USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1088 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 2 ASN : amide:sc= 0.0188 K(o=0.068,f=-2.1!) USER MOD Set 1.2: B 4 THR OG1 : rot 99:sc= 0.0493 USER MOD Set 2.1: A 8 ASN : amide:sc= 0.0104 X(o=0.019,f=-0.15) USER MOD Set 2.2: A 18 LYS NZ :NH3+ -156:sc= 0.00827 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.607 X(o=-0.61,f=-0.59) USER MOD Single : A 3 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0017) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -77:sc= -0.439 USER MOD Single : A 14 SER OG : rot -90:sc= 0.0201 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 78:sc= 1.04 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -160:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0.051) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -135:sc= 0.991 (180deg=-0.0763) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 176:sc=-0.00672 (180deg=-0.0148) USER MOD Single : B 1 MET N :NH3+ 160:sc= 0 (180deg=-0.451) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=-0.0085) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot -150:sc= -0.507 USER MOD Single : B 23 LYS NZ :NH3+ -164:sc= 0.00944 (180deg=0) USER MOD Single : B 31 SER OG : rot 88:sc= 0.35 USER MOD Single : B 33 THR OG1 : rot -10:sc= 0.156 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc=-0.00431 K(o=-0.0043,f=-0.85) USER MOD Single : B 75 LYS NZ :NH3+ -177:sc= 0.0248 (180deg=0.0235) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -10.003 9.818 -1.313 1.00 0.00 N ATOM 20 CA ASN A 2 -9.223 10.893 -2.015 1.00 0.00 C ATOM 21 C ASN A 2 -7.989 11.403 -1.202 1.00 0.00 C ATOM 22 O ASN A 2 -6.983 11.762 -1.813 1.00 0.00 O ATOM 23 CB ASN A 2 -9.972 12.116 -2.620 1.00 0.00 C ATOM 24 CG ASN A 2 -10.648 13.119 -1.667 1.00 0.00 C ATOM 25 OD1 ASN A 2 -11.802 12.968 -1.272 1.00 0.00 O ATOM 26 ND2 ASN A 2 -9.942 14.181 -1.322 1.00 0.00 N ATOM 0 HA ASN A 2 -8.916 10.316 -2.887 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -9.259 12.670 -3.231 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -10.739 11.733 -3.294 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -10.353 14.893 -0.718 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -8.986 14.289 -1.660 1.00 0.00 H new ATOM 33 N LYS A 3 -8.126 11.441 0.137 1.00 0.00 N ATOM 34 CA LYS A 3 -7.175 11.974 1.166 1.00 0.00 C ATOM 35 C LYS A 3 -7.978 12.811 2.221 1.00 0.00 C ATOM 36 O LYS A 3 -7.528 12.878 3.367 1.00 0.00 O ATOM 37 CB LYS A 3 -5.891 12.724 0.692 1.00 0.00 C ATOM 38 CG LYS A 3 -4.880 13.086 1.812 1.00 0.00 C ATOM 39 CD LYS A 3 -3.433 13.388 1.371 1.00 0.00 C ATOM 40 CE LYS A 3 -2.604 12.126 1.057 1.00 0.00 C ATOM 41 NZ LYS A 3 -1.193 12.453 0.788 1.00 0.00 N ATOM 0 H LYS A 3 -8.969 11.073 0.577 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.734 11.076 1.598 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.382 12.106 -0.048 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.192 13.642 0.187 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.261 13.957 2.346 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.853 12.262 2.525 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -3.458 14.025 0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -2.933 13.954 2.158 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -2.663 11.434 1.897 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -3.030 11.616 0.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.671 11.582 0.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.136 13.107 -0.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.774 12.901 1.628 1.00 0.00 H new ATOM 54 N THR A 4 -9.130 13.437 1.892 1.00 0.00 N ATOM 55 CA THR A 4 -10.021 14.111 2.818 1.00 0.00 C ATOM 56 C THR A 4 -11.100 13.143 3.386 1.00 0.00 C ATOM 57 O THR A 4 -11.421 13.257 4.572 1.00 0.00 O ATOM 58 CB THR A 4 -10.589 15.279 1.989 1.00 0.00 C ATOM 59 OG1 THR A 4 -9.568 16.186 1.567 1.00 0.00 O ATOM 60 CG2 THR A 4 -11.557 16.048 2.840 1.00 0.00 C ATOM 0 H THR A 4 -9.464 13.479 0.929 1.00 0.00 H new ATOM 0 HA THR A 4 -9.525 14.475 3.718 1.00 0.00 H new ATOM 0 HB THR A 4 -11.067 14.855 1.106 1.00 0.00 H new ATOM 0 HG1 THR A 4 -9.970 16.910 1.043 1.00 0.00 H new ATOM 0 HG21 THR A 4 -11.967 16.878 2.265 1.00 0.00 H new ATOM 0 HG22 THR A 4 -12.367 15.390 3.155 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.041 16.435 3.719 1.00 0.00 H new ATOM 68 N GLU A 5 -11.684 12.235 2.566 1.00 0.00 N ATOM 69 CA GLU A 5 -12.523 11.120 3.110 1.00 0.00 C ATOM 70 C GLU A 5 -11.730 10.177 4.099 1.00 0.00 C ATOM 71 O GLU A 5 -12.322 9.486 4.930 1.00 0.00 O ATOM 72 CB GLU A 5 -13.158 10.277 1.977 1.00 0.00 C ATOM 73 CG GLU A 5 -13.874 10.994 0.814 1.00 0.00 C ATOM 74 CD GLU A 5 -15.088 11.832 1.225 1.00 0.00 C ATOM 75 OE1 GLU A 5 -16.221 11.370 1.345 1.00 0.00 O ATOM 76 OE2 GLU A 5 -14.760 13.147 1.445 1.00 0.00 O ATOM 0 H GLU A 5 -11.598 12.244 1.550 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.316 11.603 3.681 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -12.369 9.660 1.546 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -13.877 9.599 2.437 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.157 11.642 0.309 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.195 10.247 0.088 1.00 0.00 H new ATOM 84 N LEU A 6 -10.383 10.200 3.981 1.00 0.00 N ATOM 85 CA LEU A 6 -9.398 9.629 4.900 1.00 0.00 C ATOM 86 C LEU A 6 -9.498 10.313 6.290 1.00 0.00 C ATOM 87 O LEU A 6 -9.703 9.603 7.262 1.00 0.00 O ATOM 88 CB LEU A 6 -8.027 9.917 4.193 1.00 0.00 C ATOM 89 CG LEU A 6 -7.209 8.663 3.850 1.00 0.00 C ATOM 90 CD1 LEU A 6 -7.889 7.721 2.838 1.00 0.00 C ATOM 91 CD2 LEU A 6 -5.758 8.981 3.477 1.00 0.00 C ATOM 0 H LEU A 6 -9.935 10.651 3.183 1.00 0.00 H new ATOM 0 HA LEU A 6 -9.541 8.566 5.092 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.216 10.474 3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.428 10.560 4.838 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.173 8.096 4.780 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -7.245 6.862 2.651 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.842 7.380 3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -8.062 8.255 1.903 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -5.231 8.056 3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -5.741 9.636 2.606 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -5.268 9.478 4.314 1.00 0.00 H new ATOM 103 N ILE A 7 -9.431 11.661 6.360 1.00 0.00 N ATOM 104 CA ILE A 7 -9.575 12.492 7.597 1.00 0.00 C ATOM 105 C ILE A 7 -10.889 12.176 8.369 1.00 0.00 C ATOM 106 O ILE A 7 -10.841 11.942 9.579 1.00 0.00 O ATOM 107 CB ILE A 7 -9.463 14.029 7.256 1.00 0.00 C ATOM 108 CG1 ILE A 7 -8.224 14.365 6.378 1.00 0.00 C ATOM 109 CG2 ILE A 7 -9.469 14.927 8.518 1.00 0.00 C ATOM 110 CD1 ILE A 7 -8.233 15.693 5.624 1.00 0.00 C ATOM 0 H ILE A 7 -9.269 12.231 5.530 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.752 12.230 8.261 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.360 14.250 6.677 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -7.343 14.348 7.019 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -8.102 13.565 5.648 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.390 15.973 8.221 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -10.398 14.776 9.068 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -8.624 14.666 9.155 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -7.309 15.794 5.055 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -9.084 15.719 4.943 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -8.313 16.515 6.336 1.00 0.00 H new ATOM 122 N ASN A 8 -12.036 12.163 7.661 1.00 0.00 N ATOM 123 CA ASN A 8 -13.340 11.762 8.259 1.00 0.00 C ATOM 124 C ASN A 8 -13.428 10.273 8.719 1.00 0.00 C ATOM 125 O ASN A 8 -14.225 9.992 9.615 1.00 0.00 O ATOM 126 CB ASN A 8 -14.520 12.106 7.306 1.00 0.00 C ATOM 127 CG ASN A 8 -14.700 13.596 6.946 1.00 0.00 C ATOM 128 OD1 ASN A 8 -15.105 14.409 7.774 1.00 0.00 O ATOM 129 ND2 ASN A 8 -14.411 13.981 5.712 1.00 0.00 N ATOM 0 H ASN A 8 -12.093 12.424 6.677 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.417 12.351 9.173 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.387 11.545 6.381 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.443 11.751 7.764 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.524 14.958 5.443 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.075 13.300 5.031 1.00 0.00 H new ATOM 136 N ALA A 9 -12.639 9.336 8.145 1.00 0.00 N ATOM 137 CA ALA A 9 -12.506 7.957 8.686 1.00 0.00 C ATOM 138 C ALA A 9 -11.826 7.891 10.066 1.00 0.00 C ATOM 139 O ALA A 9 -12.279 7.171 10.952 1.00 0.00 O ATOM 140 CB ALA A 9 -11.582 7.109 7.780 1.00 0.00 C ATOM 0 H ALA A 9 -12.083 9.507 7.307 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.532 7.594 8.743 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.495 6.103 8.189 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.004 7.057 6.776 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.595 7.569 7.735 1.00 0.00 H new ATOM 146 N VAL A 10 -10.718 8.629 10.207 1.00 0.00 N ATOM 147 CA VAL A 10 -9.858 8.653 11.400 1.00 0.00 C ATOM 148 C VAL A 10 -10.529 9.271 12.594 1.00 0.00 C ATOM 149 O VAL A 10 -10.597 8.680 13.676 1.00 0.00 O ATOM 150 CB VAL A 10 -8.437 9.222 11.146 1.00 0.00 C ATOM 151 CG1 VAL A 10 -7.408 8.491 11.980 1.00 0.00 C ATOM 152 CG2 VAL A 10 -8.031 9.132 9.683 1.00 0.00 C ATOM 0 H VAL A 10 -10.383 9.248 9.469 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.699 7.604 11.648 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.473 10.273 11.432 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.420 8.907 11.785 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -7.648 8.606 13.037 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.414 7.433 11.720 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.029 9.543 9.557 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.038 8.089 9.367 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.735 9.700 9.074 1.00 0.00 H new ATOM 162 N ALA A 11 -11.039 10.469 12.324 1.00 0.00 N ATOM 163 CA ALA A 11 -11.832 11.189 13.299 1.00 0.00 C ATOM 164 C ALA A 11 -13.201 10.551 13.669 1.00 0.00 C ATOM 165 O ALA A 11 -13.672 10.802 14.782 1.00 0.00 O ATOM 166 CB ALA A 11 -11.916 12.649 12.854 1.00 0.00 C ATOM 0 H ALA A 11 -10.914 10.956 11.437 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.319 11.126 14.259 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.509 13.215 13.572 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.913 13.071 12.800 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.386 12.704 11.872 1.00 0.00 H new ATOM 172 N GLU A 12 -13.818 9.724 12.785 1.00 0.00 N ATOM 173 CA GLU A 12 -15.012 8.924 13.156 1.00 0.00 C ATOM 174 C GLU A 12 -14.622 7.666 13.990 1.00 0.00 C ATOM 175 O GLU A 12 -15.238 7.447 15.038 1.00 0.00 O ATOM 176 CB GLU A 12 -15.869 8.608 11.900 1.00 0.00 C ATOM 177 CG GLU A 12 -17.223 7.897 12.130 1.00 0.00 C ATOM 178 CD GLU A 12 -18.252 8.730 12.903 1.00 0.00 C ATOM 179 OE1 GLU A 12 -18.948 9.600 12.380 1.00 0.00 O ATOM 180 OE2 GLU A 12 -18.302 8.393 14.231 1.00 0.00 O ATOM 0 H GLU A 12 -13.511 9.595 11.821 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.645 9.518 13.815 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.064 9.545 11.379 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.272 7.989 11.230 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.646 7.626 11.163 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -17.044 6.968 12.672 1.00 0.00 H new ATOM 188 N THR A 13 -13.619 6.862 13.564 1.00 0.00 N ATOM 189 CA THR A 13 -13.167 5.660 14.340 1.00 0.00 C ATOM 190 C THR A 13 -12.448 5.828 15.711 1.00 0.00 C ATOM 191 O THR A 13 -12.374 4.878 16.497 1.00 0.00 O ATOM 192 CB THR A 13 -12.284 4.723 13.466 1.00 0.00 C ATOM 193 OG1 THR A 13 -11.117 5.442 13.120 1.00 0.00 O ATOM 194 CG2 THR A 13 -12.881 4.144 12.177 1.00 0.00 C ATOM 0 H THR A 13 -13.105 7.014 12.696 1.00 0.00 H new ATOM 0 HA THR A 13 -14.141 5.249 14.606 1.00 0.00 H new ATOM 0 HB THR A 13 -12.127 3.845 14.093 1.00 0.00 H new ATOM 0 HG1 THR A 13 -11.323 6.074 12.400 1.00 0.00 H new ATOM 0 HG21 THR A 13 -12.141 3.513 11.684 1.00 0.00 H new ATOM 0 HG22 THR A 13 -13.761 3.549 12.419 1.00 0.00 H new ATOM 0 HG23 THR A 13 -13.166 4.958 11.510 1.00 0.00 H new ATOM 202 N SER A 14 -11.919 7.019 15.948 1.00 0.00 N ATOM 203 CA SER A 14 -11.109 7.343 17.157 1.00 0.00 C ATOM 204 C SER A 14 -11.585 8.562 17.994 1.00 0.00 C ATOM 205 O SER A 14 -11.342 8.563 19.206 1.00 0.00 O ATOM 206 CB SER A 14 -9.636 7.518 16.708 1.00 0.00 C ATOM 207 OG SER A 14 -8.757 7.623 17.823 1.00 0.00 O ATOM 0 H SER A 14 -12.030 7.809 15.312 1.00 0.00 H new ATOM 0 HA SER A 14 -11.233 6.508 17.847 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.340 6.670 16.090 1.00 0.00 H new ATOM 0 HB3 SER A 14 -9.547 8.411 16.089 1.00 0.00 H new ATOM 0 HG SER A 14 -8.667 8.564 18.081 1.00 0.00 H new ATOM 213 N GLY A 15 -12.208 9.596 17.393 1.00 0.00 N ATOM 214 CA GLY A 15 -12.561 10.844 18.119 1.00 0.00 C ATOM 215 C GLY A 15 -11.374 11.728 18.555 1.00 0.00 C ATOM 216 O GLY A 15 -11.257 12.124 19.717 1.00 0.00 O ATOM 0 H GLY A 15 -12.479 9.597 16.410 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -13.217 11.438 17.483 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -13.134 10.576 19.006 1.00 0.00 H new ATOM 220 N LEU A 16 -10.530 12.040 17.568 1.00 0.00 N ATOM 221 CA LEU A 16 -9.363 12.940 17.691 1.00 0.00 C ATOM 222 C LEU A 16 -9.884 14.365 17.315 1.00 0.00 C ATOM 223 O LEU A 16 -10.819 14.901 17.920 1.00 0.00 O ATOM 224 CB LEU A 16 -8.058 12.232 17.156 1.00 0.00 C ATOM 225 CG LEU A 16 -8.183 11.555 15.780 1.00 0.00 C ATOM 226 CD1 LEU A 16 -8.896 12.326 14.726 1.00 0.00 C ATOM 227 CD2 LEU A 16 -7.186 10.559 15.154 1.00 0.00 C ATOM 0 H LEU A 16 -10.637 11.664 16.626 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.928 13.154 18.667 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.260 12.973 17.105 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.750 11.481 17.883 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.777 10.808 16.306 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.919 11.746 13.804 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.916 12.530 15.052 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.376 13.268 14.549 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.546 10.253 14.172 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.211 11.036 15.051 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.095 9.683 15.796 1.00 0.00 H new ATOM 239 N SER A 17 -9.240 14.951 16.329 1.00 0.00 N ATOM 240 CA SER A 17 -9.650 16.210 15.660 1.00 0.00 C ATOM 241 C SER A 17 -9.585 16.022 14.119 1.00 0.00 C ATOM 242 O SER A 17 -8.852 15.186 13.599 1.00 0.00 O ATOM 243 CB SER A 17 -8.788 17.405 16.108 1.00 0.00 C ATOM 244 OG SER A 17 -8.820 17.588 17.519 1.00 0.00 O ATOM 0 H SER A 17 -8.380 14.564 15.941 1.00 0.00 H new ATOM 0 HA SER A 17 -10.676 16.436 15.952 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.758 17.250 15.786 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.142 18.311 15.617 1.00 0.00 H new ATOM 0 HG SER A 17 -8.260 18.354 17.762 1.00 0.00 H new ATOM 250 N LYS A 18 -10.333 16.826 13.350 1.00 0.00 N ATOM 251 CA LYS A 18 -10.192 16.875 11.855 1.00 0.00 C ATOM 252 C LYS A 18 -8.754 17.340 11.454 1.00 0.00 C ATOM 253 O LYS A 18 -8.120 16.686 10.632 1.00 0.00 O ATOM 254 CB LYS A 18 -11.318 17.706 11.184 1.00 0.00 C ATOM 255 CG LYS A 18 -12.761 17.178 11.373 1.00 0.00 C ATOM 256 CD LYS A 18 -13.082 15.849 10.646 1.00 0.00 C ATOM 257 CE LYS A 18 -14.448 15.229 11.003 1.00 0.00 C ATOM 258 NZ LYS A 18 -15.600 16.021 10.532 1.00 0.00 N ATOM 0 H LYS A 18 -11.045 17.456 13.720 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.319 15.864 11.468 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.272 18.723 11.573 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.111 17.764 10.115 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.944 17.043 12.439 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.457 17.941 11.025 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.048 16.022 9.570 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.299 15.126 10.878 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -14.506 14.229 10.574 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -14.514 15.116 12.