USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1286 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 HIS :FLIP no HE2:sc= 0.375 F(o=0.43,f=1.7) USER MOD Set 1.2: A 80 HIS : no HD1:sc= 0.53 K(o=1.7,f=-6.4!) USER MOD Set 1.3: A 83 THR OG1 : rot 90:sc= 0.877 USER MOD Set 1.4: A 96 HIS : no HE2:sc= -0.107 K(o=1.7,f=-6!) USER MOD Single : A 5 THR OG1 : rot 37:sc= 0.242 USER MOD Single : A 10 THR OG1 : rot 65:sc= 1.21 USER MOD Single : A 11 GLN : amide:sc= -0.0853 X(o=-0.085,f=-0.34) USER MOD Single : A 13 GLN : amide:sc= -0.337 X(o=-0.34,f=0) USER MOD Single : A 15 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 19 LYS NZ :NH3+ -127:sc=-0.00268 (180deg=-0.102) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -1.78! C(o=-1.8!,f=-5.5!) USER MOD Single : A 28 GLN : amide:sc= -0.14 X(o=-0.14,f=-0.42) USER MOD Single : A 29 SER OG : rot 25:sc= 0.228 USER MOD Single : A 43 SER OG : rot 180:sc= 0.00041 USER MOD Single : A 44 TYR OH : rot 110:sc= 0.375 USER MOD Single : A 51 TYR OH : rot -148:sc= -0.249 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 42:sc= 0.393 USER MOD Single : A 65 SER OG : rot 41:sc= 0.0865 USER MOD Single : A 70 THR OG1 : rot -125:sc= 0.529 USER MOD Single : A 71 SER OG : rot -48:sc= 1.22 USER MOD Single : A 75 THR OG1 : rot -131:sc= 0.162 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.41 X(o=-0.41,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -49:sc= 0.329 USER MOD Single : A 115 LYS NZ :NH3+ -178:sc= 0.616 (180deg=0.613) USER MOD Single : A 116 THR OG1 : rot -36:sc= 0.374 USER MOD Single : A 117 THR OG1 : rot 60:sc= 0.0781 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 120 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.36) USER MOD Single : A 121 SER OG : rot 180:sc= 0.0654 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= -0.359 USER MOD Single : A 128 MET CE :methyl -143:sc= -0.22 (180deg=-0.404) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -1.17 K(o=-1.2,f=-2.5) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.132 USER MOD Single : A 154 CYS SG : rot -103:sc= -1.86! USER MOD Single : A 156 TYR OH : rot 40:sc= -0.0277 USER MOD Single : A 157 SER OG : rot 10:sc= 1.09 USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 180:sc= 0.0652 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -2.5 K(o=-2.5,f=-4.2!) USER MOD Single : A 173 THR OG1 : rot -150:sc= 0 USER MOD Single : A 176 THR OG1 : rot 42:sc= 0.2 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.561 3.406 -16.412 1.00 51.30 N ATOM 60 CA THR A 5 -13.848 2.072 -15.864 1.00 24.23 C ATOM 61 C THR A 5 -12.699 1.089 -16.186 1.00 13.35 C ATOM 62 O THR A 5 -12.318 0.266 -15.345 1.00 15.34 O ATOM 63 CB THR A 5 -15.212 1.538 -16.410 1.00 13.24 C ATOM 64 OG1 THR A 5 -16.209 2.555 -16.244 1.00 51.02 O ATOM 65 CG2 THR A 5 -15.692 0.262 -15.688 1.00 15.43 C ATOM 0 HA THR A 5 -13.925 2.154 -14.780 1.00 24.23 H new ATOM 0 HB THR A 5 -15.061 1.286 -17.460 1.00 13.24 H new ATOM 0 HG1 THR A 5 -15.808 3.435 -16.403 1.00 51.02 H new ATOM 0 HG21 THR A 5 -16.643 -0.060 -16.112 1.00 15.43 H new ATOM 0 HG22 THR A 5 -14.952 -0.528 -15.816 1.00 15.43 H new ATOM 0 HG23 THR A 5 -15.820 0.471 -14.626 1.00 15.43 H new ATOM 73 N GLU A 6 -12.132 1.201 -17.402 1.00 72.24 N ATOM 74 CA GLU A 6 -11.016 0.338 -17.845 1.00 74.21 C ATOM 75 C GLU A 6 -9.667 0.892 -17.379 1.00 34.42 C ATOM 76 O GLU A 6 -8.712 0.136 -17.265 1.00 60.41 O ATOM 77 CB GLU A 6 -11.038 0.154 -19.384 1.00 23.40 C ATOM 78 CG GLU A 6 -10.726 1.423 -20.206 1.00 45.31 C ATOM 79 CD GLU A 6 -10.866 1.224 -21.714 1.00 61.12 C ATOM 80 OE1 GLU A 6 -9.883 0.797 -22.363 1.00 1.10 O ATOM 81 OE2 GLU A 6 -11.951 1.505 -22.267 1.00 61.25 O ATOM 0 H GLU A 6 -12.429 1.884 -18.099 1.00 72.24 H new ATOM 0 HA GLU A 6 -11.149 -0.641 -17.385 1.00 74.21 H new ATOM 0 HB2 GLU A 6 -10.317 -0.618 -19.651 1.00 23.40 H new ATOM 0 HB3 GLU A 6 -12.022 -0.214 -19.675 1.00 23.40 H new ATOM 0 HG2 GLU A 6 -11.394 2.224 -19.890 1.00 45.31 H new ATOM 0 HG3 GLU A 6 -9.710 1.749 -19.984 1.00 45.31 H new ATOM 88 N ASP A 7 -9.624 2.204 -17.055 1.00 21.23 N ATOM 89 CA ASP A 7 -8.380 2.894 -16.625 1.00 14.13 C ATOM 90 C ASP A 7 -7.803 2.252 -15.366 1.00 63.01 C ATOM 91 O ASP A 7 -6.594 2.292 -15.155 1.00 23.52 O ATOM 92 CB ASP A 7 -8.587 4.415 -16.387 1.00 51.00 C ATOM 93 CG ASP A 7 -8.613 5.269 -17.662 1.00 1.54 C ATOM 94 OD1 ASP A 7 -8.155 4.804 -18.730 1.00 4.31 O ATOM 95 OD2 ASP A 7 -9.074 6.425 -17.590 1.00 2.50 O ATOM 0 H ASP A 7 -10.442 2.813 -17.083 1.00 21.23 H new ATOM 0 HA ASP A 7 -7.673 2.781 -17.447 1.00 14.13 H new ATOM 0 HB2 ASP A 7 -9.525 4.560 -15.850 1.00 51.00 H new ATOM 0 HB3 ASP A 7 -7.789 4.779 -15.739 1.00 51.00 H new ATOM 100 N TRP A 8 -8.703 1.684 -14.548 1.00 53.12 N ATOM 101 CA TRP A 8 -8.359 0.867 -13.387 1.00 54.12 C ATOM 102 C TRP A 8 -7.356 -0.250 -13.763 1.00 15.51 C ATOM 103 O TRP A 8 -6.243 -0.278 -13.243 1.00 42.30 O ATOM 104 CB TRP A 8 -9.661 0.271 -12.804 1.00 52.15 C ATOM 105 CG TRP A 8 -9.451 -0.585 -11.587 1.00 25.31 C ATOM 106 CD1 TRP A 8 -9.049 -0.161 -10.361 1.00 43.32 C ATOM 107 CD2 TRP A 8 -9.636 -2.002 -11.480 1.00 42.32 C ATOM 108 NE1 TRP A 8 -8.968 -1.215 -9.512 1.00 31.42 N ATOM 109 CE2 TRP A 8 -9.329 -2.353 -10.161 1.00 13.23 C ATOM 110 CE3 TRP A 8 -10.041 -3.005 -12.372 1.00 31.21 C ATOM 111 CZ2 TRP A 8 -9.397 -3.658 -9.703 1.00 20.40 C ATOM 112 CZ3 TRP A 8 -10.111 -4.306 -11.915 1.00 10.13 C ATOM 113 CH2 TRP A 8 -9.798 -4.618 -10.590 1.00 73.33 C ATOM 0 H TRP A 8 -9.709 1.785 -14.683 1.00 53.12 H new ATOM 0 HA TRP A 8 -7.871 1.489 -12.637 1.00 54.12 H new ATOM 0 HB2 TRP A 8 -10.339 1.086 -12.550 1.00 52.15 H new ATOM 0 HB3 TRP A 8 -10.152 -0.324 -13.574 1.00 52.15 H new ATOM 0 HD1 TRP A 8 -8.827 0.863 -10.101 1.00 43.32 H new ATOM 0 HE1 TRP A 8 -8.680 -1.162 -8.535 1.00 31.42 H new ATOM 0 HE3 TRP A 8 -10.293 -2.765 -13.394 1.00 31.21 H new ATOM 0 HZ2 TRP A 8 -9.143 -3.908 -8.684 1.00 20.40 H new ATOM 0 HZ3 TRP A 8 -10.412 -5.093 -12.591 1.00 10.13 H new ATOM 0 HH2 TRP A 8 -9.875 -5.643 -10.258 1.00 73.33 H new ATOM 124 N GLU A 9 -7.752 -1.122 -14.712 1.00 34.31 N ATOM 125 CA GLU A 9 -6.936 -2.288 -15.129 1.00 41.53 C ATOM 126 C GLU A 9 -5.819 -1.880 -16.123 1.00 3.33 C ATOM 127 O GLU A 9 -4.802 -2.575 -16.231 1.00 74.51 O ATOM 128 CB GLU A 9 -7.839 -3.397 -15.737 1.00 23.15 C ATOM 129 CG GLU A 9 -8.615 -2.979 -17.003 1.00 42.04 C ATOM 130 CD GLU A 9 -9.463 -4.096 -17.622 1.00 22.52 C ATOM 131 OE1 GLU A 9 -10.461 -4.512 -17.002 1.00 75.01 O ATOM 132 OE2 GLU A 9 -9.137 -4.565 -18.735 1.00 54.33 O ATOM 0 H GLU A 9 -8.639 -1.042 -15.210 1.00 34.31 H new ATOM 0 HA GLU A 9 -6.449 -2.686 -14.239 1.00 41.53 H new ATOM 0 HB2 GLU A 9 -7.218 -4.260 -15.977 1.00 23.15 H new ATOM 0 HB3 GLU A 9 -8.554 -3.719 -14.980 1.00 23.15 H new ATOM 0 HG2 GLU A 9 -9.265 -2.140 -16.756 1.00 42.04 H new ATOM 0 HG3 GLU A 9 -7.905 -2.623 -17.749 1.00 42.04 H new ATOM 139 N THR A 10 -6.015 -0.747 -16.823 1.00 35.13 N ATOM 140 CA THR A 10 -5.067 -0.235 -17.831 1.00 4.31 C ATOM 141 C THR A 10 -3.791 0.298 -17.159 1.00 24.14 C ATOM 142 O THR A 10 -2.675 -0.074 -17.544 1.00 23.53 O ATOM 143 CB THR A 10 -5.735 0.880 -18.695 1.00 0.14 C ATOM 144 OG1 THR A 10 -6.922 0.348 -19.307 1.00 21.53 O ATOM 145 CG2 THR A 10 -4.802 1.428 -19.792 1.00 71.23 C ATOM 0 H THR A 10 -6.839 -0.158 -16.705 1.00 35.13 H new ATOM 0 HA THR A 10 -4.789 -1.061 -18.486 1.00 4.31 H new ATOM 0 HB THR A 10 -5.972 1.710 -18.030 1.00 0.14 H new ATOM 0 HG1 THR A 10 -7.575 0.121 -18.612 1.00 21.53 H new ATOM 0 HG21 THR A 10 -5.322 2.200 -20.360 1.00 71.23 H new ATOM 0 HG22 THR A 10 -3.911 1.854 -19.332 1.00 71.23 H new ATOM 0 HG23 THR A 10 -4.513 0.618 -20.462 1.00 71.23 H new ATOM 153 N GLN A 11 -3.961 1.179 -16.151 1.00 24.22 N ATOM 154 CA GLN A 11 -2.835 1.661 -15.332 1.00 73.44 C ATOM 155 C GLN A 11 -2.212 0.502 -14.537 1.00 40.42 C ATOM 156 O GLN A 11 -0.993 0.433 -14.388 1.00 20.12 O ATOM 157 CB GLN A 11 -3.272 2.808 -14.376 1.00 61.22 C ATOM 158 CG GLN A 11 -4.197 2.397 -13.211 1.00 13.13 C ATOM 159 CD GLN A 11 -4.562 3.545 -12.267 1.00 41.12 C ATOM 160 OE1 GLN A 11 -3.775 4.467 -12.047 1.00 13.04 O ATOM 161 NE2 GLN A 11 -5.758 3.499 -11.704 1.00 45.43 N ATOM 0 H GLN A 11 -4.866 1.569 -15.887 1.00 24.22 H new ATOM 0 HA GLN A 11 -2.083 2.065 -16.009 1.00 73.44 H new ATOM 0 HB2 GLN A 11 -2.376 3.268 -13.959 1.00 61.22 H new ATOM 0 HB3 GLN A 11 -3.779 3.573 -14.965 1.00 61.22 H new ATOM 0 HG2 GLN A 11 -5.114 1.973 -13.621 1.00 13.13 H new ATOM 0 HG3 GLN A 11 -3.711 1.609 -12.636 1.00 13.13 H new ATOM 0 HE21 GLN A 11 -6.387 2.722 -11.906 1.00 45.43 H new ATOM 0 HE22 GLN A 11 -6.051 4.240 -11.068 1.00 45.43 H new ATOM 170 N LEU A 12 -3.079 -0.432 -14.089 1.00 70.44 N ATOM 171 CA LEU A 12 -2.703 -1.534 -13.202 1.00 1.21 C ATOM 172 C LEU A 12 -1.714 -2.488 -13.866 1.00 32.34 C ATOM 173 O LEU A 12 -0.701 -2.800 -13.263 1.00 73.12 O ATOM 174 CB LEU A 12 -3.973 -2.285 -12.742 1.00 34.23 C ATOM 175 CG LEU A 12 -3.782 -3.533 -11.824 1.00 45.34 C ATOM 176 CD1 LEU A 12 -2.888 -3.229 -10.601 1.00 71.43 C ATOM 177 CD2 LEU A 12 -5.156 -4.088 -11.387 1.00 53.32 C ATOM 0 H LEU A 12 -4.068 -0.434 -14.340 1.00 70.44 H new ATOM 0 HA LEU A 12 -2.199 -1.115 -12.331 1.00 1.21 H new ATOM 0 HB2 LEU A 12 -4.611 -1.575 -12.215 1.00 34.23 H new ATOM 0 HB3 LEU A 12 -4.516 -2.603 -13.632 1.00 34.23 H new ATOM 0 HG LEU A 12 -3.264 -4.295 -12.406 1.00 45.34 H new ATOM 0 HD11 LEU A 12 -2.785 -4.128 -9.993 1.00 71.43 H new ATOM 0 HD12 LEU A 12 -1.904 -2.906 -10.941 1.00 71.43 H new ATOM 0 HD13 LEU A 12 -3.343 -2.438 -10.005 1.00 71.43 H new ATOM 0 HD21 LEU A 12 -5.010 -4.958 -10.747 1.00 53.32 H new ATOM 0 HD22 LEU A 12 -5.700 -3.320 -10.837 1.00 53.32 H new ATOM 0 HD23 LEU A 12 -5.728 -4.378 -12.268 1.00 53.32 H new ATOM 189 N GLN A 13 -1.988 -2.912 -15.118 1.00 70.00 N ATOM 190 CA GLN A 13 -1.130 -3.887 -15.834 1.00 32.41 C ATOM 191 C GLN A 13 0.325 -3.376 -15.984 1.00 42.42 C ATOM 192 O GLN A 13 1.253 -4.178 -16.075 1.00 23.25 O ATOM 193 CB GLN A 13 -1.727 -4.243 -17.218 1.00 44.35 C ATOM 194 CG GLN A 13 -1.875 -3.049 -18.176 1.00 54.23 C ATOM 195 CD GLN A 13 -2.434 -3.387 -19.559 1.00 65.44 C ATOM 196 OE1 GLN A 13 -2.092 -2.732 -20.540 1.00 33.22 O ATOM 197 NE2 GLN A 13 -3.313 -4.380 -19.659 1.00 60.30 N ATOM 0 H GLN A 13 -2.795 -2.596 -15.656 1.00 70.00 H new ATOM 0 HA GLN A 13 -1.100 -4.792 -15.227 1.00 32.41 H new ATOM 0 HB2 GLN A 13 -1.094 -4.995 -17.690 1.00 44.35 H new ATOM 0 HB3 GLN A 13 -2.707 -4.698 -17.071 1.00 44.35 H new ATOM 0 HG2 GLN A 13 -2.526 -2.309 -17.710 1.00 54.23 H new ATOM 0 HG3 GLN A 13 -0.898 -2.581 -18.301 1.00 54.23 H new ATOM 0 HE21 GLN A 13 -3.581 -4.909 -18.829 1.00 60.30 H new ATOM 0 HE22 GLN A 13 -3.719 -4.612 -20.565 1.00 60.30 H new ATOM 206 N ALA A 14 0.495 -2.037 -15.982 1.00 65.24 N ATOM 207 CA ALA A 14 1.817 -1.383 -16.012 1.00 14.41 C ATOM 208 C ALA A 14 2.433 -1.313 -14.599 1.00 2.24 C ATOM 209 O ALA A 14 3.629 -1.569 -14.427 1.00 52.21 O ATOM 210 CB ALA A 14 1.687 0.019 -16.621 1.00 74.11 C ATOM 0 H ALA A 14 -0.284 -1.379 -15.959 1.00 65.24 H new ATOM 0 HA ALA A 14 2.487 -1.977 -16.633 1.00 14.41 H new ATOM 0 HB1 ALA A 14 2.665 0.499 -16.641 1.00 74.11 H new ATOM 0 HB2 ALA A 14 1.300 -0.060 -17.637 1.00 74.11 H new ATOM 0 HB3 ALA A 14 1.003 0.616 -16.018 1.00 74.11 H new ATOM 216 N ASN A 15 1.587 -0.964 -13.602 1.00 32.30 N ATOM 217 CA ASN A 15 1.978 -0.862 -12.173 1.00 24.13 C ATOM 218 C ASN A 15 2.510 -2.208 -11.644 1.00 61.34 C ATOM 219 O ASN A 15 3.644 -2.292 -11.174 1.00 30.45 O ATOM 220 CB ASN A 15 0.770 -0.383 -11.308 1.00 21.10 C ATOM 221 CG ASN A 15 0.380 1.084 -11.534 1.00 42.24 C ATOM 222 OD1 ASN A 15 0.721 1.693 -12.547 1.00 61.01 O ATOM 223 ND2 ASN A 15 -0.385 1.647 -10.610 1.00 32.34 N ATOM 0 H ASN A 15 0.605 -0.743 -13.766 1.00 32.30 H new ATOM 0 HA ASN A 15 2.779 -0.127 -12.098 1.00 24.13 H new ATOM 0 HB2 ASN A 15 -0.092 -1.014 -11.525 1.00 21.10 H new ATOM 0 HB3 ASN A 15 1.012 -0.525 -10.255 1.00 21.10 H new ATOM 0 HD21 ASN A 15 -0.706 2.608 -10.730 1.00 32.34 H new ATOM 0 HD22 ASN A 15 -0.653 1.119 -9.779 1.00 32.34 H new ATOM 230 N ARG A 16 1.679 -3.263 -11.753 1.00 2.00 N ATOM 231 CA ARG A 16 2.049 -4.626 -11.329 1.00 52.43 C ATOM 232 C ARG A 16 3.178 -5.213 -12.181 1.00 70.35 C ATOM 233 O ARG A 16 3.830 -6.133 -11.730 1.00 10.11 O ATOM 234 CB ARG A 16 0.832 -5.597 -11.349 1.00 31.22 C ATOM 235 CG ARG A 16 0.116 -5.726 -12.718 1.00 71.12 C ATOM 236 CD ARG A 16 -0.765 -6.982 -12.850 1.00 31.02 C ATOM 237 NE ARG A 16 -1.511 -7.301 -11.617 1.00 61.42 N ATOM 238 CZ ARG A 16 -2.025 -8.506 -11.315 1.00 3.21 C ATOM 239 NH1 ARG A 16 -1.907 -9.533 -12.148 1.00 61.14 N ATOM 240 NH2 ARG A 16 -2.623 -8.684 -10.152 1.00 31.44 N ATOM 0 H ARG A 16 0.736 -3.194 -12.136 1.00 2.00 H new ATOM 0 HA ARG A 16 2.403 -4.527 -10.303 1.00 52.43 H new ATOM 0 HB2 ARG A 16 1.171 -6.586 -11.039 1.00 31.22 H new ATOM 0 HB3 ARG A 16 0.107 -5.261 -10.607 1.00 31.22 H new ATOM 0 HG2 ARG A 16 -0.503 -4.843 -12.877 1.00 71.12 H new ATOM 0 HG3 ARG A 16 0.866 -5.736 -13.509 1.00 71.12 H new ATOM 0 HD2 ARG A 16 -1.471 -6.838 -13.667 1.00 31.02 H new ATOM 0 HD3 ARG A 16 -0.137 -7.832 -13.117 1.00 31.02 H new ATOM 0 HE ARG A 16 -1.647 -6.549 -10.942 1.00 61.42 H new ATOM 0 HH11 ARG A 16 -1.419 -9.416 -13.036 1.00 61.14 H new ATOM 0 HH12 ARG A 16 -2.304 -10.439 -11.900 1.00 61.14 H new ATOM 0 HH21 ARG A 16 -2.692 -7.911 -9.491 1.00 31.44 H new ATOM 0 HH22 ARG A 16 -3.016 -9.595 -9.915 1.00 31.44 H new ATOM 254 N ASP A 17 3.396 -4.692 -13.407 1.00 2.30 N ATOM 255 CA ASP A 17 4.486 -5.171 -14.284 1.00 75.55 C ATOM 256 C ASP A 17 5.851 -4.778 -13.698 1.00 62.33 C ATOM 257 O ASP A 17 6.698 -5.637 -13.427 1.00 12.13 O ATOM 258 CB ASP A 17 4.331 -4.610 -15.718 1.00 62.44 C ATOM 259 CG ASP A 17 5.424 -5.114 -16.675 1.00 61.33 C ATOM 260 OD1 ASP A 17 5.263 -6.205 -17.262 1.00 64.13 O ATOM 261 OD2 ASP A 17 6.456 -4.434 -16.841 1.00 1.15 O ATOM 0 H ASP A 17 2.834 -3.943 -13.811 1.00 2.30 H new ATOM 0 HA ASP A 17 4.427 -6.258 -14.339 1.00 75.55 H new ATOM 0 HB2 ASP A 17 3.353 -4.891 -16.110 1.00 62.44 H new ATOM 0 HB3 ASP A 17 4.359 -3.521 -15.682 1.00 62.44 H new ATOM 266 N GLU A 18 6.031 -3.463 -13.494 1.00 34.42 N ATOM 267 CA GLU A 18 7.273 -2.888 -12.954 1.00 10.03 C ATOM 268 C GLU A 18 7.476 -3.273 -11.478 1.00 55.34 C ATOM 269 O GLU A 18 8.610 -3.418 -11.022 1.00 41.40 O ATOM 270 CB GLU A 18 7.275 -1.348 -13.136 1.00 20.20 C ATOM 271 CG GLU A 18 6.105 -0.619 -12.439 1.00 24.43 C ATOM 272 CD GLU A 18 6.027 0.881 -12.744 1.00 50.22 C ATOM 273 OE1 GLU A 18 6.001 1.249 -13.937 1.00 3.52 O ATOM 274 OE2 GLU A 18 5.989 1.699 -11.798 1.00 30.33 O ATOM 0 H GLU A 18 5.315 -2.766 -13.700 1.00 34.42 H new ATOM 0 HA GLU A 18 8.111 -3.303 -13.514 1.00 10.03 H new ATOM 0 HB2 GLU A 18 8.214 -0.951 -12.752 1.00 20.20 H new ATOM 0 HB3 GLU A 18 7.245 -1.121 -14.202 1.00 20.20 H new ATOM 0 HG2 GLU A 18 5.168 -1.089 -12.740 1.00 24.43 H new ATOM 0 HG3 GLU A 18 6.198 -0.755 -11.361 1.00 24.43 H new ATOM 281 N LYS A 19 6.368 -3.470 -10.745 1.00 33.42 N ATOM 282 CA LYS A 19 6.419 -3.751 -9.301 1.00 54.34 C ATOM 283 C LYS A 19 6.626 -5.258 -9.031 1.00 32.44 C ATOM 284 O LYS A 19 7.140 -5.630 -7.979 1.00 4.13 O ATOM 285 CB LYS A 19 5.149 -3.189 -8.602 1.00 32.24 C ATOM 286 CG LYS A 19 5.297 -2.871 -7.088 1.00 2.33 C ATOM 287 CD LYS A 19 6.485 -1.917 -6.764 1.00 61.25 C ATOM 288 CE LYS A 19 6.465 -0.585 -7.561 1.00 42.12 C ATOM 289 NZ LYS A 19 5.265 0.255 -7.284 1.00 5.33 N ATOM 0 H LYS A 19 5.424 -3.440 -11.130 1.00 33.42 H new ATOM 0 HA LYS A 19 7.282 -3.242 -8.872 1.00 54.34 H new ATOM 0 HB2 LYS A 19 4.846 -2.278 -9.118 1.00 32.24 H new ATOM 0 HB3 LYS A 19 4.340 -3.909 -8.726 1.00 32.24 H new ATOM 0 HG2 LYS A 19 4.372 -2.421 -6.728 1.00 2.33 H new ATOM 0 HG3 LYS A 19 5.432 -3.804 -6.541 1.00 2.33 H new ATOM 0 HD2 LYS A 19 6.474 -1.690 -5.698 1.00 61.25 H new ATOM 0 HD3 LYS A 19 7.421 -2.437 -6.970 1.00 61.25 H new ATOM 0 HE2 LYS A 19 7.362 -0.014 -7.321 1.00 42.12 H new ATOM 0 HE3 LYS A 19 6.505 -0.808 -8.627 1.00 42.12 H new ATOM 0 HZ1 LYS A 19 4.800 0.503 -8.181 1.00 5.33 H new ATOM 0 HZ2 LYS A 19 4.601 -0.276 -6.685 1.00 5.33 H new ATOM 0 HZ3 LYS A 19 5.556 1.124 -6.793 1.00 5.33 H new ATOM 303 N ASP A 20 6.222 -6.109 -9.997 1.00 64.15 N ATOM 304 CA ASP A 20 6.559 -7.558 -10.006 1.00 44.05 C ATOM 305 C ASP A 20 8.052 -7.753 -10.284 1.00 14.13 C ATOM 306 O ASP A 20 8.771 -8.412 -9.517 1.00 13.23 O ATOM 307 CB ASP A 20 5.712 -8.304 -11.071 1.00 44.22 C ATOM 308 CG ASP A 20 6.231 -9.707 -11.457 1.00 2.23 C ATOM 309 OD1 ASP A 20 6.216 -10.611 -10.603 1.00 43.24 O ATOM 310 OD2 ASP A 20 6.626 -9.909 -12.629 1.00 63.15 O ATOM 0 H ASP A 20 5.654 -5.818 -10.793 1.00 64.15 H new ATOM 0 HA ASP A 20 6.328 -7.974 -9.025 1.00 44.05 H new ATOM 0 HB2 ASP A 20 4.692 -8.401 -10.699 1.00 44.22 H new ATOM 0 HB3 ASP A 20 5.666 -7.691 -11.971 1.00 44.22 H new ATOM 315 N ARG A 21 8.514 -7.115 -11.373 1.00 35.34 N ATOM 316 CA ARG A 21 9.904 -7.238 -11.839 1.00 63.14 C ATOM 317 C ARG A 21 10.842 -6.422 -10.949 1.00 22.33 C ATOM 318 O ARG A 21 12.044 -6.498 -11.105 1.00 62.25 O ATOM 319 CB ARG A 21 10.050 -6.809 -13.318 1.00 3.31 C ATOM 320 CG ARG A 21 10.008 -5.289 -13.589 1.00 55.01 C ATOM 321 CD ARG A 21 10.164 -4.951 -15.081 1.00 70.41 C ATOM 322 NE ARG A 21 9.087 -5.539 -15.904 1.00 62.33 N ATOM 323 CZ ARG A 21 9.257 -6.415 -16.912 1.00 20.52 C ATOM 324 NH1 ARG A 21 10.468 -6.838 -17.270 1.00 71.41 N ATOM 325 NH2 ARG A 21 8.194 -6.857 -17.560 1.00 43.41 N ATOM 0 H ARG A 21 7.938 -6.503 -11.951 1.00 35.34 H new ATOM 0 HA ARG A 21 10.183 -8.290 -11.772 1.00 63.14 H new ATOM 0 HB2 ARG A 21 10.994 -7.200 -13.698 1.00 3.31 H new ATOM 0 HB3 ARG A 21 9.255 -7.283 -13.893 1.00 3.31 H new ATOM 0 HG2 ARG A 21 9.063 -4.885 -13.225 1.00 55.01 H new ATOM 0 HG3 ARG A 21 10.802 -4.801 -13.024 1.00 55.01 H new ATOM 0 HD2 ARG A 21 10.166 -3.868 -15.208 1.00 70.41 H new ATOM 0 HD3 ARG A 21 