GLU A 63 88.256 2.653 13.590 1.00 0.00 N ATOM 985 CA GLU A 63 88.851 3.972 13.273 1.00 0.00 C ATOM 986 C GLU A 63 88.355 4.960 14.323 1.00 0.00 C ATOM 987 O GLU A 63 89.090 5.781 14.834 1.00 0.00 O ATOM 988 CB GLU A 63 88.367 4.417 11.892 1.00 0.00 C ATOM 989 CG GLU A 63 88.978 3.532 10.802 1.00 0.00 C ATOM 990 CD GLU A 63 88.480 4.002 9.434 1.00 0.00 C ATOM 991 OE1 GLU A 63 87.856 5.048 9.381 1.00 0.00 O ATOM 992 OE2 GLU A 63 88.729 3.306 8.464 1.00 0.00 O ATOM 0 H GLU A 63 87.667 2.256 12.858 1.00 0.00 H new ATOM 0 HA GLU A 63 89.940 3.921 13.273 1.00 0.00 H new ATOM 0 HB2 GLU A 63 87.279 4.363 11.846 1.00 0.00 H new ATOM 0 HB3 GLU A 63 88.642 5.458 11.721 1.00 0.00 H new ATOM 0 HG2 GLU A 63 90.066 3.583 10.843 1.00 0.00 H new ATOM 0 HG3 GLU A 63 88.701 2.490 10.965 1.00 0.00 H new ATOM 999 N ASN A 64 87.099 4.855 14.652 1.00 0.00 N ATOM 1000 CA ASN A 64 86.496 5.744 15.677 1.00 0.00 C ATOM 1001 C ASN A 64 85.111 5.197 16.028 1.00 0.00 C ATOM 1002 O ASN A 64 84.100 5.738 15.628 1.00 0.00 O ATOM 1003 CB ASN A 64 86.369 7.165 15.124 1.00 0.00 C ATOM 1004 CG ASN A 64 86.072 8.130 16.273 1.00 0.00 C ATOM 1005 OD1 ASN A 64 86.807 8.186 17.239 1.00 0.00 O ATOM 1006 ND2 ASN A 64 85.020 8.895 16.211 1.00 0.00 N ATOM 0 H ASN A 64 86.455 4.177 14.245 1.00 0.00 H new ATOM 0 HA ASN A 64 87.126 5.774 16.566 1.00 0.00 H new ATOM 0 HB2 ASN A 64 87.291 7.455 14.619 1.00 0.00 H new ATOM 0 HB3 ASN A 64 85.572 7.209 14.382 1.00 0.00 H new ATOM 0 HD21 ASN A 64 84.813 9.541 16.973 1.00 0.00 H new ATOM 0 HD22 ASN A 64 84.403 8.848 15.400 1.00 0.00 H new ATOM 1013 N GLY A 65 85.058 4.118 16.762 1.00 0.00 N ATOM 1014 CA GLY A 65 83.738 3.524 17.127 1.00 0.00 C ATOM 1015 C GLY A 65 82.827 4.618 17.683 1.00 0.00 C ATOM 1016 O GLY A 65 81.617 4.521 17.631 1.00 0.00 O ATOM 0 H GLY A 65 85.872 3.622 17.125 1.00 0.00 H new ATOM 0 HA2 GLY A 65 83.280 3.063 16.252 1.00 0.00 H new ATOM 0 HA3 GLY A 65 83.873 2.736 17.868 1.00 0.00 H new ATOM 1020 N ASP A 66 83.402 5.656 18.226 1.00 0.00 N ATOM 1021 CA ASP A 66 82.583 6.761 18.803 1.00 0.00 C ATOM 1022 C ASP A 66 82.244 7.781 17.714 1.00 0.00 C ATOM 1023 O ASP A 66 81.589 8.772 17.966 1.00 0.00 O ATOM 1024 CB ASP A 66 83.384 7.453 19.906 1.00 0.00 C ATOM 1025 CG ASP A 66 83.562 6.496 21.086 1.00 0.00 C ATOM 1026 OD1 ASP A 66 82.688 5.669 21.289 1.00 0.00 O ATOM 1027 OD2 ASP A 66 84.573 6.601 21.760 1.00 0.00 O ATOM 0 H ASP A 66 84.411 5.787 18.295 1.00 0.00 H new ATOM 0 HA ASP A 66 81.660 6.351 19.212 1.00 0.00 H new ATOM 0 HB2 ASP A 66 84.357 7.761 19.524 1.00 0.00 H new ATOM 0 HB3 ASP A 66 82.869 8.357 20.232 1.00 0.00 H new ATOM 1032 N GLY A 67 82.687 7.557 16.505 1.00 0.00 N ATOM 1033 CA GLY A 67 82.390 8.518 15.423 1.00 0.00 C ATOM 1034 C GLY A 67 80.889 8.574 15.197 1.00 0.00 C ATOM 1035 O GLY A 67 80.101 8.330 16.090 1.00 0.00 O ATOM 0 H GLY A 67 83.242 6.747 16.228 1.00 0.00 H new ATOM 0 HA2 GLY A 67 82.767 9.507 15.686 1.00 0.00 H new ATOM 0 HA3 GLY A 67 82.896 8.218 14.506 1.00 0.00 H new ATOM 1039 N GLU A 68 80.486 8.894 14.006 1.00 0.00 N ATOM 1040 CA GLU A 68 79.026 8.980 13.709 1.00 0.00 C ATOM 1041 C GLU A 68 78.749 8.558 12.269 1.00 0.00 C ATOM 1042 O GLU A 68 79.585 8.668 11.393 1.00 0.00 O ATOM 1043 CB GLU A 68 78.549 10.419 13.931 1.00 0.00 C ATOM 1044 CG GLU A 68 77.035 10.509 13.714 1.00 0.00 C ATOM 1045 CD GLU A 68 76.570 11.943 13.969 1.00 0.00 C ATOM 1046 OE1 GLU A 68 77.365 12.723 14.467 1.00 0.00 O ATOM 1047 OE2 GLU A 68 75.425 12.237 13.665 1.00 0.00 O ATOM 0 H GLU A 68 81.102 9.101 13.220 1.00 0.00 H new ATOM 0 HA GLU A 68 78.486 8.307 14.376 1.00 0.00 H new ATOM 0 HB2 GLU A 68 78.800 10.742 14.941 1.00 0.00 H new ATOM 0 HB3 GLU A 68 79.064 11.091 13.245 1.00 0.00 H new ATOM 0 HG2 GLU A 68 76.784 10.209 12.697 1.00 0.00 H new ATOM 0 HG3 GLU A 68 76.519 9.823 14.385 1.00 0.00 H new ATOM 1054 N VAL A 69 77.567 8.064 12.035 1.00 0.00 N ATOM 1055 CA VAL A 69 77.165 7.604 10.677 1.00 0.00 C ATOM 1056 C VAL A 69 75.777 8.160 10.372 1.00 0.00 C ATOM 1057 O VAL A 69 75.054 8.545 11.277 1.00 0.00 O ATOM 1058 CB VAL A 69 77.112 6.070 10.691 1.00 0.00 C ATOM 1059 CG1 VAL A 69 78.556 5.488 10.738 1.00 0.00 C ATOM 1060 CG2 VAL A 69 76.288 5.612 11.932 1.00 0.00 C ATOM 0 H VAL A 69 76.844 7.957 12.747 1.00 0.00 H new ATOM 0 HA VAL A 69 77.872 7.946 9.921 1.00 0.00 H new ATOM 0 HB VAL A 69 76.632 5.702 9.784 1.00 0.00 H new ATOM 0 HG11 VAL A 69 78.509 4.399 10.748 1.00 0.00 H new ATOM 0 HG12 VAL A 69 79.111 5.820 9.860 1.00 0.00 H new ATOM 0 HG13 VAL A 69 79.060 5.838 11.639 1.00 0.00 H new ATOM 0 HG21 VAL A 69 76.241 4.523 11.956 1.00 0.00 H new ATOM 0 HG22 VAL A 69 76.768 5.975 12.841 1.00 0.00 H new ATOM 0 HG23 VAL A 69 75.278 6.017 11.868 1.00 0.00 H new ATOM 1070 N ASP A 70 75.402 8.214 9.112 1.00 0.00 N ATOM 1071 CA ASP A 70 74.054 8.753 8.745 1.00 0.00 C ATOM 1072 C ASP A 70 73.325 7.747 7.842 1.00 0.00 C ATOM 1073 O ASP A 70 73.633 6.571 7.828 1.00 0.00 O ATOM 1074 CB ASP A 70 74.228 10.078 8.000 1.00 0.00 C ATOM 1075 CG ASP A 70 74.823 11.124 8.946 1.00 0.00 C ATOM 1076 OD1 ASP A 70 74.735 10.924 10.146 1.00 0.00 O ATOM 1077 OD2 ASP A 70 75.353 12.106 8.453 1.00 0.00 O ATOM 0 H ASP A 70 75.973 7.908 8.324 1.00 0.00 H new ATOM 0 HA ASP A 70 73.467 8.915 9.649 1.00 0.00 H new ATOM 0 HB2 ASP A 70 74.881 9.939 7.138 1.00 0.00 H new ATOM 0 HB3 ASP A 70 73.266 10.422 7.620 1.00 0.00 H new ATOM 1082 N PHE A 71 72.338 8.201 7.116 1.00 0.00 N ATOM 1083 CA PHE A 71 71.551 7.284 6.239 1.00 0.00 C ATOM 1084 C PHE A 71 72.433 6.637 5.155 1.00 0.00 C ATOM 1085 O PHE A 71 72.327 5.465 4.898 1.00 0.00 O ATOM 1086 CB PHE A 71 70.404 8.086 5.588 1.00 0.00 C ATOM 1087 CG PHE A 71 70.839 8.674 4.252 1.00 0.00 C ATOM 1088 CD1 PHE A 71 71.846 9.646 4.197 1.00 0.00 C ATOM 1089 CD2 PHE A 71 70.237 8.231 3.068 1.00 0.00 C ATOM 1090 CE1 PHE A 71 72.245 10.170 2.971 1.00 0.00 C ATOM 1091 CE2 PHE A 71 70.638 8.760 1.840 1.00 0.00 C ATOM 1092 CZ PHE A 71 71.643 9.730 1.789 1.00 0.00 C ATOM 0 H PHE A 71 72.041 9.176 7.093 1.00 0.00 H new ATOM 0 HA PHE A 71 71.147 6.476 6.849 1.00 0.00 H new ATOM 0 HB2 PHE A 71 69.540 7.438 5.440 1.00 0.00 H new ATOM 0 HB3 PHE A 71 70.090 8.887 6.257 1.00 0.00 H new ATOM 0 HD1 PHE A 71 72.314 9.990 5.108 1.00 0.00 H new ATOM 0 HD2 PHE A 71 69.462 7.480 3.105 1.00 0.00 H new ATOM 0 HE1 PHE A 71 73.022 10.919 2.933 1.00 0.00 H new ATOM 0 HE2 PHE A 71 70.171 8.419 0.928 1.00 0.00 H new ATOM 0 HZ PHE A 71 71.954 10.138 0.839 1.00 0.00 H new ATOM 1102 N GLN A 72 73.271 7.394 4.501 1.00 0.00 N ATOM 1103 CA GLN A 72 74.129 6.807 3.428 1.00 0.00 C ATOM 1104 C GLN A 72 75.192 5.910 4.049 1.00 0.00 C ATOM 1105 O GLN A 72 75.633 4.958 3.455 1.00 0.00 O ATOM 1106 CB GLN A 72 74.817 7.920 2.631 1.00 0.00 C ATOM 1107 CG GLN A 72 75.690 7.311 1.525 1.00 0.00 C ATOM 1108 CD GLN A 72 76.339 8.437 0.719 1.00 0.00 C ATOM 1109 OE1 GLN A 72 76.149 9.596 1.020 1.00 0.00 O ATOM 1110 NE2 GLN A 72 77.098 8.144 -0.300 1.00 0.00 N ATOM 0 H GLN A 72 73.400 8.393 4.662 1.00 0.00 H new ATOM 0 HA GLN A 72 73.497 6.222 2.760 1.00 0.00 H new ATOM 0 HB2 GLN A 72 74.069 8.581 2.193 1.00 0.00 H new ATOM 0 HB3 GLN A 72 75.430 8.529 3.296 1.00 0.00 H new ATOM 0 HG2 GLN A 72 76.457 6.671 1.962 1.00 0.00 H new ATOM 0 HG3 GLN A 72 75.085 6.682 0.872 1.00 0.00 H new ATOM 0 HE21 GLN A 72 77.258 7.169 -0.553 1.00 0.00 H new ATOM 0 HE22 GLN A 72 77.532 8.890 -0.844 1.00 0.00 H new ATOM 1119 N GLU A 73 75.632 6.224 5.224 1.00 0.00 N ATOM 1120 CA GLU A 73 76.689 5.392 5.864 1.00 0.00 C ATOM 1121 C GLU A 73 76.055 4.116 6.399 1.00 0.00 C ATOM 1122 O GLU A 73 76.636 3.053 6.367 1.00 0.00 O ATOM 1123 CB GLU A 73 77.356 6.173 6.984 1.00 0.00 C ATOM 1124 CG GLU A 73 78.112 7.358 6.375 1.00 0.00 C ATOM 1125 CD GLU A 73 78.786 8.172 7.482 1.00 0.00 C ATOM 1126 OE1 GLU A 73 79.893 7.823 7.857 1.00 0.00 O ATOM 1127 OE2 GLU A 73 78.184 9.133 7.930 1.00 0.00 O ATOM 0 H GLU A 73 75.310 7.020 5.775 1.00 0.00 H new ATOM 0 HA GLU A 73 77.453 5.132 5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 73 76.609 6.527 7.695 1.00 0.00 H new ATOM 0 HB3 GLU A 73 78.042 5.531 7.536 1.00 0.00 H new ATOM 0 HG2 GLU A 73 78.861 6.999 5.669 1.00 0.00 H new ATOM 0 HG3 GLU A 73 77.423 7.990 5.815 1.00 0.00 H new ATOM 1134 N PHE A 74 74.856 4.226 6.879 1.00 0.00 N ATOM 1135 CA PHE A 74 74.134 3.043 7.405 1.00 0.00 C ATOM 1136 C PHE A 74 73.764 2.125 6.254 1.00 0.00 C ATOM 1137 O PHE A 74 73.790 0.925 6.358 1.00 0.00 O ATOM 1138 CB PHE A 74 72.850 3.529 8.069 1.00 0.00 C ATOM 1139 CG PHE A 74 72.002 2.357 8.512 1.00 0.00 C ATOM 1140 CD1 PHE A 74 71.060 1.812 7.632 1.00 0.00 C ATOM 1141 CD2 PHE A 74 72.143 1.825 9.801 1.00 0.00 C ATOM 1142 CE1 PHE A 74 70.263 0.733 8.039 1.00 0.00 C ATOM 1143 CE2 PHE A 74 71.344 0.751 10.206 1.00 0.00 C ATOM 1144 CZ PHE A 74 70.407 0.203 9.327 1.00 0.00 C ATOM 0 H PHE A 74 74.335 5.102 6.930 1.00 0.00 H new ATOM 0 HA PHE A 74 74.762 2.506 8.116 1.00 0.00 H new ATOM 0 HB2 PHE A 74 73.093 4.154 8.928 1.00 0.00 H new ATOM 0 HB3 PHE A 74 72.286 4.150 7.372 1.00 0.00 H new ATOM 0 HD1 PHE A 74 70.947 2.223 6.640 1.00 0.00 H new ATOM 0 HD2 PHE A 74 72.869 2.245 10.482 1.00 0.00 H new ATOM 0 HE1 PHE A 74 69.538 0.311 7.359 1.00 0.00 H new ATOM 0 HE2 PHE A 74 71.452 0.344 11.201 1.00 0.00 H new ATOM 0 HZ PHE A 74 69.794 -0.629 9.641 1.00 0.00 H new ATOM 1154 N VAL A 75 73.372 2.700 5.170 1.00 0.00 N ATOM 1155 CA VAL A 75 72.937 1.889 4.001 1.00 0.00 C ATOM 1156 C VAL A 75 74.125 1.242 3.296 1.00 0.00 C ATOM 1157 O VAL A 75 74.067 0.111 2.865 1.00 0.00 O ATOM 1158 CB VAL A 75 72.198 2.814 3.032 1.00 0.00 C ATOM 1159 CG1 VAL A 75 71.945 2.100 1.707 1.00 0.00 C ATOM 1160 CG2 VAL A 75 70.865 3.224 3.649 1.00 0.00 C ATOM 0 H VAL A 75 73.330 3.710 5.033 1.00 0.00 H new ATOM 0 HA VAL A 75 72.286 1.085 4.344 1.00 0.00 H new ATOM 0 HB VAL A 75 72.810 3.697 2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 75 71.418 2.770 1.027 1.00 0.00 H new ATOM 0 HG12 VAL A 75 72.897 1.808 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 75 71.339 1.211 1.883 1.00 0.00 H new ATOM 0 HG21 VAL A 75 70.334 3.883 2.963 1.00 0.00 H new ATOM 0 HG22 VAL A 75 70.263 2.335 3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 75 71.044 3.747 4.589 1.00 0.00 H new ATOM 1170 N VAL A 76 75.176 1.970 3.139 1.00 0.00 N ATOM 1171 CA VAL A 76 76.364 1.441 2.427 1.00 0.00 C ATOM 1172 C VAL A 76 77.059 0.370 3.264 1.00 0.00 C ATOM 1173 O VAL A 76 77.504 -0.641 2.756 1.00 0.00 O ATOM 1174 CB VAL A 76 77.294 2.627 2.165 1.00 0.00 C ATOM 1175 CG1 VAL A 76 78.651 2.152 1.656 1.00 0.00 C ATOM 1176 CG2 VAL A 76 76.645 3.544 1.127 1.00 0.00 C ATOM 0 H VAL A 76 75.270 2.927 3.478 1.00 0.00 H new ATOM 0 HA VAL A 76 76.077 0.969 1.487 1.00 0.00 H new ATOM 0 HB VAL A 76 77.452 3.168 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 76 79.294 3.013 1.477 1.00 0.00 H new ATOM 0 HG12 VAL A 76 79.112 1.503 2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 76 78.518 1.599 0.726 1.00 0.00 H new ATOM 0 HG21 VAL A 76 77.299 4.394 0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 76 76.484 2.990 0.202 1.00 0.00 H new ATOM 0 HG23 VAL A 76 75.688 3.903 1.506 1.00 0.00 H new ATOM 1186 N LEU A 77 77.162 0.587 4.539 