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -16.432 15.805 11.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -15.378 17.034 10.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -15.803 15.783 9.540 1.00 0.00 H new ATOM 271 N LYS A 19 -8.212 18.390 12.104 1.00 0.00 N ATOM 272 CA LYS A 19 -6.777 18.773 12.010 1.00 0.00 C ATOM 273 C LYS A 19 -5.808 17.638 12.499 1.00 0.00 C ATOM 274 O LYS A 19 -4.795 17.431 11.825 1.00 0.00 O ATOM 275 CB LYS A 19 -6.579 20.113 12.770 1.00 0.00 C ATOM 276 CG LYS A 19 -5.196 20.773 12.566 1.00 0.00 C ATOM 277 CD LYS A 19 -5.065 22.123 13.297 1.00 0.00 C ATOM 278 CE LYS A 19 -3.685 22.776 13.097 1.00 0.00 C ATOM 279 NZ LYS A 19 -3.593 24.069 13.798 1.00 0.00 N ATOM 0 H LYS A 19 -8.755 19.002 12.713 1.00 0.00 H new ATOM 0 HA LYS A 19 -6.511 18.915 10.963 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -7.351 20.813 12.451 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.729 19.936 13.835 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -4.419 20.096 12.921 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -5.024 20.924 11.500 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.839 22.802 12.939 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.240 21.973 14.362 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.908 22.106 13.464 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -3.502 22.924 12.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.651 24.482 13.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -4.320 24.716 13.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.743 23.923 14.817 1.00 0.00 H new ATOM 292 N ASP A 20 -6.091 16.901 13.609 1.00 0.00 N ATOM 293 CA ASP A 20 -5.246 15.728 14.016 1.00 0.00 C ATOM 294 C ASP A 20 -5.322 14.503 13.052 1.00 0.00 C ATOM 295 O ASP A 20 -4.319 13.805 12.916 1.00 0.00 O ATOM 296 CB ASP A 20 -5.525 15.280 15.478 1.00 0.00 C ATOM 297 CG ASP A 20 -4.742 16.083 16.526 1.00 0.00 C ATOM 298 OD1 ASP A 20 -3.575 15.836 16.832 1.00 0.00 O ATOM 299 OD2 ASP A 20 -5.486 17.097 17.071 1.00 0.00 O ATOM 0 H ASP A 20 -6.879 17.088 14.230 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.225 16.105 13.949 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.592 15.376 15.681 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.275 14.224 15.580 1.00 0.00 H new ATOM 305 N ALA A 21 -6.470 14.240 12.404 1.00 0.00 N ATOM 306 CA ALA A 21 -6.631 13.182 11.375 1.00 0.00 C ATOM 307 C ALA A 21 -5.920 13.500 10.025 1.00 0.00 C ATOM 308 O ALA A 21 -5.354 12.585 9.423 1.00 0.00 O ATOM 309 CB ALA A 21 -8.133 12.905 11.227 1.00 0.00 C ATOM 0 H ALA A 21 -7.329 14.761 12.579 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.122 12.277 11.706 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.288 12.130 10.476 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.537 12.571 12.182 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.642 13.817 10.917 1.00 0.00 H new ATOM 315 N THR A 22 -5.915 14.773 9.569 1.00 0.00 N ATOM 316 CA THR A 22 -5.131 15.253 8.396 1.00 0.00 C ATOM 317 C THR A 22 -3.596 15.053 8.576 1.00 0.00 C ATOM 318 O THR A 22 -2.921 14.496 7.704 1.00 0.00 O ATOM 319 CB THR A 22 -5.490 16.750 8.131 1.00 0.00 C ATOM 320 OG1 THR A 22 -6.874 17.035 8.287 1.00 0.00 O ATOM 321 CG2 THR A 22 -5.133 17.155 6.709 1.00 0.00 C ATOM 0 H THR A 22 -6.463 15.512 10.009 1.00 0.00 H new ATOM 0 HA THR A 22 -5.402 14.652 7.528 1.00 0.00 H new ATOM 0 HB THR A 22 -4.915 17.306 8.872 1.00 0.00 H new ATOM 0 HG1 THR A 22 -7.087 17.109 9.241 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.394 18.202 6.552 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.063 17.020 6.550 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.686 16.534 6.004 1.00 0.00 H new ATOM 329 N LYS A 23 -3.091 15.501 9.736 1.00 0.00 N ATOM 330 CA LYS A 23 -1.707 15.256 10.194 1.00 0.00 C ATOM 331 C LYS A 23 -1.340 13.758 10.263 1.00 0.00 C ATOM 332 O LYS A 23 -0.372 13.370 9.631 1.00 0.00 O ATOM 333 CB LYS A 23 -1.558 15.805 11.642 1.00 0.00 C ATOM 334 CG LYS A 23 -1.449 17.338 11.773 1.00 0.00 C ATOM 335 CD LYS A 23 -1.423 17.796 13.244 1.00 0.00 C ATOM 336 CE LYS A 23 -1.254 19.317 13.392 1.00 0.00 C ATOM 337 NZ LYS A 23 -1.302 19.726 14.807 1.00 0.00 N ATOM 0 H LYS A 23 -3.639 16.053 10.396 1.00 0.00 H new ATOM 0 HA LYS A 23 -1.053 15.746 9.472 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.414 15.470 12.227 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.671 15.357 12.090 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.544 17.680 11.272 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.292 17.805 11.264 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -2.348 17.489 13.732 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.607 17.292 13.762 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.304 19.624 12.955 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -2.040 19.828 12.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -1.185 20.757 14.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -2.219 19.454 15.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.536 19.256 15.330 1.00 0.00 H new ATOM 350 N ALA A 24 -2.119 12.976 11.022 1.00 0.00 N ATOM 351 CA ALA A 24 -1.950 11.526 11.240 1.00 0.00 C ATOM 352 C ALA A 24 -1.859 10.628 9.985 1.00 0.00 C ATOM 353 O ALA A 24 -1.085 9.675 9.958 1.00 0.00 O ATOM 354 CB ALA A 24 -3.063 11.123 12.190 1.00 0.00 C ATOM 0 H ALA A 24 -2.923 13.351 11.526 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.958 11.355 11.659 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.997 10.055 12.395 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.964 11.679 13.123 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.028 11.346 11.735 1.00 0.00 H new ATOM 360 N VAL A 25 -2.621 10.965 8.940 1.00 0.00 N ATOM 361 CA VAL A 25 -2.453 10.429 7.564 1.00 0.00 C ATOM 362 C VAL A 25 -1.022 10.802 7.056 1.00 0.00 C ATOM 363 O VAL A 25 -0.233 9.891 6.813 1.00 0.00 O ATOM 364 CB VAL A 25 -3.642 11.111 6.784 1.00 0.00 C ATOM 365 CG1 VAL A 25 -3.382 11.327 5.278 1.00 0.00 C ATOM 366 CG2 VAL A 25 -4.963 10.353 7.004 1.00 0.00 C ATOM 0 H VAL A 25 -3.390 11.630 9.017 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.504 9.346 7.452 1.00 0.00 H new ATOM 0 HB VAL A 25 -3.723 12.109 7.214 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.252 11.801 4.823 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.510 11.968 5.148 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.200 10.365 4.799 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.763 10.848 6.453 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.858 9.328 6.648 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.205 10.345 8.067 1.00 0.00 H new ATOM 376 N ASP A 26 -0.673 12.105 6.963 1.00 0.00 N ATOM 377 CA ASP A 26 0.731 12.546 6.645 1.00 0.00 C ATOM 378 C ASP A 26 1.785 12.411 7.824 1.00 0.00 C ATOM 379 O ASP A 26 2.765 13.150 7.943 1.00 0.00 O ATOM 380 CB ASP A 26 0.652 14.007 6.147 1.00 0.00 C ATOM 381 CG ASP A 26 -0.056 14.223 4.797 1.00 0.00 C ATOM 382 OD1 ASP A 26 0.484 14.020 3.710 1.00 0.00 O ATOM 383 OD2 ASP A 26 -1.350 14.652 4.951 1.00 0.00 O ATOM 0 H ASP A 26 -1.328 12.874 7.100 1.00 0.00 H new ATOM 0 HA ASP A 26 1.115 11.864 5.886 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.138 14.600 6.903 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.666 14.399 6.070 1.00 0.00 H new ATOM 389 N ALA A 27 1.513 11.432 8.685 1.00 0.00 N ATOM 390 CA ALA A 27 2.305 10.984 9.852 1.00 0.00 C ATOM 391 C ALA A 27 2.708 9.498 9.662 1.00 0.00 C ATOM 392 O ALA A 27 3.886 9.152 9.789 1.00 0.00 O ATOM 393 CB ALA A 27 1.548 11.278 11.151 1.00 0.00 C ATOM 0 H ALA A 27 0.662 10.878 8.584 1.00 0.00 H new ATOM 0 HA ALA A 27 3.237 11.545 9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.142 10.943 12.002 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.368 12.350 11.233 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.594 10.750 11.144 1.00 0.00 H new ATOM 399 N VAL A 28 1.722 8.638 9.319 1.00 0.00 N ATOM 400 CA VAL A 28 1.946 7.265 8.781 1.00 0.00 C ATOM 401 C VAL A 28 2.729 7.409 7.439 1.00 0.00 C ATOM 402 O VAL A 28 3.896 7.041 7.348 1.00 0.00 O ATOM 403 CB VAL A 28 0.557 6.577 8.513 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.649 5.163 7.939 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.301 6.426 9.741 1.00 0.00 C ATOM 0 H VAL A 28 0.734 8.875 9.407 1.00 0.00 H new ATOM 0 HA VAL A 28 2.508 6.656 9.489 1.00 0.00 H new ATOM 0 HB VAL A 28 0.118 7.269 7.794 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.355 4.766 7.786 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.177 5.191 6.986 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.190 4.522 8.635 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.240 5.943 9.471 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.222 5.816 10.478 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.507 7.409 10.164 1.00 0.00 H new ATOM 415 N PHE A 29 2.059 8.060 6.475 1.00 0.00 N ATOM 416 CA PHE A 29 2.550 8.329 5.092 1.00 0.00 C ATOM 417 C PHE A 29 3.685 9.396 4.958 1.00 0.00 C ATOM 418 O PHE A 29 3.861 9.974 3.883 1.00 0.00 O ATOM 419 CB PHE A 29 1.329 8.655 4.166 1.00 0.00 C ATOM 420 CG PHE A 29 0.186 7.621 4.172 1.00 0.00 C ATOM 421 CD1 PHE A 29 0.449 6.254 4.017 1.00 0.00 C ATOM 422 CD2 PHE A 29 -1.088 8.031 4.566 1.00 0.00 C ATOM 423 CE1 PHE A 29 -0.520 5.313 4.339 1.00 0.00 C ATOM 424 CE2 PHE A 29 -2.047 7.093 4.919 1.00 0.00 C ATOM 425 CZ PHE A 29 -1.751 5.737 4.826 1.00 0.00 C ATOM 0 H PHE A 29 1.123 8.433 6.632 1.00 0.00 H new ATOM 0 HA PHE A 29 3.044 7.412 4.769 1.00 0.00 H new ATOM 0 HB2 PHE A 29 0.921 9.621 4.462 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.691 8.762 3.144 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.410 5.930 3.645 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.329 9.083 4.596 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -0.319 4.260 4.212 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -3.019 7.414 5.264 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.484 5.007 5.135 1.00 0.00 H new ATOM 435 N ASP A 30 4.445 9.638 6.045 1.00 0.00 N ATOM 436 CA ASP A 30 5.716 10.410 6.034 1.00 0.00 C ATOM 437 C ASP A 30 6.919 9.488 6.384 1.00 0.00 C ATOM 438 O ASP A 30 7.932 9.506 5.680 1.00 0.00 O ATOM 439 CB ASP A 30 5.616 11.618 6.994 1.00 0.00 C ATOM 440 CG ASP A 30 6.650 12.718 6.727 1.00 0.00 C ATOM 441 OD1 ASP A 30 6.442 13.673 5.979 1.00 0.00 O ATOM 442 OD2 ASP A 30 7.819 12.512 7.414 1.00 0.00 O ATOM 0 H ASP A 30 4.193 9.299 6.974 1.00 0.00 H new ATOM 0 HA ASP A 30 5.888 10.799 5.030 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.617 12.047 6.918 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.734 11.265 8.018 1.00 0.00 H new ATOM 448 N SER A 31 6.813 8.708 7.476 1.00 0.00 N ATOM 449 CA SER A 31 7.825 7.667 7.826 1.00 0.00 C ATOM 450 C SER A 31 7.909 6.469 6.824 1.00 0.00 C ATOM 451 O SER A 31 8.960 5.833 6.763 1.00 0.00 O ATOM 452 CB SER A 31 7.585 7.123 9.243 1.00 0.00 C ATOM 453 OG SER A 31 7.625 8.163 10.215 1.00 0.00 O ATOM 0 H SER A 31 6.040 8.771 8.138 1.00 0.00 H new ATOM 0 HA SER A 31 8.782 8.186 7.768 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.617 6.623 9.283 1.00 0.00 H new ATOM 0 HB3 SER A 31 8.341 6.374 9.479 1.00 0.00 H new ATOM 0 HG SER A 31 7.788 7.777 11.101 1.00 0.00 H new ATOM 459 N ILE A 32 6.845 6.166 6.044 1.00 0.00 N ATOM 460 CA ILE A 32 6.817 5.120 4.994 1.00 0.00 C ATOM 461 C ILE A 32 7.593 5.608 3.783 1.00 0.00 C ATOM 462 O ILE A 32 8.545 4.954 3.411 1.00 0.00 O ATOM 463 CB ILE A 32 5.373 4.688 4.652 1.00 0.00 C ATOM 464 CG1 ILE A 32 4.668 4.275 5.949 1.00 0.00 C ATOM 465 CG2 ILE A 32 5.413 3.554 3.606 1.00 0.00 C ATOM 466 CD1 ILE A 32 3.189 4.054 5.865 1.00 0.00 C ATOM 0 H ILE A 32 5.955 6.657 6.130 1.00 0.00 H new ATOM 0 HA ILE A 32 7.304 4.220 5.368 1.00 0.00 H new ATOM 0 HB ILE A 32 4.807 5.508 4.211 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.130 3.356 6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.856 5.043 6.699 1.00 0.00 H new ATOM 0 HG21 ILE A 32 4.396 3.247 3.363 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.911 3.909 2.703 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.961 2.704 4.012 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.808 3.767 6.845 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.701 4.974 5.541 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.980 3.261 5.147 1.00 0.00 H new ATOM 478 N THR A 33 7.211 6.714 3.160 1.00 0.00 N ATOM 479 CA THR A 33 7.999 7.312 2.043 1.00 0.00 C ATOM 480 C THR A 33 9.509 7.581 2.371 1.00 0.00 C ATOM 481 O THR A 33 10.337 7.446 1.471 1.00 0.00 O ATOM 482 CB THR A 33 7.217 8.549 1.513 1.00 0.00 C ATOM 483 OG1 THR A 33 8.011 9.358 0.651 1.00 0.00 O ATOM 484 CG2 THR A 33 6.569 9.433 2.601 1.00 0.00 C ATOM 0 H THR A 33 6.363 7.230 3.395 1.00 0.00 H new ATOM 0 HA THR A 33 8.087 6.578 1.242 1.00 0.00 H new ATOM 0 HB THR A 33 6.396 8.106 0.949 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.482 10.122 0.340 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.049 10.267 2.130 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.858 8.840 3.176 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.342 9.817 3.266 1.00 0.00 H new ATOM 492 N GLU A 34 9.853 7.913 3.635 1.00 0.00 N ATOM 493 CA GLU A 34 11.256 7.888 4.127 1.00 0.00 C ATOM 494 C GLU A 34 11.790 6.424 4.257 1.00 0.00 C ATOM 495 O GLU A 34 12.952 6.214 3.918 1.00 0.00 O ATOM 496 CB GLU A 34 11.355 8.702 5.443 1.00 0.00 C ATOM 497 CG GLU A 34 12.795 8.973 5.930 1.00 0.00 C ATOM 498 CD GLU A 34 12.830 9.747 7.249 1.00 0.00 C ATOM 499 OE1 GLU A 34 12.885 10.975 7.313 1.00 0.00 O ATOM 500 OE2 GLU A 34 12.789 8.916 8.340 1.00 0.00 O ATOM 0 H GLU A 34 9.176 8.204 4.340 1.00 0.00 H new ATOM 0 HA GLU A 34 11.909 8.367 3.398 1.00 0.00 H new ATOM 0 HB2 GLU A 34 10.848 9.657 5.302 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.816 8.168 6.226 1.00 0.00 H new ATOM 0 HG2 GLU A 34 13.318 8.025 6.055 1.00 0.00 H new ATOM 0 HG3 GLU A 34 13.333 9.536 5.167 1.00 0.00 H new ATOM 508 N ALA A 35 10.989 5.424 4.708 1.00 0.00 N ATOM 509 CA ALA A 35 11.354 3.985 4.648 1.00 0.00 C ATOM 510 C ALA A 35 11.687 3.504 3.207 1.00 0.00 C ATOM 511 O ALA A 35 12.804 3.074 2.942 1.00 0.00 O ATOM 512 CB ALA A 35 10.206 3.080 5.228 1.00 0.00 C ATOM 0 H ALA A 35 10.073 5.593 5.123 1.00 0.00 H new ATOM 0 HA ALA A 35 12.252 3.886 5.258 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.504 2.033 5.170 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.022 3.348 6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.296 3.231 4.648 1.00 0.00 H new ATOM 518 N LEU A 36 10.740 3.669 2.275 1.00 0.00 N ATOM 519 CA LEU A 36 10.804 3.229 0.866 1.00 0.00 C ATOM 520 C LEU A 36 11.922 3.948 0.109 1.00 0.00 C ATOM 521 O LEU A 36 12.774 3.264 -0.467 1.00 0.00 O ATOM 522 CB LEU A 36 9.389 3.347 0.262 1.00 0.00 C ATOM 523 CG LEU A 36 8.221 2.733 1.136 1.00 0.00 C ATOM 524 CD1 LEU A 36 6.959 2.387 0.380 1.00 0.00 C ATOM 525 CD2 LEU A 36 8.553 1.445 1.922 1.00 0.00 C ATOM 0 H LEU A 36 9.860 4.137 2.490 1.00 0.00 H new ATOM 0 HA LEU A 36 11.089 2.180 0.782 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.174 4.401 0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.387 2.857 -0.712 1.00 0.00 H new ATOM 0 HG LEU A 36 8.074 3.574 1.814 1.00 0.00 H new ATOM 0 HD11 LEU A 36 6.223 1.974 1.070 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.556 3.286 -0.085 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.187 1.651 -0.391 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.674 1.123 2.481 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.848 0.660 1.226 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.371 1.642 2.615 1.00 0.00 H new ATOM 537 N ARG A 37 12.000 5.296 0.182 1.00 0.00 N ATOM 538 CA ARG A 37 13.144 6.005 -0.418 1.00 0.00 C ATOM 539 C ARG A 37 14.545 5.576 0.160 1.00 0.00 C ATOM 540 O ARG A 37 15.528 5.593 -0.586 1.00 0.00 O ATOM 541 CB ARG A 37 12.965 7.539 -0.477 1.00 0.00 C ATOM 542 CG ARG A 37 13.479 8.333 0.745 1.00 0.00 C ATOM 543 CD ARG A 37 12.870 9.718 0.910 1.00 0.00 C ATOM 544 NE ARG A 37 13.207 10.659 -0.190 1.00 0.00 N ATOM 545 CZ ARG A 37 12.391 11.623 -0.659 1.00 0.00 C ATOM 546 NH1 ARG A 37 11.170 11.865 -0.185 1.00 0.00 N ATOM 547 NH2 ARG A 37 12.828 12.374 -1.653 1.00 0.00 N ATOM 0 H ARG A 37 11.309 5.894 0.634 1.00 0.00 H new ATOM 0 HA ARG A 37 13.148 5.668 -1.455 1.00 0.00 H new ATOM 0 HB2 ARG A 37 13.476 7.910 -1.366 1.00 0.00 H new ATOM 0 HB3 ARG A 37 11.904 7.756 -0.605 1.00 0.00 H new ATOM 0 HG2 ARG A 37 13.279 7.754 1.647 1.00 0.00 H new ATOM 0 HG3 ARG A 37 14.561 8.435 0.665 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.786 9.622 0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 37 13.209 10.143 1.855 1.00 0.00 H new ATOM 0 HE ARG A 37 14.126 10.568 -0.623 1.00 0.00 H new ATOM 0 HH11 ARG A 37 10.800 11.303 0.581 1.00 0.00 H new ATOM 0 HH12 ARG A 37 10.605 12.613 -0.588 1.00 0.00 H new ATOM 0 HH21 ARG A 37 13.758 12.215 -2.042 1.00 0.00 H new ATOM 0 HH22 ARG A 37 12.236 13.113 -2.032 1.00 0.00 H new ATOM 560 N LYS A 38 14.615 5.220 1.474 1.00 0.00 N ATOM 561 CA LYS A 38 15.890 4.833 2.138 1.00 0.00 C ATOM 562 C LYS A 38 16.230 3.296 2.131 1.00 0.00 C ATOM 563 O LYS A 38 17.236 2.902 2.728 1.00 0.00 O ATOM 564 CB LYS A 38 15.836 5.445 3.568 1.00 0.00 C ATOM 565 CG LYS A 38 17.152 5.509 4.378 1.00 0.00 C ATOM 566 CD LYS A 38 17.062 6.349 5.672 1.00 0.00 C ATOM 567 CE LYS A 38 16.135 5.768 6.759 1.00 0.00 C ATOM 568 NZ LYS A 38 16.123 6.613 7.967 1.00 0.00 N ATOM 0 H LYS A 38 13.804 5.194 2.092 1.00 0.00 H new ATOM 0 HA LYS A 38 16.723 5.232 1.560 1.00 0.00 H new ATOM 0 HB2 LYS A 38 15.446 6.459 3.483 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.113 4.873 4.149 1.00 0.00 H new ATOM 0 HG2 LYS A 38 17.455 4.495 4.638 1.00 0.00 H new ATOM 0 HG3 LYS A 38 17.936 5.923 3.744 1.00 0.00 H new ATOM 0 HD2 LYS A 38 18.064 6.457 6.089 1.00 0.00 H new ATOM 0 HD3 LYS A 38 16.714 7.350 5.415 1.00 0.00 H new ATOM 0 HE2 LYS A 38 15.122 5.679 6.366 1.00 0.00 H new ATOM 0 HE3 LYS A 38 16.465 4.762 7.