11.129 -5.315 -15.435 1.00 70.41 H new ATOM 0 HE ARG A 21 8.131 -5.256 -15.690 1.00 62.33 H new ATOM 0 HH11 ARG A 21 11.293 -6.498 -16.777 1.00 71.41 H new ATOM 0 HH12 ARG A 21 10.570 -7.502 -18.037 1.00 71.41 H new ATOM 0 HH21 ARG A 21 7.264 -6.534 -17.294 1.00 43.41 H new ATOM 0 HH22 ARG A 21 8.304 -7.521 -18.326 1.00 43.41 H new ATOM 339 N PHE A 22 10.263 -5.626 -10.038 1.00 42.41 N ATOM 340 CA PHE A 22 11.001 -4.877 -9.012 1.00 23.41 C ATOM 341 C PHE A 22 11.936 -5.812 -8.208 1.00 73.10 C ATOM 342 O PHE A 22 13.105 -5.511 -8.023 1.00 24.53 O ATOM 343 CB PHE A 22 9.973 -4.167 -8.098 1.00 31.50 C ATOM 344 CG PHE A 22 10.524 -3.068 -7.205 1.00 32.02 C ATOM 345 CD1 PHE A 22 10.665 -1.766 -7.684 1.00 2.25 C ATOM 346 CD2 PHE A 22 10.865 -3.325 -5.884 1.00 21.21 C ATOM 347 CE1 PHE A 22 11.133 -0.758 -6.862 1.00 51.24 C ATOM 348 CE2 PHE A 22 11.337 -2.320 -5.070 1.00 63.52 C ATOM 349 CZ PHE A 22 11.468 -1.036 -5.555 1.00 52.42 C ATOM 0 H PHE A 22 9.254 -5.483 -9.993 1.00 42.41 H new ATOM 0 HA PHE A 22 11.642 -4.130 -9.481 1.00 23.41 H new ATOM 0 HB2 PHE A 22 9.192 -3.740 -8.727 1.00 31.50 H new ATOM 0 HB3 PHE A 22 9.499 -4.918 -7.466 1.00 31.50 H new ATOM 0 HD1 PHE A 22 10.406 -1.543 -8.708 1.00 2.25 H new ATOM 0 HD2 PHE A 22 10.759 -4.325 -5.490 1.00 21.21 H new ATOM 0 HE1 PHE A 22 11.236 0.247 -7.244 1.00 51.24 H new ATOM 0 HE2 PHE A 22 11.606 -2.538 -4.047 1.00 63.52 H new ATOM 0 HZ PHE A 22 11.833 -0.249 -4.911 1.00 52.42 H new ATOM 359 N PHE A 23 11.411 -6.973 -7.784 1.00 53.53 N ATOM 360 CA PHE A 23 12.187 -7.979 -7.012 1.00 52.13 C ATOM 361 C PHE A 23 13.092 -8.843 -7.914 1.00 11.12 C ATOM 362 O PHE A 23 13.980 -9.529 -7.407 1.00 31.11 O ATOM 363 CB PHE A 23 11.232 -8.904 -6.198 1.00 44.25 C ATOM 364 CG PHE A 23 10.574 -8.277 -4.958 1.00 13.15 C ATOM 365 CD1 PHE A 23 10.327 -6.903 -4.861 1.00 23.40 C ATOM 366 CD2 PHE A 23 10.189 -9.086 -3.885 1.00 32.22 C ATOM 367 CE1 PHE A 23 9.718 -6.365 -3.738 1.00 61.50 C ATOM 368 CE2 PHE A 23 9.580 -8.546 -2.769 1.00 42.14 C ATOM 369 CZ PHE A 23 9.344 -7.188 -2.696 1.00 12.40 C ATOM 0 H PHE A 23 10.445 -7.247 -7.961 1.00 53.53 H new ATOM 0 HA PHE A 23 12.829 -7.421 -6.330 1.00 52.13 H new ATOM 0 HB2 PHE A 23 10.444 -9.254 -6.864 1.00 44.25 H new ATOM 0 HB3 PHE A 23 11.794 -9.782 -5.881 1.00 44.25 H new ATOM 0 HD1 PHE A 23 10.615 -6.252 -5.673 1.00 23.40 H new ATOM 0 HD2 PHE A 23 10.371 -10.150 -3.929 1.00 32.22 H new ATOM 0 HE1 PHE A 23 9.536 -5.302 -3.679 1.00 61.50 H new ATOM 0 HE2 PHE A 23 9.288 -9.188 -1.951 1.00 42.14 H new ATOM 0 HZ PHE A 23 8.866 -6.769 -1.823 1.00 12.40 H new ATOM 379 N SER A 24 12.853 -8.818 -9.232 1.00 62.33 N ATOM 380 CA SER A 24 13.563 -9.679 -10.198 1.00 62.33 C ATOM 381 C SER A 24 14.653 -8.899 -10.970 1.00 13.52 C ATOM 382 O SER A 24 15.646 -9.489 -11.407 1.00 45.21 O ATOM 383 CB SER A 24 12.530 -10.284 -11.179 1.00 62.00 C ATOM 384 OG SER A 24 13.133 -11.153 -12.128 1.00 35.24 O ATOM 0 H SER A 24 12.163 -8.202 -9.662 1.00 62.33 H new ATOM 0 HA SER A 24 14.070 -10.475 -9.652 1.00 62.33 H new ATOM 0 HB2 SER A 24 11.775 -10.832 -10.616 1.00 62.00 H new ATOM 0 HB3 SER A 24 12.015 -9.479 -11.703 1.00 62.00 H new ATOM 0 HG SER A 24 12.445 -11.513 -12.726 1.00 35.24 H new ATOM 390 N GLU A 25 14.472 -7.577 -11.118 1.00 1.23 N ATOM 391 CA GLU A 25 15.258 -6.733 -12.045 1.00 12.32 C ATOM 392 C GLU A 25 15.881 -5.539 -11.302 1.00 61.12 C ATOM 393 O GLU A 25 17.095 -5.325 -11.360 1.00 20.20 O ATOM 394 CB GLU A 25 14.340 -6.194 -13.183 1.00 3.11 C ATOM 395 CG GLU A 25 13.782 -7.253 -14.153 1.00 22.42 C ATOM 396 CD GLU A 25 14.858 -7.857 -15.067 1.00 23.23 C ATOM 397 OE1 GLU A 25 15.324 -7.152 -15.993 1.00 60.31 O ATOM 398 OE2 GLU A 25 15.259 -9.021 -14.857 1.00 61.10 O ATOM 0 H GLU A 25 13.770 -7.055 -10.594 1.00 1.23 H new ATOM 0 HA GLU A 25 16.054 -7.347 -12.467 1.00 12.32 H new ATOM 0 HB2 GLU A 25 13.501 -5.667 -12.728 1.00 3.11 H new ATOM 0 HB3 GLU A 25 14.902 -5.460 -13.760 1.00 3.11 H new ATOM 0 HG2 GLU A 25 13.311 -8.051 -13.579 1.00 22.42 H new ATOM 0 HG3 GLU A 25 13.004 -6.800 -14.767 1.00 22.42 H new ATOM 405 N HIS A 26 15.018 -4.763 -10.619 1.00 11.45 N ATOM 406 CA HIS A 26 15.388 -3.465 -10.028 1.00 33.42 C ATOM 407 C HIS A 26 16.208 -3.652 -8.732 1.00 42.04 C ATOM 408 O HIS A 26 17.397 -3.312 -8.677 1.00 22.14 O ATOM 409 CB HIS A 26 14.090 -2.648 -9.761 1.00 24.13 C ATOM 410 CG HIS A 26 14.301 -1.317 -9.078 1.00 15.31 C ATOM 411 ND1 HIS A 26 14.438 -1.240 -7.717 1.00 22.05 N ATOM 412 CD2 HIS A 26 14.369 -0.060 -9.594 1.00 34.44 C ATOM 413 CE1 HIS A 26 14.582 0.035 -7.432 1.00 31.32 C ATOM 414 NE2 HIS A 26 14.545 0.794 -8.535 1.00 41.02 N ATOM 0 H HIS A 26 14.043 -5.020 -10.462 1.00 11.45 H new ATOM 0 HA HIS A 26 16.023 -2.919 -10.726 1.00 33.42 H new ATOM 0 HB2 HIS A 26 13.586 -2.475 -10.712 1.00 24.13 H new ATOM 0 HB3 HIS A 26 13.419 -3.251 -9.149 1.00 24.13 H new ATOM 0 HD2 HIS A 26 14.298 0.213 -10.637 1.00 34.44 H new ATOM 0 HE1 HIS A 26 14.714 0.423 -6.433 1.00 31.32 H new ATOM 0 HE2 HIS A 26 14.631 1.809 -8.579 1.00 41.02 H new ATOM 422 N ARG A 27 15.557 -4.201 -7.704 1.00 65.54 N ATOM 423 CA ARG A 27 16.191 -4.554 -6.424 1.00 14.33 C ATOM 424 C ARG A 27 16.630 -6.018 -6.424 1.00 40.21 C ATOM 425 O ARG A 27 16.050 -6.849 -7.135 1.00 43.25 O ATOM 426 CB ARG A 27 15.210 -4.336 -5.236 1.00 60.23 C ATOM 427 CG ARG A 27 14.859 -2.878 -4.919 1.00 1.54 C ATOM 428 CD ARG A 27 16.085 -2.013 -4.618 1.00 30.15 C ATOM 429 NE ARG A 27 15.712 -0.639 -4.249 1.00 73.44 N ATOM 430 CZ ARG A 27 16.347 0.117 -3.345 1.00 51.40 C ATOM 431 NH1 ARG A 27 17.412 -0.336 -2.687 1.00 1.33 N ATOM 432 NH2 ARG A 27 15.913 1.341 -3.108 1.00 31.12 N ATOM 0 H ARG A 27 14.561 -4.417 -7.734 1.00 65.54 H new ATOM 0 HA ARG A 27 17.059 -3.906 -6.305 1.00 14.33 H new ATOM 0 HB2 ARG A 27 14.286 -4.874 -5.449 1.00 60.23 H new ATOM 0 HB3 ARG A 27 15.644 -4.788 -4.344 1.00 60.23 H new ATOM 0 HG2 ARG A 27 14.319 -2.450 -5.763 1.00 1.54 H new ATOM 0 HG3 ARG A 27 14.185 -2.852 -4.063 1.00 1.54 H new ATOM 0 HD2 ARG A 27 16.657 -2.464 -3.807 1.00 30.15 H new ATOM 0 HD3 ARG A 27 16.736 -1.990 -5.492 1.00 30.15 H new ATOM 0 HE ARG A 27 14.905 -0.229 -4.720 1.00 73.44 H new ATOM 0 HH11 ARG A 27 17.760 -1.278 -2.867 1.00 1.33 H new ATOM 0 HH12 ARG A 27 17.880 0.258 -2.003 1.00 1.33 H new ATOM 0 HH21 ARG A 27 15.102 1.701 -3.611 1.00 31.12 H new ATOM 0 HH22 ARG A 27 16.388 1.927 -2.421 1.00 31.12 H new ATOM 446 N GLN A 28 17.671 -6.309 -5.632 1.00 74.43 N ATOM 447 CA GLN A 28 17.999 -7.679 -5.209 1.00 2.51 C ATOM 448 C GLN A 28 16.814 -8.218 -4.371 1.00 75.21 C ATOM 449 O GLN A 28 16.367 -7.535 -3.434 1.00 74.41 O ATOM 450 CB GLN A 28 19.335 -7.678 -4.393 1.00 53.40 C ATOM 451 CG GLN A 28 19.338 -6.715 -3.184 1.00 71.13 C ATOM 452 CD GLN A 28 20.672 -6.618 -2.445 1.00 32.13 C ATOM 453 OE1 GLN A 28 21.743 -6.802 -3.022 1.00 32.02 O ATOM 454 NE2 GLN A 28 20.619 -6.266 -1.177 1.00 54.43 N ATOM 0 H GLN A 28 18.309 -5.603 -5.266 1.00 74.43 H new ATOM 0 HA GLN A 28 18.149 -8.329 -6.071 1.00 2.51 H new ATOM 0 HB2 GLN A 28 19.532 -8.690 -4.038 1.00 53.40 H new ATOM 0 HB3 GLN A 28 20.155 -7.409 -5.059 1.00 53.40 H new ATOM 0 HG2 GLN A 28 19.057 -5.720 -3.529 1.00 71.13 H new ATOM 0 HG3 GLN A 28 18.571 -7.037 -2.479 1.00 71.13 H new ATOM 0 HE21 GLN A 28 19.716 -6.120 -0.725 1.00 54.43 H new ATOM 0 HE22 GLN A 28 21.481 -6.139 -0.647 1.00 54.43 H new ATOM 463 N SER A 29 16.254 -9.381 -4.770 1.00 1.40 N ATOM 464 CA SER A 29 15.090 -9.980 -4.095 1.00 31.23 C ATOM 465 C SER A 29 15.361 -10.157 -2.578 1.00 14.11 C ATOM 466 O SER A 29 16.326 -10.836 -2.210 1.00 50.12 O ATOM 467 CB SER A 29 14.740 -11.339 -4.763 1.00 45.34 C ATOM 468 OG SER A 29 15.854 -12.225 -4.780 1.00 24.24 O ATOM 0 H SER A 29 16.595 -9.924 -5.563 1.00 1.40 H new ATOM 0 HA SER A 29 14.237 -9.309 -4.199 1.00 31.23 H new ATOM 0 HB2 SER A 29 13.914 -11.805 -4.226 1.00 45.34 H new ATOM 0 HB3 SER A 29 14.399 -11.165 -5.784 1.00 45.34 H new ATOM 0 HG SER A 29 16.466 -11.995 -4.050 1.00 24.24 H new ATOM 474 N PRO A 30 14.512 -9.544 -1.679 1.00 53.21 N ATOM 475 CA PRO A 30 14.661 -9.695 -0.209 1.00 2.11 C ATOM 476 C PRO A 30 14.321 -11.114 0.265 1.00 3.53 C ATOM 477 O PRO A 30 14.526 -11.447 1.432 1.00 60.12 O ATOM 478 CB PRO A 30 13.692 -8.639 0.368 1.00 51.33 C ATOM 479 CG PRO A 30 12.661 -8.444 -0.700 1.00 24.04 C ATOM 480 CD PRO A 30 13.384 -8.627 -2.014 1.00 71.54 C ATOM 0 HA PRO A 30 15.688 -9.544 0.124 1.00 2.11 H new ATOM 0 HB2 PRO A 30 13.239 -8.984 1.297 1.00 51.33 H new ATOM 0 HB3 PRO A 30 14.210 -7.707 0.593 1.00 51.33 H new ATOM 0 HG2 PRO A 30 11.851 -9.166 -0.597 1.00 24.04 H new ATOM 0 HG3 PRO A 30 12.215 -7.452 -0.635 1.00 24.04 H new ATOM 0 HD2 PRO A 30 12.731 -9.058 -2.773 1.00 71.54 H new ATOM 0 HD3 PRO A 30 13.745 -7.677 -2.407 1.00 71.54 H new ATOM 488 N ILE A 31 13.787 -11.935 -0.661 1.00 75.34 N ATOM 489 CA ILE A 31 13.595 -13.368 -0.450 1.00 13.42 C ATOM 490 C ILE A 31 15.001 -14.021 -0.252 1.00 44.31 C ATOM 491 O ILE A 31 15.795 -14.035 -1.206 1.00 11.21 O ATOM 492 CB ILE A 31 12.852 -14.044 -1.674 1.00 53.13 C ATOM 493 CG1 ILE A 31 11.642 -13.183 -2.178 1.00 70.40 C ATOM 494 CG2 ILE A 31 12.386 -15.473 -1.314 1.00 3.04 C ATOM 495 CD1 ILE A 31 10.467 -13.054 -1.219 1.00 32.21 C ATOM 0 H ILE A 31 13.478 -11.613 -1.578 1.00 75.34 H new ATOM 0 HA ILE A 31 12.970 -13.519 0.430 1.00 13.42 H new ATOM 0 HB ILE A 31 13.572 -14.105 -2.490 1.00 53.13 H new ATOM 0 HG12 ILE A 31 12.006 -12.182 -2.411 1.00 70.40 H new ATOM 0 HG13 ILE A 31 11.278 -13.615 -3.110 1.00 70.40 H new ATOM 0 HG21 ILE A 31 11.878 -15.917 -2.170 1.00 3.04 H new ATOM 0 HG22 ILE A 31 13.251 -16.082 -1.049 1.00 3.04 H new ATOM 0 HG23 ILE A 31 11.700 -15.430 -0.468 1.00 3.04 H new ATOM 0 HD11 ILE A 31 9.692 -12.438 -1.674 1.00 32.21 H new ATOM 0 HD12 ILE A 31 10.064 -14.043 -1.003 1.00 32.21 H new ATOM 0 HD13 ILE A 31 10.803 -12.589 -0.292 1.00 32.21 H new ATOM 507 N PRO A 32 15.334 -14.524 0.989 1.00 44.23 N ATOM 508 CA PRO A 32 16.707 -15.031 1.354 1.00 73.24 C ATOM 509 C PRO A 32 17.305 -16.092 0.365 1.00 30.24 C ATOM 510 O PRO A 32 16.550 -16.738 -0.351 1.00 60.32 O ATOM 511 CB PRO A 32 16.473 -15.612 2.779 1.00 51.24 C ATOM 512 CG PRO A 32 15.334 -14.812 3.326 1.00 45.43 C ATOM 513 CD PRO A 32 14.403 -14.612 2.158 1.00 54.21 C ATOM 0 HA PRO A 32 17.458 -14.242 1.306 1.00 73.24 H new ATOM 0 HB2 PRO A 32 16.230 -16.674 2.740 1.00 51.24 H new ATOM 0 HB3 PRO A 32 17.363 -15.512 3.400 1.00 51.24 H new ATOM 0 HG2 PRO A 32 14.837 -15.338 4.141 1.00 45.43 H new ATOM 0 HG3 PRO A 32 15.677 -13.858 3.725 1.00 45.43 H new ATOM 0 HD2 PRO A 32 13.704 -15.442 2.054 1.00 54.21 H new ATOM 0 HD3 PRO A 32 13.808 -13.705 2.268 1.00 54.21 H new ATOM 521 N PRO A 33 18.683 -16.277 0.337 1.00 1.31 N ATOM 522 CA PRO A 33 19.426 -17.032 -0.738 1.00 34.24 C ATOM 523 C PRO A 33 18.855 -18.430 -1.075 1.00 52.44 C ATOM 524 O PRO A 33 18.739 -18.797 -2.249 1.00 22.04 O ATOM 525 CB PRO A 33 20.881 -17.136 -0.169 1.00 32.35 C ATOM 526 CG PRO A 33 20.765 -16.770 1.285 1.00 74.22 C ATOM 527 CD PRO A 33 19.650 -15.762 1.351 1.00 73.03 C ATOM 0 HA PRO A 33 19.350 -16.510 -1.692 1.00 34.24 H new ATOM 0 HB2 PRO A 33 21.280 -18.143 -0.291 1.00 32.35 H new ATOM 0 HB3 PRO A 33 21.557 -16.460 -0.692 1.00 32.35 H new ATOM 0 HG2 PRO A 33 20.541 -17.645 1.895 1.00 74.22 H new ATOM 0 HG3 PRO A 33 21.698 -16.350 1.661 1.00 74.22 H new ATOM 0 HD2 PRO A 33 19.206 -15.713 2.345 1.00 73.03 H new ATOM 0 HD3 PRO A 33 19.997 -14.758 1.107 1.00 73.03 H new ATOM 535 N GLU A 34 18.502 -19.188 -0.042 1.00 54.42 N ATOM 536 CA GLU A 34 17.951 -20.550 -0.194 1.00 14.44 C ATOM 537 C GLU A 34 16.427 -20.498 -0.402 1.00 63.41 C ATOM 538 O GLU A 34 15.871 -21.329 -1.122 1.00 64.11 O ATOM 539 CB GLU A 34 18.335 -21.470 1.005 1.00 14.11 C ATOM 540 CG GLU A 34 17.787 -21.070 2.392 1.00 4.21 C ATOM 541 CD GLU A 34 18.358 -19.749 2.936 1.00 61.23 C ATOM 542 OE1 GLU A 34 19.488 -19.747 3.474 1.00 64.13 O ATOM 543 OE2 GLU A 34 17.697 -18.696 2.790 1.00 42.24 O ATOM 0 H GLU A 34 18.586 -18.885 0.928 1.00 54.42 H new ATOM 0 HA GLU A 34 18.399 -20.992 -1.084 1.00 14.44 H new ATOM 0 HB2 GLU A 34 17.991 -22.480 0.782 1.00 14.11 H new ATOM 0 HB3 GLU A 34 19.422 -21.510 1.068 1.00 14.11 H new ATOM 0 HG2 GLU A 34 16.702 -20.987 2.332 1.00 4.21 H new ATOM 0 HG3 GLU A 34 18.007 -21.868 3.101 1.00 4.21 H new ATOM 550 N GLU A 35 15.760 -19.497 0.214 1.00 62.45 N ATOM 551 CA GLU A 35 14.300 -19.302 0.070 1.00 3.22 C ATOM 552 C GLU A 35 13.913 -18.920 -1.371 1.00 64.40 C ATOM 553 O GLU A 35 12.835 -19.302 -1.850 1.00 2.11 O ATOM 554 CB GLU A 35 13.790 -18.229 1.064 1.00 13.03 C ATOM 555 CG GLU A 35 14.079 -18.532 2.548 1.00 32.43 C ATOM 556 CD GLU A 35 13.566 -19.905 3.014 1.00 31.31 C ATOM 557 OE1 GLU A 35 12.332 -20.087 3.114 1.00 72.42 O ATOM 558 OE2 GLU A 35 14.386 -20.820 3.266 1.00 35.14 O ATOM 0 H GLU A 35 16.211 -18.810 0.818 1.00 62.45 H new ATOM 0 HA GLU A 35 13.822 -20.254 0.301 1.00 3.22 H new ATOM 0 HB2 GLU A 35 14.244 -17.272 0.808 1.00 13.03 H new ATOM 0 HB3 GLU A 35 12.714 -18.116 0.934 1.00 13.03 H new ATOM 0 HG2 GLU A 35 15.155 -18.480 2.717 1.00 32.43 H new ATOM 0 HG3 GLU A 35 13.622 -17.756 3.163 1.00 32.43 H new ATOM 565 N ARG A 36 14.797 -18.177 -2.070 1.00 24.04 N ATOM 566 CA ARG A 36 14.535 -17.682 -3.435 1.00 71.03 C ATOM 567 C ARG A 36 14.718 -18.776 -4.506 1.00 72.41 C ATOM 568 O ARG A 36 14.500 -18.510 -5.690 1.00 2.20 O ATOM 569 CB ARG A 36 15.441 -16.456 -3.744 1.00 51.32 C ATOM 570 CG ARG A 36 16.933 -16.793 -3.880 1.00 13.31 C ATOM 571 CD ARG A 36 17.848 -15.560 -3.939 1.00 51.43 C ATOM 572 NE ARG A 36 17.490 -14.606 -5.009 1.00 61.54 N ATOM 573 CZ ARG A 36 18.351 -14.046 -5.879 1.00 51.22 C ATOM 574 NH1 ARG A 36 19.652 -14.334 -5.854 1.00 63.54 N ATOM 575 NH2 ARG A 36 17.898 -13.175 -6.761 1.00 11.12 N ATOM 0 H ARG A 36 15.709 -17.905 -1.704 1.00 24.04 H new ATOM 0 HA ARG A 36 13.489 -17.376 -3.473 1.00 71.03 H new ATOM 0 HB2 ARG A 36 15.100 -15.990 -4.668 1.00 51.32 H new ATOM 0 HB3 ARG A 36 15.318 -15.718 -2.951 1.00 51.32 H new ATOM 0 HG2 ARG A 36 17.233 -17.416 -3.037 1.00 13.31 H new ATOM 0 HG3 ARG A 36 17.080 -17.386 -4.783 1.00 13.31 H new ATOM 0 HD2 ARG A 36 17.812 -15.046 -2.979 1.00 51.43 H new ATOM 0 HD3 ARG A 36 18.877 -15.889 -4.086 1.00 51.43 H new ATOM 0 HE ARG A 36 16.506 -14.350 -5.096 1.00 61.54 H new ATOM 0 HH11 ARG A 36 20.015 -14.992 -5.165 1.00 63.54 H new ATOM 0 HH12 ARG A 36 20.284 -13.896 -6.524 1.00 63.54 H new ATOM 0 HH21 ARG A 36 16.907 -12.934 -6.777 1.00 11.12 H new ATOM 0 HH22 ARG A 36 18.539 -12.743 -7.426 1.00 11.12 H new ATOM 589 N ASP A 37 15.124 -19.993 -4.079 1.00 54.43 N ATOM 590 CA ASP A 37 15.256 -21.169 -4.970 1.00 24.32 C ATOM 591 C ASP A 37 13.947 -21.457 -5.730 1.00 22.43 C ATOM 592 O ASP A 37 13.959 -21.712 -6.940 1.00 22.24 O ATOM 593 CB ASP A 37 15.697 -22.418 -4.161 1.00 52.02 C ATOM 594 CG ASP A 37 15.744 -23.710 -5.002 1.00 44.02 C ATOM 595 OD1 ASP A 37 16.650 -23.843 -5.856 1.00 22.33 O ATOM 596 OD2 ASP A 37 14.859 -24.586 -4.834 1.00 70.14 O ATOM 0 H ASP A 37 15.369 -20.188 -3.108 1.00 54.43 H new ATOM 0 HA ASP A 37 16.024 -20.937 -5.708 1.00 24.32 H new ATOM 0 HB2 ASP A 37 16.683 -22.235 -3.735 1.00 52.02 H new ATOM 0 HB3 ASP A 37 15.011 -22.562 -3.327 1.00 52.02 H new ATOM 601 N ASP A 38 12.828 -21.400 -4.996 1.00 4.15 N ATOM 602 CA ASP A 38 11.485 -21.693 -5.531 1.00 24.24 C ATOM 603 C ASP A 38 10.600 -20.424 -5.569 1.00 31.40 C ATOM 604 O ASP A 38 9.400 -20.527 -5.820 1.00 24.22 O ATOM 605 CB ASP A 38 10.851 -22.807 -4.647 1.00 41.41 C ATOM 606 CG ASP A 38 9.554 -23.432 -5.213 1.00 54.42 C ATOM 607 OD1 ASP A 38 9.638 -24.310 -6.106 1.00 54.31 O ATOM 608 OD2 ASP A 38 8.447 -23.061 -4.758 1.00 15.20 O ATOM 0 H ASP A 38 12.825 -21.148 -4.008 1.00 4.15 H new ATOM 0 HA ASP A 38 11.563 -22.038 -6.562 1.00 24.24 H new ATOM 0 HB2 ASP A 38 11.586 -23.599 -4.505 1.00 41.41 H new ATOM 0 HB3 ASP A 38 10.636 -22.391 -3.663 1.00 41.41 H new ATOM 613 N PHE A 39 11.187 -19.215 -5.363 1.00 62.43 N ATOM 614 CA PHE A 39 10.387 -17.963 -5.307 1.00 41.22 C ATOM 615 C PHE A 39 9.659 -17.719 -6.651 1.00 65.03 C ATOM 616 O PHE A 39 10.262 -17.800 -7.730 1.00 5.41 O ATOM 617 CB PHE A 39 11.240 -16.708 -4.876 1.00 60.31 C ATOM 618 CG PHE A 39 11.701 -15.747 -5.997 1.00 73.14 C ATOM 619 CD1 PHE A 39 12.796 -16.054 -6.807 1.00 23.52 C ATOM 620 CD2 PHE A 39 11.022 -14.541 -6.245 1.00 65.23 C ATOM 621 CE1 PHE A 39 13.194 -15.201 -7.826 1.00 62.14 C ATOM 622 CE2 PHE A 39 11.423 -13.688 -7.261 1.00 62.00 C ATOM 623 CZ PHE A 39 12.508 -14.021 -8.052 1.00 34.52 C ATOM 0 H PHE A 39 12.190 -19.082 -5.235 1.00 62.43 H new ATOM 0 HA PHE A 39 9.637 -18.100 -4.528 1.00 41.22 H new ATOM 0 HB2 PHE A 39 10.656 -16.133 -4.158 1.00 60.31 H new ATOM 0 HB3 PHE A 39 12.126 -17.066 -4.352 1.00 60.31 H new ATOM 0 HD1 PHE A 39 13.342 -16.970 -6.638 1.00 23.52 H new ATOM 0 HD2 PHE A 39 10.173 -14.275 -5.633 1.00 65.23 H new ATOM 0 HE1 PHE A 39 14.041 -15.459 -8.444 1.00 62.14 H new ATOM 0 HE2 PHE A 39 10.890 -12.765 -7.435 1.00 62.00 H new ATOM 0 HZ PHE A 39 12.820 -13.359 -8.847 1.00 34.52 H new ATOM 633 N ASP A 40 8.363 -17.479 -6.563 1.00 31.34 N ATOM 634 CA ASP A 40 7.521 -17.100 -7.703 1.00 15.25 C ATOM 635 C ASP A 40 7.354 -15.569 -7.707 1.00 10.40 C ATOM 636 O ASP A 40 7.611 -14.919 -6.678 1.00 22.24 O ATOM 637 CB ASP A 40 6.161 -17.842 -7.595 1.00 3.13 C ATOM 638 CG ASP A 40 5.160 -17.469 -8.698 1.00 31.31 C ATOM 639 OD1 ASP A 40 5.496 -17.625 -9.891 1.00 24.24 O ATOM 640 OD2 ASP A 40 4.040 -17.014 -8.375 1.00 55.42 O ATOM 0 H ASP A 40 7.849 -17.541 -5.684 1.00 31.34 H new ATOM 0 HA ASP A 40 7.980 -17.389 -8.648 1.00 15.25 H new ATOM 0 HB2 ASP A 40 6.341 -18.917 -7.629 1.00 3.13 H new ATOM 0 HB3 ASP A 40 5.715 -17.624 -6.624 1.00 3.13 H new ATOM 645 N GLY A 41 6.931 -15.000 -8.855 1.00 65.22 N ATOM 646 CA GLY A 41 6.684 -13.558 -8.990 1.00 21.23 C ATOM 647 C GLY A 41 5.653 -13.012 -8.000 1.00 53.43 C ATOM 648 O GLY A 41 4.990 -13.779 -7.298 1.00 74.23 O ATOM 0 H GLY A 41 6.753 -15.529 -9.709 1.00 65.22 H new ATOM 0 HA2 GLY A 41 7.624 -13.024 -8.853 1.00 21.23 H new ATOM 0 HA3 GLY A 41 6.345 -13.351 -10.005 1.00 21.23 H new ATOM 652 N LEU A 42 5.482 -11.685 -7.968 1.00 12.02 N ATOM 653 CA LEU A 42 4.687 -11.018 -6.930 1.00 34.43 C ATOM 654 C LEU A 42 3.205 -11.072 -7.290 1.00 70.02 C ATOM 655 O LEU A 42 2.660 -10.164 -7.933 1.00 31.24 O ATOM 656 CB LEU A 42 5.160 -9.562 -6.682 1.00 21.22 C ATOM 657 CG LEU A 42 6.606 -9.415 -6.122 1.00 10.44 C ATOM 658 CD1 LEU A 42 6.941 -7.938 -5.861 1.00 13.21 C ATOM 659 CD2 LEU A 42 6.807 -10.270 -4.843 1.00 13.41 C ATOM 0 H LEU A 42 5.887 -11.048 -8.654 1.00 12.02 H new ATOM 0 HA LEU A 42 4.836 -11.555 -5.993 1.00 34.43 H new ATOM 0 HB2 LEU A 42 5.095 -9.012 -7.621 1.00 21.22 H new ATOM 0 HB3 LEU A 42 4.469 -9.087 -5.986 1.00 21.22 H new ATOM 0 HG LEU A 42 7.297 -9.790 -6.877 1.00 10.44 H new ATOM 0 HD11 LEU A 42 7.955 -7.859 -5.470 1.00 13.21 H new ATOM 0 HD12 LEU A 42 6.866 -7.378 -6.793 1.00 13.21 H new ATOM 0 HD13 LEU A 42 6.239 -7.529 -5.134 1.00 13.21 H new ATOM 0 HD21 LEU A 42 7.826 -10.145 -4.478 1.00 13.41 H new ATOM 0 HD22 LEU A 42 6.104 -9.947 -4.075 1.00 13.41 H new ATOM 0 HD23 LEU A 42 6.632 -11.320 -5.076 1.00 13.41 H new ATOM 671 N SER A 43 2.578 -12.185 -6.908 1.00 22.31 N ATOM 672 CA SER A 43 1.136 -12.337 -6.937 1.00 55.00 C ATOM 673 C SER A 43 0.593 -11.870 -5.584 1.00 2.24 C ATOM 674 O SER A 43 1.310 -11.901 -4.569 1.00 5.13 O ATOM 675 CB SER A 43 0.758 -13.803 -7.236 1.00 61.15 C ATOM 676 OG SER A 43 1.400 -14.710 -6.353 1.00 41.21 O ATOM 0 H SER A 43 3.069 -13.011 -6.567 1.00 22.31 H new ATOM 0 HA SER A 43 0.695 -11.734 -7.730 1.00 55.00 H new ATOM 0 HB2 SER A 43 -0.322 -13.922 -7.155 1.00 61.15 H new ATOM 0 HB3 SER A 43 1.029 -14.045 -8.264 1.00 61.15 H new ATOM 0 HG SER A 43 1.133 -15.627 -6.575 1.00 41.21 H new ATOM 682 N TYR A 44 -0.646 -11.403 -5.579 1.00 72.13 N ATOM 683 CA TYR A 44 -1.296 -10.847 -4.386 1.00 23.30 C ATOM 684 C TYR A 44 -2.799 -11.109 -4.464 1.00 73.33 C ATOM 685 O TYR A 44 -3.232 -11.908 -5.306 1.00 60.13 O ATOM 686 CB TYR A 44 -0.937 -9.336 -4.242 1.00 64.55 C ATOM 687 CG TYR A 44 -1.109 -8.476 -5.510 1.00 12.33 C ATOM 688 CD1 TYR A 44 -2.340 -7.918 -5.837 1.00 3.04 C ATOM 689 CD2 TYR A 44 -0.033 -8.210 -6.370 1.00 24.21 C ATOM 690 CE1 TYR A 44 -2.502 -7.134 -6.955 1.00 40.14 C ATOM 691 CE2 TYR A 44 -0.194 -7.422 -7.497 1.00 55.12 C ATOM 692 CZ TYR A 44 -1.431 -6.887 -7.783 1.00 73.43 C ATOM 693 OH TYR A 44 -1.608 -6.101 -8.905 1.00 65.10 O ATOM 0 H TYR A 44 -1.241 -11.396 -6.408 1.00 72.13 H new ATOM 0 HA TYR A 44 -0.932 -11.337 -3.483 1.00 23.30 H new ATOM 0 HB2 TYR A 44 -1.555 -8.910 -3.452 1.00 64.55 H new ATOM 0 HB3 TYR A 44 0.099 -9.259 -3.913 1.00 64.55 H new ATOM 0 HD1 TYR A 44 -3.190 -8.105 -5.197 1.00 3.04 H new ATOM 0 HD2 TYR A 44 0.938 -8.627 -6.149 1.00 24.21 H new ATOM 0 HE1 TYR A 44 -3.470 -6.712 -7.183 1.00 40.14 H new ATOM 0 HE2 TYR A 44 0.645 -7.228 -8.148 1.00 55.12 H new ATOM 0 HH TYR A 44 -1.150 -5.244 -8.780 1.00 65.10 H new ATOM 703 N PHE A 45 -3.579 -10.474 -3.568 1.00 24.41 N ATOM 704 CA PHE A 45 -5.053 -10.567 -3.595 1.00 21.32 C ATOM 705 C PHE A 45 -5.540 -10.115 -4.987 1.00 52.11 C ATOM 706 O PHE A 45 -5.268 -8.994 -5.401 1.00 22.13 O ATOM 707 CB PHE A 45 -5.688 -9.705 -2.471 1.00 24.54 C ATOM 708 CG PHE A 45 -5.313 -10.145 -1.059 1.00 42.41 C ATOM 709 CD1 PHE A 45 -5.965 -11.219 -0.452 1.00 74.31 C ATOM 710 CD2 PHE A 45 -4.307 -9.497 -0.343 1.00 1.41 C ATOM 711 CE1 PHE A 45 -5.625 -11.629 0.823 1.00 11.24 C ATOM 712 CE2 PHE A 45 -3.970 -9.907 0.933 1.00 34.04 C ATOM 713 CZ PHE A 45 -4.625 -10.973 1.515 1.00 55.54 C ATOM 0 H PHE A 45 -3.213 -9.890 -2.816 1.00 24.41 H new ATOM 0 HA PHE A 45 -5.362 -11.597 -3.414 1.00 21.32 H new ATOM 0 HB2 PHE A 45 -5.385 -8.667 -2.609 1.00 24.54 H new ATOM 0 HB3 PHE A 45 -6.773 -9.736 -2.573 1.00 24.54 H new ATOM 0 HD1 PHE A 45 -6.747 -11.738 -0.987 1.00 74.31 H new ATOM 0 HD2 PHE A 45 -3.785 -8.665 -0.791 1.00 1.41 H new ATOM 0 HE1 PHE A 45 -6.141 -12.462 1.278 1.00 11.24 H new ATOM 0 HE2 PHE A 45 -3.192 -9.392 1.476 1.00 34.04 H new ATOM 0 HZ PHE A 45 -4.356 -11.294 2.510 1.00 55.54 H new ATOM 723 N ASP A 46 -6.226 -11.013 -5.714 1.00 1.41 N ATOM 724 CA ASP A 46 -6.452 -10.851 -7.165 1.00 3.12 C ATOM 725 C ASP A 46 -7.376 -9.643 -7.411 1.00 4.53 C ATOM 726 O ASP A 46 -8.423 -9.555 -6.761 1.00 54.03 O ATOM 727 CB ASP A 46 -7.029 -12.157 -7.764 1.00 62.12 C ATOM 728 CG ASP A 46 -7.191 -12.145 -9.296 1.00 11.12 C ATOM 729 OD1 ASP A 46 -8.264 -11.736 -9.794 1.00 12.34 O ATOM 730 OD2 ASP A 46 -6.249 -12.563 -10.017 1.00 25.33 O ATOM 0 H ASP A 46 -6.635 -11.861 -5.322 1.00 1.41 H new ATOM 0 HA ASP A 46 -5.505 -10.656 -7.668 1.00 3.12 H new ATOM 0 HB2 ASP A 46 -6.378 -12.986 -7.487 1.00 62.12 H new ATOM 0 HB3 ASP A 46 -8.001 -12.350 -7.311 1.00 62.12 H new ATOM 735 N PRO A 47 -6.972 -8.693 -8.329 1.00 20.05 N ATOM 736 CA PRO A 47 -7.682 -7.408 -8.562 1.00 12.11 C ATOM 737 C PRO A 47 -9.217 -7.541 -8.631 1.00 54.35 C ATOM 738 O PRO A 47 -9.769 -8.094 -9.585 1.00 73.30 O ATOM 739 CB PRO A 47 -7.094 -6.936 -9.909 1.00 0.14 C ATOM 740 CG PRO A 47 -5.690 -7.458 -9.898 1.00 43.15 C ATOM 741 CD PRO A 47 -5.767 -8.801 -9.209 1.00 73.04 C ATOM 0 HA PRO A 47 -7.534 -6.710 -7.738 1.00 12.11 H new ATOM 0 HB2 PRO A 47 -7.660 -7.333 -10.752 1.00 0.14 H new ATOM 0 HB3 PRO A 47 -7.115 -5.850 -9.994 1.00 0.14 H new ATOM 0 HG2 PRO A 47 -5.300 -7.558 -10.911 1.00 43.15 H new ATOM 0 HG3 PRO A 47 -5.023 -6.780 -9.365 1.00 43.15 H new ATOM 0 HD2 PRO A 47 -5.871 -9.613 -9.929 1.00 73.04 H new ATOM 0 HD3 PRO A 47 -4.867 -9.003 -8.629 1.00 73.04 H new ATOM 749 N ASP A 48 -9.886 -7.066 -7.576 1.00 13.42 N ATOM 750 CA ASP A 48 -11.346 -7.153 -7.431 1.00 23.31 C ATOM 751 C ASP A 48 -11.936 -5.733 -7.255 1.00 63.14 C ATOM 752 O ASP A 48 -11.703 -5.093 -6.218 1.00 64.05 O ATOM 753 CB ASP A 48 -11.697 -8.068 -6.233 1.00 40.01 C ATOM 754 CG ASP A 48 -13.207 -8.321 -6.083 1.00 40.13 C ATOM 755 OD1 ASP A 48 -13.887 -7.525 -5.423 1.00 70.12 O ATOM 756 OD2 ASP A 48 -13.720 -9.312 -6.636 1.00 34.22 O ATOM 0 H ASP A 48 -9.427 -6.606 -6.790 1.00 13.42 H new ATOM 0 HA ASP A 48 -11.784 -7.591 -8.328 1.00 23.31 H new ATOM 0 HB2 ASP A 48 -11.186 -9.023 -6.352 1.00 40.01 H new ATOM 0 HB3 ASP A 48 -11.318 -7.616 -5.316 1.00 40.01 H new ATOM 761 N PRO A 49 -12.715 -5.216 -8.258 1.00 51.31 N ATOM 762 CA PRO A 49 -13.303 -3.857 -8.207 1.00 4.35 C ATOM 763 C PRO A 49 -14.573 -3.774 -7.329 1.00 44.34 C ATOM 764 O PRO A 49 -15.079 -2.677 -7.080 1.00 10.42 O ATOM 765 CB PRO A 49 -13.611 -3.566 -9.691 1.00 53.22 C ATOM 766 CG PRO A 49 -13.958 -4.906 -10.262 1.00 31.12 C ATOM 767 CD PRO A 49 -13.085 -5.911 -9.529 1.00 3.15 C ATOM 0 HA PRO A 49 -12.632 -3.131 -7.747 1.00 4.35 H new ATOM 0 HB2 PRO A 49 -14.437 -2.862 -9.796 1.00 53.22 H new ATOM 0 HB3 PRO A 49 -12.752 -3.127 -10.198 1.00 53.22 H new ATOM 0 HG2 PRO A 49 -15.015 -5.130 -10.119 1.00 31.12 H new ATOM 0 HG3 PRO A 49 -13.769 -4.934 -11.335 1.00 31.12 H new ATOM 0 HD2 PRO A 49 -13.623 -6.839 -9.334 1.00 3.15 H new ATOM 0 HD3 PRO A 49 -12.202 -6.172 -10.112 1.00 3.15 H new ATOM 775 N ASP A 50 -15.094 -4.939 -6.884 1.00 11.24 N ATOM 776 CA ASP A 50 -16.317 -5.014 -6.050 1.00 64.33 C ATOM 777 C ASP A 50 -15.997 -4.911 -4.554 1.00 61.04 C ATOM 778 O ASP A 50 -16.893 -4.653 -3.751 1.00 51.21 O ATOM 779 CB ASP A 50 -17.098 -6.322 -6.329 1.00 55.42 C ATOM 780 CG ASP A 50 -17.600 -6.435 -7.775 1.00 50.24 C ATOM 781 OD1 ASP A 50 -18.565 -5.725 -8.134 1.00 44.11 O ATOM 782 OD2 ASP A 50 -17.023 -7.217 -8.564 1.00 61.01 O ATOM 0 H ASP A 50 -14.683 -5.849 -7.091 1.00 11.24 H new ATOM 0 HA ASP A 50 -16.938 -4.161 -6.323 1.00 64.33 H new ATOM 0 HB2 ASP A 50 -16.456 -7.174 -6.107 1.00 55.42 H new ATOM 0 HB3 ASP A 50 -17.949 -6.380 -5.651 1.00 55.42 H new ATOM 787 N TYR A 51 -14.727 -5.143 -4.184 1.00 73.23 N ATOM 788 CA TYR A 51 -14.254 -4.957 -2.792 1.00 62.41 C ATOM 789 C TYR A 51 -13.650 -3.544 -2.655 1.00 52.43 C ATOM 790 O TYR A 51 -13.552 -2.992 -1.551 1.00 12.14 O ATOM 791 CB TYR A 51 -13.200 -6.046 -2.421 1.00 64.40 C ATOM 792 CG TYR A 51 -12.911 -6.161 -0.913 1.00 14.31 C ATOM 793 CD1 TYR A 51 -11.954 -5.354 -0.284 1.00 70.00 C ATOM 794 CD2 TYR A 51 -13.621 -7.060 -0.111 1.00 1.44 C ATOM 795 CE1 TYR A 51 -11.719 -5.447 1.071 1.00 12.34 C ATOM 796 CE2 TYR A 51 -13.387 -7.147 1.251 1.00 11.12 C ATOM 797 CZ TYR A 51 -12.438 -6.336 1.835 1.00 63.22 C ATOM 798 OH TYR A 51 -12.206 -6.407 3.194 1.00 40.20 O ATOM 0 H TYR A 51 -14.003 -5.461 -4.828 1.00 73.23 H new ATOM 0 HA TYR A 51 -15.093 -5.061 -2.104 1.00 62.41 H new ATOM 0 HB2 TYR A 51 -13.549 -7.012 -2.787 1.00 64.40 H new ATOM 0 HB3 TYR A 51 -12.268 -5.825 -2.942 1.00 64.40 H new ATOM 0 HD1 TYR A 51 -11.390 -4.645 -0.872 1.00 70.00 H new ATOM 0 HD2 TYR A 51 -14.366 -7.699 -0.562 1.00 1.44 H new ATOM 0 HE1 TYR A 51 -10.970 -4.821 1.533 1.00 12.34 H new ATOM 0 HE2 TYR A 51 -13.946 -7.848 1.853 1.00 11.12 H new ATOM 0 HH TYR A 51 -12.355 -7.325 3.504 1.00 40.20 H new ATOM 808 N ARG A 52 -13.229 -3.001 -3.811 1.00 65.32 N ATOM 809 CA ARG A 52 -12.723 -1.630 -3.964 1.00 13.11 C ATOM 810 C ARG A 52 -13.719 -0.593 -3.407 1.00 54.44 C ATOM 811 O ARG A 52 -14.926 -0.658 -3.679 1.00 11.22 O ATOM 812 CB ARG A 52 -12.459 -1.354 -5.466 1.00 70.42 C ATOM 813 CG ARG A 52 -12.046 0.093 -5.825 1.00 63.34 C ATOM 814 CD ARG A 52 -11.882 0.292 -7.344 1.00 3.55 C ATOM 815 NE ARG A 52 -13.149 0.134 -8.074 1.00 75.14 N ATOM 816 CZ ARG A 52 -13.302 0.311 -9.395 1.00 12.13 C ATOM 817 NH1 ARG A 52 -12.270 0.640 -10.166 1.00 10.33 N ATOM 818 NH2 ARG A 52 -14.507 0.183 -9.929 1.00 25.14 N ATOM 0 H ARG A 52 -13.232 -3.521 -4.689 1.00 65.32 H new ATOM 0 HA ARG A 52 -11.798 -1.537 -3.395 1.00 13.11 H new ATOM 0 HB2 ARG A 52 -11.675 -2.030 -5.807 1.00 70.42 H new ATOM 0 HB3 ARG A 52 -13.361 -1.603 -6.025 1.00 70.42 H new ATOM 0 HG2 ARG A 52 -12.797 0.787 -5.448 1.00 63.34 H new ATOM 0 HG3 ARG A 52 -11.108 0.336 -5.325 1.00 63.34 H new ATOM 0 HD2 ARG A 52 -11.478 1.286 -7.535 1.00 3.55 H new ATOM 0 HD3 ARG A 52 -11.155 -0.426 -7.725 1.00 3.55 H new ATOM 0 HE ARG A 52 -13.974 -0.130 -7.535 1.00 75.14 H new ATOM 0 HH11 ARG A 52 -11.345 0.762 -9.755 1.00 10.33 H new ATOM 0 HH12 ARG A 52 -12.404 0.771 -11.169 1.00 10.33 H new ATOM 0 HH21 ARG A 52 -15.305 -0.048 -9.337 1.00 25.14 H new ATOM 0 HH22 ARG A 52 -14.637 0.315 -10.932 1.00 25.14 H new ATOM 832 N VAL A 53 -13.194 0.359 -2.633 1.00 40.13 N ATOM 833 CA VAL A 53 -13.966 1.471 -2.066 1.00 23.53 C ATOM 834 C VAL A 53 -13.329 2.791 -2.529 1.00 24.12 C ATOM 835 O VAL A 53 -12.400 2.795 -3.346 1.00 45.25 O ATOM 836 CB VAL A 53 -14.028 1.407 -0.483 1.00 70.23 C ATOM 837 CG1 VAL A 53 -14.589 0.052 0.011 1.00 42.01 C ATOM 838 CG2 VAL A 53 -12.658 1.710 0.160 1.00 53.32 C ATOM 0 H VAL A 53 -12.207 0.381 -2.378 1.00 40.13 H new ATOM 0 HA VAL A 53 -14.994 1.402 -2.421 1.00 23.53 H new ATOM 0 HB VAL A 53 -14.718 2.188 -0.162 1.00 70.23 H new ATOM 0 HG11 VAL A 53 -14.617 0.045 1.101 1.00 42.01 H new ATOM 0 HG12 VAL A 53 -15.597 -0.088 -0.378 1.00 42.01 H new ATOM 0 HG13 VAL A 53 -13.949 -0.757 -0.341 1.00 42.01 H new ATOM 0 HG21 VAL A 53 -12.745 1.656 1.245 1.00 53.32 H new ATOM 0 HG22 VAL A 53 -11.926 0.979 -0.182 1.00 53.32 H new ATOM 0 HG23 VAL A 53 -12.334 2.710 -0.128 1.00 53.32 H new ATOM 848 N GLU A 54 -13.860 3.902 -2.029 1.00 42.14 N ATOM 849 CA GLU A 54 -13.276 5.235 -2.214 1.00 34.32 C ATOM 850 C GLU A 54 -13.358 5.989 -0.884 1.00 24.14 C ATOM 851 O GLU A 54 -14.236 5.700 -0.060 1.00 31.11 O ATOM 852 CB GLU A 54 -13.988 5.976 -3.377 1.00 52.55 C ATOM 853 CG GLU A 54 -15.526 6.053 -3.251 1.00 13.34 C ATOM 854 CD GLU A 54 -16.220 6.467 -4.559 1.00 41.02 C ATOM 855 OE1 GLU A 54 -16.242 5.649 -5.510 1.00 31.14 O ATOM 856 OE2 GLU A 54 -16.737 7.602 -4.653 1.00 63.52 O ATOM 0 H GLU A 54 -14.718 3.907 -1.477 1.00 42.14 H new ATOM 0 HA GLU A 54 -12.226 5.164 -2.497 1.00 34.32 H new ATOM 0 HB2 GLU A 54 -13.592 6.989 -3.440 1.00 52.55 H new ATOM 0 HB3 GLU A 54 -13.739 5.477 -4.314 1.00 52.55 H new ATOM 0 HG2 GLU A 54 -15.908 5.082 -2.936 1.00 13.34 H new ATOM 0 HG3 GLU A 54 -15.785 6.766 -2.468 1.00 13.34 H new ATOM 863 N ALA A 55 -12.432 6.935 -0.665 1.00 54.21 N ATOM 864 CA ALA A 55 -12.252 7.603 0.632 1.00 43.05 C ATOM 865 C ALA A 55 -12.073 9.108 0.448 1.00 72.21 C ATOM 866 O ALA A 55 -11.511 9.545 -0.560 1.00 52.51 O ATOM 867 CB ALA A 55 -11.030 7.014 1.349 1.00 34.33 C ATOM 0 H ALA A 55 -11.786 7.259 -1.385 1.00 54.21 H new ATOM 0 HA ALA A 55 -13.144 7.437 1.236 1.00 43.05 H new ATOM 0 HB1 ALA A 55 -10.898 7.510 2.310 1.00 34.33 H new ATOM 0 HB2 ALA A 55 -11.182 5.947 1.510 1.00 34.33 H new ATOM 0 HB3 ALA A 55 -10.141 7.166 0.737 1.00 34.33 H new ATOM 873 N THR A 56 -12.550 9.893 1.426 1.00 71.24 N ATOM 874 CA THR A 56 -12.331 11.339 1.458 1.00 42.44 C ATOM 875 C THR A 56 -10.997 11.624 2.181 1.00 4.11 C ATOM 876 O THR A 56 -10.774 11.152 3.299 1.00 73.20 O ATOM 877 CB THR A 56 -13.510 12.072 2.173 1.00 52.33 C ATOM 878 OG1 THR A 56 -14.762 11.696 1.559 1.00 12.14 O ATOM 879 CG2 THR A 56 -13.357 13.608 2.118 1.00 21.00 C ATOM 0 H THR A 56 -13.096 9.541 2.212 1.00 71.24 H new ATOM 0 HA THR A 56 -12.285 11.717 0.437 1.00 42.44 H new ATOM 0 HB THR A 56 -13.495 11.770 3.220 1.00 52.33 H new ATOM 0 HG1 THR A 56 -15.499 12.156 2.011 1.00 12.14 H new ATOM 0 HG21 THR A 56 -14.199 14.076 2.627 1.00 21.00 H new ATOM 0 HG22 THR A 56 -12.429 13.899 2.609 1.00 21.00 H new ATOM 0 HG23 THR A 56 -13.335 13.934 1.078 1.00 21.00 H new ATOM 887 N VAL A 57 -10.128 12.380 1.514 1.00 14.52 N ATOM 888 CA VAL A 57 -8.775 12.702 1.972 1.00 74.25 C ATOM 889 C VAL A 57 -8.809 13.769 3.083 1.00 4.51 C ATOM 890 O VAL A 57 -9.614 14.702 3.038 1.00 74.21 O ATOM 891 CB VAL A 57 -7.906 13.235 0.772 1.00 14.30 C ATOM 892 CG1 VAL A 57 -6.423 13.355 1.167 1.00 44.04 C ATOM 893 CG2 VAL A 57 -8.080 12.346 -0.476 1.00 72.10 C ATOM 0 H VAL A 57 -10.351 12.799 0.611 1.00 14.52 H new ATOM 0 HA VAL A 57 -8.331 11.789 2.370 1.00 74.25 H new ATOM 0 HB VAL A 57 -8.263 14.234 0.522 1.00 14.30 H new ATOM 0 HG11 VAL A 57 -5.849 13.725 0.318 1.00 44.04 H new ATOM 0 HG12 VAL A 57 -6.324 14.049 2.002 1.00 44.04 H new ATOM 0 HG13 VAL A 57 -6.045 12.376 1.461 1.00 44.04 H new ATOM 0 HG21 VAL A 57 -7.469 12.737 -1.289 1.00 72.10 H new ATOM 0 HG22 VAL A 57 -7.767 11.328 -0.244 1.00 72.10 H new ATOM 0 HG23 VAL A 57 -9.127 12.344 -0.778 1.00 72.10 H new ATOM 903 N THR A 58 -7.918 13.614 4.061 1.00 54.01 N ATOM 904 CA THR A 58 -7.754 14.540 5.177 1.00 24.42 C ATOM 905 C THR A 58 -6.265 14.925 5.249 1.00 23.52 C ATOM 906 O THR A 58 -5.465 14.205 5.851 1.00 73.33 O ATOM 907 CB THR A 58 -8.228 13.851 6.507 1.00 51.32 C ATOM 908 OG1 THR A 58 -9.572 13.346 6.359 1.00 10.31 O ATOM 909 CG2 THR A 58 -8.177 14.790 7.720 1.00 41.15 C ATOM 0 H THR A 58 -7.276 12.822 4.099 1.00 54.01 H new ATOM 0 HA THR A 58 -8.357 15.437 5.037 1.00 24.42 H new ATOM 0 HB THR A 58 -7.532 13.033 6.692 1.00 51.32 H new ATOM 0 HG1 THR A 58 -9.854 12.918 7.194 1.00 10.31 H new ATOM 0 HG21 THR A 58 -8.516 14.256 8.608 1.00 41.15 H new ATOM 0 HG22 THR A 58 -7.154 15.133 7.872 1.00 41.15 H new ATOM 0 HG23 THR A 58 -8.825 15.648 7.543 1.00 41.15 H new ATOM 917 N VAL A 59 -5.885 16.039 4.594 1.00 71.12 N ATOM 918 CA VAL A 59 -4.473 16.455 4.499 1.00 32.14 C ATOM 919 C VAL A 59 -4.143 17.354 5.696 1.00 52.43 C ATOM 920 O VAL A 59 -4.877 18.306 5.987 1.00 23.33 O ATOM 921 CB VAL A 59 -4.135 17.181 3.143 1.00 55.44 C ATOM 922 CG1 VAL A 59 -2.657 17.643 3.097 1.00 24.52 C ATOM 923 CG2 VAL A 59 -4.434 16.253 1.954 1.00 12.34 C ATOM 0 H VAL A 59 -6.536 16.667 4.123 1.00 71.12 H new ATOM 0 HA VAL A 59 -3.855 15.558 4.518 1.00 32.14 H new ATOM 0 HB VAL A 59 -4.765 18.068 3.076 1.00 55.44 H new ATOM 0 HG11 VAL A 59 -2.460 18.140 2.147 1.00 24.52 H new ATOM 0 HG12 VAL A 59 -2.467 18.337 3.916 1.00 24.52 H new ATOM 0 HG13 VAL A 59 -2.002 16.777 3.196 1.00 24.52 H new ATOM 0 HG21 VAL A 59 -4.196 16.767 1.023 1.00 12.34 H new ATOM 0 HG22 VAL A 59 -3.828 15.351 2.036 1.00 12.34 H new ATOM 0 HG23 VAL A 59 -5.490 15.983 1.960 1.00 12.34 H new ATOM 933 N HIS A 60 -3.049 17.018 6.386 1.00 44.43 N ATOM 934 CA HIS A 60 -2.624 17.667 7.625 1.00 23.14 C ATOM 935 C HIS A 60 -1.630 18.795 7.318 1.00 22.24 C ATOM 936 O HIS A 60 -0.660 18.586 6.583 1.00 65.31 O ATOM 937 CB HIS A 60 -1.996 16.597 8.549 1.00 35.42 C ATOM 938 CG HIS A 60 -2.975 15.507 8.921 1.00 1.12 C ATOM 939 ND1 HIS A 60 -3.893 15.437 9.918 1.00 34.35 N flip ATOM 940 CD2 HIS A 60 -3.152 14.359 8.171 1.00 71.25 C flip ATOM 941 CE1 HIS A 60 -4.593 14.272 9.747 1.00 12.14 C flip ATOM 942 NE2 HIS A 60 -4.130 13.646 8.692 1.00 43.24 N flip ATOM 0 H HIS A 60 -2.422 16.270 6.090 1.00 44.43 H new ATOM 0 HA HIS A 60 -3.479 18.116 8.130 1.00 23.14 H new ATOM 0 HB2 HIS A 60 -1.134 16.152 8.051 1.00 35.42 H new ATOM 0 HB3 HIS A 60 -1.628 17.076 9.456 1.00 35.42 H new ATOM 0 HD1 HIS A 60 -4.035 16.125 10.658 1.00 34.35 H new ATOM 0 HD2 HIS A 60 -2.579 14.089 7.296 1.00 71.25 H new ATOM 0 HE1 HIS A 60 -5.397 13.925 10.379 1.00 12.14 H new ATOM 951 N GLU A 61 -1.885 19.978 7.908 1.00 24.25 N ATOM 952 CA GLU A 61 -1.033 21.175 7.747 1.00 11.01 C ATOM 953 C GLU A 61 0.350 20.966 8.390 1.00 4.12 C ATOM 954 O GLU A 61 1.309 21.660 8.052 1.00 62.11 O ATOM 955 CB GLU A 61 -1.734 22.438 8.332 1.00 21.21 C ATOM 956 CG GLU A 61 -2.057 22.374 9.839 1.00 23.13 C ATOM 957 CD GLU A 61 -2.607 23.697 10.391 1.00 30.13 C ATOM 958 OE1 GLU A 61 -3.828 23.940 10.291 1.00 21.52 O ATOM 959 OE2 GLU A 61 -1.813 24.510 10.916 1.00 1.13 O ATOM 0 H GLU A 61 -2.691 20.133 8.513 1.00 24.25 H new ATOM 0 HA GLU A 61 -0.882 21.335 6.679 1.00 11.01 H new ATOM 0 HB2 GLU A 61 -1.097 23.304 8.150 1.00 21.21 H new ATOM 0 HB3 GLU A 61 -2.662 22.604 7.785 1.00 21.21 H new ATOM 0 HG2 GLU A 61 -2.785 21.582 10.016 1.00 23.13 H new ATOM 0 HG3 GLU A 61 -1.154 22.105 10.387 1.00 