1.00 0.00 N ATOM 1187 CA LEU A 77 77.835 -0.407 5.415 1.00 0.00 C ATOM 1188 C LEU A 77 76.921 -1.619 5.619 1.00 0.00 C ATOM 1189 O LEU A 77 77.384 -2.727 5.782 1.00 0.00 O ATOM 1190 CB LEU A 77 78.154 0.249 6.772 1.00 0.00 C ATOM 1191 CG LEU A 77 79.405 -0.395 7.413 1.00 0.00 C ATOM 1192 CD1 LEU A 77 80.685 0.073 6.688 1.00 0.00 C ATOM 1193 CD2 LEU A 77 79.475 0.000 8.903 1.00 0.00 C ATOM 0 H LEU A 77 76.807 1.415 5.017 1.00 0.00 H new ATOM 0 HA LEU A 77 78.762 -0.741 4.948 1.00 0.00 H new ATOM 0 HB2 LEU A 77 78.320 1.318 6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 77 77.301 0.142 7.442 1.00 0.00 H new ATOM 0 HG LEU A 77 79.332 -1.479 7.323 1.00 0.00 H new ATOM 0 HD11 LEU A 77 81.556 -0.390 7.152 1.00 0.00 H new ATOM 0 HD12 LEU A 77 80.636 -0.218 5.639 1.00 0.00 H new ATOM 0 HD13 LEU A 77 80.769 1.157 6.761 1.00 0.00 H new ATOM 0 HD21 LEU A 77 80.356 -0.452 9.358 1.00 0.00 H new ATOM 0 HD22 LEU A 77 79.538 1.085 8.989 1.00 0.00 H new ATOM 0 HD23 LEU A 77 78.580 -0.353 9.415 1.00 0.00 H new ATOM 1205 N VAL A 78 75.632 -1.414 5.632 1.00 0.00 N ATOM 1206 CA VAL A 78 74.705 -2.563 5.846 1.00 0.00 C ATOM 1207 C VAL A 78 74.732 -3.464 4.617 1.00 0.00 C ATOM 1208 O VAL A 78 74.730 -4.668 4.733 1.00 0.00 O ATOM 1209 CB VAL A 78 73.274 -2.058 6.099 1.00 0.00 C ATOM 1210 CG1 VAL A 78 72.289 -3.243 6.081 1.00 0.00 C ATOM 1211 CG2 VAL A 78 73.198 -1.365 7.473 1.00 0.00 C ATOM 0 H VAL A 78 75.182 -0.507 5.505 1.00 0.00 H new ATOM 0 HA VAL A 78 75.029 -3.128 6.720 1.00 0.00 H new ATOM 0 HB VAL A 78 73.009 -1.349 5.315 1.00 0.00 H new ATOM 0 HG11 VAL A 78 71.278 -2.878 6.261 1.00 0.00 H new ATOM 0 HG12 VAL A 78 72.330 -3.735 5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 78 72.562 -3.955 6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 78 72.182 -1.010 7.646 1.00 0.00 H new ATOM 0 HG22 VAL A 78 73.472 -2.074 8.254 1.00 0.00 H new ATOM 0 HG23 VAL A 78 73.886 -0.520 7.493 1.00 0.00 H new ATOM 1221 N ALA A 79 74.771 -2.901 3.439 1.00 0.00 N ATOM 1222 CA ALA A 79 74.820 -3.758 2.228 1.00 0.00 C ATOM 1223 C ALA A 79 76.123 -4.546 2.280 1.00 0.00 C ATOM 1224 O ALA A 79 76.182 -5.715 1.961 1.00 0.00 O ATOM 1225 CB ALA A 79 74.767 -2.880 0.968 1.00 0.00 C ATOM 0 H ALA A 79 74.771 -1.896 3.267 1.00 0.00 H new ATOM 0 HA ALA A 79 73.970 -4.440 2.196 1.00 0.00 H new ATOM 0 HB1 ALA A 79 74.803 -3.513 0.082 1.00 0.00 H new ATOM 0 HB2 ALA A 79 73.842 -2.304 0.965 1.00 0.00 H new ATOM 0 HB3 ALA A 79 75.618 -2.199 0.963 1.00 0.00 H new ATOM 1231 N ALA A 80 77.164 -3.892 2.701 1.00 0.00 N ATOM 1232 CA ALA A 80 78.487 -4.551 2.814 1.00 0.00 C ATOM 1233 C ALA A 80 78.396 -5.720 3.806 1.00 0.00 C ATOM 1234 O ALA A 80 79.020 -6.735 3.635 1.00 0.00 O ATOM 1235 CB ALA A 80 79.485 -3.505 3.315 1.00 0.00 C ATOM 0 H ALA A 80 77.152 -2.910 2.976 1.00 0.00 H new ATOM 0 HA ALA A 80 78.809 -4.945 1.850 1.00 0.00 H new ATOM 0 HB1 ALA A 80 80.471 -3.959 3.409 1.00 0.00 H new ATOM 0 HB2 ALA A 80 79.532 -2.678 2.606 1.00 0.00 H new ATOM 0 HB3 ALA A 80 79.163 -3.131 4.287 1.00 0.00 H new ATOM 1241 N LEU A 81 77.633 -5.585 4.849 1.00 0.00 N ATOM 1242 CA LEU A 81 77.533 -6.702 5.831 1.00 0.00 C ATOM 1243 C LEU A 81 76.766 -7.867 5.186 1.00 0.00 C ATOM 1244 O LEU A 81 77.081 -9.023 5.386 1.00 0.00 O ATOM 1245 CB LEU A 81 76.808 -6.205 7.098 1.00 0.00 C ATOM 1246 CG LEU A 81 77.286 -6.991 8.332 1.00 0.00 C ATOM 1247 CD1 LEU A 81 76.683 -6.370 9.596 1.00 0.00 C ATOM 1248 CD2 LEU A 81 76.869 -8.469 8.216 1.00 0.00 C ATOM 0 H LEU A 81 77.077 -4.758 5.066 1.00 0.00 H new ATOM 0 HA LEU A 81 78.527 -7.048 6.114 1.00 0.00 H new ATOM 0 HB2 LEU A 81 76.998 -5.141 7.240 1.00 0.00 H new ATOM 0 HB3 LEU A 81 75.731 -6.323 6.978 1.00 0.00 H new ATOM 0 HG LEU A 81 78.373 -6.942 8.390 1.00 0.00 H new ATOM 0 HD11 LEU A 81 77.021 -6.926 10.471 1.00 0.00 H new ATOM 0 HD12 LEU A 81 77.003 -5.332 9.680 1.00 0.00 H new ATOM 0 HD13 LEU A 81 75.595 -6.410 9.538 1.00 0.00 H new ATOM 0 HD21 LEU A 81 77.213 -9.014 9.095 1.00 0.00 H new ATOM 0 HD22 LEU A 81 75.783 -8.537 8.149 1.00 0.00 H new ATOM 0 HD23 LEU A 81 77.315 -8.904 7.322 1.00 0.00 H new ATOM 1260 N THR A 82 75.764 -7.563 4.406 1.00 0.00 N ATOM 1261 CA THR A 82 74.970 -8.629 3.734 1.00 0.00 C ATOM 1262 C THR A 82 75.875 -9.469 2.825 1.00 0.00 C ATOM 1263 O THR A 82 75.744 -10.674 2.746 1.00 0.00 O ATOM 1264 CB THR A 82 73.871 -7.966 2.901 1.00 0.00 C ATOM 1265 OG1 THR A 82 73.002 -7.240 3.760 1.00 0.00 O ATOM 1266 CG2 THR A 82 73.080 -9.029 2.138 1.00 0.00 C ATOM 0 H THR A 82 75.459 -6.611 4.204 1.00 0.00 H new ATOM 0 HA THR A 82 74.528 -9.286 4.483 1.00 0.00 H new ATOM 0 HB THR A 82 74.325 -7.283 2.183 1.00 0.00 H new ATOM 0 HG1 THR A 82 73.469 -6.452 4.108 1.00 0.00 H new ATOM 0 HG21 THR A 82 72.300 -8.548 1.548 1.00 0.00 H new ATOM 0 HG22 THR A 82 73.751 -9.576 1.476 1.00 0.00 H new ATOM 0 HG23 THR A 82 72.625 -9.722 2.846 1.00 0.00 H new ATOM 1274 N VAL A 83 76.786 -8.843 2.133 1.00 0.00 N ATOM 1275 CA VAL A 83 77.695 -9.600 1.224 1.00 0.00 C ATOM 1276 C VAL A 83 78.457 -10.644 2.039 1.00 0.00 C ATOM 1277 O VAL A 83 78.797 -11.707 1.559 1.00 0.00 O ATOM 1278 CB VAL A 83 78.659 -8.595 0.548 1.00 0.00 C ATOM 1279 CG1 VAL A 83 79.887 -8.282 1.420 1.00 0.00 C ATOM 1280 CG2 VAL A 83 79.159 -9.136 -0.787 1.00 0.00 C ATOM 0 H VAL A 83 76.941 -7.835 2.157 1.00 0.00 H new ATOM 0 HA VAL A 83 77.133 -10.120 0.449 1.00 0.00 H new ATOM 0 HB VAL A 83 78.084 -7.681 0.402 1.00 0.00 H new ATOM 0 HG11 VAL A 83 80.531 -7.573 0.900 1.00 0.00 H new ATOM 0 HG12 VAL A 83 79.561 -7.850 2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 83 80.441 -9.201 1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 83 79.835 -8.412 -1.243 1.00 0.00 H new ATOM 0 HG22 VAL A 83 79.689 -10.074 -0.624 1.00 0.00 H new ATOM 0 HG23 VAL A 83 78.311 -9.309 -1.450 1.00 0.00 H new ATOM 1290 N ALA A 84 78.725 -10.331 3.269 1.00 0.00 N ATOM 1291 CA ALA A 84 79.470 -11.279 4.144 1.00 0.00 C ATOM 1292 C ALA A 84 78.606 -12.504 4.465 1.00 0.00 C ATOM 1293 O ALA A 84 79.116 -13.560 4.768 1.00 0.00 O ATOM 1294 CB ALA A 84 79.851 -10.573 5.440 1.00 0.00 C ATOM 0 H ALA A 84 78.459 -9.452 3.714 1.00 0.00 H new ATOM 0 HA ALA A 84 80.368 -11.611 3.623 1.00 0.00 H new ATOM 0 HB1 ALA A 84 80.396 -11.263 6.084 1.00 0.00 H new ATOM 0 HB2 ALA A 84 80.481 -9.713 5.214 1.00 0.00 H new ATOM 0 HB3 ALA A 84 78.948 -10.238 5.951 1.00 0.00 H new ATOM 1300 N CYS A 85 77.305 -12.380 4.401 1.00 0.00 N ATOM 1301 CA CYS A 85 76.424 -13.534 4.695 1.00 0.00 C ATOM 1302 C CYS A 85 75.181 -13.387 3.818 1.00 0.00 C ATOM 1303 O CYS A 85 74.064 -13.408 4.296 1.00 0.00 O ATOM 1304 CB CYS A 85 76.047 -13.526 6.187 1.00 0.00 C ATOM 1305 SG CYS A 85 77.381 -12.756 7.140 1.00 0.00 S ATOM 0 H CYS A 85 76.818 -11.518 4.155 1.00 0.00 H new ATOM 0 HA CYS A 85 76.922 -14.480 4.483 1.00 0.00 H new ATOM 0 HB2 CYS A 85 75.116 -12.978 6.335 1.00 0.00 H new ATOM 0 HB3 CYS A 85 75.877 -14.545 6.536 1.00 0.00 H new ATOM 0 HG CYS A 85 77.064 -12.746 8.401 1.00 0.00 H new ATOM 1311 N ASN A 86 75.378 -13.219 2.534 1.00 0.00 N ATOM 1312 CA ASN A 86 74.222 -13.056 1.610 1.00 0.00 C ATOM 1313 C ASN A 86 73.451 -14.368 1.551 1.00 0.00 C ATOM 1314 O ASN A 86 73.105 -14.860 0.495 1.00 0.00 O ATOM 1315 CB ASN A 86 74.724 -12.677 0.215 1.00 0.00 C ATOM 1316 CG ASN A 86 75.488 -13.849 -0.400 1.00 0.00 C ATOM 1317 OD1 ASN A 86 75.705 -14.856 0.245 1.00 0.00 O ATOM 1318 ND2 ASN A 86 75.911 -13.760 -1.631 1.00 0.00 N ATOM 0 H ASN A 86 76.295 -13.188 2.088 1.00 0.00 H new ATOM 0 HA ASN A 86 73.567 -12.264 1.971 1.00 0.00 H new ATOM 0 HB2 ASN A 86 73.882 -12.406 -0.422 1.00 0.00 H new ATOM 0 HB3 ASN A 86 75.371 -11.802 0.277 1.00 0.00 H new ATOM 0 HD21 ASN A 86 76.423 -14.535 -2.051 1.00 0.00 H new ATOM 0 HD22 ASN A 86 75.729 -12.915 -2.173 1.00 0.00 H new ATOM 1465 N GLU B 3 62.562 -3.944 11.950 1.00 0.00 N ATOM 1466 CA GLU B 3 61.904 -3.000 11.003 1.00 0.00 C ATOM 1467 C GLU B 3 62.785 -2.799 9.768 1.00 0.00 C ATOM 1468 O GLU B 3 62.306 -2.793 8.649 1.00 0.00 O ATOM 1469 CB GLU B 3 61.704 -1.649 11.698 1.00 0.00 C ATOM 1470 CG GLU B 3 60.650 -1.790 12.798 1.00 0.00 C ATOM 1471 CD GLU B 3 60.452 -0.440 13.490 1.00 0.00 C ATOM 1472 OE1 GLU B 3 61.175 -0.169 14.434 1.00 0.00 O ATOM 1473 OE2 GLU B 3 59.581 0.300 13.063 1.00 0.00 O ATOM 0 HA GLU B 3 60.942 -3.412 10.697 1.00 0.00 H new ATOM 0 HB2 GLU B 3 62.646 -1.305 12.125 1.00 0.00 H new ATOM 0 HB3 GLU B 3 61.390 -0.898 10.973 1.00 0.00 H new ATOM 0 HG2 GLU B 3 59.708 -2.134 12.372 1.00 0.00 H new ATOM 0 HG3 GLU B 3 60.964 -2.540 13.524 1.00 0.00 H new ATOM 1480 N LEU B 4 64.065 -2.623 9.952 1.00 0.00 N ATOM 1481 CA LEU B 4 64.950 -2.412 8.774 1.00 0.00 C ATOM 1482 C LEU B 4 65.059 -3.715 7.978 1.00 0.00 C ATOM 1483 O LEU B 4 65.068 -3.708 6.768 1.00 0.00 O ATOM 1484 CB LEU B 4 66.348 -1.955 9.246 1.00 0.00 C ATOM 1485 CG LEU B 4 67.030 -1.024 8.216 1.00 0.00 C ATOM 1486 CD1 LEU B 4 66.929 -1.598 6.800 1.00 0.00 C ATOM 1487 CD2 LEU B 4 66.392 0.375 8.253 1.00 0.00 C ATOM 0 H LEU B 4 64.532 -2.616 10.859 1.00 0.00 H new ATOM 0 HA LEU B 4 64.526 -1.638 8.134 1.00 0.00 H new ATOM 0 HB2 LEU B 4 66.257 -1.436 10.200 1.00 0.00 H new ATOM 0 HB3 LEU B 4 66.977 -2.829 9.417 1.00 0.00 H new ATOM 0 HG LEU B 4 68.084 -0.947 8.484 1.00 0.00 H new ATOM 0 HD11 LEU B 4 67.417 -0.922 6.098 1.00 0.00 H new ATOM 0 HD12 LEU B 4 67.418 -2.571 6.766 1.00 0.00 H new ATOM 0 HD13 LEU B 4 65.880 -1.710 6.527 1.00 0.00 H new ATOM 0 HD21 LEU B 4 66.883 1.018 7.523 1.00 0.00 H new ATOM 0 HD22 LEU B 4 65.331 0.298 8.014 1.00 0.00 H new ATOM 0 HD23 LEU B 4 66.509 0.802 9.249 1.00 0.00 H new ATOM 1499 N GLU B 5 65.155 -4.831 8.650 1.00 0.00 N ATOM 1500 CA GLU B 5 65.278 -6.133 7.929 1.00 0.00 C ATOM 1501 C GLU B 5 64.055 -6.360 7.036 1.00 0.00 C ATOM 1502 O GLU B 5 64.171 -6.853 5.934 1.00 0.00 O ATOM 1503 CB GLU B 5 65.383 -7.271 8.954 1.00 0.00 C ATOM 1504 CG GLU B 5 65.545 -8.620 8.244 1.00 0.00 C ATOM 1505 CD GLU B 5 66.840 -8.622 7.428 1.00 0.00 C ATOM 1506 OE1 GLU B 5 67.873 -8.938 7.994 1.00 0.00 O ATOM 1507 OE2 GLU B 5 66.776 -8.307 6.251 1.00 0.00 O ATOM 0 H GLU B 5 65.154 -4.898 9.668 1.00 0.00 H new ATOM 0 HA GLU B 5 66.172 -6.114 7.305 1.00 0.00 H new ATOM 0 HB2 GLU B 5 66.233 -7.096 9.614 1.00 0.00 H new ATOM 0 HB3 GLU B 5 64.491 -7.288 9.580 1.00 0.00 H new ATOM 0 HG2 GLU B 5 65.564 -9.427 8.976 1.00 0.00 H new ATOM 0 HG3 GLU B 5 64.692 -8.803 7.591 1.00 0.00 H new ATOM 1514 N THR B 6 62.884 -6.022 7.500 1.00 0.00 N ATOM 1515 CA THR B 6 61.668 -6.243 6.665 1.00 0.00 C ATOM 1516 C THR B 6 61.793 -5.455 5.359 1.00 0.00 C ATOM 1517 O THR B 6 61.438 -5.928 4.297 1.00 0.00 O ATOM 1518 CB THR B 6 60.431 -5.768 7.431 1.00 0.00 C ATOM 1519 OG1 THR B 6 60.316 -6.505 8.641 1.00 0.00 O ATOM 1520 CG2 THR B 6 59.180 -5.998 6.578 1.00 0.00 C ATOM 0 H THR B 6 62.716 -5.605 8.415 1.00 0.00 H new ATOM 0 HA THR B 6 61.571 -7.305 6.439 1.00 0.00 H new ATOM 0 HB THR B 6 60.528 -4.706 7.655 1.00 0.00 H new ATOM 0 HG1 THR B 6 59.526 -6.202 9.135 1.00 0.00 H new ATOM 0 HG21 THR B 6 58.300 -5.659 7.124 1.00 0.00 H new ATOM 0 HG22 THR B 6 59.267 -5.438 5.647 1.00 0.00 H new ATOM 0 HG23 THR B 6 59.082 -7.060 6.355 1.00 0.00 H new ATOM 1528 N ALA B 7 62.301 -4.259 5.433 1.00 0.00 N ATOM 1529 CA ALA B 7 62.458 -3.434 4.203 1.00 0.00 C ATOM 1530 C ALA B 7 63.529 -4.053 3.298 1.00 0.00 C ATOM 1531 O ALA B 7 63.428 -4.027 2.089 1.00 0.00 O ATOM 1532 CB ALA B 7 62.878 -2.017 4.593 1.00 0.00 C ATOM 0 H ALA B 7 62.616 -3.814 6.295 1.00 0.00 H new ATOM 0 HA ALA B 7 61.509 -3.400 3.667 1.00 0.00 H new ATOM 0 HB1 ALA B 7 62.994 -1.411 3.694 1.00 0.00 H new ATOM 0 HB2 ALA B 7 62.115 -1.574 5.233 1.00 0.00 H new ATOM 0 HB3 ALA B 7 63.826 -2.053 5.130 1.00 0.00 H new ATOM 1538 N MET B 8 64.559 -4.598 3.882 1.00 0.00 N ATOM 1539 CA MET B 8 65.652 -5.208 3.076 1.00 0.00 C ATOM 1540 C MET B 8 65.083 -6.340 2.218 1.00 0.00 C ATOM 1541 O MET B 8 65.449 -6.507 1.072 1.00 0.00 O ATOM 1542 CB MET B 8 66.722 -5.768 4.017 1.00 0.00 C ATOM 1543 CG MET B 8 67.995 -6.075 3.225 1.00 0.00 C ATOM 1544 SD MET B 8 68.873 -4.529 2.878 1.00 0.00 S ATOM 1545 CE MET B 8 70.471 -5.262 2.451 1.00 0.00 C ATOM 0 H MET B 8 64.691 -4.647 4.892 1.00 0.00 H new ATOM 0 HA MET B 8 66.095 -4.451 2.429 1.00 0.00 H new ATOM 0 HB2 MET B 8 66.938 -5.049 4.807 1.00 0.00 H new ATOM 0 HB3 MET B 8 66.356 -6.673 4.502 1.00 0.00 H new ATOM 0 HG2 MET B 8 68.635 -6.751 3.792 1.00 0.00 H new ATOM 0 HG3 MET B 8 67.744 -6.581 2.293 1.00 0.00 H new ATOM 0 HE1 MET B 8 71.178 -4.472 2.198 1.00 0.00 H new ATOM 0 HE2 MET B 8 70.850 -5.829 3.301 1.00 0.00 H new ATOM 0 HE3 MET B 8 70.349 -5.927 1.596 1.00 0.00 H new ATOM 1555 N GLU B 9 64.188 -7.116 2.762 1.00 0.00 N ATOM 1556 CA GLU B 9 63.590 -8.235 1.979 1.00 0.00 C ATOM 1557 C GLU B 9 62.890 -7.654 0.748 1.00 0.00 C ATOM 1558 O GLU B 9 62.943 -8.208 -0.332 1.00 0.00 O ATOM 1559 CB GLU B 9 62.577 -8.993 2.851 1.00 0.00 C ATOM 1560 CG GLU B 9 62.317 -10.382 2.256 1.00 0.00 C ATOM 1561 CD GLU B 9 61.633 -10.242 0.895 1.00 0.00 C ATOM 1562 OE1 GLU B 9 60.871 -9.304 0.731 1.00 0.00 O ATOM 1563 OE2 GLU B 9 61.876 -11.081 0.044 1.00 0.00 O ATOM 0 H GLU B 9 63.843 -7.024 3.718 1.00 0.00 H new ATOM 0 HA GLU B 9 64.370 -8.929 1.665 1.00 0.00 H new ATOM 0 HB2 GLU B 9 62.958 -9.088 3.868 1.00 0.00 H new ATOM 0 HB3 GLU B 9 61.644 -8.433 2.911 1.00 0.00 H new ATOM 0 HG2 GLU B 9 63.257 -10.923 2.147 1.00 0.00 H new ATOM 0 HG3 GLU B 9 61.690 -10.965 2.930 1.00 0.00 H new ATOM 1570 N THR B 10 62.228 -6.543 0.910 1.00 0.00 N ATOM 1571 CA THR B 10 61.511 -5.915 -0.235 1.00 0.00 C ATOM 1572 C THR B 10 62.512 -5.580 -1.347 1.00 0.00 C ATOM 1573 O THR B 10 62.222 -5.732 -2.517 1.00 0.00 O ATOM 1574 CB THR B 10 60.821 -4.630 0.237 1.00 0.00 C ATOM 1575 OG1 THR B 10 59.894 -4.945 1.267 1.00 0.00 O ATOM 1576 CG2 THR B 10 60.069 -3.982 -0.930 1.00 0.00 C ATOM 0 H THR B 10 62.152 -6.039 1.793 1.00 0.00 H new ATOM 0 HA THR B 10 60.763 -6.609 -0.619 1.00 0.00 H new ATOM 0 HB THR B 10 61.575 -3.937 0.612 1.00 0.00 H new ATOM 0 HG1 THR B 10 59.453 -4.125 1.572 1.00 0.00 H new ATOM 0 HG21 THR B 10 59.581 -3.070 -0.587 1.00 0.00 H new ATOM 0 HG22 THR B 10 60.773 -3.740 -1.727 1.00 0.00 H new ATOM 0 HG23 THR B 10 59.317 -4.675 -1.308 1.00 0.00 H new ATOM 1584 N LEU B 11 63.679 -5.106 -1.000 1.00 0.00 N ATOM 1585 CA LEU B 11 64.675 -4.744 -2.050 1.00 0.00 C ATOM 1586 C LEU B 11 65.015 -5.975 -2.890 1.00 0.00 C ATOM 1587 O LEU B 11 65.157 -5.885 -4.092 1.00 0.00 O ATOM 1588 CB LEU B 11 65.950 -4.207 -1.389 1.00 0.00 C ATOM 1589 CG LEU B 11 65.631 -2.946 -0.574 1.00 0.00 C ATOM 1590 CD1 LEU B 11 66.888 -2.502 0.183 1.00 0.00 C ATOM 1591 CD2 LEU B 11 65.165 -1.814 -1.507 1.00 0.00 C ATOM 0 H LEU B 11 63.985 -4.954 -0.039 1.00 0.00 H new ATOM 0 HA LEU B 11 64.249 -3.975 -2.695 1.00 0.00 H new ATOM 0 HB2 LEU B 11 66.381 -4.969 -0.740 1.00 0.00 H new ATOM 0 HB3 LEU B 11 66.695 -3.978 -2.151 1.00 0.00 H new ATOM 0 HG LEU B 11 64.833 -3.170 0.134 1.00 0.00 H new ATOM 0 HD11 LEU B 11 66.666 -1.606 0.763 1.00 0.00 H new ATOM 0 HD12 LEU B 11 67.209 -3.299 0.854 1.00 0.00 H new ATOM 0 HD13 LEU B 11 67.684 -2.285 -0.529 1.00 0.00 H new ATOM 0 HD21 LEU B 11 64.942 -0.925 -0.917 1.00 0.00 H new ATOM 0 HD22 LEU B 11 65.954 -1.585 -2.224 1.00 0.00 H new ATOM 0 HD23 LEU B 11 64.269 -2.129 -2.042 1.00 0.00 H new ATOM 1603 N ILE B 12 65.149 -7.119 -2.287 1.00 0.00 N ATOM 1604 CA ILE B 12 65.479 -8.328 -3.092 1.00 0.00 C ATOM 1605 C ILE B 12 64.374 -8.567 -4.129 1.00 0.00 C ATOM 1606 O ILE B 12 64.632 -8.923 -5.262 1.00 0.00 O ATOM 1607 CB ILE B 12 65.567 -9.551 -2.174 1.00 0.00 C ATOM 1608 CG1 ILE B 12 66.776 -9.413 -1.243 1.00 0.00 C ATOM 1609 CG2 ILE B 12 65.729 -10.814 -3.024 1.00 0.00 C ATOM 1610 CD1 ILE B 12 66.713 -10.484 -0.147 1.00 0.00 C ATOM 0 H ILE B 12 65.046 -7.272 -1.284 1.00 0.00 H new ATOM 0 HA ILE B 12 66.435 -8.174 -3.593 1.00 0.00 H new ATOM 0 HB ILE B 12 64.656 -9.620 -1.579 1.00 0.00 H new ATOM 0 HG12 ILE B 12 67.699 -9.517 -1.813 1.00 0.00 H new ATOM 0 HG13 ILE B 12 66.789 -8.420 -0.794 1.00 0.00 H new ATOM 0 HG21 ILE B 12 65.792 -11.686 -2.372 1.00 0.00 H new ATOM 0 HG22 ILE B 12 64.871 -10.918 -3.688 1.00 0.00 H new ATOM 0 HG23 ILE B 12 66.640 -10.739 -3.618 1.00 0.00 H new ATOM 0 HD11 ILE B 12 67.575 -10.381 0.512 1.00 0.00 H new ATOM 0 HD12 ILE B 12 65.797 -10.360 0.431 1.00 0.00 H new ATOM 0 HD13 ILE B 12 66.722 -11.473 -0.604 1.00 0.00 H new ATOM 1622 N ASN B 13 63.146 -8.391 -3.733 1.00 0.00 N ATOM 1623 CA ASN B 13 62.006 -8.625 -4.665 1.00 0.00 C ATOM 1624 C ASN B 13 62.059 -7.669 -5.861 1.00 0.00 C ATOM 1625 O ASN B 13 61.746 -8.036 -6.971 1.00 0.00 O ATOM 1626 CB ASN B 13 60.698 -8.404 -3.905 1.00 0.00 C ATOM 1627 CG ASN B 13 60.528 -9.510 -2.863 1.00 0.00 C ATOM 1628 OD1 ASN B 13 60.358 -9.236 -1.691 1.00 0.00 O ATOM 1629 ND2 ASN B 13 60.576 -10.757 -3.241 1.00 0.00 N ATOM 0 H ASN B 13 62.879 -8.092 -2.795 1.00 0.00 H new ATOM 0 HA ASN B 13 62.068 -9.646 -5.042 1.00 0.00 H new ATOM 0 HB2 ASN B 13 60.706 -7.428 -3.419 1.00 0.00 H new ATOM 0 HB3 ASN B 13 59.856 -8.408 -4.597 1.00 0.00 H new ATOM 0 HD21 ASN B 13 60.471 -11.503 -2.553 1.00 0.00 H new ATOM 0 HD22 ASN B 13 60.719 -10.987 -4.225 1.00 0.00 H new ATOM 1636 N VAL B 14 62.409 -6.438 -5.649 1.00 0.00 N ATOM 1637 CA VAL B 14 62.433 -5.478 -6.789 1.00 0.00 C ATOM 1638 C VAL B 14 63.579 -5.792 -7.769 1.00 0.00 C ATOM 1639 O VAL B 14 63.407 -5.697 -8.970 1.00 0.00 O ATOM 1640 CB VAL B 14 62.585 -4.065 -6.261 1.00 0.00 C ATOM 1641 CG1 VAL B 14 62.489 -3.087 -7.433 1.00 0.00 C ATOM 1642 CG2 VAL B 14 61.473 -3.764 -5.250 1.00 0.00 C ATOM 0 H VAL B 14 62.679 -6.052 -4.744 1.00 0.00 H new ATOM 0 HA VAL B 14 61.492 -5.574 -7.331 1.00 0.00 H new ATOM 0 HB VAL B 14 63.551 -3.960 -5.767 1.00 0.00 H new ATOM 0 HG11 VAL B 14 62.597 -2.067 -7.065 1.00 0.00 H new ATOM 0 HG12 VAL B 14 63.282 -3.300 -8.150 1.00 0.00 H new ATOM 0 HG13 VAL B 14 61.520 -3.197 -7.920 1.00 0.00 H new ATOM 0 HG21 VAL B 14 61.588 -2.747 -4.875 1.00 0.00 H new ATOM 0 HG22 VAL B 14 60.503 -3.864 -5.736 1.00 0.00 H new ATOM 0 HG23 VAL B 14 61.536 -4.467 -4.419 1.00 0.00 H new ATOM 1652 N PHE B 15 64.746 -6.157 -7.290 1.00 0.00 N ATOM 1653 CA PHE B 15 65.865 -6.457 -8.243 1.00 0.00 C ATOM 1654 C PHE B 15 65.362 -7.502 -9.229 1.00 0.00 C ATOM 1655 O PHE B 15 65.675 -7.484 -10.404 1.00 0.00 O ATOM 1656 CB PHE B 15 67.081 -7.053 -7.509 1.00 0.00 C ATOM 1657 CG PHE B 15 67.548 -6.189 -6.346 1.00 0.00 C ATOM 1658 CD1 PHE B 15 67.510 -4.785 -6.405 1.00 0.00 C ATOM 1659 CD2 PHE B 15 68.047 -6.818 -5.196 1.00 0.00 C ATOM 1660 CE1 PHE B 15 67.963 -4.028 -5.318 1.00 0.00 C ATOM 1661 CE2 PHE B 15 68.499 -6.056 -4.112 1.00 0.00 C ATOM 1662 CZ PHE B 15 68.455 -4.662 -4.174 1.00 0.00 C ATOM 0 H PHE B 15 64.970 -6.259 -6.300 1.00 0.00 H new ATOM 0 HA PHE B 15 66.169 -5.533 -8.734 1.00 0.00 H new ATOM 0 HB2 PHE B 15 66.826 -8.046 -7.139 1.00 0.00 H new ATOM 0 HB3 PHE B 15 67.901 -7.178 -8.216 1.00 0.00 H new ATOM 0 HD1 PHE B 15 67.132 -4.291 -7.288 1.00 0.00 H new ATOM 0 HD2 PHE B 15 68.083 -7.896 -5.146 1.00 0.00 H new ATOM 0 HE1 PHE B 15 67.932 -2.949 -5.364 1.00 0.00 H new ATOM 0 HE2 PHE B 15 68.881 -6.546 -3.229 1.00 0.00 H new ATOM 0 HZ PHE B 15 68.801 -4.073 -3.337 1.00 0.00 H new ATOM 1672 N HIS B 16 64.579 -8.408 -8.740 1.00 0.00 N ATOM 1673 CA HIS B 16 64.019 -9.483 -9.592 1.00 0.00 C ATOM 1674 C HIS B 16 63.175 -8.883 -10.721 1.00 0.00 C ATOM 1675 O HIS B 16 63.192 -9.362 -11.835 1.00 0.00 O ATOM 1676 CB HIS B 16 63.140 -10.362 -8.714 1.00 0.00 C ATOM 1677 CG HIS B 16 62.542 -11.474 -9.530 1.00 0.00 C ATOM 1678 ND1 HIS B 16 63.315 -12.460 -10.126 1.00 0.00 N ATOM 1679 CD2 HIS B 16 61.240 -11.772 -9.851 1.00 0.00 C ATOM 1680 CE1 HIS B 16 62.478 -13.297 -10.770 1.00 0.00 C ATOM 1681 NE2 HIS B 16 61.206 -12.921 -10.632 1.00 0.00 N ATOM 0 H HIS B 16 64.295 -8.451 -7.761 1.00 0.00 H new ATOM 0 HA HIS B 16 64.826 -10.064 -10.038 1.00 0.00 H new ATOM 0 HB2 HIS B 16 63.729 -10.777 -7.896 1.00 0.00 H new ATOM 0 HB3 HIS B 16 62.348 -9.764 -8.265 1.00 0.00 H new ATOM 0 HD2 HIS B 16 60.376 -11.201 -9.544 1.00 0.00 H new ATOM 0 HE1 HIS B 16 62.798 -14.164 -11.328 1.00 0.00 H new ATOM 0 HE2 HIS B 16 60.381 -13.380 -11.019 1.00 0.00 H new ATOM 1690 N ALA B 17 62.414 -7.862 -10.441 1.00 0.00 N ATOM 1691 CA ALA B 17 61.551 -7.274 -11.507 1.00 0.00 C ATOM 1692 C ALA B 17 62.397 -6.799 -12.701 1.00 0.00 C ATOM 1693 O ALA B 17 62.135 -7.170 -13.829 1.00 0.00 O ATOM 1694 CB ALA B 17 60.772 -6.091 -10.930 1.00 0.00 C ATOM 0 H ALA B 17 62.351 -7.411 -9.528 1.00 0.00 H new ATOM 0 HA ALA B 17 60.861 -8.041 -11.859 1.00 0.00 H new ATOM 0 HB1 ALA B 17 60.140 -5.658 -11.706 1.00 0.00 H new ATOM 0 HB2 ALA B 17 60.149 -6.434 -10.104 1.00 0.00 H new ATOM 0 HB3 ALA B 17 61.471 -5.337 -10.569 1.00 0.00 H new ATOM 1700 N HIS B 18 63.397 -5.978 -12.487 1.00 0.00 N ATOM 1701 CA HIS B 18 64.217 -5.503 -13.654 1.00 0.00 C ATOM 1702 C HIS B 18 65.154 -6.614 -14.152 1.00 0.00 C ATOM 1703 O HIS B 18 65.353 -6.781 -15.340 1.00 0.00 O ATOM 1704 CB HIS B 18 65.071 -4.294 -13.247 1.00 0.00 C ATOM 1705 CG HIS B 18 64.186 -3.103 -13.002 1.00 0.00 C ATOM 1706 ND1 HIS B 18 63.612 -2.379 -14.038 1.00 0.00 N ATOM 1707 CD2 HIS B 18 63.781 -2.486 -11.843 1.00 0.00 C ATOM 1708 CE1 HIS B 18 62.903 -1.377 -13.487 1.00 0.00 C ATOM 1709 NE2 HIS B 18 62.974 -1.399 -12.156 1.00 0.00 N ATOM 0 H HIS B 18 63.680 -5.620 -11.575 1.00 0.00 H new ATOM 0 HA HIS B 18 63.528 -5.224 -14.451 1.00 0.00 H new ATOM 0 HB2 HIS B 18 65.641 -4.526 -12.347 1.00 0.00 H new ATOM 0 HB3 HIS B 18 65.793 -4.067 -14.031 1.00 0.00 H new ATOM 0 HD2 HIS B 18 64.048 -2.797 -10.844 1.00 0.00 H new ATOM 0 HE1 HIS B 18 62.345 -0.645 -14.053 1.00 0.00 H new ATOM 0 HE2 HIS B 18 62.529 -0.753 -11.504 1.00 0.00 H new ATOM 1718 N SER B 19 65.753 -7.357 -13.256 1.00 0.00 N ATOM 1719 CA SER B 19 66.706 -8.436 -13.677 1.00 0.00 C ATOM 1720 C SER B 19 65.977 -9.765 -13.890 1.00 0.00 C ATOM 1721 O SER B 19 66.585 -10.760 -14.230 1.00 0.00 O ATOM 1722 CB SER B 19 67.762 -8.626 -12.587 1.00 0.00 C ATOM 1723 OG SER B 19 68.474 -7.410 -12.399 1.00 0.00 O ATOM 0 H SER B 19 65.625 -7.265 -12.248 1.00 0.00 H new ATOM 0 HA SER B 19 67.169 -8.136 -14.617 1.00 0.00 H new ATOM 0 HB2 SER B 19 67.287 -8.929 -11.654 1.00 0.00 H new ATOM 0 HB3 SER B 19 68.450 -9.423 -12.868 1.00 0.00 H new ATOM 0 HG SER B 19 69.391 -7.514 -12.729 1.00 0.00 H new ATOM 1729 N GLY B 20 64.696 -9.805 -13.674 1.00 0.00 N ATOM 1730 CA GLY B 20 63.960 -11.093 -13.843 1.00 0.00 C ATOM 1731 C GLY B 20 63.995 -11.566 -15.304 1.00 0.00 C ATOM 1732 O GLY B 20 63.221 -12.416 -15.701 1.00 0.00 O ATOM 0 H GLY B 20 64.125 -9.009 -13.389 1.00 0.00 H new ATOM 0 HA2 GLY B 20 64.403 -11.855 -13.201 1.00 0.00 H new ATOM 0 HA3 GLY B 20 62.925 -10.968 -13.523 1.00 0.00 H new ATOM 1792 N LYS B 25 70.455 -12.248 -14.543 1.00 0.00 N ATOM 1793 CA LYS B 25 69.809 -12.225 -13.206 1.00 0.00 C ATOM 1794 C LYS B 25 70.519 -11.199 -12.323 1.00 0.00 C ATOM 1795 O LYS B 25 69.916 -10.596 -11.457 1.00 0.00 O ATOM 1796 CB LYS B 25 69.883 -13.619 -12.582 1.00 0.00 C ATOM 1797 CG LYS B 25 69.208 -13.608 -11.207 1.00 0.00 C ATOM 1798 CD LYS B 25 68.843 -15.040 -10.800 1.00 0.00 C ATOM 1799 CE LYS B 25 70.076 -15.943 -10.902 1.00 0.00 C ATOM 1800 NZ LYS B 25 71.269 -15.230 -10.364 1.00 0.00 N ATOM 0 HA LYS B 25 68.761 -11.942 -13.301 1.00 0.00 H new ATOM 0 HB2 LYS B 25 69.394 -14.345 -13.232 1.00 0.00 H new ATOM 0 HB3 LYS B 25 70.923 -13.929 -12.484 1.00 0.00 H new ATOM 0 HG2 LYS B 25 69.876 -13.168 -10.467 1.00 0.00 H new ATOM 0 HG3 LYS B 25 68.312 -12.988 -11.236 1.00 0.00 H new ATOM 0 HD2 LYS B 25 68.458 -15.050 -9.780 1.00 0.00 H new ATOM 0 HD3 LYS B 25 68.050 -15.419 -11.444 1.00 0.00 H new ATOM 0 HE2 LYS B 25 69.910 -16.865 -10.345 1.00 0.00 H new ATOM 0 HE3 LYS B 25 70.247 -16.225 -11.941 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 71.927 -15.919 -9.947 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 71.745 -14.719 -11.