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 15.490 6.194 8.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.086 6.677 8.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 15.785 7.565 7.721 1.00 0.00 H new ATOM 581 N GLY A 39 15.442 2.429 1.459 1.00 0.00 N ATOM 582 CA GLY A 39 15.643 0.956 1.490 1.00 0.00 C ATOM 583 C GLY A 39 15.203 0.226 2.792 1.00 0.00 C ATOM 584 O GLY A 39 15.918 -0.657 3.271 1.00 0.00 O ATOM 0 H GLY A 39 14.653 2.723 0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 39 15.099 0.519 0.653 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.701 0.752 1.324 1.00 0.00 H new ATOM 588 N ASP A 40 14.024 0.591 3.325 1.00 0.00 N ATOM 589 CA ASP A 40 13.452 0.030 4.583 1.00 0.00 C ATOM 590 C ASP A 40 12.047 -0.564 4.316 1.00 0.00 C ATOM 591 O ASP A 40 11.184 0.078 3.707 1.00 0.00 O ATOM 592 CB ASP A 40 13.432 1.039 5.757 1.00 0.00 C ATOM 593 CG ASP A 40 14.802 1.557 6.219 1.00 0.00 C ATOM 594 OD1 ASP A 40 15.472 1.014 7.095 1.00 0.00 O ATOM 595 OD2 ASP A 40 15.186 2.683 5.537 1.00 0.00 O ATOM 0 H ASP A 40 13.424 1.295 2.894 1.00 0.00 H new ATOM 0 HA ASP A 40 14.119 -0.771 4.903 1.00 0.00 H new ATOM 0 HB2 ASP A 40 12.821 1.894 5.466 1.00 0.00 H new ATOM 0 HB3 ASP A 40 12.938 0.568 6.607 1.00 0.00 H new ATOM 601 N LYS A 41 11.832 -1.802 4.806 1.00 0.00 N ATOM 602 CA LYS A 41 10.529 -2.507 4.686 1.00 0.00 C ATOM 603 C LYS A 41 9.638 -2.080 5.880 1.00 0.00 C ATOM 604 O LYS A 41 10.036 -2.148 7.048 1.00 0.00 O ATOM 605 CB LYS A 41 10.634 -4.053 4.686 1.00 0.00 C ATOM 606 CG LYS A 41 11.653 -4.662 3.697 1.00 0.00 C ATOM 607 CD LYS A 41 11.536 -6.197 3.576 1.00 0.00 C ATOM 608 CE LYS A 41 12.481 -6.834 2.538 1.00 0.00 C ATOM 609 NZ LYS A 41 13.899 -6.811 2.946 1.00 0.00 N ATOM 0 H LYS A 41 12.547 -2.342 5.293 1.00 0.00 H new ATOM 0 HA LYS A 41 10.110 -2.226 3.720 1.00 0.00 H new ATOM 0 HB2 LYS A 41 10.895 -4.380 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 41 9.650 -4.464 4.462 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.509 -4.214 2.714 1.00 0.00 H new ATOM 0 HG3 LYS A 41 12.662 -4.405 4.020 1.00 0.00 H new ATOM 0 HD2 LYS A 41 11.737 -6.641 4.551 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.508 -6.450 3.316 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.177 -7.866 2.366 1.00 0.00 H new ATOM 0 HE3 LYS A 41 12.375 -6.308 1.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.480 -7.253 2.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.205 -5.827 3.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 14.013 -7.337 3.836 1.00 0.00 H new ATOM 622 N VAL A 42 8.412 -1.681 5.553 1.00 0.00 N ATOM 623 CA VAL A 42 7.425 -1.142 6.488 1.00 0.00 C ATOM 624 C VAL A 42 6.422 -2.272 6.745 1.00 0.00 C ATOM 625 O VAL A 42 5.679 -2.725 5.875 1.00 0.00 O ATOM 626 CB VAL A 42 6.845 0.072 5.731 1.00 0.00 C ATOM 627 CG1 VAL A 42 5.613 0.675 6.322 1.00 0.00 C ATOM 628 CG2 VAL A 42 7.821 1.222 5.714 1.00 0.00 C ATOM 0 H VAL A 42 8.065 -1.725 4.595 1.00 0.00 H new ATOM 0 HA VAL A 42 7.786 -0.818 7.464 1.00 0.00 H new ATOM 0 HB VAL A 42 6.624 -0.353 4.752 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.292 1.519 5.711 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.821 -0.073 6.353 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.826 1.020 7.334 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.384 2.062 5.174 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.044 1.525 6.737 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.741 0.911 5.219 1.00 0.00 H new ATOM 638 N GLN A 43 6.432 -2.663 8.003 1.00 0.00 N ATOM 639 CA GLN A 43 5.657 -3.843 8.483 1.00 0.00 C ATOM 640 C GLN A 43 4.317 -3.475 9.168 1.00 0.00 C ATOM 641 O GLN A 43 4.273 -2.532 9.957 1.00 0.00 O ATOM 642 CB GLN A 43 6.591 -4.887 9.154 1.00 0.00 C ATOM 643 CG GLN A 43 7.549 -5.612 8.175 1.00 0.00 C ATOM 644 CD GLN A 43 8.637 -6.476 8.836 1.00 0.00 C ATOM 645 OE1 GLN A 43 8.456 -7.066 9.901 1.00 0.00 O ATOM 646 NE2 GLN A 43 9.790 -6.582 8.192 1.00 0.00 N ATOM 0 H GLN A 43 6.965 -2.192 8.734 1.00 0.00 H new ATOM 0 HA GLN A 43 5.261 -4.394 7.630 1.00 0.00 H new ATOM 0 HB2 GLN A 43 7.184 -4.387 9.920 1.00 0.00 H new ATOM 0 HB3 GLN A 43 5.978 -5.632 9.662 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.956 -6.246 7.516 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.034 -4.864 7.547 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.929 -6.089 7.310 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.539 -7.157 8.578 1.00 0.00 H new ATOM 655 N LEU A 44 3.211 -4.163 8.785 1.00 0.00 N ATOM 656 CA LEU A 44 1.861 -3.961 9.378 1.00 0.00 C ATOM 657 C LEU A 44 1.275 -5.376 9.686 1.00 0.00 C ATOM 658 O LEU A 44 0.961 -6.129 8.755 1.00 0.00 O ATOM 659 CB LEU A 44 0.809 -3.191 8.516 1.00 0.00 C ATOM 660 CG LEU A 44 1.132 -1.873 7.748 1.00 0.00 C ATOM 661 CD1 LEU A 44 -0.156 -1.027 7.617 1.00 0.00 C ATOM 662 CD2 LEU A 44 2.276 -0.976 8.240 1.00 0.00 C ATOM 0 H LEU A 44 3.229 -4.875 8.055 1.00 0.00 H new ATOM 0 HA LEU A 44 2.024 -3.326 10.249 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.443 -3.899 7.772 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.026 -2.964 9.179 1.00 0.00 H new ATOM 0 HG LEU A 44 1.516 -2.246 6.799 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.067 -0.105 7.080 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.909 -1.593 7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.536 -0.786 8.610 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.360 -0.105 7.590 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.070 -0.650 9.259 1.00 0.00 H new ATOM 0 HD23 LEU A 44 3.211 -1.535 8.220 1.00 0.00 H new ATOM 674 N ILE A 45 1.078 -5.733 10.972 1.00 0.00 N ATOM 675 CA ILE A 45 0.520 -7.061 11.376 1.00 0.00 C ATOM 676 C ILE A 45 -1.012 -7.171 11.055 1.00 0.00 C ATOM 677 O ILE A 45 -1.765 -6.194 11.139 1.00 0.00 O ATOM 678 CB ILE A 45 0.942 -7.418 12.843 1.00 0.00 C ATOM 679 CG1 ILE A 45 0.841 -8.927 13.216 1.00 0.00 C ATOM 680 CG2 ILE A 45 0.179 -6.585 13.890 1.00 0.00 C ATOM 681 CD1 ILE A 45 1.785 -9.866 12.448 1.00 0.00 C ATOM 0 H ILE A 45 1.295 -5.123 11.760 1.00 0.00 H new ATOM 0 HA ILE A 45 0.964 -7.845 10.763 1.00 0.00 H new ATOM 0 HB ILE A 45 2.001 -7.162 12.864 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.040 -9.033 14.282 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.185 -9.256 13.049 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.507 -6.869 14.890 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.380 -5.526 13.729 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.891 -6.770 13.793 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.632 -10.891 12.785 1.00 0.00 H new ATOM 0 HD12 ILE A 45 1.575 -9.800 11.381 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.819 -9.574 12.633 1.00 0.00 H new ATOM 693 N GLY A 46 -1.437 -8.383 10.666 1.00 0.00 N ATOM 694 CA GLY A 46 -2.830 -8.653 10.200 1.00 0.00 C ATOM 695 C GLY A 46 -3.346 -7.943 8.910 1.00 0.00 C ATOM 696 O GLY A 46 -4.557 -7.866 8.686 1.00 0.00 O ATOM 0 H GLY A 46 -0.837 -9.208 10.661 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.922 -9.728 10.044 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.506 -8.390 11.013 1.00 0.00 H new ATOM 700 N PHE A 47 -2.417 -7.469 8.068 1.00 0.00 N ATOM 701 CA PHE A 47 -2.663 -6.764 6.800 1.00 0.00 C ATOM 702 C PHE A 47 -1.485 -7.290 5.926 1.00 0.00 C ATOM 703 O PHE A 47 -1.696 -8.210 5.131 1.00 0.00 O ATOM 704 CB PHE A 47 -2.696 -5.236 7.099 1.00 0.00 C ATOM 705 CG PHE A 47 -3.370 -4.381 6.015 1.00 0.00 C ATOM 706 CD1 PHE A 47 -2.864 -4.344 4.711 1.00 0.00 C ATOM 707 CD2 PHE A 47 -4.483 -3.597 6.333 1.00 0.00 C ATOM 708 CE1 PHE A 47 -3.482 -3.568 3.736 1.00 0.00 C ATOM 709 CE2 PHE A 47 -5.075 -2.795 5.361 1.00 0.00 C ATOM 710 CZ PHE A 47 -4.584 -2.791 4.065 1.00 0.00 C ATOM 0 H PHE A 47 -1.421 -7.572 8.262 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.608 -6.936 6.284 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.216 -5.076 8.043 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.673 -4.885 7.235 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -1.987 -4.922 4.460 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.885 -3.614 7.335 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -3.105 -3.570 2.724 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -5.920 -2.174 5.618 1.00 0.00 H new ATOM 0 HZ PHE A 47 -5.060 -2.182 3.310 1.00 0.00 H new ATOM 720 N GLY A 48 -0.254 -6.754 6.095 1.00 0.00 N ATOM 721 CA GLY A 48 0.931 -7.300 5.463 1.00 0.00 C ATOM 722 C GLY A 48 2.213 -6.493 5.600 1.00 0.00 C ATOM 723 O GLY A 48 2.807 -6.434 6.679 1.00 0.00 O ATOM 0 H GLY A 48 -0.073 -5.934 6.674 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.109 -8.293 5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.722 -7.428 4.401 1.00 0.00 H new ATOM 727 N ASN A 49 2.679 -5.962 4.455 1.00 0.00 N ATOM 728 CA ASN A 49 4.013 -5.294 4.380 1.00 0.00 C ATOM 729 C ASN A 49 4.271 -4.474 3.086 1.00 0.00 C ATOM 730 O ASN A 49 4.123 -5.005 1.986 1.00 0.00 O ATOM 731 CB ASN A 49 5.052 -6.455 4.384 1.00 0.00 C ATOM 732 CG ASN A 49 6.559 -6.119 4.485 1.00 0.00 C ATOM 733 OD1 ASN A 49 6.973 -5.073 4.981 1.00 0.00 O ATOM 734 ND2 ASN A 49 7.414 -7.017 4.026 1.00 0.00 N ATOM 0 H ASN A 49 2.167 -5.976 3.573 1.00 0.00 H new ATOM 0 HA ASN A 49 4.077 -4.588 5.208 1.00 0.00 H new ATOM 0 HB2 ASN A 49 4.806 -7.113 5.218 1.00 0.00 H new ATOM 0 HB3 ASN A 49 4.905 -7.030 3.470 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.417 -6.842 4.083 1.00 0.00 H new ATOM 0 HD22 ASN A 49 7.070 -7.885 3.615 1.00 0.00 H new ATOM 741 N PHE A 50 4.721 -3.211 3.203 1.00 0.00 N ATOM 742 CA PHE A 50 5.285 -2.467 2.042 1.00 0.00 C ATOM 743 C PHE A 50 6.806 -2.772 2.004 1.00 0.00 C ATOM 744 O PHE A 50 7.476 -2.886 3.036 1.00 0.00 O ATOM 745 CB PHE A 50 5.202 -0.917 2.077 1.00 0.00 C ATOM 746 CG PHE A 50 3.896 -0.147 2.131 1.00 0.00 C ATOM 747 CD1 PHE A 50 3.310 0.069 3.385 1.00 0.00 C ATOM 748 CD2 PHE A 50 3.528 0.661 1.048 1.00 0.00 C ATOM 749 CE1 PHE A 50 2.358 1.064 3.548 1.00 0.00 C ATOM 750 CE2 PHE A 50 2.570 1.653 1.215 1.00 0.00 C ATOM 751 CZ PHE A 50 1.986 1.840 2.460 1.00 0.00 C ATOM 0 H PHE A 50 4.709 -2.682 4.075 1.00 0.00 H new ATOM 0 HA PHE A 50 4.686 -2.797 1.193 1.00 0.00 H new ATOM 0 HB2 PHE A 50 5.781 -0.599 2.944 1.00 0.00 H new ATOM 0 HB3 PHE A 50 5.731 -0.562 1.192 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.601 -0.541 4.227 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.989 0.513 0.083 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.909 1.234 4.516 1.00 0.00 H new ATOM 0 HE2 PHE A 50 2.281 2.275 0.381 1.00 0.00 H new ATOM 0 HZ PHE A 50 1.230 2.601 2.584 1.00 0.00 H new ATOM 761 N GLU A 51 7.353 -2.856 0.787 1.00 0.00 N ATOM 762 CA GLU A 51 8.811 -3.021 0.594 1.00 0.00 C ATOM 763 C GLU A 51 9.228 -2.501 -0.791 1.00 0.00 C ATOM 764 O GLU A 51 8.489 -2.610 -1.773 1.00 0.00 O ATOM 765 CB GLU A 51 9.308 -4.475 0.858 1.00 0.00 C ATOM 766 CG GLU A 51 8.701 -5.598 -0.017 1.00 0.00 C ATOM 767 CD GLU A 51 9.293 -6.971 0.303 1.00 0.00 C ATOM 768 OE1 GLU A 51 8.784 -7.761 1.097 1.00 0.00 O ATOM 769 OE2 GLU A 51 10.452 -7.211 -0.392 1.00 0.00 O ATOM 0 H GLU A 51 6.817 -2.813 -0.080 1.00 0.00 H new ATOM 0 HA GLU A 51 9.308 -2.414 1.350 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.390 -4.492 0.727 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.110 -4.716 1.902 1.00 0.00 H new ATOM 0 HG2 GLU A 51 7.622 -5.627 0.132 1.00 0.00 H new ATOM 0 HG3 GLU A 51 8.872 -5.368 -1.069 1.00 0.00 H new ATOM 777 N VAL A 52 10.451 -1.958 -0.879 1.00 0.00 N ATOM 778 CA VAL A 52 10.976 -1.374 -2.110 1.00 0.00 C ATOM 779 C VAL A 52 11.826 -2.452 -2.864 1.00 0.00 C ATOM 780 O VAL A 52 12.381 -3.383 -2.264 1.00 0.00 O ATOM 781 CB VAL A 52 11.645 -0.051 -1.584 1.00 0.00 C ATOM 782 CG1 VAL A 52 13.171 -0.115 -1.602 1.00 0.00 C ATOM 783 CG2 VAL A 52 11.038 1.163 -2.299 1.00 0.00 C ATOM 0 H VAL A 52 11.101 -1.914 -0.094 1.00 0.00 H new ATOM 0 HA VAL A 52 10.283 -1.092 -2.903 1.00 0.00 H new ATOM 0 HB VAL A 52 11.413 0.068 -0.526 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.579 0.824 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.508 -0.935 -0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.516 -0.281 -2.623 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.507 2.075 -1.929 1.00 0.00 H new ATOM 0 HG22 VAL A 52 11.209 1.076 -3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 52 9.966 1.201 -2.105 1.00 0.00 H new ATOM 793 N ARG A 53 11.945 -2.279 -4.188 1.00 0.00 N ATOM 794 CA ARG A 53 12.700 -3.214 -5.053 1.00 0.00 C ATOM 795 C ARG A 53 13.807 -2.395 -5.756 1.00 0.00 C ATOM 796 O ARG A 53 13.540 -1.701 -6.741 1.00 0.00 O ATOM 797 CB ARG A 53 11.694 -3.932 -6.004 1.00 0.00 C ATOM 798 CG ARG A 53 12.262 -5.097 -6.851 1.00 0.00 C ATOM 799 CD ARG A 53 12.883 -4.676 -8.200 1.00 0.00 C ATOM 800 NE ARG A 53 13.500 -5.830 -8.896 1.00 0.00 N ATOM 801 CZ ARG A 53 14.113 -5.760 -10.095 1.00 0.00 C ATOM 802 NH1 ARG A 53 14.217 -4.643 -10.813 1.00 0.00 N ATOM 803 NH2 ARG A 53 14.640 -6.865 -10.588 1.00 0.00 N ATOM 0 H ARG A 53 11.527 -1.497 -4.692 1.00 0.00 H new ATOM 0 HA ARG A 53 13.200 -4.013 -4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 53 10.870 -4.316 -5.403 1.00 0.00 H new ATOM 0 HB3 ARG A 53 11.275 -3.189 -6.682 1.00 0.00 H new ATOM 0 HG2 ARG A 53 13.020 -5.617 -6.265 1.00 0.00 H new ATOM 0 HG3 ARG A 53 11.462 -5.811 -7.043 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.114 -4.236 -8.834 1.00 0.00 H new ATOM 0 HD3 ARG A 53 13.636 -3.906 -8.031 1.00 0.00 H new ATOM 0 HE ARG A 53 13.458 -6.740 -8.436 1.00 0.00 H new ATOM 0 HH11 ARG A 53 13.819 -3.772 -10.462 1.00 0.00 H new ATOM 0 HH12 ARG A 53 14.694 -4.659 -11.714 1.00 0.00 H new ATOM 0 HH21 ARG A 53 14.577 -7.738 -10.064 1.00 0.00 H new ATOM 0 HH22 ARG A 53 15.111 -6.846 -11.493 1.00 0.00 H new ATOM 1134 N LYS A 75 14.611 2.566 -6.733 1.00 0.00 N ATOM 1135 CA LYS A 75 13.806 1.697 -5.834 1.00 0.00 C ATOM 1136 C LYS A 75 12.319 1.785 -6.286 1.00 0.00 C ATOM 1137 O LYS A 75 11.792 2.879 -6.514 1.00 0.00 O ATOM 1138 CB LYS A 75 13.923 2.023 -4.329 1.00 0.00 C ATOM 1139 CG LYS A 75 15.327 2.313 -3.741 1.00 0.00 C ATOM 1140 CD LYS A 75 15.770 3.790 -3.815 1.00 0.00 C ATOM 1141 CE LYS A 75 17.162 4.019 -3.203 1.00 0.00 C ATOM 1142 NZ LYS A 75 17.564 5.433 -3.299 1.00 0.00 N ATOM 0 HA LYS A 75 14.207 0.688 -5.928 1.00 0.00 H new ATOM 0 HB2 LYS A 75 13.294 2.890 -4.128 1.00 0.00 H new ATOM 0 HB3 LYS A 75 13.498 1.186 -3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.341 1.997 -2.698 1.00 0.00 H new ATOM 0 HG3 LYS A 75 16.059 1.702 -4.269 1.00 0.00 H new ATOM 0 HD2 LYS A 75 15.777 4.112 -4.856 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.041 4.411 -3.294 1.00 0.00 H new ATOM 0 HE2 LYS A 75 17.157 3.711 -2.158 1.00 0.00 H new ATOM 0 HE3 LYS A 75 17.894 3.395 -3.