23.13 H new ATOM 966 N THR A 62 0.442 19.997 9.319 1.00 20.43 N ATOM 967 CA THR A 62 1.691 19.623 9.984 1.00 22.14 C ATOM 968 C THR A 62 1.937 18.096 9.809 1.00 31.43 C ATOM 969 O THR A 62 1.295 17.288 10.487 1.00 63.32 O ATOM 970 CB THR A 62 1.645 20.023 11.502 1.00 23.14 C ATOM 971 OG1 THR A 62 0.477 19.460 12.126 1.00 43.33 O ATOM 972 CG2 THR A 62 1.629 21.550 11.714 1.00 33.34 C ATOM 0 H THR A 62 -0.361 19.449 9.628 1.00 20.43 H new ATOM 0 HA THR A 62 2.521 20.162 9.526 1.00 22.14 H new ATOM 0 HB THR A 62 2.554 19.628 11.955 1.00 23.14 H new ATOM 0 HG1 THR A 62 0.349 18.541 11.812 1.00 43.33 H new ATOM 0 HG21 THR A 62 1.597 21.769 12.781 1.00 33.34 H new ATOM 0 HG22 THR A 62 2.529 21.987 11.281 1.00 33.34 H new ATOM 0 HG23 THR A 62 0.750 21.975 11.230 1.00 33.34 H new ATOM 980 N PRO A 63 2.813 17.673 8.837 1.00 11.42 N ATOM 981 CA PRO A 63 3.232 16.251 8.685 1.00 72.14 C ATOM 982 C PRO A 63 4.363 15.858 9.672 1.00 53.13 C ATOM 983 O PRO A 63 5.222 16.689 9.996 1.00 14.11 O ATOM 984 CB PRO A 63 3.719 16.208 7.217 1.00 1.25 C ATOM 985 CG PRO A 63 4.272 17.580 6.960 1.00 61.43 C ATOM 986 CD PRO A 63 3.424 18.537 7.779 1.00 40.30 C ATOM 0 HA PRO A 63 2.432 15.545 8.906 1.00 72.14 H new ATOM 0 HB2 PRO A 63 4.480 15.441 7.074 1.00 1.25 H new ATOM 0 HB3 PRO A 63 2.901 15.976 6.535 1.00 1.25 H new ATOM 0 HG2 PRO A 63 5.320 17.639 7.254 1.00 61.43 H new ATOM 0 HG3 PRO A 63 4.224 17.827 5.899 1.00 61.43 H new ATOM 0 HD2 PRO A 63 4.029 19.332 8.215 1.00 40.30 H new ATOM 0 HD3 PRO A 63 2.661 19.017 7.166 1.00 40.30 H new ATOM 994 N GLU A 64 4.362 14.597 10.167 1.00 55.23 N ATOM 995 CA GLU A 64 5.381 14.124 11.142 1.00 43.20 C ATOM 996 C GLU A 64 6.002 12.773 10.745 1.00 63.25 C ATOM 997 O GLU A 64 5.489 12.071 9.865 1.00 73.41 O ATOM 998 CB GLU A 64 4.762 14.060 12.565 1.00 33.22 C ATOM 999 CG GLU A 64 3.549 13.120 12.716 1.00 3.11 C ATOM 1000 CD GLU A 64 3.022 13.080 14.156 1.00 10.10 C ATOM 1001 OE1 GLU A 64 2.225 13.970 14.532 1.00 33.43 O ATOM 1002 OE2 GLU A 64 3.419 12.176 14.929 1.00 71.24 O ATOM 0 H GLU A 64 3.672 13.891 9.911 1.00 55.23 H new ATOM 0 HA GLU A 64 6.198 14.846 11.139 1.00 43.20 H new ATOM 0 HB2 GLU A 64 5.535 13.744 13.265 1.00 33.22 H new ATOM 0 HB3 GLU A 64 4.460 15.066 12.857 1.00 33.22 H new ATOM 0 HG2 GLU A 64 2.752 13.448 12.048 1.00 3.11 H new ATOM 0 HG3 GLU A 64 3.831 12.114 12.406 1.00 3.11 H new ATOM 1009 N SER A 65 7.121 12.435 11.426 1.00 55.52 N ATOM 1010 CA SER A 65 7.963 11.265 11.119 1.00 23.32 C ATOM 1011 C SER A 65 7.297 9.928 11.537 1.00 51.14 C ATOM 1012 O SER A 65 7.031 9.696 12.722 1.00 34.45 O ATOM 1013 CB SER A 65 9.339 11.437 11.814 1.00 65.10 C ATOM 1014 OG SER A 65 9.207 11.702 13.208 1.00 23.14 O ATOM 0 H SER A 65 7.466 12.979 12.217 1.00 55.52 H new ATOM 0 HA SER A 65 8.096 11.215 10.038 1.00 23.32 H new ATOM 0 HB2 SER A 65 9.932 10.533 11.672 1.00 65.10 H new ATOM 0 HB3 SER A 65 9.884 12.253 11.340 1.00 65.10 H new ATOM 0 HG SER A 65 8.502 11.134 13.584 1.00 23.14 H new ATOM 1020 N VAL A 66 7.039 9.063 10.542 1.00 71.42 N ATOM 1021 CA VAL A 66 6.459 7.716 10.711 1.00 22.43 C ATOM 1022 C VAL A 66 7.414 6.708 10.039 1.00 5.11 C ATOM 1023 O VAL A 66 7.623 6.776 8.827 1.00 41.32 O ATOM 1024 CB VAL A 66 5.021 7.614 10.056 1.00 32.32 C ATOM 1025 CG1 VAL A 66 4.368 6.241 10.339 1.00 5.25 C ATOM 1026 CG2 VAL A 66 4.112 8.775 10.532 1.00 34.04 C ATOM 0 H VAL A 66 7.234 9.287 9.566 1.00 71.42 H new ATOM 0 HA VAL A 66 6.345 7.501 11.774 1.00 22.43 H new ATOM 0 HB VAL A 66 5.141 7.703 8.976 1.00 32.32 H new ATOM 0 HG11 VAL A 66 3.382 6.204 9.875 1.00 5.25 H new ATOM 0 HG12 VAL A 66 4.993 5.449 9.926 1.00 5.25 H new ATOM 0 HG13 VAL A 66 4.268 6.100 11.415 1.00 5.25 H new ATOM 0 HG21 VAL A 66 3.130 8.682 10.068 1.00 34.04 H new ATOM 0 HG22 VAL A 66 4.006 8.733 11.616 1.00 34.04 H new ATOM 0 HG23 VAL A 66 4.559 9.727 10.247 1.00 34.04 H new ATOM 1036 N ASP A 67 7.989 5.788 10.824 1.00 60.23 N ATOM 1037 CA ASP A 67 9.058 4.875 10.353 1.00 41.43 C ATOM 1038 C ASP A 67 8.439 3.643 9.670 1.00 4.34 C ATOM 1039 O ASP A 67 7.794 2.837 10.336 1.00 64.43 O ATOM 1040 CB ASP A 67 9.926 4.462 11.566 1.00 60.10 C ATOM 1041 CG ASP A 67 11.156 3.612 11.218 1.00 74.42 C ATOM 1042 OD1 ASP A 67 12.002 4.079 10.415 1.00 42.24 O ATOM 1043 OD2 ASP A 67 11.308 2.501 11.782 1.00 11.44 O ATOM 0 H ASP A 67 7.733 5.650 11.802 1.00 60.23 H new ATOM 0 HA ASP A 67 9.686 5.379 9.619 1.00 41.43 H new ATOM 0 HB2 ASP A 67 10.259 5.363 12.081 1.00 60.10 H new ATOM 0 HB3 ASP A 67 9.304 3.906 12.267 1.00 60.10 H new ATOM 1048 N LEU A 68 8.604 3.529 8.337 1.00 24.34 N ATOM 1049 CA LEU A 68 8.035 2.425 7.527 1.00 34.33 C ATOM 1050 C LEU A 68 9.164 1.694 6.773 1.00 61.32 C ATOM 1051 O LEU A 68 10.128 2.338 6.334 1.00 63.34 O ATOM 1052 CB LEU A 68 6.986 2.975 6.518 1.00 10.04 C ATOM 1053 CG LEU A 68 5.874 3.909 7.102 1.00 21.05 C ATOM 1054 CD1 LEU A 68 4.946 4.420 5.991 1.00 2.25 C ATOM 1055 CD2 LEU A 68 5.055 3.218 8.213 1.00 61.21 C ATOM 0 H LEU A 68 9.138 4.202 7.786 1.00 24.34 H new ATOM 0 HA LEU A 68 7.537 1.721 8.194 1.00 34.33 H new ATOM 0 HB2 LEU A 68 7.517 3.523 5.740 1.00 10.04 H new ATOM 0 HB3 LEU A 68 6.500 2.127 6.036 1.00 10.04 H new ATOM 0 HG LEU A 68 6.382 4.761 7.553 1.00 21.05 H new ATOM 0 HD11 LEU A 68 4.182 5.067 6.423 1.00 2.25 H new ATOM 0 HD12 LEU A 68 5.528 4.983 5.261 1.00 2.25 H new ATOM 0 HD13 LEU A 68 4.468 3.573 5.498 1.00 2.25 H new ATOM 0 HD21 LEU A 68 4.296 3.906 8.587 1.00 61.21 H new ATOM 0 HD22 LEU A 68 4.571 2.329 7.809 1.00 61.21 H new ATOM 0 HD23 LEU A 68 5.718 2.931 9.029 1.00 61.21 H new ATOM 1067 N GLU A 69 9.042 0.355 6.634 1.00 31.32 N ATOM 1068 CA GLU A 69 10.043 -0.478 5.929 1.00 62.02 C ATOM 1069 C GLU A 69 10.068 -0.162 4.419 1.00 14.12 C ATOM 1070 O GLU A 69 9.028 0.134 3.810 1.00 42.34 O ATOM 1071 CB GLU A 69 9.778 -1.993 6.177 1.00 42.22 C ATOM 1072 CG GLU A 69 8.437 -2.535 5.622 1.00 11.25 C ATOM 1073 CD GLU A 69 8.126 -3.987 6.030 1.00 43.10 C ATOM 1074 OE1 GLU A 69 8.341 -4.335 7.203 1.00 5.11 O ATOM 1075 OE2 GLU A 69 7.635 -4.783 5.192 1.00 42.12 O ATOM 0 H GLU A 69 8.253 -0.176 7.004 1.00 31.32 H new ATOM 0 HA GLU A 69 11.025 -0.235 6.335 1.00 62.02 H new ATOM 0 HB2 GLU A 69 10.593 -2.564 5.732 1.00 42.22 H new ATOM 0 HB3 GLU A 69 9.808 -2.178 7.251 1.00 42.22 H new ATOM 0 HG2 GLU A 69 7.627 -1.891 5.966 1.00 11.25 H new ATOM 0 HG3 GLU A 69 8.454 -2.471 4.534 1.00 11.25 H new ATOM 1082 N THR A 70 11.272 -0.198 3.838 1.00 72.33 N ATOM 1083 CA THR A 70 11.504 0.115 2.417 1.00 34.43 C ATOM 1084 C THR A 70 12.198 -1.073 1.714 1.00 53.25 C ATOM 1085 O THR A 70 12.359 -2.141 2.304 1.00 51.43 O ATOM 1086 CB THR A 70 12.352 1.431 2.310 1.00 54.14 C ATOM 1087 OG1 THR A 70 12.530 1.824 0.938 1.00 34.30 O ATOM 1088 CG2 THR A 70 13.726 1.294 3.008 1.00 4.14 C ATOM 0 H THR A 70 12.123 -0.447 4.342 1.00 72.33 H new ATOM 0 HA THR A 70 10.552 0.278 1.912 1.00 34.43 H new ATOM 0 HB THR A 70 11.791 2.209 2.827 1.00 54.14 H new ATOM 0 HG1 THR A 70 13.486 1.929 0.749 1.00 34.30 H new ATOM 0 HG21 THR A 70 14.279 2.228 2.909 1.00 4.14 H new ATOM 0 HG22 THR A 70 13.577 1.071 4.064 1.00 4.14 H new ATOM 0 HG23 THR A 70 14.291 0.487 2.543 1.00 4.14 H new ATOM 1096 N SER A 71 12.592 -0.881 0.445 1.00 43.52 N ATOM 1097 CA SER A 71 13.257 -1.916 -0.368 1.00 11.20 C ATOM 1098 C SER A 71 14.794 -1.755 -0.347 1.00 60.30 C ATOM 1099 O SER A 71 15.496 -2.330 -1.184 1.00 72.54 O ATOM 1100 CB SER A 71 12.721 -1.832 -1.807 1.00 2.32 C ATOM 1101 OG SER A 71 11.301 -1.794 -1.829 1.00 75.34 O ATOM 0 H SER A 71 12.458 0.001 -0.050 1.00 43.52 H new ATOM 0 HA SER A 71 13.035 -2.896 0.054 1.00 11.20 H new ATOM 0 HB2 SER A 71 13.118 -0.941 -2.293 1.00 2.32 H new ATOM 0 HB3 SER A 71 13.073 -2.691 -2.379 1.00 2.32 H new ATOM 0 HG SER A 71 10.946 -2.503 -1.253 1.00 75.34 H new ATOM 1107 N ASP A 72 15.311 -1.026 0.660 1.00 42.53 N ATOM 1108 CA ASP A 72 16.747 -0.677 0.772 1.00 50.24 C ATOM 1109 C ASP A 72 17.431 -1.600 1.782 1.00 31.53 C ATOM 1110 O ASP A 72 18.493 -1.246 2.317 1.00 55.13 O ATOM 1111 CB ASP A 72 16.917 0.814 1.191 1.00 25.04 C ATOM 1112 CG ASP A 72 16.546 1.787 0.070 1.00 21.23 C ATOM 1113 OD1 ASP A 72 17.427 2.132 -0.752 1.00 71.41 O ATOM 1114 OD2 ASP A 72 15.365 2.193 -0.020 1.00 45.35 O ATOM 0 H ASP A 72 14.744 -0.659 1.425 1.00 42.53 H new ATOM 0 HA ASP A 72 17.218 -0.812 -0.202 1.00 50.24 H new ATOM 0 HB2 ASP A 72 16.294 1.016 2.063 1.00 25.04 H new ATOM 0 HB3 ASP A 72 17.951 0.988 1.490 1.00 25.04 H new ATOM 1119 N ASP A 73 16.819 -2.797 2.021 1.00 60.34 N ATOM 1120 CA ASP A 73 17.298 -3.803 3.010 1.00 73.34 C ATOM 1121 C ASP A 73 17.290 -3.201 4.434 1.00 52.31 C ATOM 1122 O ASP A 73 17.979 -3.678 5.341 1.00 2.22 O ATOM 1123 CB ASP A 73 18.696 -4.358 2.614 1.00 45.12 C ATOM 1124 CG ASP A 73 18.756 -4.797 1.144 1.00 25.12 C ATOM 1125 OD1 ASP A 73 18.231 -5.876 0.809 1.00 20.35 O ATOM 1126 OD2 ASP A 73 19.306 -4.047 0.307 1.00 21.13 O ATOM 0 H ASP A 73 15.975 -3.090 1.529 1.00 60.34 H new ATOM 0 HA ASP A 73 16.613 -4.651 3.007 1.00 73.34 H new ATOM 0 HB2 ASP A 73 19.452 -3.593 2.793 1.00 45.12 H new ATOM 0 HB3 ASP A 73 18.942 -5.205 3.254 1.00 45.12 H new ATOM 1131 N ARG A 74 16.426 -2.180 4.611 1.00 31.22 N ATOM 1132 CA ARG A 74 16.466 -1.242 5.742 1.00 42.22 C ATOM 1133 C ARG A 74 15.047 -0.626 5.935 1.00 64.12 C ATOM 1134 O ARG A 74 14.072 -1.091 5.329 1.00 30.41 O ATOM 1135 CB ARG A 74 17.575 -0.172 5.462 1.00 14.11 C ATOM 1136 CG ARG A 74 18.149 0.547 6.707 1.00 22.40 C ATOM 1137 CD ARG A 74 19.154 1.659 6.359 1.00 43.34 C ATOM 1138 NE ARG A 74 19.434 2.538 7.514 1.00 62.44 N ATOM 1139 CZ ARG A 74 19.260 3.871 7.540 1.00 32.02 C ATOM 1140 NH1 ARG A 74 18.820 4.527 6.460 1.00 25.31 N ATOM 1141 NH2 ARG A 74 19.514 4.543 8.659 1.00 54.23 N ATOM 0 H ARG A 74 15.668 -1.984 3.957 1.00 31.22 H new ATOM 0 HA ARG A 74 16.726 -1.741 6.676 1.00 42.22 H new ATOM 0 HB2 ARG A 74 18.397 -0.658 4.935 1.00 14.11 H new ATOM 0 HB3 ARG A 74 17.165 0.580 4.788 1.00 14.11 H new ATOM 0 HG2 ARG A 74 17.328 0.976 7.281 1.00 22.40 H new ATOM 0 HG3 ARG A 74 18.637 -0.187 7.349 1.00 22.40 H new ATOM 0 HD2 ARG A 74 20.085 1.210 6.012 1.00 43.34 H new ATOM 0 HD3 ARG A 74 18.762 2.257 5.536 1.00 43.34 H new ATOM 0 HE ARG A 74 19.789 2.096 8.362 1.00 62.44 H new ATOM 0 HH11 ARG A 74 18.612 4.016 5.602 1.00 25.31 H new ATOM 0 HH12 ARG A 74 18.693 5.538 6.494 1.00 25.31 H new ATOM 0 HH21 ARG A 74 19.838 4.047 9.489 1.00 54.23 H new ATOM 0 HH22 ARG A 74 19.385 5.554 8.687 1.00 54.23 H new ATOM 1155 N THR A 75 14.953 0.437 6.749 1.00 22.43 N ATOM 1156 CA THR A 75 13.694 1.060 7.177 1.00 13.02 C ATOM 1157 C THR A 75 13.939 2.585 7.175 1.00 2.44 C ATOM 1158 O THR A 75 15.062 3.020 7.468 1.00 61.34 O ATOM 1159 CB THR A 75 13.284 0.542 8.598 1.00 54.02 C ATOM 1160 OG1 THR A 75 13.363 -0.895 8.621 1.00 63.03 O ATOM 1161 CG2 THR A 75 11.859 0.954 8.992 1.00 23.40 C ATOM 0 H THR A 75 15.775 0.899 7.138 1.00 22.43 H new ATOM 0 HA THR A 75 12.872 0.807 6.508 1.00 13.02 H new ATOM 0 HB THR A 75 13.973 0.992 9.312 1.00 54.02 H new ATOM 0 HG1 THR A 75 12.537 -1.262 9.000 1.00 63.03 H new ATOM 0 HG21 THR A 75 11.630 0.568 9.985 1.00 23.40 H new ATOM 0 HG22 THR A 75 11.784 2.041 8.999 1.00 23.40 H new ATOM 0 HG23 THR A 75 11.150 0.546 8.272 1.00 23.40 H new ATOM 1169 N VAL A 76 12.918 3.393 6.838 1.00 33.41 N ATOM 1170 CA VAL A 76 13.103 4.848 6.566 1.00 1.23 C ATOM 1171 C VAL A 76 11.910 5.687 7.045 1.00 75.03 C ATOM 1172 O VAL A 76 10.816 5.176 7.282 1.00 54.44 O ATOM 1173 CB VAL A 76 13.378 5.183 5.044 1.00 75.23 C ATOM 1174 CG1 VAL A 76 14.762 4.684 4.572 1.00 13.14 C ATOM 1175 CG2 VAL A 76 12.256 4.649 4.137 1.00 72.13 C ATOM 0 H VAL A 76 11.954 3.073 6.745 1.00 33.41 H new ATOM 0 HA VAL A 76 13.992 5.114 7.137 1.00 1.23 H new ATOM 0 HB VAL A 76 13.387 6.270 4.962 1.00 75.23 H new ATOM 0 HG11 VAL A 76 14.902 4.939 3.521 1.00 13.14 H new ATOM 0 HG12 VAL A 76 15.542 5.159 5.167 1.00 13.14 H new ATOM 0 HG13 VAL A 76 14.820 3.602 4.694 1.00 13.14 H new ATOM 0 HG21 VAL A 76 12.478 4.897 3.099 1.00 72.13 H new ATOM 0 HG22 VAL A 76 12.186 3.567 4.244 1.00 72.13 H new ATOM 0 HG23 VAL A 76 11.308 5.104 4.424 1.00 72.13 H new ATOM 1185 N ARG A 77 12.165 7.001 7.144 1.00 5.14 N ATOM 1186 CA ARG A 77 11.197 8.011 7.591 1.00 42.12 C ATOM 1187 C ARG A 77 10.240 8.370 6.439 1.00 73.43 C ATOM 1188 O ARG A 77 10.677 8.657 5.320 1.00 52.11 O ATOM 1189 CB ARG A 77 12.013 9.253 8.074 1.00 22.42 C ATOM 1190 CG ARG A 77 11.263 10.425 8.768 1.00 12.41 C ATOM 1191 CD ARG A 77 10.440 11.323 7.815 1.00 4.01 C ATOM 1192 NE ARG A 77 11.110 11.528 6.512 1.00 35.42 N ATOM 1193 CZ ARG A 77 12.037 12.458 6.227 1.00 62.32 C ATOM 1194 NH1 ARG A 77 12.446 13.337 7.144 1.00 72.12 N ATOM 1195 NH2 ARG A 77 12.584 12.472 5.023 1.00 42.33 N ATOM 0 H ARG A 77 13.074 7.399 6.909 1.00 5.14 H new ATOM 0 HA ARG A 77 10.581 7.637 8.409 1.00 42.12 H new ATOM 0 HB2 ARG A 77 12.777 8.896 8.765 1.00 22.42 H new ATOM 0 HB3 ARG A 77 12.533 9.662 7.208 1.00 22.42 H new ATOM 0 HG2 ARG A 77 10.595 10.013 9.524 1.00 12.41 H new ATOM 0 HG3 ARG A 77 11.991 11.045 9.290 1.00 12.41 H new ATOM 0 HD2 ARG A 77 9.462 10.872 7.650 1.00 4.01 H new ATOM 0 HD3 ARG A 77 10.269 12.290 8.289 1.00 4.01 H new ATOM 0 HE ARG A 77 10.841 10.901 5.754 1.00 35.42 H new ATOM 0 HH11 ARG A 77 12.054 13.312 8.085 1.00 72.12 H new ATOM 0 HH12 ARG A 77 13.151 14.034 6.904 1.00 72.12 H new ATOM 0 HH21 ARG A 77 12.301 11.783 4.326 1.00 42.33 H new ATOM 0 HH22 ARG A 77 13.289 13.172 4.791 1.00 42.33 H new ATOM 1209 N TYR A 78 8.943 8.338 6.741 1.00 74.34 N ATOM 1210 CA TYR A 78 7.865 8.861 5.879 1.00 13.20 C ATOM 1211 C TYR A 78 7.145 9.994 6.627 1.00 40.12 C ATOM 1212 O TYR A 78 6.947 9.910 7.836 1.00 54.12 O ATOM 1213 CB TYR A 78 6.860 7.730 5.529 1.00 72.01 C ATOM 1214 CG TYR A 78 7.311 6.761 4.418 1.00 73.11 C ATOM 1215 CD1 TYR A 78 8.417 5.923 4.582 1.00 73.42 C ATOM 1216 CD2 TYR A 78 6.611 6.673 3.213 1.00 14.23 C ATOM 1217 CE1 TYR A 78 8.804 5.046 3.585 1.00 24.34 C ATOM 1218 CE2 TYR A 78 6.993 5.795 2.217 1.00 50.23 C ATOM 1219 CZ TYR A 78 8.089 4.982 2.408 1.00 22.32 C ATOM 1220 OH TYR A 78 8.468 4.101 1.414 1.00 52.42 O ATOM 0 H TYR A 78 8.596 7.939 7.613 1.00 74.34 H new ATOM 0 HA TYR A 78 8.289 9.241 4.949 1.00 13.20 H new ATOM 0 HB2 TYR A 78 6.661 7.153 6.432 1.00 72.01 H new ATOM 0 HB3 TYR A 78 5.917 8.186 5.228 1.00 72.01 H new ATOM 0 HD1 TYR A 78 8.979 5.961 5.503 1.00 73.42 H new ATOM 0 HD2 TYR A 78 5.750 7.306 3.056 1.00 14.23 H new ATOM 0 HE1 TYR A 78 9.666 4.411 3.728 1.00 24.34 H new ATOM 0 HE2 TYR A 78 6.435 5.746 1.293 1.00 50.23 H new ATOM 0 HH TYR A 78 7.856 4.184 0.653 1.00 52.42 H new ATOM 1230 N LEU A 79 6.760 11.054 5.910 1.00 42.11 N ATOM 1231 CA LEU A 79 5.966 12.156 6.485 1.00 32.32 C ATOM 1232 C LEU A 79 4.477 11.867 6.292 1.00 51.13 C ATOM 1233 O LEU A 79 4.044 11.553 5.172 1.00 21.11 O ATOM 1234 CB LEU A 79 6.358 13.524 5.865 1.00 21.43 C ATOM 1235 CG LEU A 79 7.759 14.080 6.277 1.00 15.02 C ATOM 1236 CD1 LEU A 79 8.015 15.468 5.651 1.00 44.32 C ATOM 1237 CD2 LEU A 79 7.910 14.134 7.815 1.00 52.32 C ATOM 0 H LEU A 79 6.985 11.177 4.923 1.00 42.11 H new ATOM 0 HA LEU A 79 6.179 12.220 7.552 1.00 32.32 H new ATOM 0 HB2 LEU A 79 6.330 13.431 4.779 1.00 21.43 H new ATOM 0 HB3 LEU A 79 5.601 14.258 6.142 1.00 21.43 H new ATOM 0 HG LEU A 79 8.512 13.393 5.890 1.00 15.02 H new ATOM 0 HD11 LEU A 79 8.997 15.829 5.956 1.00 44.32 H new ATOM 0 HD12 LEU A 79 7.978 15.389 4.564 1.00 44.32 H new ATOM 0 HD13 LEU A 79 7.250 16.167 5.990 1.00 44.32 H new ATOM 0 HD21 LEU A 79 8.895 14.525 8.070 1.00 52.32 H new ATOM 0 HD22 LEU A 79 7.142 14.784 8.233 1.00 52.32 H new ATOM 0 HD23 LEU A 79 7.800 13.131 8.227 1.00 52.32 H new ATOM 1249 N HIS A 80 3.706 11.950 7.395 1.00 72.14 N ATOM 1250 CA HIS A 80 2.260 11.735 7.367 1.00 34.12 C ATOM 1251 C HIS A 80 1.570 12.984 6.799 1.00 51.23 C ATOM 1252 O HIS A 80 1.339 13.968 7.515 1.00 33.51 O ATOM 1253 CB HIS A 80 1.756 11.410 8.798 1.00 33.22 C ATOM 1254 CG HIS A 80 0.273 11.184 8.899 1.00 24.22 C ATOM 1255 ND1 HIS A 80 -0.466 11.716 9.926 1.00 40.32 N ATOM 1256 CD2 HIS A 80 -0.547 10.473 8.086 1.00 41.43 C ATOM 1257 CE1 HIS A 80 -1.705 11.320 9.717 1.00 31.23 C ATOM 1258 NE2 HIS A 80 -1.799 10.566 8.615 1.00 63.44 N ATOM 0 H HIS A 80 4.073 12.167 8.321 1.00 72.14 H new ATOM 0 HA HIS A 80 2.018 10.889 6.723 1.00 34.12 H new ATOM 0 HB2 HIS A 80 2.272 10.520 9.158 1.00 33.22 H new ATOM 0 HB3 HIS A 80 2.032 12.229 9.462 1.00 33.22 H new ATOM 0 HD2 HIS A 80 -0.263 9.937 7.193 1.00 41.43 H new ATOM 0 HE1 HIS A 80 -2.540 11.572 10.354 1.00 31.23 H new ATOM 0 HE2 HIS A 80 -2.648 10.141 8.242 1.00 63.44 H new ATOM 1266 N VAL A 81 1.244 12.929 5.507 1.00 43.25 N ATOM 1267 CA VAL A 81 0.657 14.069 4.786 1.00 11.32 C ATOM 1268 C VAL A 81 -0.867 14.026 4.802 1.00 63.34 C ATOM 1269 O VAL A 81 -1.510 15.072 4.850 1.00 44.43 O ATOM 1270 CB VAL A 81 1.190 14.151 3.313 1.00 24.34 C ATOM 1271 CG1 VAL A 81 2.720 14.340 3.319 1.00 51.21 C ATOM 1272 CG2 VAL A 81 0.782 12.914 2.478 1.00 32.02 C ATOM 0 H VAL A 81 1.377 12.099 4.929 1.00 43.25 H new ATOM 0 HA VAL A 81 0.970 14.971 5.312 1.00 11.32 H new ATOM 0 HB VAL A 81 0.729 15.015 2.835 1.00 24.34 H new ATOM 0 HG11 VAL A 81 3.084 14.396 2.293 1.00 51.21 H new ATOM 0 HG12 VAL A 81 2.971 15.262 3.844 1.00 51.21 H new ATOM 0 HG13 VAL A 81 3.189 13.496 3.824 1.00 51.21 H new ATOM 0 HG21 VAL A 81 1.172 13.014 1.465 1.00 32.02 H new ATOM 0 HG22 VAL A 81 1.191 12.014 2.937 1.00 32.02 H new ATOM 0 HG23 VAL A 81 -0.305 12.842 2.442 1.00 32.02 H new ATOM 1282 N ALA A 82 -1.451 12.819 4.786 1.00 24.30 N ATOM 1283 CA ALA A 82 -2.911 12.666 4.663 1.00 70.13 C ATOM 1284 C ALA A 82 -3.416 11.413 5.374 1.00 12.33 C ATOM 1285 O ALA A 82 -2.641 10.525 5.712 1.00 22.25 O ATOM 1286 CB ALA A 82 -3.319 12.644 3.179 1.00 64.13 C ATOM 0 H ALA A 82 -0.940 11.939 4.856 1.00 24.30 H new ATOM 0 HA ALA A 82 -3.375 13.524 5.150 1.00 70.13 H new ATOM 0 HB1 ALA A 82 -4.400 12.530 3.101 1.00 64.13 