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 70.969 -14.553 -9.634 1.00 0.00 H new ATOM 1814 N TYR B 26 71.788 -10.981 -12.543 1.00 0.00 N ATOM 1815 CA TYR B 26 72.520 -9.970 -11.726 1.00 0.00 C ATOM 1816 C TYR B 26 71.762 -8.644 -11.832 1.00 0.00 C ATOM 1817 O TYR B 26 70.684 -8.589 -12.389 1.00 0.00 O ATOM 1818 CB TYR B 26 73.937 -9.785 -12.276 1.00 0.00 C ATOM 1819 CG TYR B 26 74.674 -11.101 -12.238 1.00 0.00 C ATOM 1820 CD1 TYR B 26 75.410 -11.464 -11.103 1.00 0.00 C ATOM 1821 CD2 TYR B 26 74.628 -11.956 -13.345 1.00 0.00 C ATOM 1822 CE1 TYR B 26 76.099 -12.683 -11.077 1.00 0.00 C ATOM 1823 CE2 TYR B 26 75.315 -13.175 -13.318 1.00 0.00 C ATOM 1824 CZ TYR B 26 76.051 -13.537 -12.185 1.00 0.00 C ATOM 1825 OH TYR B 26 76.731 -14.738 -12.160 1.00 0.00 O ATOM 0 H TYR B 26 72.348 -11.457 -13.250 1.00 0.00 H new ATOM 0 HA TYR B 26 72.584 -10.299 -10.689 1.00 0.00 H new ATOM 0 HB2 TYR B 26 73.894 -9.411 -13.299 1.00 0.00 H new ATOM 0 HB3 TYR B 26 74.472 -9.041 -11.686 1.00 0.00 H new ATOM 0 HD1 TYR B 26 75.446 -10.804 -10.249 1.00 0.00 H new ATOM 0 HD2 TYR B 26 74.062 -11.675 -14.221 1.00 0.00 H new ATOM 0 HE1 TYR B 26 76.667 -12.964 -10.203 1.00 0.00 H new ATOM 0 HE2 TYR B 26 75.277 -13.836 -14.171 1.00 0.00 H new ATOM 0 HH TYR B 26 76.592 -15.210 -13.007 1.00 0.00 H new ATOM 1835 N LYS B 27 72.294 -7.570 -11.317 1.00 0.00 N ATOM 1836 CA LYS B 27 71.543 -6.290 -11.429 1.00 0.00 C ATOM 1837 C LYS B 27 71.478 -5.877 -12.896 1.00 0.00 C ATOM 1838 O LYS B 27 70.481 -6.074 -13.545 1.00 0.00 O ATOM 1839 CB LYS B 27 72.200 -5.179 -10.582 1.00 0.00 C ATOM 1840 CG LYS B 27 71.688 -3.772 -10.985 1.00 0.00 C ATOM 1841 CD LYS B 27 70.154 -3.710 -10.914 1.00 0.00 C ATOM 1842 CE LYS B 27 69.664 -4.095 -9.508 1.00 0.00 C ATOM 1843 NZ LYS B 27 68.334 -3.470 -9.260 1.00 0.00 N ATOM 0 H LYS B 27 73.192 -7.522 -10.836 1.00 0.00 H new ATOM 0 HA LYS B 27 70.534 -6.438 -11.045 1.00 0.00 H new ATOM 0 HB2 LYS B 27 71.991 -5.354 -9.527 1.00 0.00 H new ATOM 0 HB3 LYS B 27 73.282 -5.221 -10.703 1.00 0.00 H new ATOM 0 HG2 LYS B 27 72.118 -3.020 -10.323 1.00 0.00 H new ATOM 0 HG3 LYS B 27 72.020 -3.535 -11.996 1.00 0.00 H new ATOM 0 HD2 LYS B 27 69.813 -2.705 -11.162 1.00 0.00 H new ATOM 0 HD3 LYS B 27 69.722 -4.385 -11.653 1.00 0.00 H new ATOM 0 HE2 LYS B 27 69.591 -5.179 -9.420 1.00 0.00 H new ATOM 0 HE3 LYS B 27 70.381 -3.762 -8.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 68.008 -3.715 -8.303 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 68.415 -2.437 -9.344 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 67.649 -3.822 -9.959 1.00 0.00 H new ATOM 1857 N LEU B 28 72.517 -5.286 -13.412 1.00 0.00 N ATOM 1858 CA LEU B 28 72.479 -4.825 -14.846 1.00 0.00 C ATOM 1859 C LEU B 28 73.879 -4.289 -15.221 1.00 0.00 C ATOM 1860 O LEU B 28 74.760 -4.207 -14.394 1.00 0.00 O ATOM 1861 CB LEU B 28 71.432 -3.668 -14.958 1.00 0.00 C ATOM 1862 CG LEU B 28 70.329 -3.870 -16.041 1.00 0.00 C ATOM 1863 CD1 LEU B 28 70.881 -4.357 -17.390 1.00 0.00 C ATOM 1864 CD2 LEU B 28 69.255 -4.858 -15.571 1.00 0.00 C ATOM 0 H LEU B 28 73.389 -5.099 -12.916 1.00 0.00 H new ATOM 0 HA LEU B 28 72.205 -5.642 -15.513 1.00 0.00 H new ATOM 0 HB2 LEU B 28 70.948 -3.543 -13.989 1.00 0.00 H new ATOM 0 HB3 LEU B 28 71.962 -2.740 -15.172 1.00 0.00 H new ATOM 0 HG LEU B 28 69.894 -2.881 -16.188 1.00 0.00 H new ATOM 0 HD11 LEU B 28 70.060 -4.477 -18.097 1.00 0.00 H new ATOM 0 HD12 LEU B 28 71.591 -3.626 -17.778 1.00 0.00 H new ATOM 0 HD13 LEU B 28 71.384 -5.314 -17.253 1.00 0.00 H new ATOM 0 HD21 LEU B 28 68.502 -4.975 -16.350 1.00 0.00 H new ATOM 0 HD22 LEU B 28 69.715 -5.824 -15.363 1.00 0.00 H new ATOM 0 HD23 LEU B 28 68.783 -4.478 -14.665 1.00 0.00 H new ATOM 1876 N SER B 29 74.074 -3.876 -16.440 1.00 0.00 N ATOM 1877 CA SER B 29 75.385 -3.296 -16.823 1.00 0.00 C ATOM 1878 C SER B 29 75.494 -1.941 -16.120 1.00 0.00 C ATOM 1879 O SER B 29 74.494 -1.298 -15.867 1.00 0.00 O ATOM 1880 CB SER B 29 75.427 -3.104 -18.337 1.00 0.00 C ATOM 1881 OG SER B 29 76.668 -2.519 -18.704 1.00 0.00 O ATOM 0 H SER B 29 73.381 -3.916 -17.187 1.00 0.00 H new ATOM 0 HA SER B 29 76.210 -3.948 -16.535 1.00 0.00 H new ATOM 0 HB2 SER B 29 75.302 -4.063 -18.840 1.00 0.00 H new ATOM 0 HB3 SER B 29 74.603 -2.466 -18.657 1.00 0.00 H new ATOM 0 HG SER B 29 76.664 -1.568 -18.466 1.00 0.00 H new ATOM 1887 N LYS B 30 76.669 -1.497 -15.769 1.00 0.00 N ATOM 1888 CA LYS B 30 76.749 -0.185 -15.051 1.00 0.00 C ATOM 1889 C LYS B 30 76.032 0.902 -15.876 1.00 0.00 C ATOM 1890 O LYS B 30 75.351 1.747 -15.339 1.00 0.00 O ATOM 1891 CB LYS B 30 78.225 0.225 -14.824 1.00 0.00 C ATOM 1892 CG LYS B 30 79.106 -1.025 -14.609 1.00 0.00 C ATOM 1893 CD LYS B 30 80.263 -0.710 -13.642 1.00 0.00 C ATOM 1894 CE LYS B 30 80.965 0.601 -14.038 1.00 0.00 C ATOM 1895 NZ LYS B 30 82.400 0.527 -13.644 1.00 0.00 N ATOM 0 H LYS B 30 77.558 -1.967 -15.940 1.00 0.00 H new ATOM 0 HA LYS B 30 76.263 -0.290 -14.081 1.00 0.00 H new ATOM 0 HB2 LYS B 30 78.588 0.790 -15.683 1.00 0.00 H new ATOM 0 HB3 LYS B 30 78.297 0.882 -13.957 1.00 0.00 H new ATOM 0 HG2 LYS B 30 78.501 -1.839 -14.209 1.00 0.00 H new ATOM 0 HG3 LYS B 30 79.505 -1.365 -15.565 1.00 0.00 H new ATOM 0 HD2 LYS B 30 79.881 -0.630 -12.624 1.00 0.00 H new ATOM 0 HD3 LYS B 30 80.982 -1.529 -13.649 1.00 0.00 H new ATOM 0 HE2 LYS B 30 80.878 0.764 -15.112 1.00 0.00 H new ATOM 0 HE3 LYS B 30 80.484 1.447 -13.548 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 82.777 1.489 -13.523 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 82.488 0.005 -12.749 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 82.939 0.035 -14.385 1.00 0.00 H new ATOM 1909 N LYS B 31 76.180 0.910 -17.171 1.00 0.00 N ATOM 1910 CA LYS B 31 75.501 1.974 -17.973 1.00 0.00 C ATOM 1911 C LYS B 31 73.971 1.874 -17.806 1.00 0.00 C ATOM 1912 O LYS B 31 73.306 2.844 -17.476 1.00 0.00 O ATOM 1913 CB LYS B 31 75.881 1.813 -19.450 1.00 0.00 C ATOM 1914 CG LYS B 31 75.213 2.899 -20.312 1.00 0.00 C ATOM 1915 CD LYS B 31 75.724 4.291 -19.897 1.00 0.00 C ATOM 1916 CE LYS B 31 75.508 5.286 -21.042 1.00 0.00 C ATOM 1917 NZ LYS B 31 76.341 4.885 -22.212 1.00 0.00 N ATOM 0 H LYS B 31 76.732 0.239 -17.705 1.00 0.00 H new ATOM 0 HA LYS B 31 75.823 2.953 -17.619 1.00 0.00 H new ATOM 0 HB2 LYS B 31 76.964 1.872 -19.559 1.00 0.00 H new ATOM 0 HB3 LYS B 31 75.578 0.827 -19.802 1.00 0.00 H new ATOM 0 HG2 LYS B 31 75.430 2.723 -21.366 1.00 0.00 H new ATOM 0 HG3 LYS B 31 74.130 2.851 -20.197 1.00 0.00 H new ATOM 0 HD2 LYS B 31 75.198 4.630 -19.004 1.00 0.00 H new ATOM 0 HD3 LYS B 31 76.783 4.239 -19.643 1.00 0.00 H new ATOM 0 HE2 LYS B 31 74.455 5.311 -21.323 1.00 0.00 H new ATOM 0 HE3 LYS B 31 75.775 6.292 -20.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 76.610 5.731 -22.753 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 77.199 4.401 -21.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 75.796 4.243 -22.822 1.00 0.00 H new ATOM 1931 N GLU B 32 73.401 0.714 -18.014 1.00 0.00 N ATOM 1932 CA GLU B 32 71.914 0.593 -17.848 1.00 0.00 C ATOM 1933 C GLU B 32 71.582 0.820 -16.388 1.00 0.00 C ATOM 1934 O GLU B 32 70.614 1.470 -16.055 1.00 0.00 O ATOM 1935 CB GLU B 32 71.417 -0.799 -18.247 1.00 0.00 C ATOM 1936 CG GLU B 32 69.876 -0.865 -18.120 1.00 0.00 C ATOM 1937 CD GLU B 32 69.240 0.048 -19.172 1.00 0.00 C ATOM 1938 OE1 GLU B 32 69.918 0.372 -20.133 1.00 0.00 O ATOM 1939 OE2 GLU B 32 68.088 0.407 -18.997 1.00 0.00 O ATOM 0 H GLU B 32 73.886 -0.141 -18.286 1.00 0.00 H new ATOM 0 HA GLU B 32 71.430 1.329 -18.490 1.00 0.00 H new ATOM 0 HB2 GLU B 32 71.716 -1.022 -19.271 1.00 0.00 H new ATOM 0 HB3 GLU B 32 71.876 -1.555 -17.610 1.00 0.00 H new ATOM 0 HG2 GLU B 32 69.532 -1.890 -18.257 1.00 0.00 H new ATOM 0 HG3 GLU B 32 69.569 -0.556 -17.121 1.00 0.00 H new ATOM 1946 N LEU B 33 72.392 0.288 -15.514 1.00 0.00 N ATOM 1947 CA LEU B 33 72.155 0.458 -14.057 1.00 0.00 C ATOM 1948 C LEU B 33 71.796 1.915 -13.792 1.00 0.00 C ATOM 1949 O LEU B 33 70.895 2.201 -13.052 1.00 0.00 O ATOM 1950 CB LEU B 33 73.447 0.054 -13.330 1.00 0.00 C ATOM 1951 CG LEU B 33 73.651 0.833 -12.006 1.00 0.00 C ATOM 1952 CD1 LEU B 33 74.591 0.056 -11.071 1.00 0.00 C ATOM 1953 CD2 LEU B 33 74.211 2.261 -12.260 1.00 0.00 C ATOM 0 H LEU B 33 73.217 -0.263 -15.753 1.00 0.00 H new ATOM 0 HA LEU B 33 71.334 -0.163 -13.699 1.00 0.00 H new ATOM 0 HB2 LEU B 33 73.422 -1.015 -13.119 1.00 0.00 H new ATOM 0 HB3 LEU B 33 74.299 0.230 -13.986 1.00 0.00 H new ATOM 0 HG LEU B 33 72.676 0.937 -11.531 1.00 0.00 H new ATOM 0 HD11 LEU B 33 74.726 0.614 -10.145 1.00 0.00 H new ATOM 0 HD12 LEU B 33 74.158 -0.919 -10.847 1.00 0.00 H new ATOM 0 HD13 LEU B 33 75.557 -0.079 -11.557 1.00 0.00 H new ATOM 0 HD21 LEU B 33 74.340 2.776 -11.308 1.00 0.00 H new ATOM 0 HD22 LEU B 33 75.173 2.190 -12.768 1.00 0.00 H new ATOM 0 HD23 LEU B 33 73.513 2.820 -12.883 1.00 0.00 H new ATOM 1965 N LYS B 34 72.476 2.828 -14.422 1.00 0.00 N ATOM 1966 CA LYS B 34 72.151 4.267 -14.217 1.00 0.00 C ATOM 1967 C LYS B 34 70.716 4.517 -14.632 1.00 0.00 C ATOM 1968 O LYS B 34 69.997 5.253 -13.996 1.00 0.00 O ATOM 1969 CB LYS B 34 73.069 5.130 -15.061 1.00 0.00 C ATOM 1970 CG LYS B 34 72.918 6.608 -14.654 1.00 0.00 C ATOM 1971 CD LYS B 34 73.643 6.898 -13.305 1.00 0.00 C ATOM 1972 CE LYS B 34 72.752 7.750 -12.392 1.00 0.00 C ATOM 1973 NZ LYS B 34 71.525 6.977 -12.052 1.00 0.00 N ATOM 0 H LYS B 34 73.242 2.642 -15.069 1.00 0.00 H new ATOM 0 HA LYS B 34 72.286 4.519 -13.165 1.00 0.00 H new ATOM 0 HB2 LYS B 34 74.103 4.812 -14.931 1.00 0.00 H new ATOM 0 HB3 LYS B 34 72.828 5.008 -16.117 1.00 0.00 H new ATOM 0 HG2 LYS B 34 73.329 7.247 -15.436 1.00 0.00 H new ATOM 0 HG3 LYS B 34 71.861 6.857 -14.562 1.00 0.00 H new ATOM 0 HD2 LYS B 34 73.891 5.960 -12.809 1.00 0.00 H new ATOM 0 HD3 LYS B 34 74.583 7.417 -13.494 1.00 0.00 H new ATOM 0 HE2 LYS B 34 73.291 8.018 -11.484 1.00 0.00 H new ATOM 0 HE3 LYS B 34 72.484 8.681 -12.891 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 70.884 7.572 -11.