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 18.507 5.555 -2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 17.592 5.719 -4.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 16.878 6.024 -2.789 1.00 0.00 H new ATOM 1155 N VAL A 76 11.638 0.638 -6.381 1.00 0.00 N ATOM 1156 CA VAL A 76 10.318 0.498 -6.971 1.00 0.00 C ATOM 1157 C VAL A 76 9.363 0.127 -5.782 1.00 0.00 C ATOM 1158 O VAL A 76 9.563 -0.910 -5.143 1.00 0.00 O ATOM 1159 CB VAL A 76 10.621 -0.598 -8.038 1.00 0.00 C ATOM 1160 CG1 VAL A 76 9.502 -1.573 -8.245 1.00 0.00 C ATOM 1161 CG2 VAL A 76 11.142 -0.032 -9.370 1.00 0.00 C ATOM 0 H VAL A 76 12.011 -0.246 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 76 9.823 1.342 -7.451 1.00 0.00 H new ATOM 0 HB VAL A 76 11.441 -1.170 -7.603 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.790 -2.303 -9.002 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.289 -2.087 -7.308 1.00 0.00 H new ATOM 0 HG13 VAL A 76 8.611 -1.039 -8.576 1.00 0.00 H new ATOM 0 HG21 VAL A 76 11.331 -0.851 -10.064 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.397 0.640 -9.796 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.067 0.517 -9.195 1.00 0.00 H new ATOM 1171 N PRO A 77 8.295 0.898 -5.489 1.00 0.00 N ATOM 1172 CA PRO A 77 7.416 0.651 -4.331 1.00 0.00 C ATOM 1173 C PRO A 77 6.299 -0.380 -4.576 1.00 0.00 C ATOM 1174 O PRO A 77 5.651 -0.465 -5.624 1.00 0.00 O ATOM 1175 CB PRO A 77 6.867 2.065 -4.069 1.00 0.00 C ATOM 1176 CG PRO A 77 6.801 2.714 -5.456 1.00 0.00 C ATOM 1177 CD PRO A 77 7.976 2.112 -6.235 1.00 0.00 C ATOM 0 HA PRO A 77 7.943 0.199 -3.491 1.00 0.00 H new ATOM 0 HB2 PRO A 77 5.883 2.028 -3.601 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.518 2.626 -3.399 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.852 2.500 -5.947 1.00 0.00 H new ATOM 0 HG3 PRO A 77 6.887 3.798 -5.388 1.00 0.00 H new ATOM 0 HD2 PRO A 77 7.701 1.889 -7.266 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.825 2.795 -6.272 1.00 0.00 H new ATOM 1185 N ALA A 78 6.129 -1.139 -3.500 1.00 0.00 N ATOM 1186 CA ALA A 78 5.162 -2.232 -3.391 1.00 0.00 C ATOM 1187 C ALA A 78 4.524 -2.167 -1.980 1.00 0.00 C ATOM 1188 O ALA A 78 5.026 -1.524 -1.049 1.00 0.00 O ATOM 1189 CB ALA A 78 5.965 -3.509 -3.662 1.00 0.00 C ATOM 0 H ALA A 78 6.677 -1.009 -2.650 1.00 0.00 H new ATOM 0 HA ALA A 78 4.333 -2.184 -4.097 1.00 0.00 H new ATOM 0 HB1 ALA A 78 5.305 -4.374 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.402 -3.459 -4.659 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.760 -3.603 -2.922 1.00 0.00 H new ATOM 1195 N PHE A 79 3.385 -2.848 -1.848 1.00 0.00 N ATOM 1196 CA PHE A 79 2.569 -2.823 -0.606 1.00 0.00 C ATOM 1197 C PHE A 79 2.256 -4.266 -0.077 1.00 0.00 C ATOM 1198 O PHE A 79 2.649 -5.319 -0.584 1.00 0.00 O ATOM 1199 CB PHE A 79 1.377 -1.827 -0.802 1.00 0.00 C ATOM 1200 CG PHE A 79 0.015 -2.470 -1.160 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -0.130 -3.204 -2.345 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -1.039 -2.448 -0.241 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.311 -3.886 -2.609 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -2.214 -3.148 -0.499 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.352 -3.855 -1.686 1.00 0.00 C ATOM 0 H PHE A 79 2.993 -3.433 -2.586 1.00 0.00 H new ATOM 0 HA PHE A 79 3.126 -2.416 0.238 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.255 -1.250 0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.643 -1.122 -1.589 1.00 0.00 H new ATOM 0 HD1 PHE A 79 0.681 -3.240 -3.057 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.941 -1.884 0.675 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.421 -4.440 -3.530 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.017 -3.141 0.223 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.271 -4.383 -1.894 1.00 0.00 H new ATOM 1215 N LYS A 80 1.575 -4.142 1.049 1.00 0.00 N ATOM 1216 CA LYS A 80 1.025 -5.122 1.990 1.00 0.00 C ATOM 1217 C LYS A 80 -0.138 -6.098 1.845 1.00 0.00 C ATOM 1218 O LYS A 80 -0.732 -6.320 2.905 1.00 0.00 O ATOM 1219 CB LYS A 80 0.650 -4.130 3.201 1.00 0.00 C ATOM 1220 CG LYS A 80 1.228 -2.715 3.533 1.00 0.00 C ATOM 1221 CD LYS A 80 0.237 -1.827 4.324 1.00 0.00 C ATOM 1222 CE LYS A 80 -0.968 -1.230 3.567 1.00 0.00 C ATOM 1223 NZ LYS A 80 -0.644 -0.079 2.716 1.00 0.00 N ATOM 0 H LYS A 80 1.358 -3.202 1.381 1.00 0.00 H new ATOM 0 HA LYS A 80 1.780 -5.908 1.971 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -0.426 -3.978 3.113 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.816 -4.718 4.104 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.145 -2.830 4.111 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.497 -2.211 2.604 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.150 -2.418 5.154 1.00 0.00 H new ATOM 0 HD3 LYS A 80 0.802 -1.001 4.756 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.414 -2.009 2.948 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.723 -0.928 4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.355 0.667 2.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.296 0.286 2.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.644 -0.374 1.719 1.00 0.00 H new ATOM 1236 N PRO A 81 -0.415 -6.893 0.783 1.00 0.00 N ATOM 1237 CA PRO A 81 -1.363 -8.018 0.927 1.00 0.00 C ATOM 1238 C PRO A 81 -1.032 -9.140 1.967 1.00 0.00 C ATOM 1239 O PRO A 81 -1.925 -9.931 2.277 1.00 0.00 O ATOM 1240 CB PRO A 81 -1.524 -8.547 -0.507 1.00 0.00 C ATOM 1241 CG PRO A 81 -1.008 -7.412 -1.388 1.00 0.00 C ATOM 1242 CD PRO A 81 0.071 -6.716 -0.579 1.00 0.00 C ATOM 0 HA PRO A 81 -2.284 -7.649 1.378 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -0.951 -9.461 -0.660 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.565 -8.782 -0.730 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.606 -7.797 -2.325 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.811 -6.721 -1.645 1.00 0.00 H new ATOM 0 HD2 PRO A 81 1.050 -7.172 -0.726 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.166 -5.663 -0.845 1.00 0.00 H new ATOM 1250 N GLY A 82 0.171 -9.038 2.582 1.00 0.00 N ATOM 1251 CA GLY A 82 0.883 -10.022 3.440 1.00 0.00 C ATOM 1252 C GLY A 82 0.247 -11.229 4.084 1.00 0.00 C ATOM 1253 O GLY A 82 0.328 -11.476 5.290 1.00 0.00 O ATOM 0 H GLY A 82 0.721 -8.185 2.482 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.707 -10.404 2.837 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.324 -9.446 4.254 1.00 0.00 H new ATOM 1257 N LYS A 83 -0.331 -11.942 3.138 1.00 0.00 N ATOM 1258 CA LYS A 83 -1.173 -13.160 3.375 1.00 0.00 C ATOM 1259 C LYS A 83 -2.562 -12.885 4.019 1.00 0.00 C ATOM 1260 O LYS A 83 -3.599 -13.303 3.505 1.00 0.00 O ATOM 1261 CB LYS A 83 -0.435 -14.306 4.137 1.00 0.00 C ATOM 1262 CG LYS A 83 0.159 -15.389 3.214 1.00 0.00 C ATOM 1263 CD LYS A 83 0.922 -16.486 3.987 1.00 0.00 C ATOM 1264 CE LYS A 83 1.492 -17.619 3.110 1.00 0.00 C ATOM 1265 NZ LYS A 83 2.621 -17.190 2.261 1.00 0.00 N ATOM 0 H LYS A 83 -0.243 -11.708 2.149 1.00 0.00 H new ATOM 0 HA LYS A 83 -1.366 -13.508 2.360 1.00 0.00 H new ATOM 0 HB2 LYS A 83 0.367 -13.873 4.736 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -1.133 -14.776 4.830 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.644 -15.849 2.639 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.834 -14.919 2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.742 -16.021 4.534 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.252 -16.922 4.728 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.820 -18.436 3.753 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.698 -18.012 2.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.958 -17.997 1.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.307 -16.430 1.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.394 -16.841 2.862 1.00 0.00 H new ATOM 1278 N ALA A 84 -2.521 -12.232 5.181 1.00 0.00 N ATOM 1279 CA ALA A 84 -3.666 -11.769 5.977 1.00 0.00 C ATOM 1280 C ALA A 84 -4.686 -10.890 5.233 1.00 0.00 C ATOM 1281 O ALA A 84 -5.886 -11.170 5.341 1.00 0.00 O ATOM 1282 CB ALA A 84 -3.005 -10.944 7.076 1.00 0.00 C ATOM 0 H ALA A 84 -1.632 -11.996 5.622 1.00 0.00 H new ATOM 0 HA ALA A 84 -4.256 -12.625 6.304 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.771 -10.542 7.740 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.325 -11.577 7.647 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.446 -10.123 6.628 1.00 0.00 H new ATOM 1288 N LEU A 85 -4.236 -9.845 4.487 1.00 0.00 N ATOM 1289 CA LEU A 85 -5.166 -9.087 3.630 1.00 0.00 C ATOM 1290 C LEU A 85 -5.666 -9.989 2.451 1.00 0.00 C ATOM 1291 O LEU A 85 -6.860 -9.949 2.158 1.00 0.00 O ATOM 1292 CB LEU A 85 -4.508 -7.766 3.175 1.00 0.00 C ATOM 1293 CG LEU A 85 -5.416 -6.926 2.252 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -6.450 -6.105 3.033 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -4.638 -6.050 1.254 1.00 0.00 C ATOM 0 H LEU A 85 -3.269 -9.523 4.465 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.056 -8.804 4.192 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.246 -7.176 4.053 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.578 -7.991 2.653 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.963 -7.656 1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.062 -5.533 2.336 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.087 -6.776 3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.936 -5.422 3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.340 -5.488 0.638 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.999 -5.356 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.023 -6.684 0.616 1.00 0.00 H new ATOM 1307 N LYS A 86 -4.791 -10.778 1.791 1.00 0.00 N ATOM 1308 CA LYS A 86 -5.204 -11.771 0.768 1.00 0.00 C ATOM 1309 C LYS A 86 -6.292 -12.807 1.240 1.00 0.00 C ATOM 1310 O LYS A 86 -7.040 -13.311 0.400 1.00 0.00 O ATOM 1311 CB LYS A 86 -3.923 -12.402 0.163 1.00 0.00 C ATOM 1312 CG LYS A 86 -4.097 -13.139 -1.179 1.00 0.00 C ATOM 1313 CD LYS A 86 -4.522 -12.245 -2.371 1.00 0.00 C ATOM 1314 CE LYS A 86 -4.642 -12.974 -3.722 1.00 0.00 C ATOM 1315 NZ LYS A 86 -3.337 -13.347 -4.300 1.00 0.00 N ATOM 0 H LYS A 86 -3.784 -10.747 1.949 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.748 -11.250 -0.020 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.183 -11.613 0.027 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.511 -13.104 0.888 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -3.157 -13.630 -1.430 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -4.842 -13.924 -1.050 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -5.482 -11.786 -2.137 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.799 -11.436 -2.475 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -5.244 -13.873 -3.590 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.174 -12.335 -4.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.485 -13.833 -5.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.769 -12.490 -4.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.836 -13.981 -3.645 1.00 0.00 H new ATOM 1328 N ASP A 87 -6.400 -13.080 2.560 1.00 0.00 N ATOM 1329 CA ASP A 87 -7.481 -13.864 3.190 1.00 0.00 C ATOM 1330 C ASP A 87 -8.802 -13.048 3.345 1.00 0.00 C ATOM 1331 O ASP A 87 -9.863 -13.593 3.026 1.00 0.00 O ATOM 1332 CB ASP A 87 -6.908 -14.335 4.555 1.00 0.00 C ATOM 1333 CG ASP A 87 -7.022 -15.845 4.775 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -6.120 -16.639 4.507 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -8.241 -16.202 5.293 1.00 0.00 O ATOM 0 H ASP A 87 -5.713 -12.748 3.237 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.768 -14.712 2.568 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.860 -14.044 4.620 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.433 -13.818 5.358 1.00 0.00 H new ATOM 1341 N ALA A 88 -8.749 -11.773 3.822 1.00 0.00 N ATOM 1342 CA ALA A 88 -9.918 -10.837 3.817 1.00 0.00 C ATOM 1343 C ALA A 88 -10.657 -10.756 2.447 1.00 0.00 C ATOM 1344 O ALA A 88 -11.868 -10.961 2.344 1.00 0.00 O ATOM 1345 CB ALA A 88 -9.445 -9.383 4.143 1.00 0.00 C ATOM 0 H ALA A 88 -7.903 -11.364 4.219 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.601 -11.238 4.566 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.303 -8.711 4.137 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.977 -9.365 5.127 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.724 -9.058 3.393 1.00 0.00 H new ATOM 1351 N VAL A 89 -9.848 -10.513 1.411 1.00 0.00 N ATOM 1352 CA VAL A 89 -10.257 -10.192 0.042 1.00 0.00 C ATOM 1353 C VAL A 89 -10.464 -11.390 -0.956 1.00 0.00 C ATOM 1354 O VAL A 89 -10.802 -11.144 -2.117 1.00 0.00 O ATOM 1355 CB VAL A 89 -9.070 -9.200 -0.261 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -7.822 -9.896 -0.815 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -9.494 -8.072 -1.159 1.00 0.00 C ATOM 0 H VAL A 89 -8.833 -10.537 1.512 1.00 0.00 H new ATOM 0 HA VAL A 89 -11.266 -9.798 -0.079 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.792 -8.780 0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.045 -9.155 -1.001 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.461 -10.627 -0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.071 -10.402 -1.748 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -8.645 -7.413 -1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -9.850 -8.476 -2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -10.295 -7.508 -0.681 1.00 0.00 H new ATOM 1367 N LYS A 90 -10.270 -12.653 -0.514 1.00 0.00 N ATOM 1368 CA LYS A 90 -10.321 -13.866 -1.368 1.00 0.00 C ATOM 1369 C LYS A 90 -11.710 -14.173 -1.965 1.00 0.00 C ATOM 1370 O LYS A 90 -12.718 -14.253 -1.262 1.00 0.00 O ATOM 1371 CB LYS A 90 -9.780 -15.046 -0.510 1.00 0.00 C ATOM 1372 CG LYS A 90 -9.048 -16.157 -1.295 1.00 0.00 C ATOM 1373 CD LYS A 90 -8.184 -17.078 -0.404 1.00 0.00 C ATOM 1374 CE LYS A 90 -8.984 -17.996 0.541 1.00 0.00 C ATOM 1375 NZ LYS A 90 -8.092 -18.841 1.355 1.00 0.00 N ATOM 0 H LYS A 90 -10.070 -12.864 0.464 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.703 -13.699 -2.250 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.098 -14.645 0.239 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.615 -15.495 0.027 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.785 -16.763 -1.823 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.412 -15.697 -2.052 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.557 -17.697 -1.046 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.515 -16.459 0.194 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.610 -17.390 1.196 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.653 -18.628 -0.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.662 -19.446 1.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.512 -19.437 0.