H new ATOM 0 HB2 ALA A 82 -3.017 13.578 2.705 1.00 64.13 H new ATOM 0 HB3 ALA A 82 -2.829 11.808 2.679 1.00 64.13 H new ATOM 1292 N THR A 83 -4.730 11.384 5.616 1.00 63.23 N ATOM 1293 CA THR A 83 -5.451 10.199 6.078 1.00 60.22 C ATOM 1294 C THR A 83 -6.729 10.063 5.231 1.00 34.41 C ATOM 1295 O THR A 83 -7.482 11.028 5.066 1.00 5.45 O ATOM 1296 CB THR A 83 -5.816 10.293 7.595 1.00 44.44 C ATOM 1297 OG1 THR A 83 -4.626 10.523 8.365 1.00 13.23 O ATOM 1298 CG2 THR A 83 -6.497 9.014 8.098 1.00 42.01 C ATOM 0 H THR A 83 -5.331 12.199 5.493 1.00 63.23 H new ATOM 0 HA THR A 83 -4.812 9.323 5.961 1.00 60.22 H new ATOM 0 HB THR A 83 -6.514 11.122 7.715 1.00 44.44 H new ATOM 0 HG1 THR A 83 -4.479 11.487 8.461 1.00 13.23 H new ATOM 0 HG21 THR A 83 -6.734 9.120 9.157 1.00 42.01 H new ATOM 0 HG22 THR A 83 -7.415 8.845 7.535 1.00 42.01 H new ATOM 0 HG23 THR A 83 -5.826 8.166 7.960 1.00 42.01 H new ATOM 1306 N LEU A 84 -6.956 8.865 4.700 1.00 51.32 N ATOM 1307 CA LEU A 84 -8.042 8.589 3.756 1.00 51.34 C ATOM 1308 C LEU A 84 -9.193 7.928 4.535 1.00 23.23 C ATOM 1309 O LEU A 84 -9.109 6.750 4.873 1.00 22.10 O ATOM 1310 CB LEU A 84 -7.508 7.673 2.610 1.00 2.30 C ATOM 1311 CG LEU A 84 -6.150 8.111 1.951 1.00 62.44 C ATOM 1312 CD1 LEU A 84 -5.749 7.162 0.800 1.00 13.30 C ATOM 1313 CD2 LEU A 84 -6.184 9.580 1.474 1.00 63.03 C ATOM 0 H LEU A 84 -6.386 8.047 4.914 1.00 51.32 H new ATOM 0 HA LEU A 84 -8.413 9.505 3.295 1.00 51.34 H new ATOM 0 HB2 LEU A 84 -7.388 6.664 3.005 1.00 2.30 H new ATOM 0 HB3 LEU A 84 -8.267 7.622 1.830 1.00 2.30 H new ATOM 0 HG LEU A 84 -5.386 8.040 2.725 1.00 62.44 H new ATOM 0 HD11 LEU A 84 -4.806 7.494 0.367 1.00 13.30 H new ATOM 0 HD12 LEU A 84 -5.634 6.149 1.187 1.00 13.30 H new ATOM 0 HD13 LEU A 84 -6.524 7.172 0.033 1.00 13.30 H new ATOM 0 HD21 LEU A 84 -5.225 9.839 1.025 1.00 63.03 H new ATOM 0 HD22 LEU A 84 -6.976 9.704 0.735 1.00 63.03 H new ATOM 0 HD23 LEU A 84 -6.375 10.234 2.324 1.00 63.03 H new ATOM 1325 N SER A 85 -10.230 8.711 4.863 1.00 52.11 N ATOM 1326 CA SER A 85 -11.342 8.262 5.720 1.00 32.12 C ATOM 1327 C SER A 85 -12.525 7.745 4.873 1.00 42.03 C ATOM 1328 O SER A 85 -12.913 8.373 3.885 1.00 43.41 O ATOM 1329 CB SER A 85 -11.775 9.419 6.638 1.00 71.32 C ATOM 1330 OG SER A 85 -12.763 9.008 7.572 1.00 50.14 O ATOM 0 H SER A 85 -10.324 9.675 4.543 1.00 52.11 H new ATOM 0 HA SER A 85 -11.004 7.429 6.336 1.00 32.12 H new ATOM 0 HB2 SER A 85 -10.907 9.804 7.173 1.00 71.32 H new ATOM 0 HB3 SER A 85 -12.165 10.237 6.033 1.00 71.32 H new ATOM 0 HG SER A 85 -13.013 9.767 8.139 1.00 50.14 H new ATOM 1336 N PHE A 86 -13.100 6.614 5.302 1.00 32.02 N ATOM 1337 CA PHE A 86 -14.116 5.851 4.550 1.00 43.23 C ATOM 1338 C PHE A 86 -14.833 4.885 5.507 1.00 73.43 C ATOM 1339 O PHE A 86 -14.688 4.986 6.731 1.00 72.02 O ATOM 1340 CB PHE A 86 -13.457 5.071 3.359 1.00 74.31 C ATOM 1341 CG PHE A 86 -12.368 4.061 3.756 1.00 63.44 C ATOM 1342 CD1 PHE A 86 -11.060 4.474 3.984 1.00 22.51 C ATOM 1343 CD2 PHE A 86 -12.655 2.705 3.899 1.00 32.21 C ATOM 1344 CE1 PHE A 86 -10.082 3.574 4.345 1.00 41.42 C ATOM 1345 CE2 PHE A 86 -11.678 1.804 4.258 1.00 71.20 C ATOM 1346 CZ PHE A 86 -10.392 2.238 4.483 1.00 12.02 C ATOM 0 H PHE A 86 -12.870 6.191 6.201 1.00 32.02 H new ATOM 0 HA PHE A 86 -14.845 6.542 4.127 1.00 43.23 H new ATOM 0 HB2 PHE A 86 -14.240 4.541 2.816 1.00 74.31 H new ATOM 0 HB3 PHE A 86 -13.024 5.794 2.668 1.00 74.31 H new ATOM 0 HD1 PHE A 86 -10.807 5.518 3.876 1.00 22.51 H new ATOM 0 HD2 PHE A 86 -13.662 2.355 3.725 1.00 32.21 H new ATOM 0 HE1 PHE A 86 -9.072 3.915 4.520 1.00 41.42 H new ATOM 0 HE2 PHE A 86 -11.921 0.757 4.363 1.00 71.20 H new ATOM 0 HZ PHE A 86 -9.626 1.532 4.768 1.00 12.02 H new ATOM 1356 N ASP A 87 -15.641 3.977 4.941 1.00 32.31 N ATOM 1357 CA ASP A 87 -16.189 2.823 5.681 1.00 62.11 C ATOM 1358 C ASP A 87 -15.830 1.534 4.930 1.00 32.05 C ATOM 1359 O ASP A 87 -15.682 1.540 3.702 1.00 72.51 O ATOM 1360 CB ASP A 87 -17.733 2.936 5.901 1.00 13.02 C ATOM 1361 CG ASP A 87 -18.600 2.365 4.752 1.00 13.21 C ATOM 1362 OD1 ASP A 87 -18.751 3.042 3.705 1.00 1.44 O ATOM 1363 OD2 ASP A 87 -19.121 1.228 4.890 1.00 33.23 O ATOM 0 H ASP A 87 -15.933 4.018 3.965 1.00 32.31 H new ATOM 0 HA ASP A 87 -15.742 2.807 6.675 1.00 62.11 H new ATOM 0 HB2 ASP A 87 -17.992 2.418 6.824 1.00 13.02 H new ATOM 0 HB3 ASP A 87 -17.989 3.986 6.042 1.00 13.02 H new ATOM 1368 N LEU A 88 -15.699 0.446 5.680 1.00 72.03 N ATOM 1369 CA LEU A 88 -15.431 -0.898 5.144 1.00 2.34 C ATOM 1370 C LEU A 88 -16.052 -1.890 6.121 1.00 52.53 C ATOM 1371 O LEU A 88 -15.798 -1.773 7.316 1.00 30.40 O ATOM 1372 CB LEU A 88 -13.904 -1.159 4.984 1.00 52.41 C ATOM 1373 CG LEU A 88 -13.500 -2.536 4.354 1.00 61.14 C ATOM 1374 CD1 LEU A 88 -13.959 -2.646 2.879 1.00 3.22 C ATOM 1375 CD2 LEU A 88 -11.983 -2.792 4.492 1.00 33.12 C ATOM 0 H LEU A 88 -15.776 0.466 6.697 1.00 72.03 H new ATOM 0 HA LEU A 88 -15.862 -1.003 4.149 1.00 2.34 H new ATOM 0 HB2 LEU A 88 -13.483 -0.364 4.369 1.00 52.41 H new ATOM 0 HB3 LEU A 88 -13.438 -1.082 5.967 1.00 52.41 H new ATOM 0 HG LEU A 88 -14.019 -3.314 4.913 1.00 61.14 H new ATOM 0 HD11 LEU A 88 -13.661 -3.614 2.476 1.00 3.22 H new ATOM 0 HD12 LEU A 88 -15.044 -2.550 2.827 1.00 3.22 H new ATOM 0 HD13 LEU A 88 -13.496 -1.852 2.294 1.00 3.22 H new ATOM 0 HD21 LEU A 88 -11.734 -3.755 4.046 1.00 33.12 H new ATOM 0 HD22 LEU A 88 -11.433 -2.002 3.981 1.00 33.12 H new ATOM 0 HD23 LEU A 88 -11.710 -2.800 5.547 1.00 33.12 H new ATOM 1387 N ASP A 89 -16.902 -2.808 5.613 1.00 14.23 N ATOM 1388 CA ASP A 89 -17.629 -3.814 6.439 1.00 75.44 C ATOM 1389 C ASP A 89 -18.684 -3.121 7.354 1.00 33.54 C ATOM 1390 O ASP A 89 -19.189 -3.703 8.327 1.00 23.10 O ATOM 1391 CB ASP A 89 -16.617 -4.676 7.255 1.00 44.25 C ATOM 1392 CG ASP A 89 -17.227 -5.953 7.850 1.00 45.02 C ATOM 1393 OD1 ASP A 89 -17.373 -6.958 7.112 1.00 5.15 O ATOM 1394 OD2 ASP A 89 -17.554 -5.973 9.059 1.00 22.04 O ATOM 0 H ASP A 89 -17.108 -2.878 4.617 1.00 14.23 H new ATOM 0 HA ASP A 89 -18.175 -4.487 5.778 1.00 75.44 H new ATOM 0 HB2 ASP A 89 -15.784 -4.950 6.608 1.00 44.25 H new ATOM 0 HB3 ASP A 89 -16.207 -4.070 8.063 1.00 44.25 H new ATOM 1399 N GLY A 90 -19.068 -1.884 6.979 1.00 1.14 N ATOM 1400 CA GLY A 90 -19.988 -1.066 7.779 1.00 50.31 C ATOM 1401 C GLY A 90 -19.380 -0.488 9.063 1.00 72.44 C ATOM 1402 O GLY A 90 -20.117 -0.112 9.987 1.00 63.21 O ATOM 0 H GLY A 90 -18.750 -1.432 6.122 1.00 1.14 H new ATOM 0 HA2 GLY A 90 -20.351 -0.243 7.163 1.00 50.31 H new ATOM 0 HA3 GLY A 90 -20.854 -1.672 8.044 1.00 50.31 H new ATOM 1406 N GLU A 91 -18.034 -0.404 9.121 1.00 14.33 N ATOM 1407 CA GLU A 91 -17.306 0.261 10.224 1.00 10.11 C ATOM 1408 C GLU A 91 -16.423 1.364 9.619 1.00 32.20 C ATOM 1409 O GLU A 91 -15.743 1.131 8.613 1.00 11.24 O ATOM 1410 CB GLU A 91 -16.481 -0.758 11.083 1.00 34.15 C ATOM 1411 CG GLU A 91 -15.449 -1.604 10.317 1.00 74.30 C ATOM 1412 CD GLU A 91 -14.689 -2.615 11.196 1.00 54.25 C ATOM 1413 OE1 GLU A 91 -15.272 -3.665 11.546 1.00 13.00 O ATOM 1414 OE2 GLU A 91 -13.511 -2.366 11.542 1.00 60.33 O ATOM 0 H GLU A 91 -17.421 -0.795 8.405 1.00 14.33 H new ATOM 0 HA GLU A 91 -18.019 0.708 10.916 1.00 10.11 H new ATOM 0 HB2 GLU A 91 -15.960 -0.206 11.865 1.00 34.15 H new ATOM 0 HB3 GLU A 91 -17.178 -1.433 11.579 1.00 34.15 H new ATOM 0 HG2 GLU A 91 -15.958 -2.144 9.518 1.00 74.30 H new ATOM 0 HG3 GLU A 91 -14.729 -0.937 9.843 1.00 74.30 H new ATOM 1421 N SER A 92 -16.474 2.570 10.214 1.00 61.11 N ATOM 1422 CA SER A 92 -15.759 3.756 9.711 1.00 22.50 C ATOM 1423 C SER A 92 -14.241 3.564 9.869 1.00 32.14 C ATOM 1424 O SER A 92 -13.701 3.635 10.977 1.00 5.21 O ATOM 1425 CB SER A 92 -16.263 5.027 10.445 1.00 73.30 C ATOM 1426 OG SER A 92 -15.704 6.219 9.897 1.00 15.14 O ATOM 0 H SER A 92 -17.014 2.749 11.060 1.00 61.11 H new ATOM 0 HA SER A 92 -15.964 3.884 8.648 1.00 22.50 H new ATOM 0 HB2 SER A 92 -17.350 5.075 10.382 1.00 73.30 H new ATOM 0 HB3 SER A 92 -16.008 4.960 11.503 1.00 73.30 H new ATOM 0 HG SER A 92 -16.048 6.996 10.385 1.00 15.14 H new ATOM 1432 N ARG A 93 -13.579 3.254 8.743 1.00 35.03 N ATOM 1433 CA ARG A 93 -12.135 2.948 8.684 1.00 33.15 C ATOM 1434 C ARG A 93 -11.363 4.093 8.017 1.00 53.23 C ATOM 1435 O ARG A 93 -11.894 4.770 7.141 1.00 60.33 O ATOM 1436 CB ARG A 93 -11.907 1.639 7.881 1.00 54.33 C ATOM 1437 CG ARG A 93 -12.532 0.353 8.467 1.00 2.01 C ATOM 1438 CD ARG A 93 -12.029 0.013 9.886 1.00 21.24 C ATOM 1439 NE ARG A 93 -12.749 0.755 10.932 1.00 51.43 N ATOM 1440 CZ ARG A 93 -12.461 0.734 12.241 1.00 11.41 C ATOM 1441 NH1 ARG A 93 -11.454 -0.008 12.707 1.00 70.24 N ATOM 1442 NH2 ARG A 93 -13.186 1.451 13.087 1.00 71.14 N ATOM 0 H ARG A 93 -14.036 3.207 7.832 1.00 35.03 H new ATOM 0 HA ARG A 93 -11.769 2.824 9.703 1.00 33.15 H new ATOM 0 HB2 ARG A 93 -12.302 1.783 6.875 1.00 54.33 H new ATOM 0 HB3 ARG A 93 -10.833 1.482 7.782 1.00 54.33 H new ATOM 0 HG2 ARG A 93 -13.616 0.465 8.492 1.00 2.01 H new ATOM 0 HG3 ARG A 93 -12.313 -0.483 7.803 1.00 2.01 H new ATOM 0 HD2 ARG A 93 -12.142 -1.057 10.061 1.00 21.24 H new ATOM 0 HD3 ARG A 93 -10.964 0.237 9.954 1.00 21.24 H new ATOM 0 HE ARG A 93 -13.534 1.335 10.636 1.00 51.43 H new ATOM 0 HH11 ARG A 93 -10.893 -0.568 12.065 1.00 70.24 H new ATOM 0 HH12 ARG A 93 -11.245 -0.015 13.705 1.00 70.24 H new ATOM 0 HH21 ARG A 93 -13.961 2.017 12.742 1.00 71.14 H new ATOM 0 HH22 ARG A 93 -12.969 1.437 14.084 1.00 71.14 H new ATOM 1456 N ASP A 94 -10.105 4.302 8.436 1.00 41.43 N ATOM 1457 CA ASP A 94 -9.221 5.304 7.814 1.00 13.52 C ATOM 1458 C ASP A 94 -7.794 4.762 7.655 1.00 4.32 C ATOM 1459 O ASP A 94 -7.229 4.174 8.582 1.00 33.14 O ATOM 1460 CB ASP A 94 -9.238 6.630 8.620 1.00 45.32 C ATOM 1461 CG ASP A 94 -8.754 6.491 10.075 1.00 51.33 C ATOM 1462 OD1 ASP A 94 -9.539 6.002 10.924 1.00 30.33 O ATOM 1463 OD2 ASP A 94 -7.607 6.878 10.382 1.00 73.31 O ATOM 0 H ASP A 94 -9.675 3.789 9.206 1.00 41.43 H new ATOM 0 HA ASP A 94 -9.601 5.517 6.815 1.00 13.52 H new ATOM 0 HB2 ASP A 94 -8.611 7.361 8.109 1.00 45.32 H new ATOM 0 HB3 ASP A 94 -10.253 7.027 8.623 1.00 45.32 H new ATOM 1468 N LEU A 95 -7.221 4.961 6.453 1.00 3.44 N ATOM 1469 CA LEU A 95 -5.857 4.510 6.118 1.00 15.14 C ATOM 1470 C LEU A 95 -4.992 5.721 5.812 1.00 3.54 C ATOM 1471 O LEU A 95 -5.353 6.540 4.975 1.00 1.32 O ATOM 1472 CB LEU A 95 -5.874 3.548 4.906 1.00 11.34 C ATOM 1473 CG LEU A 95 -6.777 2.297 5.054 1.00 33.34 C ATOM 1474 CD1 LEU A 95 -6.644 1.391 3.827 1.00 52.33 C ATOM 1475 CD2 LEU A 95 -6.494 1.532 6.364 1.00 61.41 C ATOM 0 H LEU A 95 -7.692 5.440 5.685 1.00 3.44 H new ATOM 0 HA LEU A 95 -5.445 3.969 6.970 1.00 15.14 H new ATOM 0 HB2 LEU A 95 -6.198 4.106 4.027 1.00 11.34 H new ATOM 0 HB3 LEU A 95 -4.854 3.216 4.714 1.00 11.34 H new ATOM 0 HG LEU A 95 -7.811 2.637 5.112 1.00 33.34 H new ATOM 0 HD11 LEU A 95 -7.285 0.518 3.948 1.00 52.33 H new ATOM 0 HD12 LEU A 95 -6.944 1.940 2.935 1.00 52.33 H new ATOM 0 HD13 LEU A 95 -5.608 1.069 3.723 1.00 52.33 H new ATOM 0 HD21 LEU A 95 -7.149 0.663 6.427 1.00 61.41 H new ATOM 0 HD22 LEU A 95 -5.454 1.205 6.377 1.00 61.41 H new ATOM 0 HD23 LEU A 95 -6.679 2.187 7.215 1.00 61.41 H new ATOM 1487 N HIS A 96 -3.833 5.801 6.446 1.00 63.24 N ATOM 1488 CA HIS A 96 -3.018 7.009 6.425 1.00 23.41 C ATOM 1489 C HIS A 96 -2.062 6.954 5.220 1.00 61.44 C ATOM 1490 O HIS A 96 -1.424 5.925 4.973 1.00 10.42 O ATOM 1491 CB HIS A 96 -2.264 7.128 7.769 1.00 54.30 C ATOM 1492 CG HIS A 96 -3.165 7.227 8.991 1.00 70.12 C ATOM 1493 ND1 HIS A 96 -3.047 8.254 9.894 1.00 13.11 N ATOM 1494 CD2 HIS A 96 -4.156 6.391 9.422 1.00 71.22 C ATOM 1495 CE1 HIS A 96 -3.945 8.023 10.835 1.00 64.41 C ATOM 1496 NE2 HIS A 96 -4.643 6.908 10.591 1.00 30.11 N ATOM 0 H HIS A 96 -3.431 5.036 6.987 1.00 63.24 H new ATOM 0 HA HIS A 96 -3.638 7.898 6.311 1.00 23.41 H new ATOM 0 HB2 HIS A 96 -1.612 6.262 7.883 1.00 54.30 H new ATOM 0 HB3 HIS A 96 -1.622 8.008 7.734 1.00 54.30 H new ATOM 0 HD1 HIS A 96 -2.396 9.038 9.848 1.00 13.11 H new ATOM 0 HD2 HIS A 96 -4.492 5.490 8.931 1.00 71.22 H new ATOM 0 HE1 HIS A 96 -4.097 8.657 11.696 1.00 64.41 H new ATOM 1504 N ALA A 97 -2.002 8.058 4.470 1.00 24.00 N ATOM 1505 CA ALA A 97 -1.189 8.184 3.259 1.00 24.42 C ATOM 1506 C ALA A 97 0.080 8.960 3.594 1.00 51.35 C ATOM 1507 O ALA A 97 0.013 10.076 4.134 1.00 14.44 O ATOM 1508 CB ALA A 97 -1.990 8.899 2.159 1.00 63.42 C ATOM 0 H ALA A 97 -2.527 8.904 4.692 1.00 24.00 H new ATOM 0 HA ALA A 97 -0.917 7.195 2.890 1.00 24.42 H new ATOM 0 HB1 ALA A 97 -1.377 8.988 1.262 1.00 63.42 H new ATOM 0 HB2 ALA A 97 -2.887 8.324 1.930 1.00 63.42 H new ATOM 0 HB3 ALA A 97 -2.275 9.893 2.504 1.00 63.42 H new ATOM 1514 N PHE A 98 1.239 8.364 3.281 1.00 14.44 N ATOM 1515 CA PHE A 98 2.551 8.935 3.604 1.00 70.01 C ATOM 1516 C PHE A 98 3.387 9.071 2.316 1.00 61.50 C ATOM 1517 O PHE A 98 2.993 8.592 1.245 1.00 44.21 O ATOM 1518 CB PHE A 98 3.319 8.026 4.606 1.00 1.01 C ATOM 1519 CG PHE A 98 2.517 7.453 5.776 1.00 51.30 C ATOM 1520 CD1 PHE A 98 2.403 8.140 6.978 1.00 63.22 C ATOM 1521 CD2 PHE A 98 1.915 6.196 5.683 1.00 22.51 C ATOM 1522 CE1 PHE A 98 1.709 7.597 8.044 1.00 42.13 C ATOM 1523 CE2 PHE A 98 1.222 5.657 6.751 1.00 74.04 C ATOM 1524 CZ PHE A 98 1.124 6.354 7.931 1.00 1.45 C ATOM 0 H PHE A 98 1.291 7.469 2.795 1.00 14.44 H new ATOM 0 HA PHE A 98 2.395 9.913 4.059 1.00 70.01 H new ATOM 0 HB2 PHE A 98 3.748 7.193 4.049 1.00 1.01 H new ATOM 0 HB3 PHE A 98 4.152 8.599 5.014 1.00 1.01 H new ATOM 0 HD1 PHE A 98 2.863 9.112 7.082 1.00 63.22 H new ATOM 0 HD2 PHE A 98 1.992 5.636 4.762 1.00 22.51 H new ATOM 0 HE1 PHE A 98 1.625 8.149 8.968 1.00 42.13 H new ATOM 0 HE2 PHE A 98 0.757 4.687 6.658 1.00 74.04 H new ATOM 0 HZ PHE A 98 0.590 5.929 8.768 1.00 1.45 H new ATOM 1534 N ARG A 99 4.540 9.726 2.461 1.00 45.41 N ATOM 1535 CA ARG A 99 5.595 9.810 1.434 1.00 44.01 C ATOM 1536 C ARG A 99 6.878 10.269 2.131 1.00 53.43 C ATOM 1537 O ARG A 99 6.794 11.105 3.031 1.00 4.40 O ATOM 1538 CB ARG A 99 5.186 10.765 0.284 1.00 71.13 C ATOM 1539 CG ARG A 99 4.956 12.247 0.696 1.00 21.21 C ATOM 1540 CD ARG A 99 3.665 12.835 0.115 1.00 55.33 C ATOM 1541 NE ARG A 99 3.622 12.830 -1.357 1.00 11.35 N ATOM 1542 CZ ARG A 99 2.783 13.566 -2.103 1.00 73.12 C ATOM 1543 NH1 ARG A 99 1.903 14.398 -1.538 1.00 32.01 N ATOM 1544 NH2 ARG A 99 2.796 13.424 -3.414 1.00 44.54 N ATOM 0 H ARG A 99 4.778 10.228 3.316 1.00 45.41 H new ATOM 0 HA ARG A 99 5.755 8.837 0.970 1.00 44.01 H new ATOM 0 HB2 ARG A 99 5.960 10.735 -0.483 1.00 71.13 H new ATOM 0 HB3 ARG A 99 4.271 10.386 -0.172 1.00 71.13 H new ATOM 0 HG2 ARG A 99 4.923 12.315 1.783 1.00 21.21 H new ATOM 0 HG3 ARG A 99 5.804 12.847 0.364 1.00 21.21 H new ATOM 0 HD2 ARG A 99 2.815 12.269 0.496 1.00 55.33 H new ATOM 0 HD3 ARG A 99 3.551 13.859 0.469 1.00 55.33 H new ATOM 0 HE ARG A 99 4.279 12.222 -1.846 1.00 11.35 H new ATOM 0 HH11 ARG A 99 1.860 14.482 -0.522 1.00 32.01 H new ATOM 0 HH12 ARG A 99 1.274 14.949 -2.122 1.00 32.01 H new ATOM 0 HH21 ARG A 99 3.438 12.761 -3.849 1.00 44.54 H new ATOM 0 HH22 ARG A 99 2.164 13.977 -3.993 1.00 44.54 H new ATOM 1558 N GLN A 100 8.041 9.732 1.695 1.00 22.31 N ATOM 1559 CA GLN A 100 9.320 9.793 2.447 1.00 25.12 C ATOM 1560 C GLN A 100 9.629 11.202 3.003 1.00 52.24 C ATOM 1561 O GLN A 100 9.505 11.421 4.213 1.00 5.24 O ATOM 1562 CB GLN A 100 10.484 9.268 1.576 1.00 61.53 C ATOM 1563 CG GLN A 100 10.272 7.846 1.018 1.00 25.24 C ATOM 1564 CD GLN A 100 11.431 7.337 0.159 1.00 1.15 C ATOM 1565 OE1 GLN A 100 11.218 6.639 -0.828 1.00 41.30 O ATOM 1566 NE2 GLN A 100 12.670 7.630 0.556 1.00 1.23 N ATOM 0 H GLN A 100 8.121 9.240 0.805 1.00 22.31 H new ATOM 0 HA GLN A 100 9.208 9.144 3.316 1.00 25.12 H new ATOM 0 HB2 GLN A 100 10.635 9.953 0.742 1.00 61.53 H new ATOM 0 HB3 GLN A 100 11.399 9.280 2.168 1.00 61.53 H new ATOM 0 HG2 GLN A 100 10.121 7.159 1.850 1.00 25.24 H new ATOM 0 HG3 GLN A 100 9.359 7.832 0.423 1.00 25.24 H new ATOM 0 HE21 GLN A 100 12.817 8.213 1.380 1.00 1.23 H new ATOM 0 HE22 GLN A 100 13.471 7.272 0.035 1.00 1.23 H new ATOM 1575 N ALA A 101 10.014 12.153 2.131 1.00 24.11 N ATOM 1576 CA ALA A 101 10.195 13.555 2.537 1.00 52.11 C ATOM 1577 C ALA A 101 9.186 14.472 1.824 1.00 74.31 C ATOM 1578 O ALA A 101 8.157 14.845 2.400 1.00 73.31 O ATOM 1579 CB ALA A 101 11.650 14.001 2.275 1.00 3.34 C ATOM 0 H ALA A 101 10.204 11.975 1.145 1.00 24.11 H new ATOM 0 HA ALA A 101 10.003 13.636 3.607 1.00 52.11 H new ATOM 0 HB1 ALA A 101 11.772 15.040 2.579 1.00 3.34 H new ATOM 0 HB2 ALA A 101 12.332 13.373 2.848 1.00 3.34 H new ATOM 0 HB3 ALA A 101 11.874 13.905 1.213 1.00 3.34 H new ATOM 1585 N ALA A 102 9.463 14.796 0.549 1.00 3.40 N ATOM 1586 CA ALA A 102 8.732 15.844 -0.197 1.00 43.14 C ATOM 1587 C ALA A 102 8.293 15.365 -1.591 1.00 24.54 C ATOM 1588 O ALA A 102 8.367 16.136 -2.559 1.00 2.11 O ATOM 1589 CB ALA A 102 9.627 17.099 -0.282 1.00 11.23 C ATOM 0 H ALA A 102 10.197 14.342 0.005 1.00 3.40 H new ATOM 0 HA ALA A 102 7.812 16.085 0.336 1.00 43.14 H new ATOM 0 HB1 ALA A 102 9.103 17.883 -0.829 1.00 11.23 H new ATOM 0 HB2 ALA A 102 9.857 17.451 0.724 1.00 11.23 H new ATOM 0 HB3 ALA A 102 10.553 16.851 -0.800 1.00 11.23 H new ATOM 1595 N ASP A 103 7.829 14.104 -1.682 1.00 71.14 N ATOM 1596 CA ASP A 103 7.465 13.451 -2.968 1.00 0.52 C ATOM 1597 C ASP A 103 6.446 14.276 -3.785 1.00 72.24 C ATOM 1598 O ASP A 103 5.430 14.719 -3.258 1.00 62.21 O ATOM 1599 CB ASP A 103 6.888 12.038 -2.709 1.00 10.24 C ATOM 1600 CG ASP A 103 6.233 11.398 -3.950 1.00 0.43 C ATOM 1601 OD1 ASP A 103 6.963 10.875 -4.812 1.00 71.10 O ATOM 1602 OD2 ASP A 103 4.982 11.459 -4.075 1.00 34.01 O ATOM 0 H ASP A 103 7.693 13.503 -0.869 1.00 71.14 H new ATOM 0 HA ASP A 103 8.382 13.381 -3.553 1.00 0.52 H new ATOM 0 HB2 ASP A 103 7.688 11.388 -2.356 1.00 10.24 H new ATOM 0 HB3 ASP A 103 6.149 12.098 -1.910 1.00 10.24 H new ATOM 1607 N GLU A 104 6.740 14.440 -5.082 1.00 45.51 N ATOM 1608 CA GLU A 104 5.878 15.151 -6.046 1.00 21.31 C ATOM 1609 C GLU A 104 5.400 14.203 -7.168 1.00 1.34 C ATOM 1610 O GLU A 104 