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 71.046 6.684 -12.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 71.787 6.134 -11.502 1.00 0.00 H new ATOM 1987 N ASP B 35 70.287 3.917 -15.693 1.00 0.00 N ATOM 1988 CA ASP B 35 68.887 4.139 -16.122 1.00 0.00 C ATOM 1989 C ASP B 35 67.950 3.692 -14.996 1.00 0.00 C ATOM 1990 O ASP B 35 66.890 4.251 -14.799 1.00 0.00 O ATOM 1991 CB ASP B 35 68.599 3.323 -17.383 1.00 0.00 C ATOM 1992 CG ASP B 35 67.199 3.661 -17.898 1.00 0.00 C ATOM 1993 OD1 ASP B 35 66.417 4.190 -17.126 1.00 0.00 O ATOM 1994 OD2 ASP B 35 66.935 3.388 -19.057 1.00 0.00 O ATOM 0 H ASP B 35 70.836 3.288 -16.279 1.00 0.00 H new ATOM 0 HA ASP B 35 68.730 5.196 -16.339 1.00 0.00 H new ATOM 0 HB2 ASP B 35 69.343 3.542 -18.149 1.00 0.00 H new ATOM 0 HB3 ASP B 35 68.671 2.258 -17.164 1.00 0.00 H new ATOM 1999 N LEU B 36 68.327 2.672 -14.267 1.00 0.00 N ATOM 2000 CA LEU B 36 67.451 2.171 -13.169 1.00 0.00 C ATOM 2001 C LEU B 36 67.442 3.135 -11.961 1.00 0.00 C ATOM 2002 O LEU B 36 66.397 3.557 -11.508 1.00 0.00 O ATOM 2003 CB LEU B 36 67.956 0.791 -12.708 1.00 0.00 C ATOM 2004 CG LEU B 36 67.424 -0.304 -13.637 1.00 0.00 C ATOM 2005 CD1 LEU B 36 67.768 0.040 -15.086 1.00 0.00 C ATOM 2006 CD2 LEU B 36 68.068 -1.640 -13.261 1.00 0.00 C ATOM 0 H LEU B 36 69.204 2.166 -14.386 1.00 0.00 H new ATOM 0 HA LEU B 36 66.434 2.100 -13.554 1.00 0.00 H new ATOM 0 HB2 LEU B 36 69.046 0.777 -12.704 1.00 0.00 H new ATOM 0 HB3 LEU B 36 67.631 0.600 -11.685 1.00 0.00 H new ATOM 0 HG LEU B 36 66.341 -0.377 -13.533 1.00 0.00 H new ATOM 0 HD11 LEU B 36 67.388 -0.741 -15.745 1.00 0.00 H new ATOM 0 HD12 LEU B 36 67.311 0.993 -15.352 1.00 0.00 H new ATOM 0 HD13 LEU B 36 68.850 0.113 -15.196 1.00 0.00 H new ATOM 0 HD21 LEU B 36 67.692 -2.423 -13.920 1.00 0.00 H new ATOM 0 HD22 LEU B 36 69.150 -1.565 -13.367 1.00 0.00 H new ATOM 0 HD23 LEU B 36 67.821 -1.885 -12.228 1.00 0.00 H new ATOM 2018 N LEU B 37 68.591 3.445 -11.404 1.00 0.00 N ATOM 2019 CA LEU B 37 68.624 4.331 -10.191 1.00 0.00 C ATOM 2020 C LEU B 37 68.017 5.697 -10.474 1.00 0.00 C ATOM 2021 O LEU B 37 67.242 6.225 -9.702 1.00 0.00 O ATOM 2022 CB LEU B 37 70.087 4.552 -9.716 1.00 0.00 C ATOM 2023 CG LEU B 37 71.018 3.428 -10.203 1.00 0.00 C ATOM 2024 CD1 LEU B 37 72.404 3.590 -9.550 1.00 0.00 C ATOM 2025 CD2 LEU B 37 70.433 2.025 -9.896 1.00 0.00 C ATOM 0 H LEU B 37 69.502 3.126 -11.733 1.00 0.00 H new ATOM 0 HA LEU B 37 68.041 3.826 -9.421 1.00 0.00 H new ATOM 0 HB2 LEU B 37 70.449 5.511 -10.086 1.00 0.00 H new ATOM 0 HB3 LEU B 37 70.113 4.600 -8.627 1.00 0.00 H new ATOM 0 HG LEU B 37 71.113 3.508 -11.286 1.00 0.00 H new ATOM 0 HD11 LEU B 37 73.064 2.794 -9.895 1.00 0.00 H new ATOM 0 HD12 LEU B 37 72.826 4.556 -9.827 1.00 0.00 H new ATOM 0 HD13 LEU B 37 72.304 3.535 -8.466 1.00 0.00 H new ATOM 0 HD21 LEU B 37 71.119 1.258 -10.255 1.00 0.00 H new ATOM 0 HD22 LEU B 37 70.297 1.915 -8.820 1.00 0.00 H new ATOM 0 HD23 LEU B 37 69.471 1.914 -10.397 1.00 0.00 H new ATOM 2037 N GLN B 38 68.403 6.284 -11.542 1.00 0.00 N ATOM 2038 CA GLN B 38 67.898 7.632 -11.862 1.00 0.00 C ATOM 2039 C GLN B 38 66.421 7.544 -12.219 1.00 0.00 C ATOM 2040 O GLN B 38 65.712 8.530 -12.230 1.00 0.00 O ATOM 2041 CB GLN B 38 68.696 8.180 -13.049 1.00 0.00 C ATOM 2042 CG GLN B 38 68.054 9.464 -13.564 1.00 0.00 C ATOM 2043 CD GLN B 38 68.984 10.119 -14.585 1.00 0.00 C ATOM 2044 OE1 GLN B 38 69.914 9.500 -15.061 1.00 0.00 O ATOM 2045 NE2 GLN B 38 68.773 11.357 -14.940 1.00 0.00 N ATOM 0 H GLN B 38 69.054 5.890 -12.221 1.00 0.00 H new ATOM 0 HA GLN B 38 68.014 8.296 -11.005 1.00 0.00 H new ATOM 0 HB2 GLN B 38 69.725 8.375 -12.747 1.00 0.00 H new ATOM 0 HB3 GLN B 38 68.733 7.438 -13.846 1.00 0.00 H new ATOM 0 HG2 GLN B 38 67.090 9.244 -14.022 1.00 0.00 H new ATOM 0 HG3 GLN B 38 67.865 10.147 -12.736 1.00 0.00 H new ATOM 0 HE21 GLN B 38 67.992 11.876 -14.540 1.00 0.00 H new ATOM 0 HE22 GLN B 38 69.389 11.805 -15.618 1.00 0.00 H new ATOM 2054 N THR B 39 65.957 6.372 -12.527 1.00 0.00 N ATOM 2055 CA THR B 39 64.523 6.219 -12.905 1.00 0.00 C ATOM 2056 C THR B 39 63.665 6.146 -11.640 1.00 0.00 C ATOM 2057 O THR B 39 62.556 6.639 -11.599 1.00 0.00 O ATOM 2058 CB THR B 39 64.376 4.947 -13.750 1.00 0.00 C ATOM 2059 OG1 THR B 39 64.752 5.235 -15.090 1.00 0.00 O ATOM 2060 CG2 THR B 39 62.930 4.428 -13.728 1.00 0.00 C ATOM 0 H THR B 39 66.504 5.511 -12.535 1.00 0.00 H new ATOM 0 HA THR B 39 64.186 7.075 -13.490 1.00 0.00 H new ATOM 0 HB THR B 39 65.022 4.176 -13.330 1.00 0.00 H new ATOM 0 HG1 THR B 39 65.466 4.624 -15.368 1.00 0.00 H new ATOM 0 HG21 THR B 39 62.858 3.526 -14.336 1.00 0.00 H new ATOM 0 HG22 THR B 39 62.641 4.198 -12.702 1.00 0.00 H new ATOM 0 HG23 THR B 39 62.263 5.191 -14.130 1.00 0.00 H new ATOM 2068 N GLU B 40 64.170 5.526 -10.611 1.00 0.00 N ATOM 2069 CA GLU B 40 63.385 5.407 -9.346 1.00 0.00 C ATOM 2070 C GLU B 40 63.666 6.614 -8.439 1.00 0.00 C ATOM 2071 O GLU B 40 63.048 6.782 -7.408 1.00 0.00 O ATOM 2072 CB GLU B 40 63.783 4.106 -8.640 1.00 0.00 C ATOM 2073 CG GLU B 40 65.274 4.138 -8.315 1.00 0.00 C ATOM 2074 CD GLU B 40 65.747 2.743 -7.904 1.00 0.00 C ATOM 2075 OE1 GLU B 40 65.669 1.845 -8.726 1.00 0.00 O ATOM 2076 OE2 GLU B 40 66.181 2.597 -6.773 1.00 0.00 O ATOM 0 H GLU B 40 65.094 5.095 -10.589 1.00 0.00 H new ATOM 0 HA GLU B 40 62.319 5.388 -9.571 1.00 0.00 H new ATOM 0 HB2 GLU B 40 63.203 3.984 -7.725 1.00 0.00 H new ATOM 0 HB3 GLU B 40 63.557 3.251 -9.277 1.00 0.00 H new ATOM 0 HG2 GLU B 40 65.837 4.481 -9.183 1.00 0.00 H new ATOM 0 HG3 GLU B 40 65.465 4.848 -7.510 1.00 0.00 H new ATOM 2083 N LEU B 41 64.597 7.455 -8.817 1.00 0.00 N ATOM 2084 CA LEU B 41 64.940 8.661 -7.986 1.00 0.00 C ATOM 2085 C LEU B 41 64.508 9.931 -8.720 1.00 0.00 C ATOM 2086 O LEU B 41 65.110 10.976 -8.580 1.00 0.00 O ATOM 2087 CB LEU B 41 66.461 8.692 -7.770 1.00 0.00 C ATOM 2088 CG LEU B 41 66.866 7.708 -6.656 1.00 0.00 C ATOM 2089 CD1 LEU B 41 68.334 7.312 -6.835 1.00 0.00 C ATOM 2090 CD2 LEU B 41 66.693 8.363 -5.275 1.00 0.00 C ATOM 0 H LEU B 41 65.142 7.360 -9.674 1.00 0.00 H new ATOM 0 HA LEU B 41 64.425 8.608 -7.027 1.00 0.00 H new ATOM 0 HB2 LEU B 41 66.972 8.432 -8.697 1.00 0.00 H new ATOM 0 HB3 LEU B 41 66.776 9.701 -7.505 1.00 0.00 H new ATOM 0 HG LEU B 41 66.228 6.827 -6.719 1.00 0.00 H new ATOM 0 HD11 LEU B 41 68.622 6.616 -6.047 1.00 0.00 H new ATOM 0 HD12 LEU B 41 68.467 6.836 -7.806 1.00 0.00 H new ATOM 0 HD13 LEU B 41 68.960 8.202 -6.779 1.00 0.00 H new ATOM 0 HD21 LEU B 41 66.983 7.656 -4.498 1.00 0.00 H new ATOM 0 HD22 LEU B 41 67.323 9.250 -5.212 1.00 0.00 H new ATOM 0 HD23 LEU B 41 65.650 8.648 -5.135 1.00 0.00 H new ATOM 2102 N SER B 42 63.485 9.844 -9.509 1.00 0.00 N ATOM 2103 CA SER B 42 63.023 11.037 -10.267 1.00 0.00 C ATOM 2104 C SER B 42 62.630 12.167 -9.320 1.00 0.00 C ATOM 2105 O SER B 42 62.920 13.322 -9.562 1.00 0.00 O ATOM 2106 CB SER B 42 61.788 10.644 -11.053 1.00 0.00 C ATOM 2107 OG SER B 42 62.119 9.617 -11.979 1.00 0.00 O ATOM 0 H SER B 42 62.943 8.995 -9.666 1.00 0.00 H new ATOM 0 HA SER B 42 63.830 11.377 -10.916 1.00 0.00 H new ATOM 0 HB2 SER B 42 61.008 10.299 -10.375 1.00 0.00 H new ATOM 0 HB3 SER B 42 61.390 11.510 -11.582 1.00 0.00 H new ATOM 0 HG SER B 42 62.200 8.763 -11.505 1.00 0.00 H new ATOM 2113 N SER B 43 61.965 11.850 -8.250 1.00 0.00 N ATOM 2114 CA SER B 43 61.545 12.915 -7.295 1.00 0.00 C ATOM 2115 C SER B 43 62.754 13.368 -6.503 1.00 0.00 C ATOM 2116 O SER B 43 62.915 14.528 -6.201 1.00 0.00 O ATOM 2117 CB SER B 43 60.477 12.370 -6.347 1.00 0.00 C ATOM 2118 OG SER B 43 61.045 11.343 -5.544 1.00 0.00 O ATOM 0 H SER B 43 61.692 10.902 -7.992 1.00 0.00 H new ATOM 0 HA SER B 43 61.128 13.759 -7.845 1.00 0.00 H new ATOM 0 HB2 SER B 43 60.091 13.170 -5.716 1.00 0.00 H new ATOM 0 HB3 SER B 43 59.634 11.979 -6.916 1.00 0.00 H new ATOM 0 HG SER B 43 60.364 10.991 -4.933 1.00 0.00 H new ATOM 2124 N PHE B 44 63.625 12.472 -6.184 1.00 0.00 N ATOM 2125 CA PHE B 44 64.836 12.900 -5.439 1.00 0.00 C ATOM 2126 C PHE B 44 65.568 13.914 -6.309 1.00 0.00 C ATOM 2127 O PHE B 44 66.060 14.918 -5.837 1.00 0.00 O ATOM 2128 CB PHE B 44 65.727 11.694 -5.116 1.00 0.00 C ATOM 2129 CG PHE B 44 65.216 11.013 -3.861 1.00 0.00 C ATOM 2130 CD1 PHE B 44 64.035 10.262 -3.900 1.00 0.00 C ATOM 2131 CD2 PHE B 44 65.919 11.148 -2.655 1.00 0.00 C ATOM 2132 CE1 PHE B 44 63.559 9.643 -2.736 1.00 0.00 C ATOM 2133 CE2 PHE B 44 65.442 10.530 -1.492 1.00 0.00 C ATOM 2134 CZ PHE B 44 64.263 9.777 -1.533 1.00 0.00 C ATOM 0 H PHE B 44 63.561 11.477 -6.399 1.00 0.00 H new ATOM 0 HA PHE B 44 64.564 13.352 -4.485 1.00 0.00 H new ATOM 0 HB2 PHE B 44 65.725 10.993 -5.950 1.00 0.00 H new ATOM 0 HB3 PHE B 44 66.758 12.017 -4.974 1.00 0.00 H new ATOM 0 HD1 PHE B 44 63.491 10.160 -4.827 1.00 0.00 H new ATOM 0 HD2 PHE B 44 66.829 11.729 -2.623 1.00 0.00 H new ATOM 0 HE1 PHE B 44 62.649 9.062 -2.767 1.00 0.00 H new ATOM 0 HE2 PHE B 44 65.984 10.635 -0.564 1.00 0.00 H new ATOM 0 HZ PHE B 44 63.896 9.299 -0.637 1.00 0.00 H new ATOM 2144 N LEU B 45 65.612 13.668 -7.589 1.00 0.00 N ATOM 2145 CA LEU B 45 66.275 14.622 -8.517 1.00 0.00 C ATOM 2146 C LEU B 45 65.535 15.968 -8.455 1.00 0.00 C ATOM 2147 O LEU B 45 65.861 16.896 -9.169 1.00 0.00 O ATOM 2148 CB LEU B 45 66.225 14.054 -9.958 1.00 0.00 C ATOM 2149 CG LEU B 45 67.538 13.337 -10.314 1.00 0.00 C ATOM 2150 CD1 LEU B 45 67.642 12.025 -9.535 1.00 0.00 C ATOM 2151 CD2 LEU B 45 67.554 13.037 -11.815 1.00 0.00 C ATOM 0 H LEU B 45 65.214 12.841 -8.033 1.00 0.00 H new ATOM 0 HA LEU B 45 67.316 14.766 -8.229 1.00 0.00 H new ATOM 0 HB2 LEU B 45 65.390 13.359 -10.050 1.00 0.00 H new ATOM 0 HB3 LEU B 45 66.045 14.863 -10.666 1.00 0.00 H new ATOM 0 HG LEU B 45 68.382 13.976 -10.053 1.00 0.00 H new ATOM 0 HD11 LEU B 45 68.574 11.522 -9.792 1.00 0.00 H new ATOM 0 HD12 LEU B 45 67.626 12.235 -8.465 1.00 0.00 H new ATOM 0 HD13 LEU B 45 66.800 11.382 -9.792 1.00 0.00 H new ATOM 0 HD21 LEU B 45 68.483 12.528 -12.075 1.00 0.00 H new ATOM 0 HD22 LEU B 45 66.708 12.398 -12.067 1.00 0.00 H new ATOM 0 HD23 LEU B 45 67.483 13.970 -12.373 1.00 0.00 H new ATOM 2163 N ASP B 46 64.534 16.083 -7.616 1.00 0.00 N ATOM 2164 CA ASP B 46 63.784 17.369 -7.536 1.00 0.00 C ATOM 2165 C ASP B 46 64.749 18.493 -7.133 1.00 0.00 C ATOM 2166 O ASP B 46 64.670 19.597 -7.634 1.00 0.00 O ATOM 2167 CB ASP B 46 62.666 17.273 -6.485 1.00 0.00 C ATOM 2168 CG ASP B 46 61.479 16.483 -7.048 1.00 0.00 C ATOM 2169 OD1 ASP B 46 61.355 16.409 -8.259 1.00 0.00 O ATOM 2170 OD2 ASP B 46 60.713 15.963 -6.253 1.00 0.00 O ATOM 0 H ASP B 46 64.208 15.347 -6.989 1.00 0.00 H new ATOM 0 HA ASP B 46 63.343 17.580 -8.510 1.00 0.00 H new ATOM 0 HB2 ASP B 46 63.043 16.786 -5.586 1.00 0.00 H new ATOM 0 HB3 ASP B 46 62.343 18.273 -6.195 1.00 0.00 H new ATOM 2175 N VAL B 47 65.654 18.221 -6.220 1.00 0.00 N ATOM 2176 CA VAL B 47 