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.471 -18.237 1.931 1.00 0.00 H new ATOM 1389 N MET B 1 9.178 -2.017 10.018 1.00 0.00 N ATOM 1390 CA MET B 1 8.427 -1.504 11.171 1.00 0.00 C ATOM 1391 C MET B 1 7.828 -2.717 11.943 1.00 0.00 C ATOM 1392 O MET B 1 8.593 -3.470 12.550 1.00 0.00 O ATOM 1393 CB MET B 1 7.476 -0.344 10.736 1.00 0.00 C ATOM 1394 CG MET B 1 8.155 0.972 10.309 1.00 0.00 C ATOM 1395 SD MET B 1 7.043 2.347 10.684 1.00 0.00 S ATOM 1396 CE MET B 1 7.156 3.389 9.219 1.00 0.00 C ATOM 0 H1 MET B 1 9.296 -1.259 9.316 1.00 0.00 H new ATOM 0 H2 MET B 1 10.113 -2.347 10.332 1.00 0.00 H new ATOM 0 H3 MET B 1 8.658 -2.809 9.589 1.00 0.00 H new ATOM 0 HA MET B 1 9.053 -1.003 11.909 1.00 0.00 H new ATOM 0 HB2 MET B 1 6.863 -0.697 9.907 1.00 0.00 H new ATOM 0 HB3 MET B 1 6.800 -0.127 11.563 1.00 0.00 H new ATOM 0 HG2 MET B 1 9.101 1.097 10.835 1.00 0.00 H new ATOM 0 HG3 MET B 1 8.384 0.951 9.243 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.461 4.223 9.311 1.00 0.00 H new ATOM 0 HE2 MET B 1 8.172 3.772 9.123 1.00 0.00 H new ATOM 0 HE3 MET B 1 6.904 2.803 8.335 1.00 0.00 H new ATOM 1407 N ASN B 2 6.492 -2.875 11.919 1.00 0.00 N ATOM 1408 CA ASN B 2 5.688 -3.997 12.514 1.00 0.00 C ATOM 1409 C ASN B 2 4.174 -3.681 12.714 1.00 0.00 C ATOM 1410 O ASN B 2 3.376 -4.619 12.736 1.00 0.00 O ATOM 1411 CB ASN B 2 6.182 -4.749 13.782 1.00 0.00 C ATOM 1412 CG ASN B 2 6.167 -4.011 15.136 1.00 0.00 C ATOM 1413 OD1 ASN B 2 5.165 -4.045 15.848 1.00 0.00 O ATOM 1414 ND2 ASN B 2 7.258 -3.378 15.535 1.00 0.00 N ATOM 0 H ASN B 2 5.893 -2.189 11.459 1.00 0.00 H new ATOM 0 HA ASN B 2 5.865 -4.693 11.694 1.00 0.00 H new ATOM 0 HB2 ASN B 2 5.576 -5.648 13.890 1.00 0.00 H new ATOM 0 HB3 ASN B 2 7.205 -5.075 13.595 1.00 0.00 H new ATOM 0 HD21 ASN B 2 7.274 -2.911 16.442 1.00 0.00 H new ATOM 0 HD22 ASN B 2 8.083 -3.357 14.936 1.00 0.00 H new ATOM 1421 N LYS B 3 3.853 -2.383 12.880 1.00 0.00 N ATOM 1422 CA LYS B 3 2.519 -1.777 13.212 1.00 0.00 C ATOM 1423 C LYS B 3 2.597 -0.970 14.552 1.00 0.00 C ATOM 1424 O LYS B 3 1.719 -0.136 14.771 1.00 0.00 O ATOM 1425 CB LYS B 3 1.278 -2.714 13.182 1.00 0.00 C ATOM 1426 CG LYS B 3 -0.096 -2.054 12.937 1.00 0.00 C ATOM 1427 CD LYS B 3 -1.201 -3.097 12.657 1.00 0.00 C ATOM 1428 CE LYS B 3 -2.543 -2.525 12.169 1.00 0.00 C ATOM 1429 NZ LYS B 3 -2.504 -2.028 10.778 1.00 0.00 N ATOM 0 H LYS B 3 4.567 -1.661 12.781 1.00 0.00 H new ATOM 0 HA LYS B 3 2.328 -1.108 12.373 1.00 0.00 H new ATOM 0 HB2 LYS B 3 1.437 -3.462 12.405 1.00 0.00 H new ATOM 0 HB3 LYS B 3 1.233 -3.246 14.132 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -0.372 -1.459 13.808 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -0.023 -1.369 12.093 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -0.832 -3.800 11.910 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -1.379 -3.666 13.569 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -3.308 -3.297 12.249 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -2.843 -1.711 12.829 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -3.440 -1.658 10.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -1.797 -1.269 10.700 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.248 -2.807 10.138 1.00 0.00 H new ATOM 1442 N THR B 4 3.617 -1.173 15.419 1.00 0.00 N ATOM 1443 CA THR B 4 3.916 -0.405 16.610 1.00 0.00 C ATOM 1444 C THR B 4 4.957 0.711 16.306 1.00 0.00 C ATOM 1445 O THR B 4 4.808 1.799 16.870 1.00 0.00 O ATOM 1446 CB THR B 4 4.422 -1.452 17.620 1.00 0.00 C ATOM 1447 OG1 THR B 4 3.449 -2.464 17.890 1.00 0.00 O ATOM 1448 CG2 THR B 4 4.727 -0.762 18.919 1.00 0.00 C ATOM 0 H THR B 4 4.285 -1.931 15.279 1.00 0.00 H new ATOM 0 HA THR B 4 3.054 0.132 17.005 1.00 0.00 H new ATOM 0 HB THR B 4 5.303 -1.923 17.185 1.00 0.00 H new ATOM 0 HG1 THR B 4 3.653 -3.263 17.361 1.00 0.00 H new ATOM 0 HG21 THR B 4 5.086 -1.493 19.643 1.00 0.00 H new ATOM 0 HG22 THR B 4 5.493 -0.004 18.757 1.00 0.00 H new ATOM 0 HG23 THR B 4 3.823 -0.288 19.300 1.00 0.00 H new ATOM 1456 N GLU B 5 6.010 0.469 15.476 1.00 0.00 N ATOM 1457 CA GLU B 5 6.872 1.595 14.983 1.00 0.00 C ATOM 1458 C GLU B 5 6.066 2.667 14.144 1.00 0.00 C ATOM 1459 O GLU B 5 6.491 3.814 13.993 1.00 0.00 O ATOM 1460 CB GLU B 5 8.129 1.129 14.197 1.00 0.00 C ATOM 1461 CG GLU B 5 8.910 -0.112 14.682 1.00 0.00 C ATOM 1462 CD GLU B 5 9.475 -0.005 16.102 1.00 0.00 C ATOM 1463 OE1 GLU B 5 8.906 -0.463 17.092 1.00 0.00 O ATOM 1464 OE2 GLU B 5 10.675 0.659 16.134 1.00 0.00 O ATOM 0 H GLU B 5 6.280 -0.456 15.142 1.00 0.00 H new ATOM 0 HA GLU B 5 7.226 2.075 15.895 1.00 0.00 H new ATOM 0 HB2 GLU B 5 7.820 0.940 13.169 1.00 0.00 H new ATOM 0 HB3 GLU B 5 8.827 1.965 14.171 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.252 -0.979 14.633 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.733 -0.297 13.992 1.00 0.00 H new ATOM 1472 N LEU B 6 4.888 2.241 13.634 1.00 0.00 N ATOM 1473 CA LEU B 6 3.828 3.050 13.029 1.00 0.00 C ATOM 1474 C LEU B 6 3.251 4.058 14.049 1.00 0.00 C ATOM 1475 O LEU B 6 3.302 5.252 13.792 1.00 0.00 O ATOM 1476 CB LEU B 6 2.756 1.977 12.601 1.00 0.00 C ATOM 1477 CG LEU B 6 2.464 1.963 11.093 1.00 0.00 C ATOM 1478 CD1 LEU B 6 3.665 1.551 10.223 1.00 0.00 C ATOM 1479 CD2 LEU B 6 1.188 1.201 10.734 1.00 0.00 C ATOM 0 H LEU B 6 4.645 1.250 13.639 1.00 0.00 H new ATOM 0 HA LEU B 6 4.172 3.657 12.192 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.103 0.989 12.904 1.00 0.00 H new ATOM 0 HB3 LEU B 6 1.828 2.168 13.140 1.00 0.00 H new ATOM 0 HG LEU B 6 2.277 3.007 10.842 1.00 0.00 H new ATOM 0 HD11 LEU B 6 3.375 1.567 9.172 1.00 0.00 H new ATOM 0 HD12 LEU B 6 4.487 2.249 10.383 1.00 0.00 H new ATOM 0 HD13 LEU B 6 3.984 0.545 10.496 1.00 0.00 H new ATOM 0 HD21 LEU B 6 1.039 1.229 9.655 1.00 0.00 H new ATOM 0 HD22 LEU B 6 1.278 0.165 11.061 1.00 0.00 H new ATOM 0 HD23 LEU B 6 0.335 1.665 11.230 1.00 0.00 H new ATOM 1491 N ILE B 7 2.785 3.563 15.210 1.00 0.00 N ATOM 1492 CA ILE B 7 2.234 4.345 16.348 1.00 0.00 C ATOM 1493 C ILE B 7 3.194 5.467 16.824 1.00 0.00 C ATOM 1494 O ILE B 7 2.772 6.620 16.938 1.00 0.00 O ATOM 1495 CB ILE B 7 1.861 3.382 17.538 1.00 0.00 C ATOM 1496 CG1 ILE B 7 1.116 2.092 17.109 1.00 0.00 C ATOM 1497 CG2 ILE B 7 1.037 4.125 18.602 1.00 0.00 C ATOM 1498 CD1 ILE B 7 0.879 1.024 18.186 1.00 0.00 C ATOM 0 H ILE B 7 2.779 2.560 15.396 1.00 0.00 H new ATOM 0 HA ILE B 7 1.331 4.842 15.992 1.00 0.00 H new ATOM 0 HB ILE B 7 2.816 3.061 17.954 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.147 2.382 16.702 1.00 0.00 H new ATOM 0 HG13 ILE B 7 1.678 1.632 16.296 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.790 3.441 19.414 1.00 0.00 H new ATOM 0 HG22 ILE B 7 1.618 4.960 18.994 1.00 0.00 H new ATOM 0 HG23 ILE B 7 0.118 4.501 18.153 1.00 0.00 H new ATOM 0 HD11 ILE B 7 0.349 0.178 17.749 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.837 0.687 18.581 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.282 1.448 18.994 1.00 0.00 H new ATOM 1510 N ASN B 8 4.467 5.112 17.084 1.00 0.00 N ATOM 1511 CA ASN B 8 5.507 6.111 17.447 1.00 0.00 C ATOM 1512 C ASN B 8 5.879 7.121 16.316 1.00 0.00 C ATOM 1513 O ASN B 8 6.400 8.187 16.650 1.00 0.00 O ATOM 1514 CB ASN B 8 6.769 5.416 18.027 1.00 0.00 C ATOM 1515 CG ASN B 8 6.561 4.640 19.346 1.00 0.00 C ATOM 1516 OD1 ASN B 8 6.391 5.228 20.414 1.00 0.00 O ATOM 1517 ND2 ASN B 8 6.568 3.316 19.300 1.00 0.00 N ATOM 0 H ASN B 8 4.805 4.150 17.052 1.00 0.00 H new ATOM 0 HA ASN B 8 5.049 6.726 18.222 1.00 0.00 H new ATOM 0 HB2 ASN B 8 7.157 4.725 17.278 1.00 0.00 H new ATOM 0 HB3 ASN B 8 7.536 6.174 18.190 1.00 0.00 H new ATOM 0 HD21 ASN B 8 6.432 2.775 20.154 1.00 0.00 H new ATOM 0 HD22 ASN B 8 6.710 2.837 18.410 1.00 0.00 H new ATOM 1524 N ALA B 9 5.615 6.832 15.019 1.00 0.00 N ATOM 1525 CA ALA B 9 5.721 7.852 13.944 1.00 0.00 C ATOM 1526 C ALA B 9 4.639 8.938 14.023 1.00 0.00 C ATOM 1527 O ALA B 9 4.945 10.121 13.886 1.00 0.00 O ATOM 1528 CB ALA B 9 5.488 7.212 12.558 1.00 0.00 C ATOM 0 H ALA B 9 5.329 5.909 14.692 1.00 0.00 H new ATOM 0 HA ALA B 9 6.717 8.275 14.076 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.570 7.977 11.786 1.00 0.00 H new ATOM 0 HB2 ALA B 9 6.236 6.439 12.384 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.493 6.768 12.525 1.00 0.00 H new ATOM 1534 N VAL B 10 3.380 8.510 14.209 1.00 0.00 N ATOM 1535 CA VAL B 10 2.191 9.370 14.205 1.00 0.00 C ATOM 1536 C VAL B 10 2.189 10.298 15.388 1.00 0.00 C ATOM 1537 O VAL B 10 2.126 11.514 15.232 1.00 0.00 O ATOM 1538 CB VAL B 10 0.857 8.573 14.096 1.00 0.00 C ATOM 1539 CG1 VAL B 10 -0.285 9.363 13.478 1.00 0.00 C ATOM 1540 CG2 VAL B 10 1.049 7.284 13.320 1.00 0.00 C ATOM 0 H VAL B 10 3.158 7.528 14.371 1.00 0.00 H new ATOM 0 HA VAL B 10 2.251 9.974 13.300 1.00 0.00 H new ATOM 0 HB VAL B 10 0.576 8.353 15.126 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.178 8.740 13.437 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.486 10.246 14.084 1.00 0.00 H new ATOM 0 HG13 VAL B 10 -0.010 9.670 12.469 1.00 0.00 H new ATOM 0 HG21 VAL B 10 0.101 6.750 13.261 1.00 0.00 H new ATOM 0 HG22 VAL B 10 1.399 7.514 12.314 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.785 6.660 13.827 1.00 0.00 H new ATOM 1550 N ALA B 11 2.314 9.674 16.558 1.00 0.00 N ATOM 1551 CA ALA B 11 2.418 10.402 17.802 1.00 0.00 C ATOM 1552 C ALA B 11 3.662 11.308 17.968 1.00 0.00 C ATOM 1553 O ALA B 11 3.561 12.293 18.706 1.00 0.00 O ATOM 1554 CB ALA B 11 2.237 9.392 18.933 1.00 0.00 C ATOM 0 H ALA B 11 2.345 8.660 16.661 1.00 0.00 H new ATOM 0 HA ALA B 11 1.626 11.151 17.819 1.00 0.00 H new ATOM 0 HB1 ALA B 11 2.309 9.904 19.893 1.00 0.00 H new ATOM 0 HB2 ALA B 11 1.258 8.920 18.846 1.00 0.00 H new ATOM 0 HB3 ALA B 11 3.014 8.631 18.869 1.00 0.00 H new ATOM 1560 N GLU B 12 4.798 11.015 17.284 1.00 0.00 N ATOM 1561 CA GLU B 12 5.937 11.960 17.239 1.00 0.00 C ATOM 1562 C GLU B 12 5.683 13.117 16.231 1.00 0.00 C ATOM 1563 O GLU B 12 5.887 14.271 16.623 1.00 0.00 O ATOM 1564 CB GLU B 12 7.274 11.203 17.012 1.00 0.00 C ATOM 1565 CG GLU B 12 8.573 12.038 17.086 1.00 0.00 C ATOM 1566 CD GLU B 12 8.878 12.616 18.474 1.00 0.00 C ATOM 1567 OE1 GLU B 12 9.457 11.985 19.358 1.00 0.00 O ATOM 1568 OE2 GLU B 12 8.429 13.905 18.610 1.00 0.00 O ATOM 0 H GLU B 12 4.946 10.149 16.766 1.00 0.00 H new ATOM 0 HA GLU B 12 6.028 12.446 18.211 1.00 0.00 H new ATOM 0 HB2 GLU B 12 7.341 10.405 17.751 1.00 0.00 H new ATOM 0 HB3 GLU B 12 7.232 10.727 16.032 1.00 0.00 H new ATOM 0 HG2 GLU B 12 9.410 11.413 16.774 1.00 0.00 H new ATOM 0 HG3 GLU B 12 8.504 12.858 16.372 1.00 0.00 H new ATOM 1576 N THR B 13 5.234 12.846 14.980 1.00 0.00 N ATOM 1577 CA THR B 13 4.984 13.934 13.970 1.00 0.00 C ATOM 1578 C THR B 13 3.564 14.580 13.879 1.00 0.00 C ATOM 1579 O THR B 13 3.249 15.313 12.937 1.00 0.00 O ATOM 1580 CB THR B 13 5.633 13.500 12.635 1.00 0.00 C ATOM 1581 OG1 THR B 13 6.155 14.633 11.948 1.00 0.00 O ATOM 1582 CG2 THR B 13 4.783 12.696 11.659 1.00 0.00 C ATOM 0 H THR B 13 5.037 11.905 14.640 1.00 0.00 H new ATOM 0 HA THR B 13 5.475 14.830 14.351 1.00 0.00 H new ATOM 0 HB THR B 13 6.406 12.806 12.964 1.00 0.00 H new ATOM 0 HG1 THR B 13 6.564 14.345 11.106 1.00 0.00 H new ATOM 0 HG21 THR B 13 5.370 12.464 10.770 1.00 0.00 H new ATOM 0 HG22 THR B 13 4.462 11.769 12.134 1.00 0.00 H new ATOM 0 HG23 THR B 13 3.907 13.279 11.373 1.00 0.00 H new ATOM 1590 N SER B 14 2.763 14.332 14.913 1.00 0.00 N ATOM 1591 CA SER B 14 1.394 14.899 15.088 1.00 0.00 C ATOM 1592 C SER B 14 1.105 15.371 16.546 1.00 0.00 C ATOM 1593 O SER B 14 0.413 16.383 16.701 1.00 0.00 O ATOM 1594 CB SER B 14 0.295 13.919 14.602 1.00 0.00 C ATOM 1595 OG SER B 14 -0.988 14.536 14.594 1.00 0.00 O ATOM 0 H SER B 14 3.039 13.719 15.680 1.00 0.00 H new ATOM 0 HA SER B 14 1.365 15.787 14.457 1.00 0.00 H new ATOM 0 HB2 SER B 14 0.537 13.568 13.599 1.00 0.00 H new ATOM 0 HB3 SER B 14 0.275 13.043 15.250 1.00 0.00 H new ATOM 0 HG SER B 14 -1.658 13.893 14.282 1.00 0.00 H new ATOM 1601 N GLY B 15 1.572 14.658 17.597 1.00 0.00 N ATOM 1602 CA GLY B 15 1.259 15.010 19.006 1.00 0.00 C ATOM 1603 C GLY B 15 -0.187 14.741 19.458 1.00 0.00 C ATOM 1604 O GLY B 15 -0.932 15.649 19.835 1.00 0.00 O ATOM 0 H GLY B 15 2.167 13.835 17.498 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.933 14.454 19.658 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.475 16.068 19.153 1.00 0.00 H new ATOM 1608 N LEU B 16 -0.518 13.453 19.431 1.00 0.00 N ATOM 1609 CA LEU B 16 -1.826 12.899 19.839 1.00 0.00 C ATOM 1610 C LEU B 16 -1.542 12.069 21.135 1.00 0.00 C ATOM 1611 O LEU B 16 -1.013 12.570 22.133 1.00 0.00 O ATOM 1612 CB LEU B 16 -2.645 12.431 18.575 1.00 0.00 C ATOM 1613 CG LEU B 16 -1.861 11.564 17.576 1.00 0.00 C ATOM 1614 CD1 LEU B 16 -1.021 10.479 18.150 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -2.275 11.220 16.137 1.00 0.00 C ATOM 0 H LEU B 16 0.132 12.733 19.115 1.00 0.00 H new ATOM 0 HA LEU B 16 -2.619 13.554 20.200 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -3.517 11.871 18.913 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -3.016 13.314 18.054 1.00 0.00 H new ATOM 0 HG LEU B 16 -1.348 12.496 17.339 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -0.521 9.942 17.345 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -0.275 10.911 18.817 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -1.651 9.788 18.710 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -1.514 10.588 15.681 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -3.227 10.690 16.149 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -2.378 12.138 15.559 1.00 0.00 H new ATOM 1627 N SER B 17 -1.934 10.812 21.083 1.00 0.00 N ATOM 1628 CA SER B 17 -1.636 9.766 22.094 1.00 0.00 C ATOM 1629 C SER B 17 -1.097 8.488 21.392 1.00 0.00 C ATOM 1630 O SER B 17 -1.374 8.231 20.225 1.00 0.00 O ATOM 1631 CB SER B 17 -2.871 9.438 22.953 1.00 0.00 C ATOM 1632 OG SER B 17 -3.406 10.593 23.590 1.00 0.00 O ATOM 0 H SER B 17 -2.495 10.456 20.309 1.00 0.00 H new ATOM 0 HA SER B 17 -0.869 10.153 22.765 1.00 0.00 H new ATOM 0 HB2 SER B 17 -3.638 8.984 22.325 1.00 0.00 H new ATOM 0 HB3 SER B 17 -2.600 8.701 23.709 1.00 0.00 H new ATOM 0 HG SER B 17 -4.189 10.340 24.123 1.00 0.00 H new ATOM 1638 N LYS B 18 -0.340 7.636 22.101 1.00 0.00 N ATOM 1639 CA LYS B 18 0.058 6.284 21.578 1.00 0.00 C ATOM 1640 C LYS B 18 -1.189 5.372 21.347 1.00 0.00 C ATOM 1641 O LYS B 18 -1.270 4.704 20.314 1.00 0.00 O ATOM 1642 CB LYS B 18 1.172 5.624 22.439 1.00 0.00 C ATOM 1643 CG LYS B 18 2.626 5.963 22.031 1.00 0.00 C ATOM 1644 CD LYS B 18 3.054 7.435 22.204 1.00 0.00 C ATOM 1645 CE LYS B 18 4.494 7.694 21.724 1.00 0.00 C ATOM 1646 NZ LYS B 18 4.861 9.116 21.849 1.00 0.00 N ATOM 0 H LYS B 18 0.016 7.841 23.035 1.00 0.00 H new ATOM 0 HA LYS B 18 0.510 6.426 20.596 1.00 0.00 H new ATOM 0 HB2 LYS B 18 1.027 5.922 23.478 1.00 0.00 H new ATOM 0 HB3 LYS B 18 1.045 4.542 22.397 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.301 5.338 22.616 1.00 0.00 H new ATOM 0 HG3 LYS B 18 2.762 5.687 20.985 1.00 0.00 H new ATOM 0 HD2 LYS B 18 2.369 8.076 21.649 1.00 0.00 H new ATOM 0 HD3 LYS B 18 2.970 7.713 23.255 1.00 0.00 H new ATOM 0 HE2 LYS B 18 5.187 7.086 22.306 1.00 0.00 H new ATOM 0 HE3 LYS B 18 4.593 7.382 20.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 5.837 9.253 21.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 4.215 9.693 21.