4.649 14.624 -8.056 1.00 73.25 O ATOM 1611 CB GLU A 104 6.666 16.354 -6.639 1.00 21.42 C ATOM 1612 CG GLU A 104 7.161 17.374 -5.592 1.00 2.03 C ATOM 1613 CD GLU A 104 8.000 18.503 -6.205 1.00 20.13 C ATOM 1614 OE1 GLU A 104 7.410 19.446 -6.776 1.00 75.41 O ATOM 1615 OE2 GLU A 104 9.249 18.447 -6.135 1.00 25.22 O ATOM 0 H GLU A 104 7.596 14.078 -5.501 1.00 45.51 H new ATOM 0 HA GLU A 104 4.990 15.517 -5.530 1.00 21.31 H new ATOM 0 HB2 GLU A 104 7.525 15.973 -7.191 1.00 21.42 H new ATOM 0 HB3 GLU A 104 6.029 16.870 -7.358 1.00 21.42 H new ATOM 0 HG2 GLU A 104 6.302 17.805 -5.078 1.00 2.03 H new ATOM 0 HG3 GLU A 104 7.755 16.855 -4.840 1.00 2.03 H new ATOM 1622 N SER A 105 5.810 12.916 -7.109 1.00 1.32 N ATOM 1623 CA SER A 105 5.486 11.910 -8.149 1.00 21.34 C ATOM 1624 C SER A 105 4.118 11.232 -7.922 1.00 62.43 C ATOM 1625 O SER A 105 3.853 10.185 -8.527 1.00 33.12 O ATOM 1626 CB SER A 105 6.617 10.854 -8.209 1.00 74.25 C ATOM 1627 OG SER A 105 7.864 11.465 -8.502 1.00 23.33 O ATOM 0 H SER A 105 6.372 12.545 -6.343 1.00 1.32 H new ATOM 0 HA SER A 105 5.412 12.432 -9.103 1.00 21.34 H new ATOM 0 HB2 SER A 105 6.680 10.328 -7.256 1.00 74.25 H new ATOM 0 HB3 SER A 105 6.385 10.109 -8.970 1.00 74.25 H new ATOM 0 HG SER A 105 8.564 10.780 -8.533 1.00 23.33 H new ATOM 1633 N ARG A 106 3.260 11.848 -7.064 1.00 13.11 N ATOM 1634 CA ARG A 106 1.909 11.336 -6.694 1.00 51.24 C ATOM 1635 C ARG A 106 2.003 10.026 -5.886 1.00 73.34 C ATOM 1636 O ARG A 106 0.975 9.429 -5.556 1.00 20.34 O ATOM 1637 CB ARG A 106 0.988 11.118 -7.943 1.00 24.35 C ATOM 1638 CG ARG A 106 0.862 12.316 -8.912 1.00 25.52 C ATOM 1639 CD ARG A 106 0.282 13.586 -8.266 1.00 62.43 C ATOM 1640 NE ARG A 106 0.078 14.660 -9.266 1.00 23.31 N ATOM 1641 CZ ARG A 106 0.340 15.973 -9.088 1.00 72.10 C ATOM 1642 NH1 ARG A 106 0.825 16.424 -7.937 1.00 10.20 N ATOM 1643 NH2 ARG A 106 0.096 16.827 -10.074 1.00 42.42 N ATOM 0 H ARG A 106 3.490 12.728 -6.602 1.00 13.11 H new ATOM 0 HA ARG A 106 1.456 12.107 -6.071 1.00 51.24 H new ATOM 0 HB2 ARG A 106 1.366 10.262 -8.503 1.00 24.35 H new ATOM 0 HB3 ARG A 106 -0.010 10.854 -7.592 1.00 24.35 H new ATOM 0 HG2 ARG A 106 1.847 12.545 -9.319 1.00 25.52 H new ATOM 0 HG3 ARG A 106 0.229 12.026 -9.751 1.00 25.52 H new ATOM 0 HD2 ARG A 106 -0.667 13.350 -7.786 1.00 62.43 H new ATOM 0 HD3 ARG A 106 0.956 13.938 -7.485 1.00 62.43 H new ATOM 0 HE ARG A 106 -0.295 14.382 -10.174 1.00 23.31 H new ATOM 0 HH11 ARG A 106 1.005 15.776 -7.171 1.00 10.20 H new ATOM 0 HH12 ARG A 106 1.017 17.419 -7.819 1.00 10.20 H new ATOM 0 HH21 ARG A 106 -0.286 16.490 -10.958 1.00 42.42 H new ATOM 0 HH22 ARG A 106 0.291 17.820 -9.948 1.00 42.42 H new ATOM 1657 N THR A 107 3.235 9.618 -5.525 1.00 71.45 N ATOM 1658 CA THR A 107 3.508 8.298 -4.965 1.00 3.35 C ATOM 1659 C THR A 107 3.141 8.277 -3.473 1.00 44.23 C ATOM 1660 O THR A 107 3.945 8.643 -2.602 1.00 72.41 O ATOM 1661 CB THR A 107 5.011 7.910 -5.180 1.00 21.02 C ATOM 1662 OG1 THR A 107 5.355 8.076 -6.567 1.00 42.43 O ATOM 1663 CG2 THR A 107 5.306 6.461 -4.754 1.00 24.43 C ATOM 0 H THR A 107 4.065 10.203 -5.617 1.00 71.45 H new ATOM 0 HA THR A 107 2.896 7.559 -5.482 1.00 3.35 H new ATOM 0 HB THR A 107 5.612 8.569 -4.554 1.00 21.02 H new ATOM 0 HG1 THR A 107 4.681 7.637 -7.126 1.00 42.43 H new ATOM 0 HG21 THR A 107 6.360 6.240 -4.922 1.00 24.43 H new ATOM 0 HG22 THR A 107 5.074 6.338 -3.696 1.00 24.43 H new ATOM 0 HG23 THR A 107 4.694 5.777 -5.342 1.00 24.43 H new ATOM 1671 N LEU A 108 1.887 7.912 -3.198 1.00 71.12 N ATOM 1672 CA LEU A 108 1.354 7.820 -1.839 1.00 32.11 C ATOM 1673 C LEU A 108 1.364 6.362 -1.395 1.00 34.32 C ATOM 1674 O LEU A 108 0.856 5.479 -2.100 1.00 13.20 O ATOM 1675 CB LEU A 108 -0.079 8.400 -1.786 1.00 53.11 C ATOM 1676 CG LEU A 108 -0.258 9.827 -2.375 1.00 72.24 C ATOM 1677 CD1 LEU A 108 -1.686 10.334 -2.178 1.00 64.23 C ATOM 1678 CD2 LEU A 108 0.766 10.811 -1.782 1.00 1.31 C ATOM 0 H LEU A 108 1.208 7.670 -3.919 1.00 71.12 H new ATOM 0 HA LEU A 108 1.978 8.403 -1.161 1.00 32.11 H new ATOM 0 HB2 LEU A 108 -0.744 7.722 -2.320 1.00 53.11 H new ATOM 0 HB3 LEU A 108 -0.406 8.414 -0.746 1.00 53.11 H new ATOM 0 HG LEU A 108 -0.073 9.763 -3.447 1.00 72.24 H new ATOM 0 HD11 LEU A 108 -1.778 11.334 -2.601 1.00 64.23 H new ATOM 0 HD12 LEU A 108 -2.383 9.662 -2.679 1.00 64.23 H new ATOM 0 HD13 LEU A 108 -1.917 10.367 -1.113 1.00 64.23 H new ATOM 0 HD21 LEU A 108 0.613 11.800 -2.215 1.00 1.31 H new ATOM 0 HD22 LEU A 108 0.636 10.864 -0.701 1.00 1.31 H new ATOM 0 HD23 LEU A 108 1.775 10.467 -2.009 1.00 1.31 H new ATOM 1690 N PHE A 109 1.931 6.128 -0.221 1.00 63.50 N ATOM 1691 CA PHE A 109 2.081 4.799 0.349 1.00 52.20 C ATOM 1692 C PHE A 109 1.061 4.658 1.479 1.00 32.42 C ATOM 1693 O PHE A 109 1.139 5.382 2.481 1.00 74.44 O ATOM 1694 CB PHE A 109 3.532 4.635 0.859 1.00 25.45 C ATOM 1695 CG PHE A 109 3.885 3.243 1.386 1.00 40.20 C ATOM 1696 CD1 PHE A 109 3.780 2.119 0.563 1.00 1.02 C ATOM 1697 CD2 PHE A 109 4.343 3.063 2.691 1.00 23.41 C ATOM 1698 CE1 PHE A 109 4.120 0.863 1.033 1.00 43.35 C ATOM 1699 CE2 PHE A 109 4.681 1.807 3.159 1.00 62.30 C ATOM 1700 CZ PHE A 109 4.571 0.710 2.331 1.00 21.05 C ATOM 0 H PHE A 109 2.306 6.869 0.371 1.00 63.50 H new ATOM 0 HA PHE A 109 1.898 4.018 -0.389 1.00 52.20 H new ATOM 0 HB2 PHE A 109 4.215 4.882 0.047 1.00 25.45 H new ATOM 0 HB3 PHE A 109 3.705 5.361 1.653 1.00 25.45 H new ATOM 0 HD1 PHE A 109 3.429 2.232 -0.452 1.00 1.02 H new ATOM 0 HD2 PHE A 109 4.435 3.917 3.345 1.00 23.41 H new ATOM 0 HE1 PHE A 109 4.033 0.002 0.386 1.00 43.35 H new ATOM 0 HE2 PHE A 109 5.031 1.685 4.173 1.00 62.30 H new ATOM 0 HZ PHE A 109 4.838 -0.271 2.697 1.00 21.05 H new ATOM 1710 N VAL A 110 0.075 3.769 1.284 1.00 70.40 N ATOM 1711 CA VAL A 110 -0.963 3.463 2.288 1.00 45.31 C ATOM 1712 C VAL A 110 -0.811 2.005 2.791 1.00 34.43 C ATOM 1713 O VAL A 110 -1.381 1.068 2.215 1.00 23.32 O ATOM 1714 CB VAL A 110 -2.432 3.740 1.742 1.00 23.34 C ATOM 1715 CG1 VAL A 110 -2.722 5.253 1.662 1.00 44.11 C ATOM 1716 CG2 VAL A 110 -2.686 3.089 0.360 1.00 3.32 C ATOM 0 H VAL A 110 -0.028 3.237 0.420 1.00 70.40 H new ATOM 0 HA VAL A 110 -0.816 4.138 3.131 1.00 45.31 H new ATOM 0 HB VAL A 110 -3.112 3.280 2.458 1.00 23.34 H new ATOM 0 HG11 VAL A 110 -3.733 5.410 1.286 1.00 44.11 H new ATOM 0 HG12 VAL A 110 -2.632 5.694 2.655 1.00 44.11 H new ATOM 0 HG13 VAL A 110 -2.007 5.725 0.989 1.00 44.11 H new ATOM 0 HG21 VAL A 110 -3.703 3.310 0.035 1.00 3.32 H new ATOM 0 HG22 VAL A 110 -1.978 3.489 -0.366 1.00 3.32 H new ATOM 0 HG23 VAL A 110 -2.556 2.010 0.437 1.00 3.32 H new ATOM 1726 N PRO A 111 0.019 1.772 3.858 1.00 42.14 N ATOM 1727 CA PRO A 111 0.056 0.467 4.530 1.00 22.34 C ATOM 1728 C PRO A 111 -1.190 0.306 5.414 1.00 42.11 C ATOM 1729 O PRO A 111 -1.464 1.162 6.264 1.00 14.04 O ATOM 1730 CB PRO A 111 1.356 0.536 5.368 1.00 25.43 C ATOM 1731 CG PRO A 111 1.567 1.994 5.655 1.00 34.02 C ATOM 1732 CD PRO A 111 0.968 2.743 4.481 1.00 2.24 C ATOM 0 HA PRO A 111 0.053 -0.386 3.851 1.00 22.34 H new ATOM 0 HB2 PRO A 111 1.260 -0.036 6.291 1.00 25.43 H new ATOM 0 HB3 PRO A 111 2.200 0.117 4.820 1.00 25.43 H new ATOM 0 HG2 PRO A 111 1.084 2.282 6.589 1.00 34.02 H new ATOM 0 HG3 PRO A 111 2.628 2.221 5.762 1.00 34.02 H new ATOM 0 HD2 PRO A 111 0.453 3.646 4.808 1.00 2.24 H new ATOM 0 HD3 PRO A 111 1.738 3.053 3.775 1.00 2.24 H new ATOM 1740 N PHE A 112 -1.947 -0.776 5.205 1.00 14.44 N ATOM 1741 CA PHE A 112 -3.138 -1.070 6.003 1.00 62.34 C ATOM 1742 C PHE A 112 -2.958 -2.400 6.725 1.00 70.34 C ATOM 1743 O PHE A 112 -2.519 -3.391 6.138 1.00 22.00 O ATOM 1744 CB PHE A 112 -4.434 -1.056 5.151 1.00 45.24 C ATOM 1745 CG PHE A 112 -4.580 -2.123 4.070 1.00 2.04 C ATOM 1746 CD1 PHE A 112 -3.996 -1.956 2.816 1.00 74.30 C ATOM 1747 CD2 PHE A 112 -5.336 -3.277 4.299 1.00 21.32 C ATOM 1748 CE1 PHE A 112 -4.162 -2.907 1.831 1.00 23.11 C ATOM 1749 CE2 PHE A 112 -5.493 -4.225 3.316 1.00 62.42 C ATOM 1750 CZ PHE A 112 -4.909 -4.041 2.084 1.00 41.12 C ATOM 0 H PHE A 112 -1.752 -1.468 4.482 1.00 14.44 H new ATOM 0 HA PHE A 112 -3.253 -0.279 6.744 1.00 62.34 H new ATOM 0 HB2 PHE A 112 -5.283 -1.146 5.829 1.00 45.24 H new ATOM 0 HB3 PHE A 112 -4.511 -0.080 4.672 1.00 45.24 H new ATOM 0 HD1 PHE A 112 -3.408 -1.073 2.613 1.00 74.30 H new ATOM 0 HD2 PHE A 112 -5.803 -3.425 5.261 1.00 21.32 H new ATOM 0 HE1 PHE A 112 -3.708 -2.765 0.862 1.00 23.11 H new ATOM 0 HE2 PHE A 112 -6.075 -5.114 3.511 1.00 62.42 H new ATOM 0 HZ PHE A 112 -5.035 -4.786 1.312 1.00 41.12 H new ATOM 1760 N ARG A 113 -3.273 -2.401 8.014 1.00 42.33 N ATOM 1761 CA ARG A 113 -3.252 -3.604 8.839 1.00 72.44 C ATOM 1762 C ARG A 113 -4.693 -4.070 9.037 1.00 72.42 C ATOM 1763 O ARG A 113 -5.484 -3.349 9.632 1.00 64.30 O ATOM 1764 CB ARG A 113 -2.584 -3.304 10.201 1.00 42.31 C ATOM 1765 CG ARG A 113 -2.592 -4.517 11.158 1.00 71.32 C ATOM 1766 CD ARG A 113 -2.056 -4.209 12.559 1.00 60.44 C ATOM 1767 NE ARG A 113 -2.300 -5.333 13.478 1.00 14.34 N ATOM 1768 CZ ARG A 113 -3.454 -5.567 14.128 1.00 34.41 C ATOM 1769 NH1 ARG A 113 -4.504 -4.762 13.989 1.00 63.32 N ATOM 1770 NH2 ARG A 113 -3.553 -6.630 14.901 1.00 43.14 N ATOM 0 H ARG A 113 -3.552 -1.561 8.521 1.00 42.33 H new ATOM 0 HA ARG A 113 -2.674 -4.388 8.350 1.00 72.44 H new ATOM 0 HB2 ARG A 113 -1.555 -2.988 10.033 1.00 42.31 H new ATOM 0 HB3 ARG A 113 -3.100 -2.470 10.676 1.00 42.31 H new ATOM 0 HG2 ARG A 113 -3.612 -4.892 11.245 1.00 71.32 H new ATOM 0 HG3 ARG A 113 -1.995 -5.317 10.719 1.00 71.32 H new ATOM 0 HD2 ARG A 113 -0.987 -4.004 12.506 1.00 60.44 H new ATOM 0 HD3 ARG A 113 -2.534 -3.309 12.945 1.00 60.44 H new ATOM 0 HE ARG A 113 -1.533 -5.986 13.634 1.00 14.34 H new ATOM 0 HH11 ARG A 113 -4.444 -3.947 13.379 1.00 63.32 H new ATOM 0 HH12 ARG A 113 -5.369 -4.960 14.492 1.00 63.32 H new ATOM 0 HH21 ARG A 113 -2.760 -7.264 15.001 1.00 43.14 H new ATOM 0 HH22 ARG A 113 -4.423 -6.819 15.399 1.00 43.14 H new ATOM 1784 N ASP A 114 -5.031 -5.252 8.522 1.00 33.24 N ATOM 1785 CA ASP A 114 -6.388 -5.817 8.615 1.00 55.24 C ATOM 1786 C ASP A 114 -6.318 -7.166 9.366 1.00 74.52 C ATOM 1787 O ASP A 114 -5.332 -7.433 10.070 1.00 63.10 O ATOM 1788 CB ASP A 114 -6.981 -5.958 7.184 1.00 54.33 C ATOM 1789 CG ASP A 114 -6.377 -7.114 6.386 1.00 62.12 C ATOM 1790 OD1 ASP A 114 -5.141 -7.187 6.272 1.00 10.00 O ATOM 1791 OD2 ASP A 114 -7.136 -7.994 5.945 1.00 60.10 O ATOM 0 H ASP A 114 -4.372 -5.852 8.025 1.00 33.24 H new ATOM 0 HA ASP A 114 -7.051 -5.160 9.178 1.00 55.24 H new ATOM 0 HB2 ASP A 114 -8.059 -6.102 7.258 1.00 54.33 H new ATOM 0 HB3 ASP A 114 -6.821 -5.028 6.639 1.00 54.33 H new ATOM 1796 N LYS A 115 -7.357 -8.015 9.220 1.00 44.04 N ATOM 1797 CA LYS A 115 -7.417 -9.318 9.910 1.00 61.23 C ATOM 1798 C LYS A 115 -6.689 -10.440 9.154 1.00 45.41 C ATOM 1799 O LYS A 115 -6.489 -11.510 9.735 1.00 0.12 O ATOM 1800 CB LYS A 115 -8.885 -9.712 10.192 1.00 30.31 C ATOM 1801 CG LYS A 115 -9.651 -8.697 11.063 1.00 3.31 C ATOM 1802 CD LYS A 115 -9.069 -8.510 12.476 1.00 14.33 C ATOM 1803 CE LYS A 115 -9.223 -9.767 13.343 1.00 14.32 C ATOM 1804 NZ LYS A 115 -8.676 -9.572 14.710 1.00 13.11 N ATOM 0 H LYS A 115 -8.166 -7.820 8.630 1.00 44.04 H new ATOM 0 HA LYS A 115 -6.888 -9.194 10.855 1.00 61.23 H new ATOM 0 HB2 LYS A 115 -9.408 -9.828 9.243 1.00 30.31 H new ATOM 0 HB3 LYS A 115 -8.901 -10.684 10.686 1.00 30.31 H new ATOM 0 HG2 LYS A 115 -9.659 -7.733 10.555 1.00 3.31 H new ATOM 0 HG3 LYS A 115 -10.688 -9.020 11.150 1.00 3.31 H new ATOM 0 HD2 LYS A 115 -8.013 -8.252 12.400 1.00 14.33 H new ATOM 0 HD3 LYS A 115 -9.568 -7.672 12.964 1.00 14.33 H new ATOM 0 HE2 LYS A 115 -10.278 -10.034 13.410 1.00 14.32 H new ATOM 0 HE3 LYS A 115 -8.712 -10.602 12.864 1.00 14.32 H new ATOM 0 HZ1 LYS A 115 -8.770 -10.455 15.251 1.00 13.11 H new ATOM 0 HZ2 LYS A 115 -7.672 -9.309 14.648 1.00 13.11 H new ATOM 0 HZ3 LYS A 115 -9.203 -8.815 15.190 1.00 13.11 H new ATOM 1818 N THR A 116 -6.307 -10.236 7.867 1.00 22.03 N ATOM 1819 CA THR A 116 -5.458 -11.221 7.156 1.00 61.13 C ATOM 1820 C THR A 116 -4.021 -11.162 7.703 1.00 73.43 C ATOM 1821 O THR A 116 -3.337 -12.191 7.780 1.00 11.54 O ATOM 1822 CB THR A 116 -5.429 -11.050 5.588 1.00 12.20 C ATOM 1823 OG1 THR A 116 -4.785 -9.830 5.208 1.00 31.22 O ATOM 1824 CG2 THR A 116 -6.837 -11.109 4.959 1.00 15.23 C ATOM 0 H THR A 116 -6.566 -9.419 7.314 1.00 22.03 H new ATOM 0 HA THR A 116 -5.913 -12.193 7.346 1.00 61.13 H new ATOM 0 HB THR A 116 -4.855 -11.893 5.205 1.00 12.20 H new ATOM 0 HG1 THR A 116 -5.001 -9.130 5.859 1.00 31.22 H new ATOM 0 HG21 THR A 116 -6.758 -10.986 3.879 1.00 15.23 H new ATOM 0 HG22 THR A 116 -7.295 -12.073 5.182 1.00 15.23 H new ATOM 0 HG23 THR A 116 -7.453 -10.310 5.371 1.00 15.23 H new ATOM 1832 N THR A 117 -3.618 -9.947 8.130 1.00 63.54 N ATOM 1833 CA THR A 117 -2.274 -9.645 8.644 1.00 5.04 C ATOM 1834 C THR A 117 -1.898 -10.560 9.841 1.00 74.44 C ATOM 1835 O THR A 117 -2.544 -10.517 10.895 1.00 73.25 O ATOM 1836 CB THR A 117 -2.197 -8.131 9.066 1.00 51.34 C ATOM 1837 OG1 THR A 117 -2.421 -7.285 7.916 1.00 4.22 O ATOM 1838 CG2 THR A 117 -0.844 -7.763 9.717 1.00 53.42 C ATOM 0 H THR A 117 -4.234 -9.134 8.125 1.00 63.54 H new ATOM 0 HA THR A 117 -1.555 -9.838 7.848 1.00 5.04 H new ATOM 0 HB THR A 117 -2.976 -7.970 9.812 1.00 51.34 H new ATOM 0 HG1 THR A 117 -3.305 -7.474 7.538 1.00 4.22 H new ATOM 0 HG21 THR A 117 -0.846 -6.707 9.988 1.00 53.42 H new ATOM 0 HG22 THR A 117 -0.694 -8.367 10.612 1.00 53.42 H new ATOM 0 HG23 THR A 117 -0.036 -7.955 9.011 1.00 53.42 H new ATOM 1846 N GLY A 118 -0.857 -11.388 9.630 1.00 64.22 N ATOM 1847 CA GLY A 118 -0.323 -12.294 10.653 1.00 24.02 C ATOM 1848 C GLY A 118 -1.242 -13.445 11.051 1.00 44.45 C ATOM 1849 O GLY A 118 -0.957 -14.139 12.032 1.00 72.42 O ATOM 0 H GLY A 118 -0.364 -11.444 8.739 1.00 64.22 H new ATOM 0 HA2 GLY A 118 0.617 -12.710 10.291 1.00 24.02 H new ATOM 0 HA3 GLY A 118 -0.091 -11.712 11.545 1.00 24.02 H new ATOM 1853 N GLN A 119 -2.355 -13.653 10.309 1.00 22.34 N ATOM 1854 CA GLN A 119 -3.365 -14.683 10.642 1.00 41.11 C ATOM 1855 C GLN A 119 -3.549 -15.644 9.443 1.00 23.40 C ATOM 1856 O GLN A 119 -3.001 -16.750 9.438 1.00 25.32 O ATOM 1857 CB GLN A 119 -4.721 -14.018 11.056 1.00 0.24 C ATOM 1858 CG GLN A 119 -4.618 -12.902 12.130 1.00 61.02 C ATOM 1859 CD GLN A 119 -4.026 -13.358 13.470 1.00 0.10 C ATOM 1860 OE1 GLN A 119 -4.200 -14.501 13.895 1.00 33.34 O ATOM 1861 NE2 GLN A 119 -3.314 -12.468 14.144 1.00 42.15 N ATOM 0 H GLN A 119 -2.576 -13.116 9.470 1.00 22.34 H new ATOM 0 HA GLN A 119 -3.014 -15.263 11.496 1.00 41.11 H new ATOM 0 HB2 GLN A 119 -5.187 -13.598 10.164 1.00 0.24 H new ATOM 0 HB3 GLN A 119 -5.388 -14.796 11.428 1.00 0.24 H new ATOM 0 HG2 GLN A 119 -4.006 -12.091 11.735 1.00 61.02 H new ATOM 0 HG3 GLN A 119 -5.613 -12.494 12.307 1.00 61.02 H new ATOM 0 HE21 GLN A 119 -3.185 -11.528 13.769 1.00 42.15 H new ATOM 0 HE22 GLN A 119 -2.894 -12.722 15.038 1.00 42.15 H new ATOM 1870 N GLN A 120 -4.318 -15.205 8.416 1.00 41.10 N ATOM 1871 CA GLN A 120 -4.516 -15.975 7.155 1.00 1.30 C ATOM 1872 C GLN A 120 -3.615 -15.418 6.031 1.00 71.44 C ATOM 1873 O GLN A 120 -3.817 -15.711 4.848 1.00 10.53 O ATOM 1874 CB GLN A 120 -6.018 -15.959 6.736 1.00 23.34 C ATOM 1875 CG GLN A 120 -6.610 -14.566 6.499 1.00 25.35 C ATOM 1876 CD GLN A 120 -8.071 -14.572 6.024 1.00 13.44 C ATOM 1877 OE1 GLN A 120 -8.348 -14.559 4.827 1.00 32.55 O ATOM 1878 NE2 GLN A 120 -9.009 -14.630 6.956 1.00 61.43 N ATOM 0 H GLN A 120 -4.816 -14.315 8.434 1.00 41.10 H new ATOM 0 HA GLN A 120 -4.228 -17.011 7.331 1.00 1.30 H new ATOM 0 HB2 GLN A 120 -6.131 -16.545 5.824 1.00 23.34 H new ATOM 0 HB3 GLN A 120 -6.601 -16.458 7.510 1.00 23.34 H new ATOM 0 HG2 GLN A 120 -6.543 -13.994 7.424 1.00 25.35 H new ATOM 0 HG3 GLN A 120 -6.002 -14.047 5.758 1.00 25.35 H new ATOM 0 HE21 GLN A 120 -8.748 -14.639 7.942 1.00 61.43 H new ATOM 0 HE22 GLN A 120 -9.993 -14.665 6.688 1.00 61.43 H new ATOM 1887 N SER A 121 -2.588 -14.670 6.448 1.00 11.05 N ATOM 1888 CA SER A 121 -1.597 -14.021 5.569 1.00 14.04 C ATOM 1889 C SER A 121 -0.405 -13.567 6.433 1.00 74.45 C ATOM 1890 O SER A 121 -0.441 -13.708 7.661 1.00 52.13 O ATOM 1891 CB SER A 121 -2.225 -12.829 4.785 1.00 72.15 C ATOM 1892 OG SER A 121 -1.324 -12.280 3.831 1.00 5.41 O ATOM 0 H SER A 121 -2.414 -14.491 7.437 1.00 11.05 H new ATOM 0 HA SER A 121 -1.252 -14.732 4.819 1.00 14.04 H new ATOM 0 HB2 SER A 121 -3.129 -13.166 4.277 1.00 72.15 H new ATOM 0 HB3 SER A 121 -2.525 -12.052 5.488 1.00 72.15 H new ATOM 0 HG SER A 121 -1.758 -11.537 3.361 1.00 5.41 H new ATOM 1898 N TYR A 122 0.631 -13.015 5.788 1.00 62.32 N ATOM 1899 CA TYR A 122 1.911 -12.668 6.438 1.00 31.40 C ATOM 1900 C TYR A 122 1.778 -11.446 7.379 1.00 14.42 C ATOM 1901 O TYR A 122 0.875 -10.613 7.214 1.00 35.24 O ATOM 1902 CB TYR A 122 2.980 -12.393 5.359 1.00 41.14 C ATOM 1903 CG TYR A 122 3.244 -13.566 4.408 1.00 52.42 C ATOM 1904 CD1 TYR A 122 4.172 -14.560 4.729 1.00 53.44 C ATOM 1905 CD2 TYR A 122 2.564 -13.681 3.190 1.00 1.52 C ATOM 1906 CE1 TYR A 122 4.406 -15.619 3.878 1.00 34.14 C ATOM 1907 CE2 TYR A 122 2.799 -14.741 2.339 1.00 52.01 C ATOM 1908 CZ TYR A 122 3.722 -15.706 2.689 1.00 62.04 C ATOM 1909 OH TYR A 122 3.953 -16.768 1.852 1.00 74.33 O ATOM 0 H TYR A 122 0.609 -12.793 4.793 1.00 62.32 H new ATOM 0 HA TYR A 122 2.212 -13.516 7.053 1.00 31.40 H new ATOM 0 HB2 TYR A 122 2.670 -11.529 4.771 1.00 41.14 H new ATOM 0 HB3 TYR A 122 3.914 -12.125 5.852 1.00 41.14 H new ATOM 0 HD1 TYR A 122 4.716 -14.498 5.660 1.00 53.44 H new ATOM 0 HD2 TYR A 122 1.843 -12.927 2.912 1.00 1.52 H new ATOM 0 HE1 TYR A 122 5.125 -16.379 4.145 1.00 34.14 H new ATOM 0 HE2 TYR A 122 2.264 -14.815 1.404 1.00 52.01 H new ATOM 0 HH TYR A 122 3.391 -16.684 1.054 1.00 74.33 H new ATOM 1919 N ASP A 123 2.698 -11.357 8.359 1.00 30.04 N ATOM 1920 CA ASP A 123 2.713 -10.276 9.376 1.00 12.41 C ATOM 1921 C ASP A 123 3.419 -9.016 8.834 1.00 71.41 C ATOM 1922 O ASP A 123 3.870 -8.994 7.691 1.00 31.22 O ATOM 1923 CB ASP A 123 3.396 -10.768 10.687 1.00 23.34 C ATOM 1924 CG ASP A 123 4.944 -10.755 10.641 1.00 63.54 C ATOM 1925 OD1 ASP A 123 5.534 -11.419 9.757 1.00 55.03 O ATOM 1926 OD2 ASP A 123 5.573 -10.078 11.489 1.00 14.41 O ATOM 0 H ASP A 123 3.455 -12.031 8.472 1.00 30.04 H new ATOM 0 HA ASP A 123 1.680 -10.011 9.603 1.00 12.41 H new ATOM 0 HB2 ASP A 123 3.063 -10.141 11.514 1.00 23.34 H new ATOM 0 HB3 ASP A 123 3.059 -11.782 10.900 1.00 23.34 H new ATOM 1931 N GLY A 124 3.519 -7.967 9.673 1.00 71.54 N ATOM 1932 CA GLY A 124 4.071 -6.675 9.249 1.00 33.20 C ATOM 1933 C GLY A 124 2.979 -5.739 8.761 1.00 31.02 C ATOM 1934 O GLY A 124 2.977 -4.544 9.075 1.00 64.22 O ATOM 0 H GLY A 124 3.223 -7.994 10.649 1.00 71.54 H new ATOM 0 HA2 GLY A 124 4.602 -6.214 10.082 1.00 33.20 H new ATOM 0 HA3 GLY A 124 4.800 -6.832 8.454 1.00 33.20 H new ATOM 1938 N GLY A 125 2.036 -6.296 7.989 1.00 62.03 N ATOM 1939 CA GLY A 125 0.911 -5.548 7.449 1.00 42.43 C ATOM 1940 C GLY A 125 0.667 -5.889 6.002 1.00 15.31 C ATOM 1941 O GLY A 125 1.355 -6.736 5.410 1.00 42.41 O ATOM 0 H GLY A 125 2.039 -7.281 7.725 1.00 62.03 H new ATOM 0 HA2 GLY A 125 0.015 -5.764 8.031 1.00 42.43 H new ATOM 0 HA3 GLY A 125 1.103 -4.479 7.545 1.00 42.43 H new ATOM 1945 N ARG A 126 -0.345 -5.252 5.434 1.00 15.35 N ATOM 1946 CA ARG A 126 -0.586 -5.260 3.993 1.00 71.11 C ATOM 1947 C ARG A 126 -0.155 -3.891 3.476 1.00 73.42 C ATOM 1948 O ARG A 126 -0.509 -2.875 4.066 1.00 63.53 O ATOM 1949 CB ARG A 126 -2.088 -5.540 3.714 1.00 53.33 C ATOM 1950 CG ARG A 126 -2.642 -6.858 4.317 1.00 2.45 C ATOM 1951 CD ARG A 126 -2.211 -8.135 3.576 1.00 10.41 C ATOM 1952 NE ARG A 126 -0.749 -8.282 3.520 1.00 44.44 N ATOM 1953 CZ ARG A 126 -0.024 -8.409 2.399 1.00 24.11 C ATOM 1954 NH1 ARG A 126 -0.594 -8.435 1.196 1.00 0.13 N ATOM 1955 NH2 ARG A 126 1.284 -8.417 2.494 1.00 72.53 N ATOM 0 H ARG A 126 -1.030 -4.710 5.961 1.00 15.35 H new ATOM 0 HA ARG A 126 -0.023 -6.043 3.486 1.00 71.11 H new ATOM 0 HB2 ARG A 126 -2.674 -4.708 4.104 1.00 53.33 H new ATOM 0 HB3 ARG A 126 -2.242 -5.561 2.635 1.00 53.33 H new ATOM 0 HG2 ARG A 126 -2.319 -6.930 5.356 1.00 2.45 H new ATOM 0 HG3 ARG A 126 -3.731 -6.809 4.325 1.00 2.45 H new ATOM 0 HD2 ARG A 126 -2.642 -9.004 4.073 1.00 10.41 H new ATOM 0 HD3 ARG A 126 -2.611 -8.117 2.562 1.00 10.41 H new ATOM 0 HE ARG A 126 -0.245 -8.288 4.407 1.00 44.44 H new ATOM 0 HH11 ARG A 126 -1.607 -8.357 1.110 1.00 0.13 H new ATOM 0 HH12 ARG A 126 -0.017 -8.533 0.360 1.00 0.13 H new ATOM 0 HH21 ARG A 126 1.730 -8.328 3.407 1.00 72.53 H new ATOM 0 HH22 ARG A 126 1.856 -8.513 1.655 1.00 72.53 H new ATOM 1969 N TYR A 127 0.633 -3.853 2.398 1.00 60.53 N ATOM 1970 CA TYR A 127 1.188 -2.585 1.887 1.00 31.31 C ATOM 1971 C TYR A 127 0.576 -2.303 0.531 1.00 3.33 C ATOM 1972 O TYR A 127 0.618 -3.145 -0.350 1.00 21.34 O ATOM 1973 CB TYR A 127 2.730 -2.689 1.809 1.00 41.55 C ATOM 1974 CG TYR A 127 3.355 -3.039 3.169 1.00 62.23 C ATOM 1975 CD1 TYR A 127 3.514 -2.074 4.164 1.00 33.24 C ATOM 1976 CD2 TYR A 127 3.734 -4.345 3.473 1.00 10.43 C ATOM 1977 CE1 TYR A 127 4.045 -2.394 5.399 1.00 41.25 C ATOM 1978 CE2 TYR A 127 4.265 -4.657 4.702 1.00 32.14 C ATOM 1979 CZ TYR A 127 4.409 -3.692 5.659 1.00 31.30 C ATOM 1980 OH TYR A 127 4.939 -4.026 6.882 1.00 74.31 O ATOM 0 H TYR A 127 0.903 -4.677 1.861 1.00 60.53 H new ATOM 0 HA TYR A 127 0.947 -1.759 2.556 1.00 31.31 H new ATOM 0 HB2 TYR A 127 3.005 -3.449 1.078 1.00 41.55 H new ATOM 0 HB3 TYR A 127 3.139 -1.743 1.455 1.00 41.55 H new ATOM 0 HD1 TYR A 127 3.216 -1.055 3.965 1.00 33.24 H new ATOM 0 HD2 TYR A 127 3.609 -5.122 2.734 1.00 10.43 H new ATOM 0 HE1 TYR A 127 4.172 -1.631 6.152 1.00 41.25 H new ATOM 0 HE2 TYR A 127 4.570 -5.671 4.913 1.00 32.14 H new ATOM 0 HH TYR A 127 5.141 -4.985 6.900 1.00 74.31 H new ATOM 1990 N MET A 128 0.042 -1.103 0.362 1.00 0.21 N ATOM 1991 CA MET A 128 -0.723 -0.742 -0.834 1.00 73.22 C ATOM 1992 C MET A 128 -0.255 0.641 -1.285 1.00 45.14 C ATOM 1993 O MET A 128 0.094 1.477 -0.444 1.00 43.21 O ATOM 1994 CB MET A 128 -2.251 -0.785 -0.501 1.00 31.31 C ATOM 1995 CG MET A 128 -3.152 -1.216 -1.670 1.00 34.33 C ATOM 1996 SD MET A 128 -3.378 0.065 -2.921 1.00 44.22 S ATOM 1997 CE MET A 128 -4.664 1.047 -2.156 1.00 22.13 C ATOM 0 H MET A 128 0.123 -0.350 1.045 1.00 0.21 H new ATOM 0 HA MET A 128 -0.558 -1.444 -1.651 1.00 73.22 H new ATOM 0 HB2 MET A 128 -2.408 -1.470 0.332 1.00 31.31 H new ATOM 0 HB3 MET A 128 -2.564 0.204 -0.165 1.00 31.31 H new ATOM 0 HG2 MET A 128 -2.723 -2.100 -2.141 1.00 34.33 H new ATOM 0 HG3 MET A 128 -4.127 -1.505 -1.278 1.00 34.33 H new ATOM 0 HE1 MET A 128 -5.350 1.408 -2.922 1.00 22.13 H new ATOM 0 HE2 MET A 128 -5.211 0.435 -1.438 1.00 22.13 H new ATOM 0 HE3 MET A 128 -4.215 1.897 -1.641 1.00 22.13 H new ATOM 2007 N GLU A 129 -0.205 0.868 -2.601 1.00 13.10 N ATOM 2008 CA GLU A 129 0.297 2.130 -3.165 1.00 71.21 C ATOM 2009 C GLU A 129 -0.685 2.661 -4.217 1.00 72.44 C ATOM 2010 O GLU A 129 -1.141 1.909 -5.089 1.00 31.21 O ATOM 2011 CB GLU A 129 1.705 1.903 -3.773 1.00 51.35 C ATOM 2012 CG GLU A 129 2.394 3.167 -4.336 1.00 21.04 C ATOM 2013 CD GLU A 129 3.793 2.882 -4.903 1.00 44.13 C ATOM 2014 OE1 GLU A 129 3.901 2.444 -6.072 1.00 24.42 O ATOM 2015 OE2 GLU A 129 4.794 3.068 -4.176 1.00 3.32 O ATOM 0 H GLU A 129 -0.508 0.191 -3.302 1.00 13.10 H new ATOM 0 HA GLU A 129 0.380 2.878 -2.376 1.00 71.21 H new ATOM 0 HB2 GLU A 129 2.348 1.470 -3.007 1.00 51.35 H new ATOM 0 HB3 GLU A 129 1.623 1.167 -4.573 1.00 51.35 H new ATOM 0 HG2 GLU A 129 1.770 3.596 -5.120 1.00 21.04 H new ATOM 0 HG3 GLU A 129 2.473 3.914 -3.546 1.00 21.04 H new ATOM 2022 N LEU A 130 -1.007 3.958 -4.113 1.00 53.45 N ATOM 2023 CA LEU A 130 -1.876 4.665 -5.062 1.00 21.32 C ATOM 2024 C LEU A 130 -1.204 5.968 -5.503 1.00 32.23 C ATOM 2025 O LEU A 130 -0.539 6.645 -4.708 1.00 2.11 O ATOM 2026 CB LEU A 130 -3.309 4.921 -4.471 1.00 42.22 C ATOM 2027 CG LEU A 130 -3.471 4.958 -2.908 1.00 55.44 C ATOM 2028 CD1 LEU A 130 -2.801 6.187 -2.274 1.00 44.50 C ATOM 2029 CD2 LEU A 130 -4.959 4.894 -2.513 1.00 22.25 C ATOM 0 H LEU A 130 -0.666 4.552 -3.357 1.00 53.45 H new ATOM 0 HA LEU A 130 -2.017 4.031 -5.937 1.00 21.32 H new ATOM 0 HB2 LEU A 130 -3.667 5.872 -4.866 1.00 42.22 H new ATOM 0 HB3 LEU A 130 -3.972 4.146 -4.856 1.00 42.22 H new ATOM 0 HG LEU A 130 -2.960 4.078 -2.518 1.00 55.44 H new ATOM 0 HD11 LEU A 130 -2.943 6.162 -1.194 1.00 44.50 H new ATOM 0 HD12 LEU A 130 -1.735 6.177 -2.500 1.00 44.50 H new ATOM 0 HD13 LEU A 130 -3.249 7.095 -2.678 1.00 44.50 H new ATOM 0 HD21 LEU A 130 -5.049 4.921 -1.427 1.00 22.25 H new ATOM 0 HD22 LEU A 130 -5.486 5.746 -2.942 1.00 22.25 H new ATOM 0 HD23 LEU A 130 -5.396 3.970 -2.890 1.00 22.25 H new ATOM 2041 N GLU A 131 -1.388 6.294 -6.786 1.00 75.25 N ATOM 2042 CA GLU A 131 -0.881 7.518 -7.403 1.00 63.51 C ATOM 2043 C GLU A 131 -2.051 8.244 -8.088 1.00 54.15 C ATOM 2044 O GLU A 131 -2.455 7.858 -9.193 1.00 1.14 O ATOM 2045 CB GLU A 131 0.267 7.200 -8.395 1.00 4.24 C ATOM 2046 CG GLU A 131 1.510 6.582 -7.725 1.00 53.25 C ATOM 2047 CD GLU A 131 2.611 6.219 -8.715 1.00 20.41 C ATOM 2048 OE1 GLU A 131 2.453 5.212 -9.441 1.00 71.21 O ATOM 2049 OE2 GLU A 131 3.636 6.933 -8.785 1.00 54.20 O ATOM 0 H GLU A 131 -1.904 5.701 -7.436 1.00 75.25 H new ATOM 0 HA GLU A 131 -0.459 8.174 -6.641 1.00 63.51 H new ATOM 0 HB2 GLU A 131 -0.103 6.514 -9.157 1.00 4.24 H new ATOM 0 HB3 GLU A 131 0.559 8.118 -8.906 1.00 4.24 H new ATOM 0 HG2 GLU A 131 1.907 7.285 -6.993 1.00 53.25 H new ATOM 0 HG3 GLU A 131 1.213 5.687 -7.179 1.00 53.25 H new ATOM 2056 N PRO A 132 -2.660 9.271 -7.404 1.00 72.31 N ATOM 2057 CA PRO A 132 -3.796 10.058 -7.955 1.00 35.34 C ATOM 2058 C PRO A 132 -3.401 10.883 -9.195 1.00 12.13 C ATOM 2059 O PRO A 132 -2.209 11.084 -9.476 1.00 40.20 O ATOM 2060 CB PRO A 132 -4.194 10.978 -6.771 1.00 52.04 C ATOM 2061 CG PRO A 132 -2.950 11.089 -5.943 1.00 60.22 C ATOM 2062 CD PRO A 132 -2.294 9.741 -6.035 1.00 52.15 C ATOM 0 HA PRO A 132 -4.608 9.420 -8.305 1.00 35.34 H new ATOM 0 HB2 PRO A 132 -4.525 11.955 -7.122 1.00 52.04 H new ATOM 0 HB3 PRO A 132 -5.016 10.551 -6.196 1.00 52.04 H new ATOM 0 HG2 PRO A 132 -2.294 11.873 -6.321 1.00 60.22 H new ATOM 0 HG3 PRO A 132 -3.186 11.342 -4.909 1.00 60.22 H new ATOM 0 HD2 PRO A 132 -1.213 9.811 -5.910 1.00 52.15 H new ATOM 0 HD3 PRO A 132 -2.661 9.062 -5.265 1.00 52.15 H new ATOM 2070 N ASP A 133 -4.428 11.364 -9.917 1.00 24.44 N ATOM 2071 CA ASP A 133 -4.264 12.152 -11.151 1.00 51.22 C ATOM 2072 C ASP A 133 -3.558 13.486 -10.841 1.00 21.24 C ATOM 2073 O ASP A 133 -2.583 13.861 -11.497 1.00 51.24 O ATOM 2074 CB ASP A 133 -5.652 12.376 -11.809 1.00 60.11 C ATOM 2075 CG ASP A 133 -5.589 13.187 -13.110 1.00 41.05 C ATOM 2076 OD1 ASP A 133 -5.040 12.670 -14.110 1.00 5.41 O ATOM 2077 OD2 ASP A 133 -6.074 14.340 -13.141 1.00 2.24 O ATOM 0 H ASP A 133 -5.403 11.215 -9.658 1.00 24.44 H new ATOM 0 HA ASP A 133 -3.636 11.607 -11.856 1.00 51.22 H new ATOM 0 HB2 ASP A 133 -6.108 11.408 -12.016 1.00 60.11 H new ATOM 0 HB3 ASP A 133 -6.302 12.890 -11.101 1.00 60.11 H new ATOM 2082 N ARG A 134 -4.069 14.187 -9.826 1.00 41.04 N ATOM 2083 CA ARG A 134 -3.432 15.377 -9.238 1.00 61.12 C ATOM 2084 C ARG A 134 -3.104 15.080 -7.763 1.00 24.34 C ATOM 2085 O ARG A 134 -3.391 13.982 -7.290 1.00 3.42 O ATOM 2086 CB ARG A 134 -4.372 16.612 -9.424 1.00 2.54 C ATOM 2087 CG ARG A 134 -5.809 16.478 -8.828 1.00 72.13 C ATOM 2088 CD ARG A 134 -5.934 16.989 -7.376 1.00 3.24 C ATOM 2089 NE ARG A 134 -7.327 16.970 -6.881 1.00 25.24 N ATOM 2090 CZ ARG A 134 -8.085 18.052 -6.639 1.00 24.13 C ATOM 2091 NH1 ARG A 134 -7.616 19.277 -6.839 1.00 14.02 N ATOM 2092 NH2 ARG A 134 -9.327 17.890 -6.200 1.00 11.53 N ATOM 0 H ARG A 134 -4.953 13.942 -9.379 1.00 41.04 H new ATOM 0 HA ARG A 134 -2.495 15.618 -9.740 1.00 61.12 H new ATOM 0 HB2 ARG A 134 -3.892 17.480 -8.971 1.00 2.54 H new ATOM 0 HB3 ARG A 134 -4.461 16.818 -10.491 1.00 2.54 H new ATOM 0 HG2 ARG A 134 -6.506 17.030 -9.458 1.00 72.13 H new ATOM 0 HG3 ARG A 134 -6.109 15.431 -8.861 1.00 72.13 H new ATOM 0 HD2 ARG A 134 -5.313 16.374 -6.724 1.00 3.24 H new ATOM 0 HD3 ARG A 134 -5.547 18.006 -7.319 1.00 3.24 H new ATOM 0 HE ARG A 134 -7.748 16.057 -6.709 1.00 25.24 H new ATOM 0 HH11 ARG A 134 -6.665 19.409 -7.182 1.00 14.02 H new ATOM 0 HH12 ARG A 134 -8.207 20.087 -6.649 1.00 14.02 H new ATOM 0 HH21 ARG A 134 -9.696 16.951 -6.050 1.00 11.53 H new ATOM 0 HH22 ARG A 134 -9.912 18.704 -6.013 1.00 11.53 H new ATOM 2106 N ASP A 135 -2.517 16.048 -7.029 1.00 1.10 N ATOM 2107 CA ASP A 135 -2.118 15.822 -5.615 1.00 61.21 C ATOM 2108 C ASP A 135 -3.345 15.996 -4.710 1.00 63.43 C ATOM 2109 O ASP A 135 -4.073 16.985 -4.854 1.00 51.30 O ATOM 2110 CB ASP A 135 -0.985 16.782 -5.165 1.00 13.54 C ATOM 2111 CG ASP A 135 -0.369 16.374 -3.806 1.00 22.43 C ATOM 2112 OD1 ASP A 135 0.424 15.410 -3.784 1.00 65.34 O ATOM 2113 OD2 ASP A 135 -0.690 16.989 -2.761 1.00 31.45 O ATOM 0 H ASP A 135 -2.309 16.982 -7.381 1.00 1.10 H new ATOM 0 HA ASP A 135 -1.730 14.807 -5.533 1.00 61.21 H new ATOM 0 HB2 ASP A 135 -0.203 16.798 -5.925 1.00 13.54 H new ATOM 0 HB3 ASP A 135 -1.379 17.796 -5.092 1.00 13.54 H new ATOM 2118 N LEU A 136 -3.533 15.073 -3.751 1.00 11.03 N ATOM 2119 CA LEU A 136 -4.748 15.022 -2.923 1.00 55.32 C ATOM 2120 C LEU A 136 -4.814 16.218 -1.961 1.00 41.04 C ATOM 2121 O LEU A 136 -3.849 16.506 -1.245 1.00 53.31 O ATOM 2122 CB LEU A 136 -4.815 13.692 -2.143 1.00 43.33 C ATOM 2123 CG LEU A 136 -4.944 12.403 -3.000 1.00 53.42 C ATOM 2124 CD1 LEU A 136 -5.010 11.153 -2.110 1.00 30.14 C ATOM 2125 CD2 LEU A 136 -6.165 12.467 -3.937 1.00 31.25 C ATOM 0 H LEU A 136 -2.852 14.347 -3.530 1.00 11.03 H new ATOM 0 HA LEU A 136 -5.611 15.079 -3.587 1.00 55.32 H new ATOM 0 HB2 LEU A 136 -3.918 13.608 -1.530 1.00 43.33 H new ATOM 0 HB3 LEU A 136 -5.664 13.737 -1.461 1.00 43.33 H new ATOM 0 HG LEU A 136 -4.051 12.335 -3.621 1.00 53.42 H new ATOM 0 HD11 LEU A 136 -5.100 10.265 -2.736 1.00 30.14 H new ATOM 0 HD12 LEU A 136 -4.102 11.084 -1.511 1.00 30.14 H new ATOM 0 HD13 LEU A 136 -5.875 11.221 -1.450 1.00 30.14 H new ATOM 0 HD21 LEU A 136 -6.224 11.549 -4.521 1.00 31.25 H new ATOM 0 HD22 LEU A 136 -7.073 12.579 -3.344 1.00 31.25 H new ATOM 0 HD23 LEU A 136 -6.063 13.319 -4.609 1.00 31.25 H new ATOM 2137 N SER A 137 -5.955 16.915 -1.982 1.00 33.21 N ATOM 2138 CA SER A 137 -6.233 18.073 -1.116 1.00 33.05 C ATOM 2139 C SER A 137 -7.112 17.641 0.072 1.00 4.24 C ATOM 2140 O SER A 137 -7.648 16.526 0.087 1.00 42.11 O ATOM 2141 CB SER A 137 -6.938 19.170 -1.949 1.00 73.34 C ATOM 2142 OG SER A 137 -6.163 19.518 -3.085 1.00 54.13 O ATOM 0 H SER A 137 -6.726 16.689 -2.610 1.00 33.21 H new ATOM 0 HA SER A 137 -5.299 18.472 -0.720 1.00 33.05 H new ATOM 0 HB2 SER A 137 -7.919 18.817 -2.267 1.00 73.34 H new ATOM 0 HB3 SER A 137 -7.102 20.053 -1.331 1.00 73.34 H new ATOM 0 HG SER A 137 -6.628 20.212 -3.598 1.00 54.13 H new ATOM 2148 N ASP A 138 -7.245 18.514 1.074 1.00 13.01 N ATOM 2149 CA ASP A 138 -8.112 18.269 2.241 1.00 12.15 C ATOM 2150 C ASP A 138 -9.591 18.450 1.843 1.00 0.21 C ATOM 2151 O ASP A 138 -10.058 19.566 1.609 1.00 51.04 O ATOM 2152 CB ASP A 138 -7.698 19.188 3.429 1.00 50.33 C ATOM 2153 CG ASP A 138 -7.673 20.696 3.110 1.00 61.44 C ATOM 2154 OD1 ASP A 138 -6.814 21.128 2.307 1.00 73.03 O ATOM 2155 OD2 ASP A 138 -8.500 21.455 3.659 1.00 24.31 O ATOM 0 H ASP A 138 -6.758 19.410 1.104 1.00 13.01 H new ATOM 0 HA ASP A 138 -7.988 17.240 2.579 1.00 12.15 H new ATOM 0 HB2 ASP A 138 -8.387 19.019 4.257 1.00 50.33 H new ATOM 0 HB3 ASP A 138 -6.708 18.888 3.772 1.00 50.33 H new ATOM 2160 N GLY A 139 -10.297 17.320 1.701 1.00 11.33 N ATOM 2161 CA GLY A 139 -11.688 17.297 1.215 1.00 31.13 C ATOM 2162 C GLY A 139 -11.808 16.628 -0.146 1.00 21.14 C ATOM 2163 O GLY A 139 -12.920 16.386 -0.621 1.00 33.15 O ATOM 0 H GLY A 139 -9.923 16.396 1.919 1.00 11.33 H new ATOM 0 HA2 GLY A 139 -12.314 16.769 1.934 1.00 31.13 H new ATOM 0 HA3 GLY A 139 -12.066 18.317 1.151 1.00 31.13 H new ATOM 2167 N ASP A 140 -10.651 16.345 -0.781 1.00 43.43 N ATOM 2168 CA ASP A 140 -10.571 15.628 -2.079 1.00 55.45 C ATOM 2169 C ASP A 140 -10.983 14.158 -1.884 1.00 42.45 C ATOM 2170 O ASP A 140 -11.119 13.716 -0.754 1.00 70.00 O ATOM 2171 CB ASP A 140 -9.115 15.729 -2.620 1.00 41.32 C ATOM 2172 CG ASP A 140 -8.917 15.398 -4.110 1.00 64.24 C ATOM 2173 OD1 ASP A 140 -9.905 15.271 -4.862 1.00 35.10 O ATOM 2174 OD2 ASP A 140 -7.754 15.298 -4.542 1.00 21.12 O ATOM 0 H ASP A 140 -9.739 16.608 -0.408 1.00 43.43 H new ATOM 0 HA ASP A 140 -11.251 16.079 -2.802 1.00 55.45 H new ATOM 0 HB2 ASP A 140 -8.754 16.742 -2.444 1.00 41.32 H new ATOM 0 HB3 ASP A 140 -8.485 15.060 -2.034 1.00 41.32 H new ATOM 2179 N GLU A 141 -11.221 13.400 -2.963 1.00 52.32 N ATOM 2180 CA GLU A 141 -11.564 11.957 -2.857 1.00 72.11 C ATOM 2181 C GLU A 141 -10.584 11.111 -3.685 1.00 44.01 C ATOM 2182 O GLU A 141 -9.995 11.602 -4.647 1.00 31.42 O ATOM 2183 CB GLU A 141 -13.039 11.742 -3.287 1.00 41.43 C ATOM 2184 CG GLU A 141 -14.056 12.466 -2.377 1.00 43.34 C ATOM 2185 CD GLU A 141 -15.495 12.425 -2.898 1.00 13.41 C ATOM 2186 OE1 GLU A 141 -16.185 11.404 -2.701 1.00 63.23 O ATOM 2187 OE2 GLU A 141 -15.944 13.424 -3.505 1.00 11.14 O ATOM 0 H GLU A 141 -11.185 13.751 -3.920 1.00 52.32 H new ATOM 0 HA GLU A 141 -11.468 11.629 -1.822 1.00 72.11 H new ATOM 0 HB2 GLU A 141 -13.166 12.092 -4.311 1.00 41.43 H new ATOM 0 HB3 GLU A 141 -13.258 10.674 -3.286 1.00 41.43 H new ATOM 0 HG2 GLU A 141 -14.026 12.015 -1.385 1.00 43.34 H new ATOM 0 HG3 GLU A 141 -13.751 13.506 -2.263 1.00 43.34 H new ATOM 2194 N ILE A 142 -10.429 9.831 -3.305 1.00 24.05 N ATOM 2195 CA ILE A 142 -9.391 8.928 -3.855 1.00 65.13 C ATOM 2196 C ILE A 142 -9.910 7.470 -3.839 1.00 71.33 C ATOM 2197 O ILE A 142 -10.675 7.094 -2.951 1.00 44.14 O ATOM 2198 CB ILE A 142 -8.055 9.054 -3.020 1.00 72.41 C ATOM 2199 CG1 ILE A 142 -6.916 8.118 -3.553 1.00 23.24 C ATOM 2200 CG2 ILE A 142 -8.311 8.804 -1.517 1.00 35.15 C ATOM 2201 CD1 ILE A 142 -6.420 8.428 -4.962 1.00 62.40 C ATOM 0 H ILE A 142 -11.022 9.387 -2.604 1.00 24.05 H new ATOM 0 HA ILE A 142 -9.175 9.214 -4.884 1.00 65.13 H new ATOM 0 HB ILE A 142 -7.707 10.079 -3.148 1.00 72.41 H new ATOM 0 HG12 ILE A 142 -6.071 8.176 -2.867 1.00 23.24 H new ATOM 0 HG13 ILE A 142 -7.274 7.089 -3.530 1.00 23.24 H new ATOM 0 HG21 ILE A 142 -7.374 8.897 -0.968 1.00 35.15 H new ATOM 0 HG22 ILE A 142 -9.026 9.537 -1.143 1.00 35.15 H new ATOM 0 HG23 ILE A 142 -8.714 7.801 -1.379 1.00 35.15 H new ATOM 0 HD11 ILE A 142 -5.634 7.724 -5.234 1.00 62.40 H new ATOM 0 HD12 ILE A 142 -7.247 8.339 -5.667 1.00 62.40 H new ATOM 0 HD13 ILE A 142 -6.024 9.443 -4.993 1.00 62.40 H new ATOM 2213 N THR A 143 -9.504 6.665 -4.831 1.00 41.53 N ATOM 2214 CA THR A 143 -9.880 5.242 -4.919 1.00 14.25 C ATOM 2215 C THR A 143 -8.949 4.377 -4.034 1.00 53.13 C ATOM 2216 O THR A 143 -7.739 4.611 -4.008 1.00 4.42 O ATOM 2217 CB THR A 143 -9.809 4.775 -6.404 1.00 70.32 C ATOM 2218 OG1 THR A 143 -10.737 5.541 -7.198 1.00 1.14 O ATOM 2219 CG2 THR A 143 -10.114 3.287 -6.561 1.00 43.04 C ATOM 0 H THR A 143 -8.906 6.979 -5.595 1.00 41.53 H new ATOM 0 HA THR A 143 -10.900 5.121 -4.555 1.00 14.25 H new ATOM 0 HB THR A 143 -8.788 4.940 -6.748 1.00 70.32 H new ATOM 0 HG1 THR A 143 -10.689 5.247 -8.132 1.00 1.14 H new ATOM 0 HG21 THR A 143 -10.052 3.012 -7.614 1.00 43.04 H new ATOM 0 HG22 THR A 143 -9.390 2.705 -5.990 1.00 43.04 H new ATOM 0 HG23 THR A 143 -11.118 3.080 -6.191 1.00 43.04 H new ATOM 2227 N LEU A 144 -9.522 3.390 -3.310 1.00 40.23 N ATOM 2228 CA LEU A 144 -8.785 2.500 -2.376 1.00 21.34 C ATOM 2229 C LEU A 144 -9.006 1.019 -2.778 1.00 31.41 C ATOM 2230 O LEU A 144 -10.069 0.438 -2.499 1.00 30.14 O ATOM 2231 CB LEU A 144 -9.257 2.742 -0.898 1.00 24.34 C ATOM 2232 CG LEU A 144 -8.489 3.813 -0.047 1.00 64.25 C ATOM 2233 CD1 LEU A 144 -7.020 3.392 0.214 1.00 5.40 C ATOM 2234 CD2 LEU A 144 -8.569 5.221 -0.677 1.00 0.24 C ATOM 0 H LEU A 144 -10.520 3.184 -3.356 