66.624 19.271 -5.767 1.00 0.00 C ATOM 2177 C VAL B 47 68.035 18.672 -5.659 1.00 0.00 C ATOM 2178 O VAL B 47 68.382 18.029 -4.689 1.00 0.00 O ATOM 2179 CB VAL B 47 66.176 19.811 -4.399 1.00 0.00 C ATOM 2180 CG1 VAL B 47 65.031 20.810 -4.592 1.00 0.00 C ATOM 2181 CG2 VAL B 47 65.685 18.657 -3.522 1.00 0.00 C ATOM 0 H VAL B 47 65.762 17.313 -5.768 1.00 0.00 H new ATOM 0 HA VAL B 47 66.646 20.085 -6.492 1.00 0.00 H new ATOM 0 HB VAL B 47 67.021 20.304 -3.918 1.00 0.00 H new ATOM 0 HG11 VAL B 47 64.714 21.192 -3.622 1.00 0.00 H new ATOM 0 HG12 VAL B 47 65.371 21.638 -5.214 1.00 0.00 H new ATOM 0 HG13 VAL B 47 64.192 20.312 -5.077 1.00 0.00 H new ATOM 0 HG21 VAL B 47 65.369 19.045 -2.554 1.00 0.00 H new ATOM 0 HG22 VAL B 47 64.843 18.164 -4.008 1.00 0.00 H new ATOM 0 HG23 VAL B 47 66.493 17.939 -3.379 1.00 0.00 H new ATOM 2191 N GLN B 48 68.853 18.889 -6.652 1.00 0.00 N ATOM 2192 CA GLN B 48 70.237 18.353 -6.622 1.00 0.00 C ATOM 2193 C GLN B 48 71.017 19.067 -5.520 1.00 0.00 C ATOM 2194 O GLN B 48 71.255 20.256 -5.579 1.00 0.00 O ATOM 2195 CB GLN B 48 70.908 18.618 -7.973 1.00 0.00 C ATOM 2196 CG GLN B 48 72.308 18.001 -7.987 1.00 0.00 C ATOM 2197 CD GLN B 48 72.973 18.281 -9.336 1.00 0.00 C ATOM 2198 OE1 GLN B 48 74.175 18.166 -9.470 1.00 0.00 O ATOM 2199 NE2 GLN B 48 72.237 18.651 -10.348 1.00 0.00 N ATOM 0 H GLN B 48 68.616 19.420 -7.490 1.00 0.00 H new ATOM 0 HA GLN B 48 70.219 17.280 -6.428 1.00 0.00 H new ATOM 0 HB2 GLN B 48 70.306 18.195 -8.777 1.00 0.00 H new ATOM 0 HB3 GLN B 48 70.972 19.691 -8.153 1.00 0.00 H new ATOM 0 HG2 GLN B 48 72.909 18.418 -7.179 1.00 0.00 H new ATOM 0 HG3 GLN B 48 72.246 16.926 -7.816 1.00 0.00 H new ATOM 0 HE21 GLN B 48 71.228 18.748 -10.236 1.00 0.00 H new ATOM 0 HE22 GLN B 48 72.671 18.843 -11.251 1.00 0.00 H new ATOM 2208 N LYS B 49 71.409 18.343 -4.518 1.00 0.00 N ATOM 2209 CA LYS B 49 72.176 18.954 -3.389 1.00 0.00 C ATOM 2210 C LYS B 49 73.682 18.852 -3.668 1.00 0.00 C ATOM 2211 O LYS B 49 74.323 19.828 -4.008 1.00 0.00 O ATOM 2212 CB LYS B 49 71.842 18.219 -2.081 1.00 0.00 C ATOM 2213 CG LYS B 49 70.304 18.181 -1.850 1.00 0.00 C ATOM 2214 CD LYS B 49 69.859 19.263 -0.843 1.00 0.00 C ATOM 2215 CE LYS B 49 69.986 20.672 -1.451 1.00 0.00 C ATOM 2216 NZ LYS B 49 71.348 21.214 -1.176 1.00 0.00 N ATOM 0 H LYS B 49 71.233 17.343 -4.425 1.00 0.00 H new ATOM 0 HA LYS B 49 71.900 20.004 -3.295 1.00 0.00 H new ATOM 0 HB2 LYS B 49 72.235 17.203 -2.118 1.00 0.00 H new ATOM 0 HB3 LYS B 49 72.329 18.718 -1.243 1.00 0.00 H new ATOM 0 HG2 LYS B 49 69.788 18.330 -2.799 1.00 0.00 H new ATOM 0 HG3 LYS B 49 70.014 17.197 -1.481 1.00 0.00 H new ATOM 0 HD2 LYS B 49 68.826 19.084 -0.545 1.00 0.00 H new ATOM 0 HD3 LYS B 49 70.467 19.197 0.059 1.00 0.00 H new ATOM 0 HE2 LYS B 49 69.809 20.633 -2.526 1.00 0.00 H new ATOM 0 HE3 LYS B 49 69.229 21.332 -1.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 71.270 22.063 -0.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 71.914 20.495 -0.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 71.811 21.462 -2.074 1.00 0.00 H new ATOM 2230 N ASP B 50 74.259 17.680 -3.519 1.00 0.00 N ATOM 2231 CA ASP B 50 75.729 17.521 -3.769 1.00 0.00 C ATOM 2232 C ASP B 50 75.963 16.964 -5.178 1.00 0.00 C ATOM 2233 O ASP B 50 75.778 15.787 -5.447 1.00 0.00 O ATOM 2234 CB ASP B 50 76.327 16.567 -2.732 1.00 0.00 C ATOM 2235 CG ASP B 50 77.848 16.534 -2.891 1.00 0.00 C ATOM 2236 OD1 ASP B 50 78.330 17.069 -3.874 1.00 0.00 O ATOM 2237 OD2 ASP B 50 78.503 15.975 -2.027 1.00 0.00 O ATOM 0 H ASP B 50 73.775 16.828 -3.235 1.00 0.00 H new ATOM 0 HA ASP B 50 76.212 18.495 -3.686 1.00 0.00 H new ATOM 0 HB2 ASP B 50 76.062 16.893 -1.726 1.00 0.00 H new ATOM 0 HB3 ASP B 50 75.915 15.566 -2.862 1.00 0.00 H new ATOM 2242 N ALA B 51 76.382 17.810 -6.074 1.00 0.00 N ATOM 2243 CA ALA B 51 76.649 17.373 -7.471 1.00 0.00 C ATOM 2244 C ALA B 51 77.950 16.583 -7.503 1.00 0.00 C ATOM 2245 O ALA B 51 78.234 15.883 -8.440 1.00 0.00 O ATOM 2246 CB ALA B 51 76.781 18.599 -8.375 1.00 0.00 C ATOM 0 H ALA B 51 76.553 18.800 -5.896 1.00 0.00 H new ATOM 0 HA ALA B 51 75.827 16.750 -7.824 1.00 0.00 H new ATOM 0 HB1 ALA B 51 76.977 18.277 -9.398 1.00 0.00 H new ATOM 0 HB2 ALA B 51 75.855 19.174 -8.346 1.00 0.00 H new ATOM 0 HB3 ALA B 51 77.605 19.221 -8.026 1.00 0.00 H new ATOM 2252 N ASP B 52 78.742 16.710 -6.482 1.00 0.00 N ATOM 2253 CA ASP B 52 80.033 15.977 -6.421 1.00 0.00 C ATOM 2254 C ASP B 52 79.752 14.487 -6.220 1.00 0.00 C ATOM 2255 O ASP B 52 80.410 13.643 -6.789 1.00 0.00 O ATOM 2256 CB ASP B 52 80.875 16.507 -5.255 1.00 0.00 C ATOM 2257 CG ASP B 52 82.305 15.980 -5.375 1.00 0.00 C ATOM 2258 OD1 ASP B 52 82.479 14.917 -5.950 1.00 0.00 O ATOM 2259 OD2 ASP B 52 83.204 16.646 -4.886 1.00 0.00 O ATOM 0 H ASP B 52 78.547 17.300 -5.673 1.00 0.00 H new ATOM 0 HA ASP B 52 80.583 16.125 -7.351 1.00 0.00 H new ATOM 0 HB2 ASP B 52 80.877 17.597 -5.260 1.00 0.00 H new ATOM 0 HB3 ASP B 52 80.439 16.193 -4.306 1.00 0.00 H new ATOM 2264 N ALA B 53 78.784 14.159 -5.402 1.00 0.00 N ATOM 2265 CA ALA B 53 78.469 12.715 -5.162 1.00 0.00 C ATOM 2266 C ALA B 53 77.922 12.093 -6.446 1.00 0.00 C ATOM 2267 O ALA B 53 78.396 11.073 -6.907 1.00 0.00 O ATOM 2268 CB ALA B 53 77.433 12.591 -4.045 1.00 0.00 C ATOM 0 H ALA B 53 78.201 14.823 -4.892 1.00 0.00 H new ATOM 0 HA ALA B 53 79.377 12.191 -4.865 1.00 0.00 H new ATOM 0 HB1 ALA B 53 77.207 11.539 -3.874 1.00 0.00 H new ATOM 0 HB2 ALA B 53 77.830 13.030 -3.130 1.00 0.00 H new ATOM 0 HB3 ALA B 53 76.522 13.116 -4.334 1.00 0.00 H new ATOM 2274 N VAL B 54 76.941 12.710 -7.037 1.00 0.00 N ATOM 2275 CA VAL B 54 76.378 12.157 -8.317 1.00 0.00 C ATOM 2276 C VAL B 54 77.509 12.117 -9.348 1.00 0.00 C ATOM 2277 O VAL B 54 77.594 11.225 -10.164 1.00 0.00 O ATOM 2278 CB VAL B 54 75.209 13.070 -8.799 1.00 0.00 C ATOM 2279 CG1 VAL B 54 75.289 13.352 -10.314 1.00 0.00 C ATOM 2280 CG2 VAL B 54 73.844 12.408 -8.498 1.00 0.00 C ATOM 0 H VAL B 54 76.501 13.567 -6.700 1.00 0.00 H new ATOM 0 HA VAL B 54 75.983 11.151 -8.175 1.00 0.00 H new ATOM 0 HB VAL B 54 75.301 14.011 -8.257 1.00 0.00 H new ATOM 0 HG11 VAL B 54 74.457 13.991 -10.610 1.00 0.00 H new ATOM 0 HG12 VAL B 54 76.230 13.853 -10.542 1.00 0.00 H new ATOM 0 HG13 VAL B 54 75.237 12.411 -10.862 1.00 0.00 H new ATOM 0 HG21 VAL B 54 73.040 13.059 -8.841 1.00 0.00 H new ATOM 0 HG22 VAL B 54 73.782 11.451 -9.016 1.00 0.00 H new ATOM 0 HG23 VAL B 54 73.747 12.247 -7.424 1.00 0.00 H new ATOM 2290 N ASP B 55 78.361 13.092 -9.317 1.00 0.00 N ATOM 2291 CA ASP B 55 79.488 13.148 -10.291 1.00 0.00 C ATOM 2292 C ASP B 55 80.376 11.905 -10.148 1.00 0.00 C ATOM 2293 O ASP B 55 80.831 11.347 -11.127 1.00 0.00 O ATOM 2294 CB ASP B 55 80.312 14.414 -10.016 1.00 0.00 C ATOM 2295 CG ASP B 55 81.484 14.510 -11.000 1.00 0.00 C ATOM 2296 OD1 ASP B 55 81.872 13.488 -11.542 1.00 0.00 O ATOM 2297 OD2 ASP B 55 81.978 15.608 -11.192 1.00 0.00 O ATOM 0 H ASP B 55 78.329 13.865 -8.652 1.00 0.00 H new ATOM 0 HA ASP B 55 79.094 13.173 -11.307 1.00 0.00 H new ATOM 0 HB2 ASP B 55 79.678 15.296 -10.108 1.00 0.00 H new ATOM 0 HB3 ASP B 55 80.688 14.397 -8.993 1.00 0.00 H new ATOM 2302 N LYS B 56 80.625 11.461 -8.948 1.00 0.00 N ATOM 2303 CA LYS B 56 81.485 10.253 -8.764 1.00 0.00 C ATOM 2304 C LYS B 56 80.769 9.027 -9.314 1.00 0.00 C ATOM 2305 O LYS B 56 81.367 8.154 -9.909 1.00 0.00 O ATOM 2306 CB LYS B 56 81.786 10.041 -7.284 1.00 0.00 C ATOM 2307 CG LYS B 56 82.726 11.143 -6.811 1.00 0.00 C ATOM 2308 CD LYS B 56 83.036 10.941 -5.326 1.00 0.00 C ATOM 2309 CE LYS B 56 83.948 12.065 -4.835 1.00 0.00 C ATOM 2310 NZ LYS B 56 84.382 11.780 -3.439 1.00 0.00 N ATOM 0 H LYS B 56 80.272 11.879 -8.087 1.00 0.00 H new ATOM 0 HA LYS B 56 82.422 10.403 -9.301 1.00 0.00 H new ATOM 0 HB2 LYS B 56 80.863 10.058 -6.705 1.00 0.00 H new ATOM 0 HB3 LYS B 56 82.242 9.063 -7.128 1.00 0.00 H new ATOM 0 HG2 LYS B 56 83.648 11.125 -7.392 1.00 0.00 H new ATOM 0 HG3 LYS B 56 82.269 12.120 -6.969 1.00 0.00 H new ATOM 0 HD2 LYS B 56 82.111 10.931 -4.749 1.00 0.00 H new ATOM 0 HD3 LYS B 56 83.517 9.975 -5.173 1.00 0.00 H new ATOM 0 HE2 LYS B 56 84.817 12.153 -5.486 1.00 0.00 H new ATOM 0 HE3 LYS B 56 83.422 13.019 -4.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 85.002 12.545 -3.105 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 83.547 11.717 -2.822 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 84.900 10.878 -3.414 1.00 0.00 H new ATOM 2324 N ILE B 57 79.492 8.957 -9.111 1.00 0.00 N ATOM 2325 CA ILE B 57 78.719 7.795 -9.607 1.00 0.00 C ATOM 2326 C ILE B 57 78.854 7.707 -11.124 1.00 0.00 C ATOM 2327 O ILE B 57 79.003 6.637 -11.691 1.00 0.00 O ATOM 2328 CB ILE B 57 77.255 8.003 -9.204 1.00 0.00 C ATOM 2329 CG1 ILE B 57 77.129 7.822 -7.684 1.00 0.00 C ATOM 2330 CG2 ILE B 57 76.352 7.011 -9.936 1.00 0.00 C ATOM 2331 CD1 ILE B 57 75.729 8.231 -7.201 1.00 0.00 C ATOM 0 H ILE B 57 78.944 9.662 -8.618 1.00 0.00 H new ATOM 0 HA ILE B 57 79.091 6.864 -9.179 1.00 0.00 H new ATOM 0 HB ILE B 57 76.940 9.009 -9.480 1.00 0.00 H new ATOM 0 HG12 ILE B 57 77.321 6.782 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE B 57 77.884 8.424 -7.178 1.00 0.00 H new ATOM 0 HG21 ILE B 57 75.316 7.173 -9.638 1.00 0.00 H new ATOM 0 HG22 ILE B 57 76.447 7.158 -11.012 1.00 0.00 H new ATOM 0 HG23 ILE B 57 76.648 5.993 -9.681 1.00 0.00 H new ATOM 0 HD11 ILE B 57 75.662 8.095 -6.122 1.00 0.00 H new ATOM 0 HD12 ILE B 57 75.551 9.278 -7.446 1.00 0.00 H new ATOM 0 HD13 ILE B 57 74.979 7.611 -7.692 1.00 0.00 H new ATOM 2343 N MET B 58 78.823 8.819 -11.784 1.00 0.00 N ATOM 2344 CA MET B 58 78.968 8.805 -13.257 1.00 0.00 C ATOM 2345 C MET B 58 80.357 8.275 -13.625 1.00 0.00 C ATOM 2346 O MET B 58 80.536 7.636 -14.642 1.00 0.00 O ATOM 2347 CB MET B 58 78.776 10.225 -13.808 1.00 0.00 C ATOM 2348 CG MET B 58 77.278 10.563 -13.879 1.00 0.00 C ATOM 2349 SD MET B 58 76.463 10.081 -12.333 1.00 0.00 S ATOM 2350 CE MET B 58 74.750 10.356 -12.858 1.00 0.00 C ATOM 0 H MET B 58 78.703 9.742 -11.367 1.00 0.00 H new ATOM 0 HA MET B 58 78.211 8.154 -13.695 1.00 0.00 H new ATOM 0 HB2 MET B 58 79.290 10.944 -13.170 1.00 0.00 H new ATOM 0 HB3 MET B 58 79.222 10.303 -14.799 1.00 0.00 H new ATOM 0 HG2 MET B 58 77.145 11.631 -14.053 1.00 0.00 H new ATOM 0 HG3 MET B 58 76.818 10.044 -14.720 1.00 0.00 H new ATOM 0 HE1 MET B 58 74.079 10.182 -12.017 1.00 0.00 H new ATOM 0 HE2 MET B 58 74.637 11.383 -13.207 1.00 0.00 H new ATOM 0 HE3 MET B 58 74.503 9.669 -13.667 1.00 0.00 H new ATOM 2360 N LYS B 59 81.351 8.554 -12.820 1.00 0.00 N ATOM 2361 CA LYS B 59 82.723 8.081 -13.159 1.00 0.00 C ATOM 2362 C LYS B 59 82.775 6.551 -13.228 1.00 0.00 C ATOM 2363 O LYS B 59 83.398 6.008 -14.104 1.00 0.00 O ATOM 2364 CB LYS B 59 83.729 8.572 -12.114 1.00 0.00 C ATOM 2365 CG LYS B 59 83.905 10.085 -12.248 1.00 0.00 C ATOM 2366 CD LYS B 59 84.910 10.580 -11.206 1.00 0.00 C ATOM 2367 CE LYS B 59 85.082 12.094 -11.345 1.00 0.00 C ATOM 2368 NZ LYS B 59 86.151 12.557 -10.417 1.00 0.00 N ATOM 0 H LYS B 59 81.272 9.083 -11.952 1.00 0.00 H new ATOM 0 HA LYS B 59 82.983 8.488 -14.136 1.00 0.00 H new ATOM 0 HB2 LYS B 59 83.380 8.323 -11.112 1.00 0.00 H new ATOM 0 HB3 LYS B 59 84.687 8.070 -12.251 1.00 0.00 H new ATOM 0 HG2 LYS B 59 84.254 10.333 -13.251 1.00 0.00 H new ATOM 0 HG3 LYS B 59 82.947 10.586 -12.110 1.00 0.00 H new ATOM 0 HD2 LYS B 59 84.562 10.333 -10.203 1.00 0.00 H new ATOM 0 HD3 LYS B 59 85.869 10.080 -11.343 1.00 0.00 H new ATOM 0 HE2 LYS B 59 85.341 12.349 -12.373 1.00 0.00 H new ATOM 0 HE3 LYS B 59 84.144 12.600 -11.118 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 86.270 13.586 -10.510 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 85.885 12.326 -9.