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 4.790 9.406 22.845 1.00 0.00 H new ATOM 1659 N LYS B 19 -2.196 5.393 22.247 1.00 0.00 N ATOM 1660 CA LYS B 19 -3.519 4.783 21.965 1.00 0.00 C ATOM 1661 C LYS B 19 -4.236 5.491 20.768 1.00 0.00 C ATOM 1662 O LYS B 19 -4.740 4.753 19.923 1.00 0.00 O ATOM 1663 CB LYS B 19 -4.370 4.737 23.263 1.00 0.00 C ATOM 1664 CG LYS B 19 -5.687 3.927 23.184 1.00 0.00 C ATOM 1665 CD LYS B 19 -5.507 2.403 22.981 1.00 0.00 C ATOM 1666 CE LYS B 19 -6.805 1.577 23.072 1.00 0.00 C ATOM 1667 NZ LYS B 19 -7.714 1.784 21.928 1.00 0.00 N ATOM 0 H LYS B 19 -2.122 5.822 23.169 1.00 0.00 H new ATOM 0 HA LYS B 19 -3.377 3.752 21.642 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -3.757 4.318 24.061 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -4.613 5.760 23.551 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -6.253 4.092 24.101 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -6.288 4.319 22.364 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -5.053 2.233 22.005 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -4.805 2.032 23.728 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -6.550 0.519 23.137 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.328 1.836 23.993 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -8.566 1.200 22.051 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -7.986 2.787 21.877 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -7.232 1.511 21.048 1.00 0.00 H new ATOM 1680 N ASP B 20 -4.250 6.848 20.642 1.00 0.00 N ATOM 1681 CA ASP B 20 -4.860 7.528 19.451 1.00 0.00 C ATOM 1682 C ASP B 20 -4.133 7.323 18.089 1.00 0.00 C ATOM 1683 O ASP B 20 -4.802 7.366 17.057 1.00 0.00 O ATOM 1684 CB ASP B 20 -5.039 9.051 19.709 1.00 0.00 C ATOM 1685 CG ASP B 20 -6.273 9.394 20.554 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -6.234 9.561 21.773 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -7.412 9.492 19.796 1.00 0.00 O ATOM 0 H ASP B 20 -3.855 7.486 21.333 1.00 0.00 H new ATOM 0 HA ASP B 20 -5.822 7.027 19.343 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -4.149 9.432 20.210 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -5.111 9.566 18.751 1.00 0.00 H new ATOM 1693 N ALA B 21 -2.809 7.118 18.075 1.00 0.00 N ATOM 1694 CA ALA B 21 -2.030 6.786 16.860 1.00 0.00 C ATOM 1695 C ALA B 21 -2.245 5.342 16.344 1.00 0.00 C ATOM 1696 O ALA B 21 -2.261 5.161 15.126 1.00 0.00 O ATOM 1697 CB ALA B 21 -0.549 7.058 17.161 1.00 0.00 C ATOM 0 H ALA B 21 -2.235 7.177 18.916 1.00 0.00 H new ATOM 0 HA ALA B 21 -2.387 7.418 16.047 1.00 0.00 H new ATOM 0 HB1 ALA B 21 0.050 6.822 16.282 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -0.417 8.109 17.418 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -0.228 6.437 17.997 1.00 0.00 H new ATOM 1703 N THR B 22 -2.416 4.334 17.227 1.00 0.00 N ATOM 1704 CA THR B 22 -2.696 2.921 16.792 1.00 0.00 C ATOM 1705 C THR B 22 -4.118 2.648 16.284 1.00 0.00 C ATOM 1706 O THR B 22 -4.340 1.932 15.308 1.00 0.00 O ATOM 1707 CB THR B 22 -2.177 1.873 17.770 1.00 0.00 C ATOM 1708 OG1 THR B 22 -1.840 0.697 17.037 1.00 0.00 O ATOM 1709 CG2 THR B 22 -2.700 1.435 19.123 1.00 0.00 C ATOM 0 H THR B 22 -2.368 4.456 18.239 1.00 0.00 H new ATOM 0 HA THR B 22 -2.094 2.810 15.890 1.00 0.00 H new ATOM 0 HB THR B 22 -1.449 2.564 18.195 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.967 -0.091 17.606 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.057 0.653 19.526 1.00 0.00 H new ATOM 0 HG22 THR B 22 -2.706 2.286 19.804 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.714 1.050 19.014 1.00 0.00 H new ATOM 1717 N LYS B 23 -5.056 3.254 16.998 1.00 0.00 N ATOM 1718 CA LYS B 23 -6.431 3.517 16.544 1.00 0.00 C ATOM 1719 C LYS B 23 -6.532 4.191 15.150 1.00 0.00 C ATOM 1720 O LYS B 23 -7.303 3.724 14.319 1.00 0.00 O ATOM 1721 CB LYS B 23 -6.888 4.576 17.597 1.00 0.00 C ATOM 1722 CG LYS B 23 -7.494 4.023 18.910 1.00 0.00 C ATOM 1723 CD LYS B 23 -9.014 3.744 18.895 1.00 0.00 C ATOM 1724 CE LYS B 23 -9.471 2.596 17.975 1.00 0.00 C ATOM 1725 NZ LYS B 23 -10.909 2.318 18.133 1.00 0.00 N ATOM 0 H LYS B 23 -4.883 3.592 17.945 1.00 0.00 H new ATOM 0 HA LYS B 23 -7.002 2.592 16.460 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -6.029 5.197 17.852 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -7.625 5.228 17.128 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -6.978 3.097 19.162 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -7.284 4.733 19.710 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -9.334 3.520 19.912 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -9.530 4.655 18.592 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -9.261 2.854 16.937 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -8.898 1.697 18.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -11.130 1.389 17.721 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -11.153 2.315 19.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -11.460 3.053 17.646 1.00 0.00 H new ATOM 1738 N ALA B 24 -5.761 5.272 14.939 1.00 0.00 N ATOM 1739 CA ALA B 24 -5.675 6.018 13.672 1.00 0.00 C ATOM 1740 C ALA B 24 -5.012 5.270 12.485 1.00 0.00 C ATOM 1741 O ALA B 24 -5.381 5.481 11.336 1.00 0.00 O ATOM 1742 CB ALA B 24 -4.986 7.321 14.027 1.00 0.00 C ATOM 0 H ALA B 24 -5.163 5.662 15.667 1.00 0.00 H new ATOM 0 HA ALA B 24 -6.676 6.175 13.271 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -4.884 7.935 13.132 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -5.579 7.856 14.768 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -3.998 7.110 14.436 1.00 0.00 H new ATOM 1748 N VAL B 25 -4.047 4.386 12.747 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.558 3.355 11.796 1.00 0.00 C ATOM 1750 C VAL B 25 -4.746 2.380 11.486 1.00 0.00 C ATOM 1751 O VAL B 25 -5.119 2.271 10.319 1.00 0.00 O ATOM 1752 CB VAL B 25 -2.362 2.720 12.604 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -2.116 1.226 12.308 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -1.071 3.544 12.439 1.00 0.00 C ATOM 0 H VAL B 25 -3.565 4.357 13.645 1.00 0.00 H new ATOM 0 HA VAL B 25 -3.221 3.694 10.816 1.00 0.00 H new ATOM 0 HB VAL B 25 -2.670 2.760 13.649 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -1.277 0.870 12.905 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -3.009 0.653 12.559 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.888 1.097 11.250 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -0.267 3.078 13.009 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -0.795 3.581 11.385 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -1.236 4.557 12.806 1.00 0.00 H new ATOM 1764 N ASP B 26 -5.362 1.729 12.505 1.00 0.00 N ATOM 1765 CA ASP B 26 -6.609 0.908 12.309 1.00 0.00 C ATOM 1766 C ASP B 26 -7.950 1.728 12.139 1.00 0.00 C ATOM 1767 O ASP B 26 -9.053 1.355 12.548 1.00 0.00 O ATOM 1768 CB ASP B 26 -6.744 -0.065 13.502 1.00 0.00 C ATOM 1769 CG ASP B 26 -5.704 -1.188 13.590 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -5.747 -2.203 12.895 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -4.737 -0.930 14.528 1.00 0.00 O ATOM 0 H ASP B 26 -5.027 1.749 13.468 1.00 0.00 H new ATOM 0 HA ASP B 26 -6.481 0.389 11.359 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -6.697 0.516 14.423 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -7.734 -0.519 13.461 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.767 2.876 11.512 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.777 3.840 11.061 1.00 0.00 C ATOM 1779 C ALA B 27 -8.652 4.016 9.527 1.00 0.00 C ATOM 1780 O ALA B 27 -9.627 3.836 8.794 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.608 5.147 11.803 1.00 0.00 C ATOM 0 H ALA B 27 -6.826 3.194 11.281 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.780 3.475 11.280 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -9.361 5.858 11.463 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.727 4.976 12.873 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.614 5.550 11.608 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.430 4.360 9.070 1.00 0.00 N ATOM 1788 CA VAL B 28 -7.026 4.383 7.643 1.00 0.00 C ATOM 1789 C VAL B 28 -7.130 2.945 7.060 1.00 0.00 C ATOM 1790 O VAL B 28 -7.909 2.706 6.145 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.543 4.880 7.525 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -5.107 5.036 6.073 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -5.242 6.214 8.166 1.00 0.00 C ATOM 0 H VAL B 28 -6.675 4.637 9.697 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.681 5.056 7.090 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.004 4.096 8.056 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -4.074 5.382 6.038 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.185 4.075 5.564 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.750 5.763 5.576 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -4.189 6.457 8.023 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -5.858 6.986 7.706 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -5.461 6.163 9.233 1.00 0.00 H new ATOM 1803 N PHE B 29 -6.333 2.034 7.641 1.00 0.00 N ATOM 1804 CA PHE B 29 -6.259 0.593 7.259 1.00 0.00 C ATOM 1805 C PHE B 29 -7.572 -0.195 7.527 1.00 0.00 C ATOM 1806 O PHE B 29 -7.828 -1.150 6.794 1.00 0.00 O ATOM 1807 CB PHE B 29 -4.949 -0.068 7.794 1.00 0.00 C ATOM 1808 CG PHE B 29 -3.654 0.668 7.397 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -3.350 0.907 6.050 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.913 1.311 8.389 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -2.413 1.876 5.708 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.977 2.277 8.051 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.758 2.582 6.712 1.00 0.00 C ATOM 0 H PHE B 29 -5.704 2.272 8.408 1.00 0.00 H new ATOM 0 HA PHE B 29 -6.181 0.543 6.173 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -5.002 -0.122 8.881 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -4.897 -1.093 7.426 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -3.844 0.338 5.276 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -3.069 1.055 9.427 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -2.195 2.079 4.670 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -1.422 2.789 8.823 1.00 0.00 H new ATOM 0 HZ PHE B 29 -1.073 3.374 6.449 1.00 0.00 H new ATOM 1823 N ASP B 30 -8.438 0.199 8.494 1.00 0.00 N ATOM 1824 CA ASP B 30 -9.824 -0.355 8.576 1.00 0.00 C ATOM 1825 C ASP B 30 -10.715 0.091 7.367 1.00 0.00 C ATOM 1826 O ASP B 30 -11.457 -0.718 6.810 1.00 0.00 O ATOM 1827 CB ASP B 30 -10.462 0.076 9.914 1.00 0.00 C ATOM 1828 CG ASP B 30 -11.700 -0.734 10.320 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -12.852 -0.385 10.063 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -11.370 -1.882 10.994 1.00 0.00 O ATOM 0 H ASP B 30 -8.213 0.883 9.216 1.00 0.00 H new ATOM 0 HA ASP B 30 -9.760 -1.442 8.529 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.714 -0.008 10.702 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.738 1.128 9.848 1.00 0.00 H new ATOM 1836 N SER B 31 -10.612 1.383 7.003 1.00 0.00 N ATOM 1837 CA SER B 31 -11.297 1.980 5.827 1.00 0.00 C ATOM 1838 C SER B 31 -10.738 1.510 4.446 1.00 0.00 C ATOM 1839 O SER B 31 -11.551 1.418 3.520 1.00 0.00 O ATOM 1840 CB SER B 31 -11.388 3.512 5.962 1.00 0.00 C ATOM 1841 OG SER B 31 -12.113 3.866 7.135 1.00 0.00 O ATOM 0 H SER B 31 -10.045 2.055 7.520 1.00 0.00 H new ATOM 0 HA SER B 31 -12.314 1.589 5.834 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.386 3.940 6.003 1.00 0.00 H new ATOM 0 HB3 SER B 31 -11.878 3.932 5.084 1.00 0.00 H new ATOM 0 HG SER B 31 -11.499 3.914 7.897 1.00 0.00 H new ATOM 1847 N ILE B 32 -9.419 1.186 4.261 1.00 0.00 N ATOM 1848 CA ILE B 32 -8.931 0.454 3.074 1.00 0.00 C ATOM 1849 C ILE B 32 -9.637 -0.949 3.081 1.00 0.00 C ATOM 1850 O ILE B 32 -10.132 -1.335 2.027 1.00 0.00 O ATOM 1851 CB ILE B 32 -7.374 0.193 3.022 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -6.283 1.278 2.812 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -7.140 -0.731 1.787 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -5.985 2.453 3.742 1.00 0.00 C ATOM 0 H ILE B 32 -8.685 1.426 4.927 1.00 0.00 H new ATOM 0 HA ILE B 32 -9.160 1.080 2.212 1.00 0.00 H new ATOM 0 HB ILE B 32 -7.220 -0.121 4.054 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.343 0.734 2.717 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -6.494 1.721 1.839 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -6.077 -0.951 1.694 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -7.693 -1.661 1.919 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.487 -0.227 0.885 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -5.166 3.043 3.332 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -6.873 3.079 3.833 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -5.704 2.076 4.725 1.00 0.00 H new ATOM 1866 N THR B 33 -9.570 -1.752 4.166 1.00 0.00 N ATOM 1867 CA THR B 33 -10.194 -3.104 4.160 1.00 0.00 C ATOM 1868 C THR B 33 -11.727 -3.131 3.969 1.00 0.00 C ATOM 1869 O THR B 33 -12.227 -4.167 3.563 1.00 0.00 O ATOM 1870 CB THR B 33 -9.735 -4.038 5.295 1.00 0.00 C ATOM 1871 OG1 THR B 33 -10.199 -3.594 6.567 1.00 0.00 O ATOM 1872 CG2 THR B 33 -8.216 -4.199 5.325 1.00 0.00 C ATOM 0 H THR B 33 -9.104 -1.501 5.038 1.00 0.00 H new ATOM 0 HA THR B 33 -9.785 -3.526 3.242 1.00 0.00 H new ATOM 0 HB THR B 33 -10.179 -5.011 5.085 1.00 0.00 H new ATOM 0 HG1 THR B 33 -10.589 -2.699 6.479 1.00 0.00 H new ATOM 0 HG21 THR B 33 -7.937 -4.866 6.141 1.00 0.00 H new ATOM 0 HG22 THR B 33 -7.876 -4.621 4.379 1.00 0.00 H new ATOM 0 HG23 THR B 33 -7.750 -3.225 5.476 1.00 0.00 H new ATOM 1880 N GLU B 34 -12.460 -2.039 4.229 1.00 0.00 N ATOM 1881 CA GLU B 34 -13.870 -1.918 3.779 1.00 0.00 C ATOM 1882 C GLU B 34 -13.975 -1.443 2.294 1.00 0.00 C ATOM 1883 O GLU B 34 -15.023 -1.662 1.688 1.00 0.00 O ATOM 1884 CB GLU B 34 -14.680 -1.062 4.791 1.00 0.00 C ATOM 1885 CG GLU B 34 -16.219 -1.175 4.703 1.00 0.00 C ATOM 1886 CD GLU B 34 -16.768 -2.540 5.138 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -16.874 -3.502 4.378 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -17.116 -2.562 6.464 1.00 0.00 O ATOM 0 H GLU B 34 -12.112 -1.230 4.743 1.00 0.00 H new ATOM 0 HA GLU B 34 -14.331 -2.906 3.774 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -14.373 -1.342 5.799 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -14.405 -0.016 4.653 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -16.667 -0.400 5.325 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -16.530 -0.980 3.677 1.00 0.00 H new ATOM 1896 N ALA B 35 -12.927 -0.832 1.688 1.00 0.00 N ATOM 1897 CA ALA B 35 -12.846 -0.631 0.232 1.00 0.00 C ATOM 1898 C ALA B 35 -12.572 -1.976 -0.472 1.00 0.00 C ATOM 1899 O ALA B 35 -13.468 -2.512 -1.119 1.00 0.00 O ATOM 1900 CB ALA B 35 -11.758 0.421 -0.134 1.00 0.00 C ATOM 0 H ALA B 35 -12.122 -0.469 2.198 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.804 -0.243 -0.115 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -11.723 0.547 -1.216 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -12.002 1.375 0.334 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -10.787 0.079 0.223 1.00 0.00 H new ATOM 1906 N LEU B 36 -11.391 -2.577 -0.282 1.00 0.00 N ATOM 1907 CA LEU B 36 -10.944 -3.777 -1.016 1.00 0.00 C ATOM 1908 C LEU B 36 -11.766 -5.014 -0.696 1.00 0.00 C ATOM 1909 O LEU B 36 -12.175 -5.705 -1.634 1.00 0.00 O ATOM 1910 CB LEU B 36 -9.444 -3.913 -0.742 1.00 0.00 C ATOM 1911 CG LEU B 36 -8.636 -2.609 -1.104 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -7.157 -2.437 -1.040 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -9.133 -1.723 -2.283 1.00 0.00 C ATOM 0 H LEU B 36 -10.706 -2.242 0.395 1.00 0.00 H new ATOM 0 HA LEU B 36 -11.108 -3.668 -2.088 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -9.292 -4.149 0.311 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -9.049 -4.751 -1.316 1.00 0.00 H new ATOM 0 HG LEU B 36 -8.966 -2.316 -0.107 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.895 -1.426 -1.350 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.815 -2.603 -0.018 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.678 -3.156 -1.704 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -8.468 -0.867 -2.400 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -9.136 -2.309 -3.202 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -10.143 -1.371 -2.073 1.00 0.00 H new ATOM 1925 N ARG B 37 -12.085 -5.267 0.592 1.00 0.00 N ATOM 1926 CA ARG B 37 -12.971 -6.388 0.907 1.00 0.00 C ATOM 1927 C ARG B 37 -14.427 -6.204 0.366 1.00 0.00 C ATOM 1928 O ARG B 37 -15.040 -7.230 0.058 1.00 0.00 O ATOM 1929 CB ARG B 37 -12.991 -6.636 2.420 1.00 0.00 C ATOM 1930 CG ARG B 37 -13.496 -7.992 2.915 1.00 0.00 C ATOM 1931 CD ARG B 37 -13.521 -7.955 4.450 1.00 0.00 C ATOM 1932 NE ARG B 37 -13.813 -9.278 5.056 1.00 0.00 N ATOM 1933 CZ ARG B 37 -15.045 -9.763 5.308 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -16.173 -9.108 5.039 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -15.139 -10.962 5.852 1.00 0.00 N ATOM 0 H ARG B 37 -11.754 -4.731 1.394 1.00 0.00 H new ATOM 0 HA ARG B 37 -12.563 -7.259 0.394 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -11.977 -6.499 2.795 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -13.607 -5.862 2.878 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -14.492 -8.195 2.522 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -12.846 -8.793 2.563 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -12.558 -7.599 4.815 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -14.272 -7.237 4.779 1.00 0.00 H new ATOM 0 HE ARG B 37 -13.018 -9.867 5.301 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -16.136 -8.180 4.616 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -17.074 -9.534 5.256 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -14.294 -11.491 6.069 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -16.056 -11.359 6.056 1.00 0.00 H new ATOM 1948 N LYS B 38 -14.977 -4.955 0.250 1.00 0.00 N ATOM 1949 CA LYS B 38 -16.380 -4.782 -0.224 1.00 0.00 C ATOM 1950 C LYS B 38 -16.539 -4.496 -1.766 1.00 0.00 C ATOM 1951 O LYS B 38 -17.648 -4.179 -2.208 1.00 0.00 O ATOM 1952 CB LYS B 38 -17.036 -3.667 0.641 1.00 0.00 C ATOM 1953 CG LYS B 38 -18.581 -3.687 0.740 1.00 0.00 C ATOM 1954 CD LYS B 38 -19.180 -2.606 1.666 1.00 0.00 C ATOM 1955 CE LYS B 38 -19.004 -1.158 1.167 1.00 0.00 C ATOM 1956 NZ LYS B 38 -19.637 -0.192 2.082 1.00 0.00 N ATOM 0 H LYS B 38 -14.489 -4.087 0.470 1.00 0.00 H new ATOM 0 HA LYS B 38 -16.891 -5.736 -0.096 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -16.629 -3.734 1.650 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -16.733 -2.700 0.239 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -18.998 -3.562 -0.259 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -18.896 -4.668 1.097 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -20.244 -2.805 1.793 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -18.720 -2.695 2.650 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -17.942 -0.931 1.074 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -19.440 -1.059 0.173 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -19.500 0.772 1.717 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -20.655 -0.395 2.151 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -19.203 -0.271 3.024 1.00 0.00 H new ATOM 1969 N GLY B 39 -15.478 -4.612 -2.597 1.00 0.00 N ATOM 1970 CA GLY B 39 -15.525 -4.202 -4.030 1.00 0.00 C ATOM 1971 C GLY B 39 -15.585 -2.663 -4.256 1.00 0.00 C ATOM 1972 O GLY B 39 -16.405 -2.174 -5.036 1.00 0.00 O ATOM 0 H GLY B 39 -14.575 -4.986 -2.305 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -14.645 -4.598 -4.538 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -16.396 -4.660 -4.498 1.00 0.00 H new ATOM 1976 N ASP B 40 -14.699 -1.934 -3.556 1.00 0.00 N ATOM 1977 CA ASP B 40 -14.647 -0.447 -3.521 1.00 0.00 C ATOM 1978 C ASP B 40 -13.190 0.083 -3.613 1.00 0.00 C ATOM 1979 O ASP B 40 -12.211 -0.626 -3.359 1.00 0.00 O ATOM 1980 CB ASP B 40 -15.492 0.090 -2.326 1.00 0.00 C ATOM 1981 CG ASP B 40 -16.998 0.199 -2.604 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -17.517 1.174 -3.147 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -17.687 -0.912 -2.184 1.00 0.00 O ATOM 0 H ASP B 40 -13.976 -2.366 -2.981 1.00 0.00 H new ATOM 0 HA ASP B 40 -15.119 -0.038 -4.414 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -15.341 -0.565 -1.468 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -15.116 1.074 -2.046 1.00 0.00 H new ATOM 1989 N LYS B 41 -13.079 1.357 -4.040 1.00 0.00 N ATOM 1990 CA LYS B 41 -11.781 2.048 -4.241 1.00 0.00 C ATOM 1991 C LYS B 41 -11.476 2.976 -3.035 1.00 0.00 C ATOM 1992 O LYS B 41 -12.363 3.603 -2.442 1.00 0.00 O ATOM 1993 CB LYS B 41 -11.773 2.935 -5.521 1.00 0.00 C ATOM 1994 CG LYS B 41 -12.176 2.260 -6.852 1.00 0.00 C ATOM 1995 CD LYS B 41 -11.979 3.199 -8.058 1.00 0.00 C ATOM 1996 CE LYS B 41 -12.458 2.580 -9.382 1.00 0.00 C ATOM 1997 NZ LYS B 41 -12.175 3.466 -10.525 1.00 0.00 N ATOM 0 H LYS B 41 -13.887 1.941 -4.257 1.00 0.00 H new ATOM 0 HA LYS B 41 -11.030 1.265 -4.342 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -12.445 3.777 -5.353 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -10.771 3.346 -5.641 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -11.583 1.357 -6.995 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -13.220 1.951 -6.800 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -12.520 4.129 -7.881 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -10.923 3.456 -8.144 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -11.967 1.619 -9.535 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -13.529 2.385 -9.328 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -12.510 3.019 -11.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -12.664 4.374 -10.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -11.150 3.631 -10.591 1.00 0.00 H new ATOM 2010 N VAL B 42 -10.176 3.128 -2.757 1.00 0.00 N ATOM 2011 CA VAL B 42 -9.644 3.997 -1.703 1.00 0.00 C ATOM 2012 C VAL B 42 -9.356 5.379 -2.400 1.00 0.00 C ATOM 2013 O VAL B 42 -10.087 5.793 -3.307 1.00 0.00 O ATOM 2014 CB VAL B 42 -8.434 3.150 -1.171 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -7.877 3.681 0.131 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -8.729 1.687 -0.751 1.00 0.00 C ATOM 0 H VAL B 42 -9.446 2.637 -3.273 1.00 0.00 H new ATOM 0 HA VAL B 42 -10.261 4.263 -0.844 1.00 0.00 H new ATOM 0 HB VAL B 42 -7.782 3.208 -2.043 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -7.043 3.057 0.451 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -7.530 4.704 -0.012 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -8.656 3.665 0.893 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -7.810 1.216 -0.404 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -9.466 1.681 0.052 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -9.119 1.135 -1.606 1.00 0.00 H new ATOM 2026 N GLN B 43 -8.396 6.141 -1.863 1.00 0.00 N ATOM 2027 CA GLN B 43 -7.745 7.317 -2.503 1.00 0.00 C ATOM 2028 C GLN B 43 -6.879 8.187 -1.538 1.00 0.00 C ATOM 2029 O GLN B 43 -7.287 8.509 -0.422 1.00 0.00 O ATOM 2030 CB GLN B 43 -8.310 7.989 -3.794 1.00 0.00 C ATOM 2031 CG GLN B 43 -8.081 7.145 -5.065 1.00 0.00 C ATOM 2032 CD GLN B 43 -8.862 7.623 -6.298 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -8.560 8.661 -6.885 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -9.864 6.867 -6.723 1.00 0.00 N ATOM 0 H GLN B 43 -8.027 5.957 -0.930 1.00 0.00 H new ATOM 0 HA GLN B 43 -7.051 6.756 -3.130 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -9.379 8.163 -3.668 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -7.841 8.965 -3.924 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -7.017 7.149 -5.301 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -8.357 6.112 -4.854 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -10.102 6.009 -6.225 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -10.397 7.143 -7.548 1.00 0.00 H new ATOM 2043 N LEU B 44 -5.665 8.535 -2.010 1.00 0.00 N ATOM 2044 CA LEU B 44 -4.636 9.335 -1.307 1.00 0.00 C ATOM 2045 C LEU B 44 -3.926 10.109 -2.461 1.00 0.00 C ATOM 2046 O LEU B 44 -3.288 9.490 -3.322 1.00 0.00 O ATOM 2047 CB LEU B 44 -3.588 8.485 -0.524 1.00 0.00 C ATOM 2048 CG LEU B 44 -4.134 7.423 0.469 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -4.388 6.033 -0.150 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -3.183 7.255 1.667 1.00 0.00 C ATOM 0 H LEU B 44 -5.358 8.252 -2.940 1.00 0.00 H new ATOM 0 HA LEU B 44 -5.097 9.964 -0.546 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.956 7.974 -1.251 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.946 9.169 0.032 1.00 0.00 H new ATOM 0 HG LEU B 44 -5.101 7.815 0.784 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.768 5.357 0.616 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -5.121 6.120 -0.952 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -3.455 5.638 -0.552 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.586 6.506 2.349 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.204 6.933 1.312 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -3.085 8.206 2.190 1.00 0.00 H new ATOM 2062 N ILE B 45 -4.022 11.452 -2.502 1.00 0.00 N ATOM 2063 CA ILE B 45 -3.517 12.271 -3.662 1.00 0.00 C ATOM 2064 C ILE B 45 -2.007 12.541 -3.877 1.00 0.00 C ATOM 2065 O ILE B 45 -1.536 12.701 -5.009 1.00 0.00 O ATOM 2066 CB ILE B 45 -4.473 13.487 -3.892 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -4.432 14.045 -5.344 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -4.268 14.587 -2.827 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -5.604 14.961 -5.733 1.00 0.00 C ATOM 0 H ILE B 45 -4.441 12.007 -1.756 1.00 0.00 H new ATOM 0 HA ILE B 45 -3.566 11.569 -4.494 1.00 0.00 H new ATOM 0 HB ILE B 45 -5.485 13.102 -3.765 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -3.502 14.598 -5.476 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -4.405 13.204 -6.037 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -4.951 15.414 -3.022 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -4.468 14.177 -1.837 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -3.240 14.947 -2.869 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -5.479 15.295 -6.763 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -6.541 14.412 -5.641 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -5.624 15.827 -5.071 1.00 0.00 H new ATOM 2081 N GLY B 46 -1.298 12.567 -2.772 1.00 0.00 N ATOM 2082 CA GLY B 46 0.185 12.621 -2.770 1.00 0.00 C ATOM 2083 C GLY B 46 0.883 11.304 -2.350 1.00 0.00 C ATOM 2084 O GLY B 46 2.011 11.378 -1.853 1.00 0.00 O ATOM 0 H GLY B 46 -1.712 12.552 -1.840 1.00 0.00 H new ATOM 0 HA2 GLY B 46 0.526 12.894 -3.769 1.00 0.00 H new ATOM 0 HA3 GLY B 46 0.505 13.416 -2.096 1.00 0.00 H new ATOM 2088 N PHE B 47 0.258 10.118 -2.558 1.00 0.00 N ATOM 2089 CA PHE B 47 0.787 8.834 -2.044 1.00 0.00 C ATOM 2090 C PHE B 47 0.261 7.552 -2.752 1.00 0.00 C ATOM 2091 O PHE B 47 1.075 6.648 -2.962 1.00 0.00 O ATOM 2092 CB PHE B 47 0.435 8.768 -0.529 1.00 0.00 C ATOM 2093 CG PHE B 47 1.325 7.782 0.247 1.00 0.00 C ATOM 2094 CD1 PHE B 47 2.606 8.163 0.662 1.00 0.00 C ATOM 2095 CD2 PHE B 47 0.915 6.456 0.416 1.00 0.00 C ATOM 2096 CE1 PHE B 47 3.467 7.223 1.221 1.00 0.00 C ATOM 2097 CE2 PHE B 47 1.794 5.513 0.942 1.00 0.00 C ATOM 2098 CZ PHE B 47 3.075 5.895 1.327 1.00 0.00 C ATOM 0 H PHE B 47 -0.614 10.027 -3.079 1.00 0.00 H new ATOM 0 HA PHE B 47 1.859 8.833 -2.243 1.00 0.00 H new ATOM 0 HB2 PHE B 47 0.536 9.762 -0.093 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -0.609 8.475 -0.416 1.00 0.00 H new ATOM 0 HD1 PHE B 47 2.927 9.188 0.548 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -0.086 6.162 0.138 1.00 0.00 H new ATOM 0 HE1 PHE B 47 4.442 7.527 1.573 1.00 0.00 H new ATOM 0 HE2 PHE B 47 1.481 4.485 1.051 1.00 0.00 H new ATOM 0 HZ PHE B 47 3.766 5.158 1.709 1.00 0.00 H new ATOM 2108 N GLY B 48 -1.055 7.412 -3.030 1.00 0.00 N ATOM 2109 CA GLY B 48 -1.589 6.172 -3.615 1.00 0.00 C ATOM 2110 C GLY B 48 -3.085 6.057 -3.910 1.00 0.00 C ATOM 2111 O GLY B 48 -3.929 6.661 -3.256 1.00 0.00 O ATOM 0 H GLY B 48 -1.754 8.135 -2.860 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -1.058 5.998 -4.551 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.326 5.355 -2.943 1.00 0.00 H new ATOM 2115 N ASN B 49 -3.389 5.213 -4.903 1.00 0.00 N ATOM 2116 CA ASN B 49 -4.776 4.898 -5.323 1.00 0.00 C ATOM 2117 C ASN B 49 -4.874 3.353 -5.295 1.00 0.00 C ATOM 2118 O ASN B 49 -4.457 2.677 -6.243 1.00 0.00 O ATOM 2119 CB ASN B 49 -5.075 5.544 -6.710 1.00 0.00 C ATOM 2120 CG ASN B 49 -6.409 5.177 -7.408 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -7.260 4.447 -6.896 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -6.617 5.688 -8.611 1.00 0.00 N ATOM 0 H ASN B 49 -2.680 4.721 -5.447 1.00 0.00 H new ATOM 0 HA ASN B 49 -5.538 5.314 -4.664 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -5.049 6.627 -6.587 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -4.261 5.280 -7.385 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -7.480 5.477 -9.112 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -5.914 6.292 -9.037 1.00 0.00 H new ATOM 2129 N PHE B 50 -5.439 2.807 -4.204 1.00 0.00 N ATOM 2130 CA PHE B 50 -5.660 1.347 -4.080 1.00 0.00 C ATOM 2131 C PHE B 50 -7.017 0.968 -4.708 1.00 0.00 C ATOM 2132 O PHE B 50 -8.007 1.703 -4.587 1.00 0.00 O ATOM 2133 CB PHE B 50 -5.810 0.795 -2.634 1.00 0.00 C ATOM 2134 CG PHE B 50 -4.766 0.982 -1.559 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -4.629 2.251 -0.991 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -4.255 -0.138 -0.887 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -3.922 2.413 0.190 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -3.552 0.031 0.302 1.00 0.00 C ATOM 2139 CZ PHE B 50 -3.365 1.309 0.806 1.00 0.00 C ATOM 0 H PHE B 50 -5.751 3.347 -3.397 1.00 0.00 H new ATOM 0 HA PHE B 50 -4.769 0.933 -4.553 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -6.735 1.215 -2.240 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -5.963 -0.280 -2.730 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -5.075 3.108 -1.473 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -4.407 -1.128 -1.291 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -3.807 3.395 0.625 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -3.156 -0.825 0.827 1.00 0.00 H new ATOM 0 HZ PHE B 50 -2.772 1.444 1.698 1.00 0.00 H new ATOM 2149 N GLU B 51 -7.054 -0.243 -5.284 1.00 0.00 N ATOM 2150 CA GLU B 51 -8.333 -0.840 -5.733 1.00 0.00 C ATOM 2151 C GLU B 51 -8.203 -2.345 -6.039 1.00 0.00 C ATOM 2152 O GLU B 51 -7.135 -2.856 -6.382 1.00 0.00 O ATOM 2153 CB GLU B 51 -9.032 -0.053 -6.890 1.00 0.00 C ATOM 2154 CG GLU B 51 -8.227 0.068 -8.207 1.00 0.00 C ATOM 2155 CD GLU B 51 -8.875 1.013 -9.218 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -8.667 2.226 -9.240 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -9.706 0.354 -10.087 1.00 0.00 O ATOM 0 H GLU B 51 -6.232 -0.824 -5.450 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.006 -0.746 -4.880 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -9.983 -0.538 -7.111 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -9.262 0.951 -6.534 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.221 0.422 -7.980 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.124 -0.920 -8.656 1.00 0.00 H new ATOM 2165 N VAL B 52 -9.332 -3.064 -5.933 1.00 0.00 N ATOM 2166 CA VAL B 52 -9.379 -4.521 -6.077 1.00 0.00 C ATOM 2167 C VAL B 52 -9.558 -4.938 -7.578 1.00 0.00 C ATOM 2168 O VAL B 52 -10.004 -4.138 -8.412 1.00 0.00 O ATOM 2169 CB VAL B 52 -10.466 -4.906 -5.005 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -11.802 -5.305 -5.625 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -9.905 -5.923 -4.007 1.00 0.00 C ATOM 0 H VAL B 52 -10.242 -2.644 -5.744 1.00 0.00 H new ATOM 0 HA VAL B 52 -8.473 -5.089 -5.868 1.00 0.00 H new ATOM 0 HB VAL B 52 -10.704 -4.010 -4.432 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -12.509 -5.559 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -12.195 -4.473 -6.209 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -11.658 -6.169 -6.274 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -10.672 -6.176 -3.275 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -9.600 -6.824 -4.539 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -9.043 -5.494 -3.496 1.00 0.00 H new ATOM 2181 N ARG B 53 -9.232 -6.205 -7.903 1.00 0.00 N ATOM 2182 CA ARG B 53 -9.352 -6.720 -9.295 1.00 0.00 C ATOM 2183 C ARG B 53 -10.060 -8.101 -9.261 1.00 0.00 C ATOM 2184 O ARG B 53 -9.426 -9.136 -9.038 1.00 0.00 O ATOM 2185 CB ARG B 53 -7.948 -6.728 -9.974 1.00 0.00 C ATOM 2186 CG ARG B 53 -7.951 -6.567 -11.514 1.00 0.00 C ATOM 2187 CD ARG B 53 -8.380 -5.185 -12.058 1.00 0.00 C ATOM 2188 NE ARG B 53 -7.463 -4.091 -11.640 1.00 0.00 N ATOM 2189 CZ ARG B 53 -7.809 -2.795 -11.521 1.00 0.00 C ATOM 2190 NH1 ARG B 53 -9.029 -2.324 -11.773 1.00 0.00 N ATOM 2191 NH2 ARG B 53 -6.882 -1.939 -11.133 1.00 0.00 N ATOM 0 H ARG B 53 -8.886 -6.891 -7.232 1.00 0.00 H new ATOM 0 HA ARG B 53 -9.973 -6.070 -9.912 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -7.351 -5.924 -9.543 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -7.449 -7.664 -9.725 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -6.948 -6.783 -11.882 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -8.615 -7.322 -11.935 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -8.419 -5.224 -13.147 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -9.388 -4.960 -11.711 1.00 0.00 H new ATOM 0 HE ARG B 53 -6.498 -4.342 -11.427 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -9.768 -2.958 -12.076 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -9.224 -1.329 -11.663 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -5.937 -2.267 -10.933 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -7.111 -0.950 -11.033 1.00 0.00 H new ATOM 2522 N LYS B 75 -11.037 -11.264 -5.608 1.00 0.00 N ATOM 2523 CA LYS B 75 -10.710 -9.808 -5.665 1.00 0.00 C ATOM 2524 C LYS B 75 -9.238 -9.626 -5.204 1.00 0.00 C ATOM 2525 O LYS B 75 -8.871 -10.063 -4.110 1.00 0.00 O ATOM 2526 CB LYS B 75 -11.680 -8.880 -4.890 1.00 0.00 C ATOM 2527 CG LYS B 75 -13.146 -9.345 -4.712 1.00 0.00 C ATOM 2528 CD LYS B 75 -14.032 -8.351 -3.935 1.00 0.00 C ATOM 2529 CE LYS B 75 -15.452 -8.905 -3.713 1.00 0.00 C ATOM 2530 NZ LYS B 75 -16.297 -7.965 -2.959 1.00 0.00 N ATOM 0 HA LYS B 75 -10.838 -9.487 -6.699 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -11.260 -8.712 -3.898 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -11.695 -7.915 -5.397 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -13.584 -9.514 -5.696 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -13.151 -10.303 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -13.573 -8.131 -2.971 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -14.090 -7.410 -4.483 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -15.914 -9.115 -4.677 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -15.392 -9.851 -3.175 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -17.228 -8.396 -2.787 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -15.844 -7.744 -2.