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 87.046 12.083 -10.654 1.00 0.00 H new ATOM 2382 N GLU B 60 82.137 5.849 -12.322 1.00 0.00 N ATOM 2383 CA GLU B 60 82.184 4.356 -12.367 1.00 0.00 C ATOM 2384 C GLU B 60 81.603 3.853 -13.686 1.00 0.00 C ATOM 2385 O GLU B 60 82.114 2.932 -14.290 1.00 0.00 O ATOM 2386 CB GLU B 60 81.367 3.783 -11.206 1.00 0.00 C ATOM 2387 CG GLU B 60 82.088 4.059 -9.885 1.00 0.00 C ATOM 2388 CD GLU B 60 83.352 3.201 -9.806 1.00 0.00 C ATOM 2389 OE1 GLU B 60 83.299 2.062 -10.243 1.00 0.00 O ATOM 2390 OE2 GLU B 60 84.350 3.694 -9.308 1.00 0.00 O ATOM 0 H GLU B 60 81.589 6.244 -11.558 1.00 0.00 H new ATOM 0 HA GLU B 60 83.221 4.032 -12.284 1.00 0.00 H new ATOM 0 HB2 GLU B 60 80.374 4.232 -11.191 1.00 0.00 H new ATOM 0 HB3 GLU B 60 81.230 2.710 -11.340 1.00 0.00 H new ATOM 0 HG2 GLU B 60 82.347 5.115 -9.814 1.00 0.00 H new ATOM 0 HG3 GLU B 60 81.430 3.835 -9.045 1.00 0.00 H new ATOM 2397 N LEU B 61 80.545 4.454 -14.138 1.00 0.00 N ATOM 2398 CA LEU B 61 79.928 4.015 -15.418 1.00 0.00 C ATOM 2399 C LEU B 61 80.901 4.321 -16.556 1.00 0.00 C ATOM 2400 O LEU B 61 80.878 3.708 -17.606 1.00 0.00 O ATOM 2401 CB LEU B 61 78.629 4.791 -15.640 1.00 0.00 C ATOM 2402 CG LEU B 61 77.828 4.871 -14.335 1.00 0.00 C ATOM 2403 CD1 LEU B 61 76.551 5.648 -14.605 1.00 0.00 C ATOM 2404 CD2 LEU B 61 77.480 3.458 -13.829 1.00 0.00 C ATOM 0 H LEU B 61 80.077 5.234 -13.676 1.00 0.00 H new ATOM 0 HA LEU B 61 79.713 2.947 -15.387 1.00 0.00 H new ATOM 0 HB2 LEU B 61 78.854 5.795 -15.999 1.00 0.00 H new ATOM 0 HB3 LEU B 61 78.033 4.303 -16.411 1.00 0.00 H new ATOM 0 HG LEU B 61 78.422 5.371 -13.570 1.00 0.00 H new ATOM 0 HD11 LEU B 61 75.966 5.716 -13.688 1.00 0.00 H new ATOM 0 HD12 LEU B 61 76.802 6.651 -14.951 1.00 0.00 H new ATOM 0 HD13 LEU B 61 75.968 5.135 -15.370 1.00 0.00 H new ATOM 0 HD21 LEU B 61 76.912 3.533 -12.902 1.00 0.00 H new ATOM 0 HD22 LEU B 61 76.883 2.939 -14.579 1.00 0.00 H new ATOM 0 HD23 LEU B 61 78.399 2.900 -13.647 1.00 0.00 H new ATOM 2416 N ASP B 62 81.750 5.281 -16.340 1.00 0.00 N ATOM 2417 CA ASP B 62 82.742 5.675 -17.379 1.00 0.00 C ATOM 2418 C ASP B 62 83.910 4.695 -17.352 1.00 0.00 C ATOM 2419 O ASP B 62 84.549 4.441 -18.355 1.00 0.00 O ATOM 2420 CB ASP B 62 83.250 7.089 -17.081 1.00 0.00 C ATOM 2421 CG ASP B 62 84.067 7.603 -18.267 1.00 0.00 C ATOM 2422 OD1 ASP B 62 84.428 6.796 -19.107 1.00 0.00 O ATOM 2423 OD2 ASP B 62 84.315 8.796 -18.318 1.00 0.00 O ATOM 0 H ASP B 62 81.801 5.819 -15.475 1.00 0.00 H new ATOM 0 HA ASP B 62 82.275 5.658 -18.364 1.00 0.00 H new ATOM 0 HB2 ASP B 62 82.409 7.755 -16.890 1.00 0.00 H new ATOM 0 HB3 ASP B 62 83.863 7.083 -16.180 1.00 0.00 H new ATOM 2428 N GLU B 63 84.185 4.132 -16.210 1.00 0.00 N ATOM 2429 CA GLU B 63 85.297 3.158 -16.108 1.00 0.00 C ATOM 2430 C GLU B 63 84.981 2.006 -17.055 1.00 0.00 C ATOM 2431 O GLU B 63 85.829 1.505 -17.767 1.00 0.00 O ATOM 2432 CB GLU B 63 85.362 2.630 -14.674 1.00 0.00 C ATOM 2433 CG GLU B 63 85.841 3.732 -13.723 1.00 0.00 C ATOM 2434 CD GLU B 63 85.901 3.176 -12.300 1.00 0.00 C ATOM 2435 OE1 GLU B 63 85.760 1.974 -12.147 1.00 0.00 O ATOM 2436 OE2 GLU B 63 86.086 3.962 -11.386 1.00 0.00 O ATOM 0 H GLU B 63 83.683 4.308 -15.340 1.00 0.00 H new ATOM 0 HA GLU B 63 86.250 3.620 -16.366 1.00 0.00 H new ATOM 0 HB2 GLU B 63 84.379 2.275 -14.365 1.00 0.00 H new ATOM 0 HB3 GLU B 63 86.039 1.777 -14.624 1.00 0.00 H new ATOM 0 HG2 GLU B 63 86.824 4.090 -14.028 1.00 0.00 H new ATOM 0 HG3 GLU B 63 85.164 4.585 -13.765 1.00 0.00 H new ATOM 2443 N ASN B 64 83.742 1.606 -17.070 1.00 0.00 N ATOM 2444 CA ASN B 64 83.300 0.506 -17.963 1.00 0.00 C ATOM 2445 C ASN B 64 81.770 0.462 -17.942 1.00 0.00 C ATOM 2446 O ASN B 64 81.172 -0.405 -17.337 1.00 0.00 O ATOM 2447 CB ASN B 64 83.867 -0.826 -17.468 1.00 0.00 C ATOM 2448 CG ASN B 64 83.692 -1.886 -18.556 1.00 0.00 C ATOM 2449 OD1 ASN B 64 84.138 -1.708 -19.671 1.00 0.00 O ATOM 2450 ND2 ASN B 64 83.058 -2.991 -18.278 1.00 0.00 N ATOM 0 H ASN B 64 83.004 2.004 -16.489 1.00 0.00 H new ATOM 0 HA ASN B 64 83.658 0.677 -18.978 1.00 0.00 H new ATOM 0 HB2 ASN B 64 84.922 -0.715 -17.219 1.00 0.00 H new ATOM 0 HB3 ASN B 64 83.355 -1.136 -16.557 1.00 0.00 H new ATOM 0 HD21 ASN B 64 82.937 -3.704 -18.997 1.00 0.00 H new ATOM 0 HD22 ASN B 64 82.683 -3.142 -17.342 1.00 0.00 H new ATOM 2457 N GLY B 65 81.133 1.400 -18.592 1.00 0.00 N ATOM 2458 CA GLY B 65 79.642 1.426 -18.603 1.00 0.00 C ATOM 2459 C GLY B 65 79.114 0.040 -18.973 1.00 0.00 C ATOM 2460 O GLY B 65 78.012 -0.332 -18.624 1.00 0.00 O ATOM 0 H GLY B 65 81.583 2.150 -19.117 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.265 1.722 -17.624 1.00 0.00 H new ATOM 0 HA3 GLY B 65 79.285 2.166 -19.319 1.00 0.00 H new ATOM 2464 N ASP B 66 79.893 -0.724 -19.691 1.00 0.00 N ATOM 2465 CA ASP B 66 79.444 -2.085 -20.102 1.00 0.00 C ATOM 2466 C ASP B 66 79.796 -3.099 -19.012 1.00 0.00 C ATOM 2467 O ASP B 66 79.532 -4.278 -19.146 1.00 0.00 O ATOM 2468 CB ASP B 66 80.151 -2.478 -21.400 1.00 0.00 C ATOM 2469 CG ASP B 66 79.669 -1.576 -22.537 1.00 0.00 C ATOM 2470 OD1 ASP B 66 78.525 -1.155 -22.488 1.00 0.00 O ATOM 2471 OD2 ASP B 66 80.454 -1.315 -23.434 1.00 0.00 O ATOM 0 H ASP B 66 80.825 -0.462 -20.012 1.00 0.00 H new ATOM 0 HA ASP B 66 78.365 -2.077 -20.254 1.00 0.00 H new ATOM 0 HB2 ASP B 66 81.231 -2.385 -21.281 1.00 0.00 H new ATOM 0 HB3 ASP B 66 79.945 -3.522 -21.637 1.00 0.00 H new ATOM 2476 N GLY B 67 80.394 -2.660 -17.937 1.00 0.00 N ATOM 2477 CA GLY B 67 80.757 -3.606 -16.860 1.00 0.00 C ATOM 2478 C GLY B 67 79.494 -4.224 -16.287 1.00 0.00 C ATOM 2479 O GLY B 67 78.484 -4.345 -16.953 1.00 0.00 O ATOM 0 H GLY B 67 80.644 -1.686 -17.764 1.00 0.00 H new ATOM 0 HA2 GLY B 67 81.412 -4.385 -17.250 1.00 0.00 H new ATOM 0 HA3 GLY B 67 81.310 -3.088 -16.076 1.00 0.00 H new ATOM 2483 N GLU B 68 79.543 -4.617 -15.051 1.00 0.00 N ATOM 2484 CA GLU B 68 78.346 -5.243 -14.419 1.00 0.00 C ATOM 2485 C GLU B 68 78.282 -4.890 -12.934 1.00 0.00 C ATOM 2486 O GLU B 68 79.281 -4.627 -12.292 1.00 0.00 O ATOM 2487 CB GLU B 68 78.420 -6.765 -14.587 1.00 0.00 C ATOM 2488 CG GLU B 68 77.161 -7.418 -14.008 1.00 0.00 C ATOM 2489 CD GLU B 68 77.230 -8.931 -14.221 1.00 0.00 C ATOM 2490 OE1 GLU B 68 78.113 -9.368 -14.940 1.00 0.00 O ATOM 2491 OE2 GLU B 68 76.398 -9.626 -13.663 1.00 0.00 O ATOM 0 H GLU B 68 80.360 -4.534 -14.446 1.00 0.00 H new ATOM 0 HA GLU B 68 77.448 -4.863 -14.906 1.00 0.00 H new ATOM 0 HB2 GLU B 68 78.518 -7.018 -15.643 1.00 0.00 H new ATOM 0 HB3 GLU B 68 79.305 -7.152 -14.083 1.00 0.00 H new ATOM 0 HG2 GLU B 68 77.077 -7.193 -12.945 1.00 0.00 H new ATOM 0 HG3 GLU B 68 76.272 -7.012 -14.491 1.00 0.00 H new ATOM 2498 N VAL B 69 77.096 -4.878 -12.398 1.00 0.00 N ATOM 2499 CA VAL B 69 76.888 -4.543 -10.962 1.00 0.00 C ATOM 2500 C VAL B 69 75.936 -5.572 -10.361 1.00 0.00 C ATOM 2501 O VAL B 69 75.222 -6.249 -11.083 1.00 0.00 O ATOM 2502 CB VAL B 69 76.250 -3.150 -10.883 1.00 0.00 C ATOM 2503 CG1 VAL B 69 77.303 -2.060 -11.241 1.00 0.00 C ATOM 2504 CG2 VAL B 69 75.045 -3.100 -11.869 1.00 0.00 C ATOM 0 H VAL B 69 76.239 -5.092 -12.908 1.00 0.00 H new ATOM 0 HA VAL B 69 77.832 -4.552 -10.418 1.00 0.00 H new ATOM 0 HB VAL B 69 75.897 -2.955 -9.870 1.00 0.00 H new ATOM 0 HG11 VAL B 69 76.841 -1.075 -11.182 1.00 0.00 H new ATOM 0 HG12 VAL B 69 78.135 -2.113 -10.539 1.00 0.00 H new ATOM 0 HG13 VAL B 69 77.671 -2.228 -12.253 1.00 0.00 H new ATOM 0 HG21 VAL B 69 74.580 -2.115 -11.825 1.00 0.00 H new ATOM 0 HG22 VAL B 69 75.396 -3.290 -12.883 1.00 0.00 H new ATOM 0 HG23 VAL B 69 74.315 -3.859 -11.590 1.00 0.00 H new ATOM 2514 N ASP B 70 75.924 -5.705 -9.052 1.00 0.00 N ATOM 2515 CA ASP B 70 75.015 -6.698 -8.398 1.00 0.00 C ATOM 2516 C ASP B 70 74.198 -6.005 -7.300 1.00 0.00 C ATOM 2517 O ASP B 70 74.027 -4.802 -7.302 1.00 0.00 O ATOM 2518 CB ASP B 70 75.854 -7.821 -7.784 1.00 0.00 C ATOM 2519 CG ASP B 70 76.561 -8.598 -8.896 1.00 0.00 C ATOM 2520 OD1 ASP B 70 76.119 -8.506 -10.029 1.00 0.00 O ATOM 2521 OD2 ASP B 70 77.532 -9.274 -8.594 1.00 0.00 O ATOM 0 H ASP B 70 76.506 -5.167 -8.410 1.00 0.00 H new ATOM 0 HA ASP B 70 74.335 -7.115 -9.141 1.00 0.00 H new ATOM 0 HB2 ASP B 70 76.588 -7.405 -7.094 1.00 0.00 H new ATOM 0 HB3 ASP B 70 75.217 -8.491 -7.206 1.00 0.00 H new ATOM 2526 N PHE B 71 73.663 -6.766 -6.383 1.00 0.00 N ATOM 2527 CA PHE B 71 72.820 -6.179 -5.299 1.00 0.00 C ATOM 2528 C PHE B 71 73.618 -5.190 -4.428 1.00 0.00 C ATOM 2529 O PHE B 71 73.133 -4.139 -4.092 1.00 0.00 O ATOM 2530 CB PHE B 71 72.261 -7.328 -4.434 1.00 0.00 C ATOM 2531 CG PHE B 71 73.192 -7.635 -3.270 1.00 0.00 C ATOM 2532 CD1 PHE B 71 74.478 -8.142 -3.503 1.00 0.00 C ATOM 2533 CD2 PHE B 71 72.767 -7.401 -1.957 1.00 0.00 C ATOM 2534 CE1 PHE B 71 75.326 -8.412 -2.436 1.00 0.00 C ATOM 2535 CE2 PHE B 71 73.620 -7.673 -0.887 1.00 0.00 C ATOM 2536 CZ PHE B 71 74.902 -8.179 -1.124 1.00 0.00 C ATOM 0 H PHE B 71 73.775 -7.779 -6.338 1.00 0.00 H new ATOM 0 HA PHE B 71 72.004 -5.617 -5.753 1.00 0.00 H new ATOM 0 HB2 PHE B 71 71.276 -7.057 -4.055 1.00 0.00 H new ATOM 0 HB3 PHE B 71 72.132 -8.220 -5.047 1.00 0.00 H new ATOM 0 HD1 PHE B 71 74.810 -8.323 -4.514 1.00 0.00 H new ATOM 0 HD2 PHE B 71 71.778 -7.009 -1.772 1.00 0.00 H new ATOM 0 HE1 PHE B 71 76.316 -8.803 -2.620 1.00 0.00 H new ATOM 0 HE2 PHE B 71 73.290 -7.493 0.125 1.00 0.00 H new ATOM 0 HZ PHE B 71 75.563 -8.389 -0.296 1.00 0.00 H new ATOM 2546 N GLN B 72 74.814 -5.533 -4.035 1.00 0.00 N ATOM 2547 CA GLN B 72 75.613 -4.612 -3.170 1.00 0.00 C ATOM 2548 C GLN B 72 76.071 -3.407 -3.982 1.00 0.00 C ATOM 2549 O GLN B 72 76.243 -2.333 -3.467 1.00 0.00 O ATOM 2550 CB GLN B 72 76.845 -5.338 -2.618 1.00 0.00 C ATOM 2551 CG GLN B 72 77.648 -4.395 -1.713 1.00 0.00 C ATOM 2552 CD GLN B 72 78.860 -5.141 -1.155 1.00 0.00 C ATOM 2553 OE1 GLN B 72 79.052 -6.304 -1.440 1.00 0.00 O ATOM 2554 NE2 GLN B 72 79.680 -4.521 -0.352 1.00 0.00 N ATOM 0 H GLN B 72 75.275 -6.411 -4.274 1.00 0.00 H new ATOM 0 HA GLN B 72 74.985 -4.283 -2.342 1.00 0.00 H new ATOM 0 HB2 GLN B 72 76.536 -6.219 -2.056 1.00 0.00 H new ATOM 0 HB3 GLN B 72 77.470 -5.687 -3.440 1.00 0.00 H new ATOM 0 HG2 GLN B 72 77.973 -3.520 -2.277 1.00 0.00 H new ATOM 0 HG3 GLN B 72 77.021 -4.034 -0.897 1.00 0.00 H new ATOM 0 HE21 GLN B 72 79.518 -3.543 -0.113 1.00 0.00 H new ATOM 0 HE22 GLN B 72 80.484 -5.014 0.037 1.00 0.00 H new ATOM 2563 N GLU B 73 76.300 -3.586 -5.243 1.00 0.00 N ATOM 2564 CA GLU B 73 76.769 -2.446 -6.078 1.00 0.00 C ATOM 2565 C GLU B 73 75.587 -1.539 -6.380 1.00 0.00 C ATOM 2566 O GLU B 73 75.704 -0.335 -6.433 1.00 0.00 O ATOM 2567 CB GLU B 73 77.394 -2.969 -7.360 1.00 0.00 C ATOM 2568 CG GLU B 73 78.681 -3.724 -7.012 1.00 0.00 C ATOM 2569 CD GLU B 73 79.321 -4.281 -8.283 1.00 0.00 C ATOM 2570 OE1 GLU B 73 80.091 -3.562 -8.899 1.00 0.00 O ATOM 2571 OE2 GLU B 73 79.037 -5.420 -8.615 1.00 0.00 O ATOM 0 H GLU B 73 76.185 -4.470 -5.738 1.00 0.00 H new ATOM 0 HA GLU B 73 77.527 -1.875 -5.542 1.00 0.00 H new ATOM 0 HB2 GLU B 73 76.698 -3.629 -7.877 1.00 0.00 H new ATOM 0 HB3 GLU B 73 77.613 -2.143 -8.037 1.00 0.00 H new ATOM 0 HG2 GLU B 73 79.379 -3.056 -6.506 1.00 0.00 H new ATOM 0 HG3 GLU B 73 78.460 -4.537 -6.320 1.00 0.00 H new ATOM 2578 N PHE B 74 74.445 -2.124 -6.565 1.00 0.00 N ATOM 2579 CA PHE B 74 73.219 -1.335 -6.843 1.00 0.00 C ATOM 2580 C PHE B 74 72.817 -0.573 -5.593 1.00 0.00 C ATOM 2581 O PHE B 74 72.364 0.542 -5.642 1.00 0.00 O ATOM 2582 CB PHE B 74 72.100 -2.307 -7.197 1.00 0.00 C ATOM 2583 CG PHE B 74 70.789 -1.570 -7.371 1.00 0.00 C ATOM 2584 CD1 PHE B 74 69.945 -1.387 -6.268 1.00 0.00 C ATOM 2585 CD2 PHE B 74 70.405 -1.089 -8.629 1.00 0.00 C ATOM 2586 CE1 PHE B 74 68.723 -0.719 -6.424 1.00 0.00 C ATOM 2587 CE2 PHE B 74 69.182 -0.426 -8.783 1.00 0.00 C ATOM 2588 CZ PHE B 74 68.343 -0.239 -7.682 1.00 0.00 C ATOM 0 H PHE B 74 74.305 -3.134 -6.535 1.00 0.00 H new ATOM 0 HA PHE B 74 73.400 -0.635 -7.659 1.00 0.00 H new ATOM 0 HB2 PHE B 74 72.349 -2.838 -8.116 1.00 0.00 H new ATOM 0 HB3 PHE B 74 72.000 -3.057 -6.412 1.00 0.00 H new ATOM 0 HD1 PHE B 74 70.236 -1.761 -5.297 1.00 0.00 H new ATOM 0 HD2 PHE B 74 71.053 -1.230 -9.481 1.00 0.00 H new ATOM 0 HE1 PHE B 74 68.074 -0.575 -5.573 1.00 0.00 H new ATOM 0 HE2 PHE B 74 68.887 -0.058 -9.755 1.00 0.00 H new ATOM 0 HZ PHE B 74 67.401 0.276 -7.802 1.00 0.00 H new ATOM 2598 N VAL B 75 72.940 -1.204 -4.479 1.00 0.00 N ATOM 2599 CA VAL B 75 72.526 -0.565 -3.201 1.00 0.00 C ATOM 2600 C VAL B 75 73.507 0.520 -2.772 1.00 0.00 C ATOM 2601 O VAL B 75 73.127 1.562 -2.285 1.00 0.00 O ATOM 2602 CB VAL B 75 72.450 -1.655 -2.130 1.00 0.00 C ATOM 2603 CG1 VAL B 75 72.280 -1.029 -0.747 1.00 0.00 C ATOM 2604 CG2 VAL B 75 71.259 -2.562 -2.425 1.00 0.00 C ATOM 0 H VAL B 75 73.314 -2.149 -4.387 1.00 0.00 H new ATOM 0 HA VAL B 75 71.556 -0.087 -3.337 1.00 0.00 H new ATOM 0 HB VAL B 75 73.374 -2.234 -2.143 1.00 0.00 H new ATOM 0 HG11 VAL B 75 72.227 -1.816 0.005 1.00 0.00 H new ATOM 0 HG12 VAL B 75 73.130 -0.380 -0.534 1.00 0.00 H new ATOM 0 HG13 VAL B 75 71.361 -0.443 -0.723 1.00 0.00 H new ATOM 0 HG21 VAL B 75 71.198 -3.342 -1.666 1.00 0.00 H new ATOM 0 HG22 VAL B 75 70.342 -1.973 -2.414 1.00 0.00 H new ATOM 0 HG23 VAL B 75 71.385 -3.020 -3.406 1.00 0.00 H new ATOM 2614 N VAL B 76 74.760 0.258 -2.908 1.00 0.00 N ATOM 2615 CA VAL B 76 75.786 1.233 -2.477 1.00 0.00 C ATOM 2616 C VAL B 76 75.797 2.450 -3.401 1.00 0.00 C ATOM 2617 O VAL B 76 75.927 3.576 -2.963 1.00 0.00 O ATOM 2618 CB VAL B 76 77.133 0.510 -2.506 1.00 0.00 C ATOM 2619 CG1 VAL B 76 78.281 1.491 -2.305 1.00 0.00 C ATOM 2620 CG2 VAL B 76 77.148 -0.544 -1.397 1.00 0.00 C ATOM 0 H VAL B 76 75.129 -0.605 -3.307 1.00 0.00 H new ATOM 0 HA VAL B 76 75.572 1.601 -1.473 1.00 0.00 H new ATOM 0 HB VAL B 76 77.264 0.035 -3.478 1.00 0.00 H new ATOM 0 HG11 VAL B 76 79.228 0.952 -2.330 1.00 0.00 H new ATOM 0 HG12 VAL B 76 78.266 2.236 -3.100 1.00 0.00 H new ATOM 0 HG13 VAL B 76 78.171 1.987 -1.341 1.00 0.00 H new ATOM 0 HG21 VAL B 76 78.104 -1.068 -1.406 1.00 0.00 H new ATOM 0 HG22 VAL B 76 77.010 -0.058 -0.431 1.00 0.00 H new ATOM 0 HG23 VAL B 76 76.341 -1.258 -1.563 1.00 0.00 H new ATOM 2630 N LEU B 77 75.671 2.228 -4.671 1.00 0.00 N ATOM 2631 CA LEU B 77 75.684 3.362 -5.631 1.00 0.00 C ATOM 2632 C LEU B 77 74.355 4.119 -5.556 1.00 0.00 C ATOM 2633 O LEU B 77 74.305 5.310 -5.770 1.00 0.00 O ATOM 2634 CB LEU B 77 75.908 2.813 -7.053 1.00 0.00 C ATOM 2635 CG LEU B 77 76.596 3.869 -7.949 1.00 0.00 C ATOM 2636 CD1 LEU B 77 78.088 4.002 -7.580 1.00 0.00 C ATOM 2637 CD2 LEU B 77 76.461 3.450 -9.429 1.00 0.00 C ATOM 0 H LEU B 77 75.559 1.306 -5.091 1.00 0.00 H new ATOM 0 HA LEU B 77 76.490 4.051 -5.380 1.00 0.00 H new ATOM 0 HB2 LEU B 77 76.522 1.913 -7.008 1.00 0.00 H new ATOM 0 HB3 LEU B 77 74.952 2.525 -7.491 1.00 0.00 H new ATOM 0 HG LEU B 77 76.113 4.834 -7.794 1.00 0.00 H new ATOM 0 HD11 LEU B 77 78.556 4.749 -8.221 1.00 0.00 H new ATOM 0 HD12 LEU B 77 78.179 4.309 -6.538 1.00 0.00 H new ATOM 0 HD13 LEU B 77 78.584 3.042 -7.720 1.00 0.00 H new ATOM 0 HD21 LEU B 77 76.945 4.193 -10.063 1.00 0.00 H new ATOM 0 HD22 LEU B 77 76.937 2.481 -9.578 1.00 0.00 H new ATOM 0 HD23 LEU B 77 75.406 3.380 -9.693 1.00 0.00 H new ATOM 2649 N VAL B 78 73.280 3.435 -5.271 1.00 0.00 N ATOM 2650 CA VAL B 78 71.964 4.129 -5.201 1.00 0.00 C ATOM 2651 C VAL B 78 71.934 5.030 -3.970 1.00 0.00 C ATOM 2652 O VAL B 78 71.442 6.134 -4.025 1.00 0.00 O ATOM 2653 CB VAL B 78 70.820 3.100 -5.133 1.00 0.00 C ATOM 2654 CG1 VAL B 78 69.495 3.820 -4.822 1.00 0.00 C ATOM 2655 CG2 VAL B 78 70.693 2.365 -6.483 1.00 0.00 C ATOM 0 H VAL B 78 73.256 2.432 -5.085 1.00 0.00 H new ATOM 0 HA VAL B 78 71.829 4.735 -6.097 1.00 0.00 H new ATOM 0 HB VAL B 78 71.039 2.378 -4.347 1.00 0.00 H new ATOM 0 HG11 VAL B 78 68.687 3.090 -4.774 1.00 0.00 H new ATOM 0 HG12 VAL B 78 69.576 4.334 -3.864 1.00 0.00 H new ATOM 0 HG13 VAL B 78 69.282 4.546 -5.607 1.00 0.00 H new ATOM 0 HG21 VAL B 78 69.882 1.639 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL B 78 70.480 3.087 -7.272 1.00 0.00 H new ATOM 0 HG23 VAL B 78 71.627 1.849 -6.706 1.00 0.00 H new ATOM 2665 N ALA B 79 72.468 4.586 -2.864 1.00 0.00 N ATOM 2666 CA ALA B 79 72.471 5.456 -1.659 1.00 0.00 C ATOM 2667 C ALA B 79 73.318 6.681 -1.983 1.00 0.00 C ATOM 2668 O ALA B 79 72.998 7.797 -1.632 1.00 0.00 O ATOM 2669 CB ALA B 79 73.058 4.686 -0.461 1.00 0.00 C ATOM 0 H ALA B 79 72.897 3.668 -2.745 1.00 0.00 H new ATOM 0 HA ALA B 79 71.459 5.761 -1.393 1.00 0.00 H new ATOM 0 HB1 ALA B 79 73.058 5.328 0.420 1.00 0.00 H new ATOM 0 HB2 ALA B 79 72.452 3.801 -0.265 1.00 0.00 H new ATOM 0 HB3 ALA B 79 74.080 4.383 -0.689 1.00 0.00 H new ATOM 2675 N ALA B 80 74.397 6.458 -2.673 1.00 0.00 N ATOM 2676 CA ALA B 80 75.299 7.567 -3.068 1.00 0.00 C ATOM 2677 C ALA B 80 74.530 8.562 -3.950 1.00 0.00 C ATOM 2678 O ALA B 80 74.738 9.746 -3.888 1.00 0.00 O ATOM 2679 CB ALA B 80 76.468 6.958 -3.847 1.00 0.00 C ATOM 0 H ALA B 80 74.697 5.534 -2.986 1.00 0.00 H new ATOM 0 HA ALA B 80 75.669 8.101 -2.193 1.00 0.00 H new ATOM 0 HB1 ALA B 80 77.152 7.749 -4.153 1.00 0.00 H new ATOM 0 HB2 ALA B 80 76.996 6.246 -3.213 1.00 0.00 H new ATOM 0 HB3 ALA B 80 76.088 6.444 -4.730 1.00 0.00 H new ATOM 2685 N LEU B 81 73.653 8.093 -4.785 1.00 0.00 N ATOM 2686 CA LEU B 81 72.897 9.033 -5.660 1.00 0.00 C ATOM 2687 C LEU B 81 71.921 9.846 -4.795 1.00 0.00 C ATOM 2688 O LEU B 81 71.713 11.025 -5.009 1.00 0.00 O ATOM 2689 CB LEU B 81 72.140 8.228 -6.733 1.00 0.00 C ATOM 2690 CG LEU B 81 71.967 9.069 -8.010 1.00 0.00 C ATOM 2691 CD1 LEU B 81 71.342 8.203 -9.111 1.00 0.00 C ATOM 2692 CD2 LEU B 81 71.071 10.288 -7.722 1.00 0.00 C ATOM 0 H LEU B 81 73.425 7.106 -4.902 1.00 0.00 H new ATOM 0 HA LEU B 81 73.579 9.721 -6.159 1.00 0.00 H new ATOM 0 HB2 LEU B 81 72.686 7.313 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU B 81 71.164 7.929 -6.351 1.00 0.00 H new ATOM 0 HG LEU B 81 72.942 9.424 -8.343 1.00 0.00 H new ATOM 0 HD11 LEU B 81 71.219 8.798 -10.016 1.00 0.00 H new ATOM 0 HD12 LEU B 81 71.993 7.354 -9.320 1.00 0.00 H new ATOM 0 HD13 LEU B 81 70.369 7.840 -8.780 1.00 0.00 H new ATOM 0 HD21 LEU B 81 70.955 10.877 -8.632 1.00 0.00 H new ATOM 0 HD22 LEU B 81 70.093 9.948 -7.382 1.00 0.00 H new ATOM 0 HD23 LEU B 81 71.531 10.903 -6.948 1.00 0.00 H new ATOM 2704 N THR B 82 71.330 9.220 -3.812 1.00 0.00 N ATOM 2705 CA THR B 82 70.376 9.933 -2.918 1.00 0.00 C ATOM 2706 C THR B 82 71.082 11.097 -2.213 1.00 0.00 C ATOM 2707 O THR B 82 70.522 12.163 -2.046 1.00 0.00 O ATOM 2708 CB THR B 82 69.849 8.941 -1.880 1.00 0.00 C ATOM 2709 OG1 THR B 82 69.155 7.892 -2.541 1.00 0.00 O ATOM 2710 CG2 THR B 82 68.907 9.651 -0.904 1.00 0.00 C ATOM 0 H THR B 82 71.470 8.235 -3.589 1.00 0.00 H new ATOM 0 HA THR B 82 69.550 10.335 -3.505 1.00 0.00 H new ATOM 0 HB THR B 82 70.688 8.528 -1.320 1.00 0.00 H new ATOM 0 HG1 THR B 82 69.798 7.313 -3.000 1.00 0.00 H new ATOM 0 HG21 THR B 82 68.538 8.936 -0.169 1.00 0.00 H new ATOM 0 HG22 THR B 82 69.446 10.449 -0.394 1.00 0.00 H new ATOM 0 HG23 THR B 82 68.066 10.074 -1.453 1.00 0.00 H new ATOM 2718 N VAL B 83 72.301 10.901 -1.793 1.00 0.00 N ATOM 2719 CA VAL B 83 73.038 11.992 -1.091 1.00 0.00 C ATOM 2720 C VAL B 83 73.119 13.208 -2.013 1.00 0.00 C ATOM 2721 O VAL B 83 73.130 14.342 -1.578 1.00 0.00 O ATOM 2722 CB VAL B 83 74.447 11.472 -0.716 1.00 0.00 C ATOM 2723 CG1 VAL B 83 75.449 11.635 -1.867 1.00 0.00 C ATOM 2724 CG2 VAL B 83 74.999 12.219 0.495 1.00 0.00 C ATOM 0 H VAL B 83 72.821 10.031 -1.905 1.00 0.00 H new ATOM 0 HA VAL B 83 72.523 12.290 -0.178 1.00 0.00 H new ATOM 0 HB VAL B 83 74.328 10.412 -0.490 1.00 0.00 H new ATOM 0 HG11 VAL B 83 76.423 11.257 -1.558 1.00 0.00 H new ATOM 0 HG12 VAL B 83 75.101 11.074 -2.735 1.00 0.00 H new ATOM 0 HG13 VAL B 83 75.536 12.690 -2.127 1.00 0.00 H new ATOM 0 HG21 VAL B 83 75.990 11.835 0.739 1.00 0.00 H new ATOM 0 HG22 VAL B 83 75.068 13.282 0.266 1.00 0.00 H new ATOM 0 HG23 VAL B 83 74.334 12.073 1.346 1.00 0.00 H new ATOM 2734 N ALA B 84 73.188 12.964 -3.285 1.00 0.00 N ATOM 2735 CA ALA B 84 73.279 14.086 -4.263 1.00 0.00 C ATOM 2736 C ALA B 84 71.962 14.863 -4.310 1.00 0.00 C ATOM 2737 O ALA B 84 71.937 16.018 -4.678 1.00 0.00 O ATOM 2738 CB ALA B 84 73.595 13.529 -5.645 1.00 0.00 C ATOM 0 H ALA B 84 73.186 12.031 -3.697 1.00 0.00 H new ATOM 0 HA ALA B 84 74.073 14.764 -3.949 1.00 0.00 H new ATOM 0 HB1 ALA B 84 73.662 14.348 -6.361 1.00 0.00 H new ATOM 0 HB2 ALA B 84 74.545 12.996 -5.614 1.00 0.00 H new ATOM 0 HB3 ALA B 84 72.804 12.844 -5.951 1.00 0.00 H new ATOM 2744 N CYS B 85 70.865 14.252 -3.941 1.00 0.00 N ATOM 2745 CA CYS B 85 69.567 14.964 -3.963 1.00 0.00 C ATOM 2746 C CYS B 85 68.724 14.397 -2.822 1.00 0.00 C ATOM 2747 O CYS B 85 67.605 13.968 -3.016 1.00 0.00 O ATOM 2748 CB CYS B 85 68.878 14.732 -5.320 1.00 0.00 C ATOM 2749 SG CYS B 85 70.136 14.503 -6.603 1.00 0.00 S ATOM 0 H CYS B 85 70.820 13.283 -3.624 1.00 0.00 H new ATOM 0 HA CYS B 85 69.698 16.038 -3.835 1.00 0.00 H new ATOM 0 HB2 CYS B 85 68.233 13.855 -5.267 1.00 0.00 H new ATOM 0 HB3 CYS B 85 68.241 15.582 -5.567 1.00 0.00 H new ATOM 0 HG CYS B 85 69.556 14.305 -7.749 1.00 0.00 H new ATOM 2755 N ASN B 86 69.272 14.379 -1.633 1.00 0.00 N ATOM 2756 CA ASN B 86 68.524 13.831 -0.467 1.00 0.00 C ATOM 2757 C ASN B 86 67.348 14.750 -0.161 1.00 0.00 C ATOM 2758 O ASN B 86 67.105 15.121 0.969 1.00 0.00 O ATOM 2759 CB ASN B 86 69.450 13.740 0.749 1.00 0.00 C ATOM 2760 CG ASN B 86 69.837 15.145 1.216 1.00 0.00 C ATOM 2761 OD1 ASN B 86 69.484 16.126 0.592 1.00 0.00 O ATOM 2762 ND2 ASN B 86 70.555 15.282 2.297 1.00 0.00 N ATOM 0 H ASN B 86 70.209 14.722 -1.422 1.00 0.00 H new ATOM 0 HA ASN B 86 68.157 12.831 -0.700 1.00 0.00 H new ATOM 0 HB2 ASN B 86 68.952 13.203 1.557 1.00 0.00 H new ATOM 0 HB3 ASN B 86 70.345 13.173 0.494 1.00 0.00 H new ATOM 0 HD21 ASN B 86 70.820 16.213 2.619 1.00 0.00 H new ATOM 0 HD22 ASN B 86 70.851 14.458 2.820 1.00 0.00 H new