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -16.417 -7.090 -3.507 1.00 0.00 H new ATOM 2543 N VAL B 76 -8.405 -8.987 -6.038 1.00 0.00 N ATOM 2544 CA VAL B 76 -6.954 -8.952 -5.882 1.00 0.00 C ATOM 2545 C VAL B 76 -6.602 -7.481 -5.483 1.00 0.00 C ATOM 2546 O VAL B 76 -6.800 -6.565 -6.286 1.00 0.00 O ATOM 2547 CB VAL B 76 -6.484 -9.514 -7.261 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -5.504 -8.647 -8.016 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -6.011 -10.964 -7.175 1.00 0.00 C ATOM 0 H VAL B 76 -8.733 -8.471 -6.855 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.461 -9.539 -5.107 1.00 0.00 H new ATOM 0 HB VAL B 76 -7.390 -9.493 -7.867 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -5.243 -9.129 -8.958 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -5.957 -7.677 -8.218 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -4.604 -8.509 -7.417 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.696 -11.303 -8.162 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -5.172 -11.033 -6.483 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -6.827 -11.592 -6.819 1.00 0.00 H new ATOM 2559 N PRO B 77 -6.059 -7.206 -4.280 1.00 0.00 N ATOM 2560 CA PRO B 77 -5.797 -5.833 -3.814 1.00 0.00 C ATOM 2561 C PRO B 77 -4.481 -5.256 -4.369 1.00 0.00 C ATOM 2562 O PRO B 77 -3.423 -5.894 -4.403 1.00 0.00 O ATOM 2563 CB PRO B 77 -5.802 -6.051 -2.292 1.00 0.00 C ATOM 2564 CG PRO B 77 -5.202 -7.451 -2.106 1.00 0.00 C ATOM 2565 CD PRO B 77 -5.721 -8.247 -3.311 1.00 0.00 C ATOM 0 HA PRO B 77 -6.517 -5.086 -4.149 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -5.209 -5.293 -1.780 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -6.812 -5.994 -1.886 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -4.113 -7.418 -2.090 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -5.521 -7.899 -1.165 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.964 -8.928 -3.700 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.590 -8.851 -3.050 1.00 0.00 H new ATOM 2573 N ALA B 78 -4.636 -4.010 -4.801 1.00 0.00 N ATOM 2574 CA ALA B 78 -3.580 -3.231 -5.456 1.00 0.00 C ATOM 2575 C ALA B 78 -3.423 -1.854 -4.752 1.00 0.00 C ATOM 2576 O ALA B 78 -4.265 -1.414 -3.968 1.00 0.00 O ATOM 2577 CB ALA B 78 -4.023 -3.168 -6.927 1.00 0.00 C ATOM 0 H ALA B 78 -5.514 -3.499 -4.706 1.00 0.00 H new ATOM 0 HA ALA B 78 -2.583 -3.666 -5.393 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -3.292 -2.601 -7.503 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -4.097 -4.179 -7.328 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -4.995 -2.679 -6.994 1.00 0.00 H new ATOM 2583 N PHE B 79 -2.289 -1.218 -5.041 1.00 0.00 N ATOM 2584 CA PHE B 79 -1.876 0.105 -4.486 1.00 0.00 C ATOM 2585 C PHE B 79 -1.005 0.714 -5.625 1.00 0.00 C ATOM 2586 O PHE B 79 0.063 0.211 -5.997 1.00 0.00 O ATOM 2587 CB PHE B 79 -1.067 -0.022 -3.185 1.00 0.00 C ATOM 2588 CG PHE B 79 -0.263 1.204 -2.690 1.00 0.00 C ATOM 2589 CD1 PHE B 79 -0.878 2.221 -1.959 1.00 0.00 C ATOM 2590 CD2 PHE B 79 1.098 1.320 -3.011 1.00 0.00 C ATOM 2591 CE1 PHE B 79 -0.150 3.335 -1.553 1.00 0.00 C ATOM 2592 CE2 PHE B 79 1.820 2.443 -2.624 1.00 0.00 C ATOM 2593 CZ PHE B 79 1.193 3.454 -1.905 1.00 0.00 C ATOM 0 H PHE B 79 -1.600 -1.606 -5.685 1.00 0.00 H new ATOM 0 HA PHE B 79 -2.735 0.719 -4.214 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -1.758 -0.307 -2.392 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -0.367 -0.848 -3.310 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -1.925 2.143 -1.707 1.00 0.00 H new ATOM 0 HD2 PHE B 79 1.588 0.531 -3.563 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -0.625 4.107 -0.966 1.00 0.00 H new ATOM 0 HE2 PHE B 79 2.865 2.530 -2.881 1.00 0.00 H new ATOM 0 HZ PHE B 79 1.749 4.335 -1.618 1.00 0.00 H new ATOM 2603 N LYS B 80 -1.488 1.843 -6.113 1.00 0.00 N ATOM 2604 CA LYS B 80 -0.709 2.760 -7.009 1.00 0.00 C ATOM 2605 C LYS B 80 0.206 3.622 -6.100 1.00 0.00 C ATOM 2606 O LYS B 80 -0.217 3.951 -4.988 1.00 0.00 O ATOM 2607 CB LYS B 80 -1.645 3.619 -7.896 1.00 0.00 C ATOM 2608 CG LYS B 80 -2.371 2.798 -8.990 1.00 0.00 C ATOM 2609 CD LYS B 80 -3.291 3.640 -9.893 1.00 0.00 C ATOM 2610 CE LYS B 80 -4.028 2.789 -10.943 1.00 0.00 C ATOM 2611 NZ LYS B 80 -4.927 3.613 -11.770 1.00 0.00 N ATOM 0 H LYS B 80 -2.432 2.174 -5.914 1.00 0.00 H new ATOM 0 HA LYS B 80 -0.098 2.189 -7.708 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.387 4.107 -7.264 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -1.062 4.409 -8.370 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -1.626 2.299 -9.610 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -2.963 2.017 -8.512 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -4.022 4.162 -9.275 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -2.699 4.402 -10.399 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -3.301 2.288 -11.582 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -4.604 2.010 -10.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -5.408 3.009 -12.467 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -5.635 4.072 -11.162 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -4.373 4.340 -12.266 1.00 0.00 H new ATOM 2624 N PRO B 81 1.462 4.001 -6.470 1.00 0.00 N ATOM 2625 CA PRO B 81 2.237 4.991 -5.676 1.00 0.00 C ATOM 2626 C PRO B 81 1.801 6.476 -5.935 1.00 0.00 C ATOM 2627 O PRO B 81 2.617 7.388 -5.815 1.00 0.00 O ATOM 2628 CB PRO B 81 3.659 4.643 -6.155 1.00 0.00 C ATOM 2629 CG PRO B 81 3.511 4.234 -7.622 1.00 0.00 C ATOM 2630 CD PRO B 81 2.178 3.492 -7.659 1.00 0.00 C ATOM 0 HA PRO B 81 2.104 4.933 -4.596 1.00 0.00 H new ATOM 0 HB2 PRO B 81 4.327 5.498 -6.052 1.00 0.00 H new ATOM 0 HB3 PRO B 81 4.085 3.833 -5.563 1.00 0.00 H new ATOM 0 HG2 PRO B 81 3.504 5.102 -8.281 1.00 0.00 H new ATOM 0 HG3 PRO B 81 4.334 3.596 -7.944 1.00 0.00 H new ATOM 0 HD2 PRO B 81 1.629 3.700 -8.577 1.00 0.00 H new ATOM 0 HD3 PRO B 81 2.319 2.412 -7.610 1.00 0.00 H new ATOM 2638 N GLY B 82 0.516 6.713 -6.286 1.00 0.00 N ATOM 2639 CA GLY B 82 -0.052 8.025 -6.672 1.00 0.00 C ATOM 2640 C GLY B 82 0.746 8.912 -7.647 1.00 0.00 C ATOM 2641 O GLY B 82 0.463 10.112 -7.677 1.00 0.00 O ATOM 0 H GLY B 82 -0.180 5.967 -6.309 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -1.032 7.845 -7.114 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -0.214 8.598 -5.759 1.00 0.00 H new ATOM 2645 N LYS B 83 1.726 8.329 -8.393 1.00 0.00 N ATOM 2646 CA LYS B 83 2.776 9.098 -9.162 1.00 0.00 C ATOM 2647 C LYS B 83 3.855 9.817 -8.270 1.00 0.00 C ATOM 2648 O LYS B 83 5.060 9.780 -8.516 1.00 0.00 O ATOM 2649 CB LYS B 83 2.200 10.108 -10.199 1.00 0.00 C ATOM 2650 CG LYS B 83 2.280 9.684 -11.684 1.00 0.00 C ATOM 2651 CD LYS B 83 1.303 8.583 -12.158 1.00 0.00 C ATOM 2652 CE LYS B 83 1.753 7.134 -11.882 1.00 0.00 C ATOM 2653 NZ LYS B 83 0.808 6.157 -12.453 1.00 0.00 N ATOM 0 H LYS B 83 1.820 7.318 -8.485 1.00 0.00 H new ATOM 0 HA LYS B 83 3.281 8.302 -9.709 1.00 0.00 H new ATOM 0 HB2 LYS B 83 1.155 10.294 -9.952 1.00 0.00 H new ATOM 0 HB3 LYS B 83 2.728 11.055 -10.084 1.00 0.00 H new ATOM 0 HG2 LYS B 83 2.114 10.570 -12.298 1.00 0.00 H new ATOM 0 HG3 LYS B 83 3.296 9.343 -11.884 1.00 0.00 H new ATOM 0 HD2 LYS B 83 0.339 8.744 -11.675 1.00 0.00 H new ATOM 0 HD3 LYS B 83 1.145 8.698 -13.230 1.00 0.00 H new ATOM 0 HE2 LYS B 83 2.745 6.973 -12.305 1.00 0.00 H new ATOM 0 HE3 LYS B 83 1.836 6.976 -10.807 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 1.140 5.193 -12.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -0.132 6.296 -12.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 0.748 6.292 -13.482 1.00 0.00 H new ATOM 2666 N ALA B 84 3.326 10.533 -7.285 1.00 0.00 N ATOM 2667 CA ALA B 84 4.003 11.294 -6.224 1.00 0.00 C ATOM 2668 C ALA B 84 5.003 10.500 -5.358 1.00 0.00 C ATOM 2669 O ALA B 84 6.144 10.949 -5.213 1.00 0.00 O ATOM 2670 CB ALA B 84 2.812 11.762 -5.386 1.00 0.00 C ATOM 0 H ALA B 84 2.313 10.607 -7.194 1.00 0.00 H new ATOM 0 HA ALA B 84 4.639 12.075 -6.641 1.00 0.00 H new ATOM 0 HB1 ALA B 84 3.170 12.353 -4.543 1.00 0.00 H new ATOM 0 HB2 ALA B 84 2.151 12.372 -6.002 1.00 0.00 H new ATOM 0 HB3 ALA B 84 2.265 10.895 -5.015 1.00 0.00 H new ATOM 2676 N LEU B 85 4.592 9.339 -4.787 1.00 0.00 N ATOM 2677 CA LEU B 85 5.532 8.397 -4.155 1.00 0.00 C ATOM 2678 C LEU B 85 6.554 7.856 -5.209 1.00 0.00 C ATOM 2679 O LEU B 85 7.730 7.759 -4.868 1.00 0.00 O ATOM 2680 CB LEU B 85 4.745 7.289 -3.404 1.00 0.00 C ATOM 2681 CG LEU B 85 5.660 6.251 -2.731 1.00 0.00 C ATOM 2682 CD1 LEU B 85 6.323 6.740 -1.439 1.00 0.00 C ATOM 2683 CD2 LEU B 85 4.945 4.909 -2.491 1.00 0.00 C ATOM 0 H LEU B 85 3.617 9.040 -4.755 1.00 0.00 H new ATOM 0 HA LEU B 85 6.131 8.908 -3.401 1.00 0.00 H new ATOM 0 HB2 LEU B 85 4.111 7.751 -2.647 1.00 0.00 H new ATOM 0 HB3 LEU B 85 4.084 6.781 -4.106 1.00 0.00 H new ATOM 0 HG LEU B 85 6.463 6.095 -3.451 1.00 0.00 H new ATOM 0 HD11 LEU B 85 6.950 5.948 -1.030 1.00 0.00 H new ATOM 0 HD12 LEU B 85 6.937 7.615 -1.654 1.00 0.00 H new ATOM 0 HD13 LEU B 85 5.554 7.005 -0.713 1.00 0.00 H new ATOM 0 HD21 LEU B 85 5.633 4.211 -2.014 1.00 0.00 H new ATOM 0 HD22 LEU B 85 4.082 5.067 -1.844 1.00 0.00 H new ATOM 0 HD23 LEU B 85 4.613 4.498 -3.444 1.00 0.00 H new ATOM 2695 N LYS B 86 6.140 7.521 -6.450 1.00 0.00 N ATOM 2696 CA LYS B 86 7.082 7.153 -7.549 1.00 0.00 C ATOM 2697 C LYS B 86 8.232 8.191 -7.807 1.00 0.00 C ATOM 2698 O LYS B 86 9.320 7.788 -8.219 1.00 0.00 O ATOM 2699 CB LYS B 86 6.302 6.773 -8.835 1.00 0.00 C ATOM 2700 CG LYS B 86 7.055 5.805 -9.771 1.00 0.00 C ATOM 2701 CD LYS B 86 6.247 5.437 -11.030 1.00 0.00 C ATOM 2702 CE LYS B 86 7.017 4.486 -11.964 1.00 0.00 C ATOM 2703 NZ LYS B 86 6.219 4.135 -13.152 1.00 0.00 N ATOM 0 H LYS B 86 5.158 7.495 -6.724 1.00 0.00 H new ATOM 0 HA LYS B 86 7.618 6.268 -7.205 1.00 0.00 H new ATOM 0 HB2 LYS B 86 5.353 6.319 -8.550 1.00 0.00 H new ATOM 0 HB3 LYS B 86 6.067 7.684 -9.386 1.00 0.00 H new ATOM 0 HG2 LYS B 86 7.999 6.259 -10.072 1.00 0.00 H new ATOM 0 HG3 LYS B 86 7.299 4.895 -9.223 1.00 0.00 H new ATOM 0 HD2 LYS B 86 5.309 4.969 -10.732 1.00 0.00 H new ATOM 0 HD3 LYS B 86 5.991 6.347 -11.573 1.00 0.00 H new ATOM 0 HE2 LYS B 86 7.949 4.956 -12.276 1.00 0.00 H new ATOM 0 HE3 LYS B 86 7.284 3.579 -11.422 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 6.766 3.493 -13.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 5.341 3.664 -12.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 5.986 4.999 -13.681 1.00 0.00 H new ATOM 2716 N ASP B 87 8.010 9.493 -7.523 1.00 0.00 N ATOM 2717 CA ASP B 87 9.062 10.534 -7.527 1.00 0.00 C ATOM 2718 C ASP B 87 9.953 10.518 -6.241 1.00 0.00 C ATOM 2719 O ASP B 87 11.177 10.621 -6.368 1.00 0.00 O ATOM 2720 CB ASP B 87 8.316 11.880 -7.733 1.00 0.00 C ATOM 2721 CG ASP B 87 8.907 12.736 -8.856 1.00 0.00 C ATOM 2722 OD1 ASP B 87 8.482 12.727 -10.011 1.00 0.00 O ATOM 2723 OD2 ASP B 87 9.959 13.502 -8.422 1.00 0.00 O ATOM 0 H ASP B 87 7.087 9.855 -7.282 1.00 0.00 H new ATOM 0 HA ASP B 87 9.781 10.357 -8.327 1.00 0.00 H new ATOM 0 HB2 ASP B 87 7.268 11.676 -7.954 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.341 12.447 -6.802 1.00 0.00 H new ATOM 2729 N ALA B 88 9.357 10.390 -5.028 1.00 0.00 N ATOM 2730 CA ALA B 88 10.099 10.180 -3.747 1.00 0.00 C ATOM 2731 C ALA B 88 11.154 9.033 -3.747 1.00 0.00 C ATOM 2732 O ALA B 88 12.264 9.177 -3.231 1.00 0.00 O ATOM 2733 CB ALA B 88 9.080 9.776 -2.643 1.00 0.00 C ATOM 0 H ALA B 88 8.345 10.429 -4.905 1.00 0.00 H new ATOM 0 HA ALA B 88 10.622 11.123 -3.585 1.00 0.00 H new ATOM 0 HB1 ALA B 88 9.607 9.619 -1.702 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.344 10.570 -2.519 1.00 0.00 H new ATOM 0 HB3 ALA B 88 8.575 8.855 -2.934 1.00 0.00 H new ATOM 2739 N VAL B 89 10.743 7.905 -4.338 1.00 0.00 N ATOM 2740 CA VAL B 89 11.424 6.610 -4.321 1.00 0.00 C ATOM 2741 C VAL B 89 12.425 6.334 -5.499 1.00 0.00 C ATOM 2742 O VAL B 89 13.183 5.364 -5.431 1.00 0.00 O ATOM 2743 CB VAL B 89 10.129 5.724 -4.216 1.00 0.00 C ATOM 2744 CG1 VAL B 89 9.521 5.355 -5.571 1.00 0.00 C ATOM 2745 CG2 VAL B 89 10.349 4.491 -3.388 1.00 0.00 C ATOM 0 H VAL B 89 9.874 7.872 -4.872 1.00 0.00 H new ATOM 0 HA VAL B 89 12.161 6.445 -3.535 1.00 0.00 H new ATOM 0 HB VAL B 89 9.402 6.357 -3.707 1.00 0.00 H new ATOM 0 HG11 VAL B 89 8.632 4.744 -5.416 1.00 0.00 H new ATOM 0 HG12 VAL B 89 9.248 6.264 -6.107 1.00 0.00 H new ATOM 0 HG13 VAL B 89 10.250 4.794 -6.156 1.00 0.00 H new ATOM 0 HG21 VAL B 89 9.426 3.912 -3.345 1.00 0.00 H new ATOM 0 HG22 VAL B 89 11.136 3.886 -3.838 1.00 0.00 H new ATOM 0 HG23 VAL B 89 10.644 4.778 -2.379 1.00 0.00 H new ATOM 2755 N LYS B 90 12.419 7.181 -6.554 1.00 0.00 N ATOM 2756 CA LYS B 90 13.289 7.074 -7.743 1.00 0.00 C ATOM 2757 C LYS B 90 14.744 7.435 -7.395 1.00 0.00 C ATOM 2758 O LYS B 90 15.560 6.560 -7.104 1.00 0.00 O ATOM 2759 CB LYS B 90 12.713 8.037 -8.824 1.00 0.00 C ATOM 2760 CG LYS B 90 11.949 7.326 -9.961 1.00 0.00 C ATOM 2761 CD LYS B 90 11.265 8.317 -10.924 1.00 0.00 C ATOM 2762 CE LYS B 90 10.419 7.614 -11.998 1.00 0.00 C ATOM 2763 NZ LYS B 90 9.762 8.583 -12.892 1.00 0.00 N ATOM 0 H LYS B 90 11.789 7.981 -6.601 1.00 0.00 H new ATOM 0 HA LYS B 90 13.304 6.050 -8.116 1.00 0.00 H new ATOM 0 HB2 LYS B 90 12.044 8.749 -8.341 1.00 0.00 H new ATOM 0 HB3 LYS B 90 13.532 8.612 -9.256 1.00 0.00 H new ATOM 0 HG2 LYS B 90 12.641 6.698 -10.522 1.00 0.00 H new ATOM 0 HG3 LYS B 90 11.197 6.665 -9.531 1.00 0.00 H new ATOM 0 HD2 LYS B 90 10.629 8.993 -10.352 1.00 0.00 H new ATOM 0 HD3 LYS B 90 12.025 8.929 -11.409 1.00 0.00 H new ATOM 0 HE2 LYS B 90 11.054 6.950 -12.584 1.00 0.00 H new ATOM 0 HE3 LYS B 90 9.664 6.992 -11.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 9.200 8.073 -13.604 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 9.137 9.201 -12.335 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 10.484 9.160 -13.369 1.00 0.00 H new