1.00 40.23 H new ATOM 0 HA LEU A 144 -7.721 2.729 -2.436 1.00 21.34 H new ATOM 0 HB2 LEU A 144 -10.308 3.028 -0.926 1.00 24.34 H new ATOM 0 HB3 LEU A 144 -9.200 1.791 -0.369 1.00 24.34 H new ATOM 0 HG LEU A 144 -8.991 3.866 0.919 1.00 64.25 H new ATOM 0 HD11 LEU A 144 -6.521 4.159 0.806 1.00 5.40 H new ATOM 0 HD12 LEU A 144 -7.003 2.447 0.757 1.00 5.40 H new ATOM 0 HD13 LEU A 144 -6.501 3.274 -0.737 1.00 5.40 H new ATOM 0 HD21 LEU A 144 -8.024 5.930 -0.054 1.00 0.24 H new ATOM 0 HD22 LEU A 144 -8.128 5.199 -1.674 1.00 0.24 H new ATOM 0 HD23 LEU A 144 -9.612 5.529 -0.749 1.00 0.24 H new ATOM 2246 N ASP A 145 -8.014 0.428 -3.468 1.00 4.53 N ATOM 2247 CA ASP A 145 -8.013 -1.008 -3.826 1.00 62.14 C ATOM 2248 C ASP A 145 -7.169 -1.827 -2.846 1.00 62.14 C ATOM 2249 O ASP A 145 -5.946 -1.876 -2.960 1.00 52.42 O ATOM 2250 CB ASP A 145 -7.475 -1.215 -5.255 1.00 64.40 C ATOM 2251 CG ASP A 145 -8.502 -0.897 -6.322 1.00 60.32 C ATOM 2252 OD1 ASP A 145 -9.302 -1.803 -6.657 1.00 53.44 O ATOM 2253 OD2 ASP A 145 -8.524 0.246 -6.830 1.00 23.14 O ATOM 0 H ASP A 145 -7.188 0.930 -3.795 1.00 4.53 H new ATOM 0 HA ASP A 145 -9.046 -1.353 -3.774 1.00 62.14 H new ATOM 0 HB2 ASP A 145 -6.598 -0.585 -5.403 1.00 64.40 H new ATOM 0 HB3 ASP A 145 -7.148 -2.249 -5.369 1.00 64.40 H new ATOM 2258 N PHE A 146 -7.835 -2.496 -1.904 1.00 30.32 N ATOM 2259 CA PHE A 146 -7.163 -3.333 -0.885 1.00 21.31 C ATOM 2260 C PHE A 146 -6.686 -4.668 -1.476 1.00 21.51 C ATOM 2261 O PHE A 146 -5.884 -5.381 -0.864 1.00 32.24 O ATOM 2262 CB PHE A 146 -8.112 -3.559 0.306 1.00 72.31 C ATOM 2263 CG PHE A 146 -8.746 -2.279 0.828 1.00 32.41 C ATOM 2264 CD1 PHE A 146 -7.986 -1.121 0.975 1.00 74.54 C ATOM 2265 CD2 PHE A 146 -10.101 -2.221 1.138 1.00 74.22 C ATOM 2266 CE1 PHE A 146 -8.561 0.041 1.417 1.00 74.14 C ATOM 2267 CE2 PHE A 146 -10.673 -1.053 1.580 1.00 12.02 C ATOM 2268 CZ PHE A 146 -9.901 0.080 1.719 1.00 63.11 C ATOM 0 H PHE A 146 -8.851 -2.479 -1.818 1.00 30.32 H new ATOM 0 HA PHE A 146 -6.275 -2.807 -0.535 1.00 21.31 H new ATOM 0 HB2 PHE A 146 -8.900 -4.249 0.006 1.00 72.31 H new ATOM 0 HB3 PHE A 146 -7.560 -4.038 1.115 1.00 72.31 H new ATOM 0 HD1 PHE A 146 -6.932 -1.140 0.738 1.00 74.54 H new ATOM 0 HD2 PHE A 146 -10.711 -3.106 1.030 1.00 74.22 H new ATOM 0 HE1 PHE A 146 -7.959 0.930 1.529 1.00 74.14 H new ATOM 0 HE2 PHE A 146 -11.726 -1.023 1.818 1.00 12.02 H new ATOM 0 HZ PHE A 146 -10.349 0.999 2.066 1.00 63.11 H new ATOM 2278 N ASN A 147 -7.209 -4.984 -2.665 1.00 31.30 N ATOM 2279 CA ASN A 147 -6.763 -6.133 -3.463 1.00 25.15 C ATOM 2280 C ASN A 147 -5.295 -5.968 -3.902 1.00 2.41 C ATOM 2281 O ASN A 147 -4.548 -6.937 -3.907 1.00 52.22 O ATOM 2282 CB ASN A 147 -7.705 -6.366 -4.672 1.00 34.24 C ATOM 2283 CG ASN A 147 -8.061 -5.096 -5.446 1.00 3.31 C ATOM 2284 OD1 ASN A 147 -7.395 -4.723 -6.400 1.00 13.33 O ATOM 2285 ND2 ASN A 147 -9.125 -4.421 -5.037 1.00 21.34 N ATOM 0 H ASN A 147 -7.957 -4.448 -3.104 1.00 31.30 H new ATOM 0 HA ASN A 147 -6.813 -7.023 -2.836 1.00 25.15 H new ATOM 0 HB2 ASN A 147 -7.233 -7.073 -5.354 1.00 34.24 H new ATOM 0 HB3 ASN A 147 -8.625 -6.831 -4.317 1.00 34.24 H new ATOM 0 HD21 ASN A 147 -9.405 -3.568 -5.521 1.00 21.34 H new ATOM 0 HD22 ASN A 147 -9.664 -4.754 -4.238 1.00 21.34 H new ATOM 2292 N LEU A 148 -4.855 -4.720 -4.158 1.00 71.23 N ATOM 2293 CA LEU A 148 -3.487 -4.426 -4.657 1.00 73.23 C ATOM 2294 C LEU A 148 -2.435 -4.429 -3.514 1.00 12.33 C ATOM 2295 O LEU A 148 -1.442 -3.699 -3.576 1.00 34.14 O ATOM 2296 CB LEU A 148 -3.499 -3.065 -5.414 1.00 33.30 C ATOM 2297 CG LEU A 148 -4.528 -2.939 -6.585 1.00 24.04 C ATOM 2298 CD1 LEU A 148 -4.354 -1.611 -7.358 1.00 12.15 C ATOM 2299 CD2 LEU A 148 -4.472 -4.159 -7.534 1.00 54.12 C ATOM 0 H LEU A 148 -5.431 -3.888 -4.027 1.00 71.23 H new ATOM 0 HA LEU A 148 -3.192 -5.218 -5.345 1.00 73.23 H new ATOM 0 HB2 LEU A 148 -3.701 -2.273 -4.693 1.00 33.30 H new ATOM 0 HB3 LEU A 148 -2.501 -2.886 -5.813 1.00 33.30 H new ATOM 0 HG LEU A 148 -5.521 -2.926 -6.136 1.00 24.04 H new ATOM 0 HD11 LEU A 148 -5.086 -1.560 -8.164 1.00 12.15 H new ATOM 0 HD12 LEU A 148 -4.503 -0.772 -6.678 1.00 12.15 H new ATOM 0 HD13 LEU A 148 -3.349 -1.563 -7.778 1.00 12.15 H new ATOM 0 HD21 LEU A 148 -5.202 -4.032 -8.333 1.00 54.12 H new ATOM 0 HD22 LEU A 148 -3.474 -4.240 -7.964 1.00 54.12 H new ATOM 0 HD23 LEU A 148 -4.701 -5.066 -6.974 1.00 54.12 H new ATOM 2311 N ALA A 149 -2.646 -5.266 -2.478 1.00 45.45 N ATOM 2312 CA ALA A 149 -1.768 -5.332 -1.301 1.00 22.42 C ATOM 2313 C ALA A 149 -0.581 -6.305 -1.530 1.00 23.22 C ATOM 2314 O ALA A 149 -0.771 -7.516 -1.657 1.00 42.12 O ATOM 2315 CB ALA A 149 -2.585 -5.741 -0.072 1.00 52.04 C ATOM 0 H ALA A 149 -3.432 -5.915 -2.438 1.00 45.45 H new ATOM 0 HA ALA A 149 -1.342 -4.343 -1.131 1.00 22.42 H new ATOM 0 HB1 ALA A 149 -1.932 -5.789 0.799 1.00 52.04 H new ATOM 0 HB2 ALA A 149 -3.371 -5.006 0.104 1.00 52.04 H new ATOM 0 HB3 ALA A 149 -3.035 -6.719 -0.243 1.00 52.04 H new ATOM 2321 N TYR A 150 0.634 -5.748 -1.492 1.00 65.02 N ATOM 2322 CA TYR A 150 1.894 -6.432 -1.848 1.00 73.14 C ATOM 2323 C TYR A 150 2.518 -7.097 -0.600 1.00 41.23 C ATOM 2324 O TYR A 150 2.286 -6.639 0.526 1.00 53.20 O ATOM 2325 CB TYR A 150 2.861 -5.396 -2.483 1.00 22.31 C ATOM 2326 CG TYR A 150 2.201 -4.531 -3.582 1.00 52.22 C ATOM 2327 CD1 TYR A 150 1.627 -5.121 -4.712 1.00 44.13 C ATOM 2328 CD2 TYR A 150 2.131 -3.129 -3.480 1.00 34.23 C ATOM 2329 CE1 TYR A 150 1.015 -4.360 -5.689 1.00 13.21 C ATOM 2330 CE2 TYR A 150 1.520 -2.365 -4.466 1.00 55.24 C ATOM 2331 CZ TYR A 150 0.964 -2.989 -5.569 1.00 14.24 C ATOM 2332 OH TYR A 150 0.342 -2.244 -6.554 1.00 4.21 O ATOM 0 H TYR A 150 0.778 -4.780 -1.205 1.00 65.02 H new ATOM 0 HA TYR A 150 1.698 -7.224 -2.571 1.00 73.14 H new ATOM 0 HB2 TYR A 150 3.247 -4.743 -1.700 1.00 22.31 H new ATOM 0 HB3 TYR A 150 3.715 -5.922 -2.909 1.00 22.31 H new ATOM 0 HD1 TYR A 150 1.663 -6.195 -4.823 1.00 44.13 H new ATOM 0 HD2 TYR A 150 2.560 -2.638 -2.619 1.00 34.23 H new ATOM 0 HE1 TYR A 150 0.575 -4.842 -6.550 1.00 13.21 H new ATOM 0 HE2 TYR A 150 1.479 -1.290 -4.372 1.00 55.24 H new ATOM 0 HH TYR A 150 0.389 -1.293 -6.323 1.00 4.21 H new ATOM 2342 N SER A 151 3.274 -8.194 -0.818 1.00 44.54 N ATOM 2343 CA SER A 151 3.884 -9.025 0.250 1.00 22.25 C ATOM 2344 C SER A 151 4.901 -8.229 1.139 1.00 32.33 C ATOM 2345 O SER A 151 5.632 -7.376 0.622 1.00 13.53 O ATOM 2346 CB SER A 151 4.557 -10.262 -0.411 1.00 61.42 C ATOM 2347 OG SER A 151 4.966 -11.222 0.546 1.00 51.41 O ATOM 0 H SER A 151 3.483 -8.536 -1.756 1.00 44.54 H new ATOM 0 HA SER A 151 3.095 -9.346 0.930 1.00 22.25 H new ATOM 0 HB2 SER A 151 3.859 -10.723 -1.110 1.00 61.42 H new ATOM 0 HB3 SER A 151 5.421 -9.937 -0.990 1.00 61.42 H new ATOM 0 HG SER A 151 5.382 -11.983 0.089 1.00 51.41 H new ATOM 2353 N PRO A 152 4.943 -8.505 2.495 1.00 61.51 N ATOM 2354 CA PRO A 152 5.745 -7.730 3.486 1.00 73.22 C ATOM 2355 C PRO A 152 7.226 -8.138 3.532 1.00 20.32 C ATOM 2356 O PRO A 152 7.534 -9.322 3.706 1.00 22.31 O ATOM 2357 CB PRO A 152 5.050 -8.074 4.851 1.00 11.14 C ATOM 2358 CG PRO A 152 3.856 -8.910 4.492 1.00 62.53 C ATOM 2359 CD PRO A 152 4.222 -9.589 3.200 1.00 5.33 C ATOM 0 HA PRO A 152 5.763 -6.669 3.237 1.00 73.22 H new ATOM 0 HB2 PRO A 152 5.727 -8.618 5.510 1.00 11.14 H new ATOM 0 HB3 PRO A 152 4.751 -7.168 5.379 1.00 11.14 H new ATOM 0 HG2 PRO A 152 3.638 -9.640 5.272 1.00 62.53 H new ATOM 0 HG3 PRO A 152 2.965 -8.293 4.374 1.00 62.53 H new ATOM 0 HD2 PRO A 152 4.851 -10.465 3.360 1.00 5.33 H new ATOM 0 HD3 PRO A 152 3.343 -9.924 2.649 1.00 5.33 H new ATOM 2367 N PHE A 153 8.126 -7.153 3.382 1.00 15.23 N ATOM 2368 CA PHE A 153 9.581 -7.327 3.563 1.00 52.52 C ATOM 2369 C PHE A 153 9.954 -8.040 4.887 1.00 60.35 C ATOM 2370 O PHE A 153 10.650 -9.057 4.858 1.00 35.12 O ATOM 2371 CB PHE A 153 10.281 -5.953 3.463 1.00 3.44 C ATOM 2372 CG PHE A 153 10.103 -5.270 2.105 1.00 31.32 C ATOM 2373 CD1 PHE A 153 10.906 -5.631 1.022 1.00 75.24 C ATOM 2374 CD2 PHE A 153 9.123 -4.292 1.901 1.00 4.21 C ATOM 2375 CE1 PHE A 153 10.740 -5.038 -0.214 1.00 54.23 C ATOM 2376 CE2 PHE A 153 8.955 -3.705 0.659 1.00 42.55 C ATOM 2377 CZ PHE A 153 9.762 -4.078 -0.395 1.00 34.32 C ATOM 0 H PHE A 153 7.863 -6.201 3.128 1.00 15.23 H new ATOM 0 HA PHE A 153 9.930 -7.981 2.764 1.00 52.52 H new ATOM 0 HB2 PHE A 153 9.891 -5.299 4.243 1.00 3.44 H new ATOM 0 HB3 PHE A 153 11.346 -6.082 3.658 1.00 3.44 H new ATOM 0 HD1 PHE A 153 11.668 -6.385 1.153 1.00 75.24 H new ATOM 0 HD2 PHE A 153 8.490 -3.992 2.723 1.00 4.21 H new ATOM 0 HE1 PHE A 153 11.375 -5.324 -1.040 1.00 54.23 H new ATOM 0 HE2 PHE A 153 8.192 -2.955 0.515 1.00 42.55 H new ATOM 0 HZ PHE A 153 9.630 -3.619 -1.364 1.00 34.32 H new ATOM 2387 N CYS A 154 9.453 -7.531 6.024 1.00 42.30 N ATOM 2388 CA CYS A 154 9.768 -8.084 7.364 1.00 60.22 C ATOM 2389 C CYS A 154 9.361 -9.564 7.509 1.00 33.21 C ATOM 2390 O CYS A 154 10.049 -10.330 8.189 1.00 50.22 O ATOM 2391 CB CYS A 154 9.078 -7.241 8.445 1.00 44.43 C ATOM 2392 SG CYS A 154 7.285 -7.117 8.226 1.00 41.01 S ATOM 0 H CYS A 154 8.822 -6.730 6.048 1.00 42.30 H new ATOM 0 HA CYS A 154 10.850 -8.040 7.487 1.00 60.22 H new ATOM 0 HB2 CYS A 154 9.288 -7.675 9.423 1.00 44.43 H new ATOM 0 HB3 CYS A 154 9.507 -6.239 8.442 1.00 44.43 H new ATOM 0 HG CYS A 154 6.988 -5.953 7.730 1.00 41.01 H new ATOM 2398 N ALA A 155 8.235 -9.931 6.872 1.00 33.13 N ATOM 2399 CA ALA A 155 7.668 -11.293 6.904 1.00 14.14 C ATOM 2400 C ALA A 155 8.680 -12.397 6.539 1.00 71.42 C ATOM 2401 O ALA A 155 9.026 -13.237 7.376 1.00 64.12 O ATOM 2402 CB ALA A 155 6.480 -11.357 5.948 1.00 2.12 C ATOM 0 H ALA A 155 7.684 -9.281 6.312 1.00 33.13 H new ATOM 0 HA ALA A 155 7.363 -11.485 7.933 1.00 14.14 H new ATOM 0 HB1 ALA A 155 6.054 -12.360 5.964 1.00 2.12 H new ATOM 0 HB2 ALA A 155 5.724 -10.636 6.259 1.00 2.12 H new ATOM 0 HB3 ALA A 155 6.813 -11.121 4.937 1.00 2.12 H new ATOM 2408 N TYR A 156 9.137 -12.383 5.278 1.00 22.54 N ATOM 2409 CA TYR A 156 10.028 -13.430 4.731 1.00 3.51 C ATOM 2410 C TYR A 156 11.517 -13.148 5.027 1.00 23.31 C ATOM 2411 O TYR A 156 12.353 -14.044 4.865 1.00 75.24 O ATOM 2412 CB TYR A 156 9.769 -13.636 3.201 1.00 74.34 C ATOM 2413 CG TYR A 156 9.548 -12.339 2.397 1.00 62.34 C ATOM 2414 CD1 TYR A 156 10.540 -11.367 2.301 1.00 34.31 C ATOM 2415 CD2 TYR A 156 8.333 -12.088 1.746 1.00 53.13 C ATOM 2416 CE1 TYR A 156 10.335 -10.206 1.594 1.00 51.41 C ATOM 2417 CE2 TYR A 156 8.131 -10.921 1.030 1.00 12.32 C ATOM 2418 CZ TYR A 156 9.136 -9.985 0.963 1.00 0.51 C ATOM 2419 OH TYR A 156 8.938 -8.809 0.277 1.00 70.30 O ATOM 0 H TYR A 156 8.903 -11.651 4.607 1.00 22.54 H new ATOM 0 HA TYR A 156 9.786 -14.362 5.242 1.00 3.51 H new ATOM 0 HB2 TYR A 156 10.617 -14.171 2.773 1.00 74.34 H new ATOM 0 HB3 TYR A 156 8.894 -14.275 3.079 1.00 74.34 H new ATOM 0 HD1 TYR A 156 11.489 -11.528 2.791 1.00 34.31 H new ATOM 0 HD2 TYR A 156 7.540 -12.818 1.804 1.00 53.13 H new ATOM 0 HE1 TYR A 156 11.119 -9.466 1.535 1.00 51.41 H new ATOM 0 HE2 TYR A 156 7.191 -10.747 0.528 1.00 12.32 H new ATOM 0 HH TYR A 156 9.757 -8.569 -0.205 1.00 70.30 H new ATOM 2429 N SER A 157 11.841 -11.914 5.461 1.00 53.13 N ATOM 2430 CA SER A 157 13.222 -11.518 5.791 1.00 34.52 C ATOM 2431 C SER A 157 13.234 -10.568 7.007 1.00 71.23 C ATOM 2432 O SER A 157 12.783 -9.419 6.926 1.00 2.44 O ATOM 2433 CB SER A 157 13.895 -10.883 4.552 1.00 10.53 C ATOM 2434 OG SER A 157 13.072 -9.900 3.945 1.00 64.10 O ATOM 0 H SER A 157 11.157 -11.169 5.592 1.00 53.13 H new ATOM 0 HA SER A 157 13.798 -12.401 6.067 1.00 34.52 H new ATOM 0 HB2 SER A 157 14.842 -10.431 4.846 1.00 10.53 H new ATOM 0 HB3 SER A 157 14.125 -11.662 3.825 1.00 10.53 H new ATOM 0 HG SER A 157 12.310 -9.704 4.530 1.00 64.10 H new ATOM 2440 N ASP A 158 13.793 -11.065 8.124 1.00 71.20 N ATOM 2441 CA ASP A 158 13.727 -10.403 9.452 1.00 53.03 C ATOM 2442 C ASP A 158 14.705 -9.223 9.589 1.00 3.41 C ATOM 2443 O ASP A 158 14.708 -8.537 10.621 1.00 12.12 O ATOM 2444 CB ASP A 158 13.998 -11.443 10.566 1.00 63.31 C ATOM 2445 CG ASP A 158 12.998 -12.608 10.546 1.00 5.20 C ATOM 2446 OD1 ASP A 158 11.925 -12.494 11.180 1.00 44.32 O ATOM 2447 OD2 ASP A 158 13.274 -13.639 9.891 1.00 24.41 O ATOM 0 H ASP A 158 14.309 -11.945 8.138 1.00 71.20 H new ATOM 0 HA ASP A 158 12.723 -9.991 9.552 1.00 53.03 H new ATOM 0 HB2 ASP A 158 15.009 -11.835 10.453 1.00 63.31 H new ATOM 0 HB3 ASP A 158 13.955 -10.949 11.537 1.00 63.31 H new ATOM 2452 N THR A 159 15.519 -8.977 8.547 1.00 70.33 N ATOM 2453 CA THR A 159 16.504 -7.876 8.529 1.00 54.35 C ATOM 2454 C THR A 159 15.814 -6.489 8.481 1.00 51.15 C ATOM 2455 O THR A 159 16.424 -5.485 8.852 1.00 62.31 O ATOM 2456 CB THR A 159 17.513 -8.031 7.334 1.00 65.44 C ATOM 2457 OG1 THR A 159 18.550 -7.031 7.408 1.00 41.43 O ATOM 2458 CG2 THR A 159 16.808 -7.949 5.968 1.00 71.22 C ATOM 0 H THR A 159 15.514 -9.535 7.693 1.00 70.33 H new ATOM 0 HA THR A 159 17.066 -7.937 9.461 1.00 54.35 H new ATOM 0 HB THR A 159 17.960 -9.021 7.423 1.00 65.44 H new ATOM 0 HG1 THR A 159 19.169 -7.145 6.657 1.00 41.43 H new ATOM 0 HG21 THR A 159 17.544 -8.061 5.172 1.00 71.22 H new ATOM 0 HG22 THR A 159 16.067 -8.745 5.892 1.00 71.22 H new ATOM 0 HG23 THR A 159 16.313 -6.983 5.871 1.00 71.22 H new ATOM 2466 N PHE A 160 14.526 -6.451 8.092 1.00 51.13 N ATOM 2467 CA PHE A 160 13.761 -5.195 7.977 1.00 52.03 C ATOM 2468 C PHE A 160 13.070 -4.907 9.318 1.00 51.44 C ATOM 2469 O PHE A 160 12.311 -5.754 9.809 1.00 23.50 O ATOM 2470 CB PHE A 160 12.690 -5.304 6.858 1.00 35.22 C ATOM 2471 CG PHE A 160 13.253 -5.470 5.448 1.00 31.43 C ATOM 2472 CD1 PHE A 160 13.574 -6.732 4.946 1.00 55.12 C ATOM 2473 CD2 PHE A 160 13.436 -4.366 4.615 1.00 1.31 C ATOM 2474 CE1 PHE A 160 14.064 -6.882 3.659 1.00 13.33 C ATOM 2475 CE2 PHE A 160 13.922 -4.522 3.331 1.00 74.11 C ATOM 2476 CZ PHE A 160 14.234 -5.778 2.853 1.00 2.32 C ATOM 0 H PHE A 160 13.989 -7.284 7.850 1.00 51.13 H new ATOM 0 HA PHE A 160 14.446 -4.386 7.723 1.00 52.03 H new ATOM 0 HB2 PHE A 160 12.041 -6.152 7.077 1.00 35.22 H new ATOM 0 HB3 PHE A 160 12.067 -4.410 6.882 1.00 35.22 H new ATOM 0 HD1 PHE A 160 13.439 -7.603 5.569 1.00 55.12 H new ATOM 0 HD2 PHE A 160 13.195 -3.378 4.978 1.00 1.31 H new ATOM 0 HE1 PHE A 160 14.313 -7.865 3.287 1.00 13.33 H new ATOM 0 HE2 PHE A 160 14.058 -3.657 2.699 1.00 74.11 H new ATOM 0 HZ PHE A 160 14.611 -5.896 1.848 1.00 2.32 H new ATOM 2486 N SER A 161 13.344 -3.732 9.912 1.00 13.02 N ATOM 2487 CA SER A 161 12.622 -3.262 11.104 1.00 73.01 C ATOM 2488 C SER A 161 11.172 -2.941 10.697 1.00 64.21 C ATOM 2489 O SER A 161 10.955 -2.264 9.683 1.00 44.21 O ATOM 2490 CB SER A 161 13.313 -2.018 11.712 1.00 54.22 C ATOM 2491 OG SER A 161 12.635 -1.552 12.874 1.00 11.23 O ATOM 0 H SER A 161 14.064 -3.089 9.583 1.00 13.02 H new ATOM 0 HA SER A 161 12.627 -4.039 11.869 1.00 73.01 H new ATOM 0 HB2 SER A 161 14.344 -2.263 11.966 1.00 54.22 H new ATOM 0 HB3 SER A 161 13.349 -1.222 10.968 1.00 54.22 H new ATOM 0 HG SER A 161 13.100 -0.767 13.232 1.00 11.23 H new ATOM 2497 N CYS A 162 10.200 -3.452 11.469 1.00 14.21 N ATOM 2498 CA CYS A 162 8.767 -3.332 11.157 1.00 24.34 C ATOM 2499 C CYS A 162 8.292 -1.855 11.155 1.00 45.00 C ATOM 2500 O CYS A 162 8.849 -1.024 11.885 1.00 61.42 O ATOM 2501 CB CYS A 162 7.966 -4.169 12.184 1.00 42.44 C ATOM 2502 SG CYS A 162 8.326 -3.753 13.903 1.00 61.22 S ATOM 0 H CYS A 162 10.387 -3.963 12.332 1.00 14.21 H new ATOM 0 HA CYS A 162 8.594 -3.712 10.150 1.00 24.34 H new ATOM 0 HB2 CYS A 162 6.901 -4.028 12.001 1.00 42.44 H new ATOM 0 HB3 CYS A 162 8.180 -5.226 12.023 1.00 42.44 H new ATOM 0 HG CYS A 162 7.610 -4.500 14.689 1.00 61.22 H new ATOM 2508 N PRO A 163 7.261 -1.506 10.317 1.00 73.41 N ATOM 2509 CA PRO A 163 6.675 -0.142 10.259 1.00 14.52 C ATOM 2510 C PRO A 163 5.969 0.269 11.564 1.00 21.12 C ATOM 2511 O PRO A 163 5.779 -0.556 12.467 1.00 64.54 O ATOM 2512 CB PRO A 163 5.661 -0.223 9.082 1.00 34.11 C ATOM 2513 CG PRO A 163 6.081 -1.419 8.304 1.00 2.40 C ATOM 2514 CD PRO A 163 6.588 -2.398 9.330 1.00 63.45 C ATOM 0 HA PRO A 163 7.446 0.615 10.119 1.00 14.52 H new ATOM 0 HB2 PRO A 163 4.639 -0.326 9.446 1.00 34.11 H new ATOM 0 HB3 PRO A 163 5.692 0.678 8.470 1.00 34.11 H new ATOM 0 HG2 PRO A 163 5.246 -1.836 7.741 1.00 2.40 H new ATOM 0 HG3 PRO A 163 6.858 -1.167 7.582 1.00 2.40 H new ATOM 0 HD2 PRO A 163 5.777 -2.968 9.784 1.00 63.45 H new ATOM 0 HD3 PRO A 163 7.280 -3.119 8.896 1.00 63.45 H new ATOM 2522 N LEU A 164 5.605 1.560 11.655 1.00 53.33 N ATOM 2523 CA LEU A 164 4.781 2.099 12.748 1.00 23.32 C ATOM 2524 C LEU A 164 3.333 2.263 12.221 1.00 72.40 C ATOM 2525 O LEU A 164 3.029 3.284 11.589 1.00 72.35 O ATOM 2526 CB LEU A 164 5.342 3.473 13.246 1.00 63.05 C ATOM 2527 CG LEU A 164 6.808 3.481 13.792 1.00 5.03 C ATOM 2528 CD1 LEU A 164 7.246 4.906 14.211 1.00 75.11 C ATOM 2529 CD2 LEU A 164 6.985 2.486 14.957 1.00 2.05 C ATOM 0 H LEU A 164 5.877 2.262 10.967 1.00 53.33 H new ATOM 0 HA LEU A 164 4.799 1.415 13.596 1.00 23.32 H new ATOM 0 HB2 LEU A 164 5.283 4.183 12.421 1.00 63.05 H new ATOM 0 HB3 LEU A 164 4.685 3.843 14.033 1.00 63.05 H new ATOM 0 HG LEU A 164 7.457 3.156 12.978 1.00 5.03 H new ATOM 0 HD11 LEU A 164 8.269 4.877 14.586 1.00 75.11 H new ATOM 0 HD12 LEU A 164 7.194 5.571 13.349 1.00 75.11 H new ATOM 0 HD13 LEU A 164 6.583 5.275 14.994 1.00 75.11 H new ATOM 0 HD21 LEU A 164 8.016 2.519 15.310 1.00 2.05 H new ATOM 0 HD22 LEU A 164 6.313 2.756 15.772 1.00 2.05 H new ATOM 0 HD23 LEU A 164 6.752 1.478 14.613 1.00 2.05 H new ATOM 2541 N PRO A 165 2.428 1.242 12.393 1.00 22.34 N ATOM 2542 CA PRO A 165 1.033 1.355 11.941 1.00 32.31 C ATOM 2543 C PRO A 165 0.141 2.011 13.029 1.00 33.44 C ATOM 2544 O PRO A 165 0.075 1.512 14.163 1.00 62.04 O ATOM 2545 CB PRO A 165 0.651 -0.123 11.667 1.00 61.14 C ATOM 2546 CG PRO A 165 1.453 -0.930 12.656 1.00 71.04 C ATOM 2547 CD PRO A 165 2.673 -0.085 13.030 1.00 25.15 C ATOM 0 HA PRO A 165 0.899 1.993 11.067 1.00 32.31 H new ATOM 0 HB2 PRO A 165 -0.418 -0.285 11.803 1.00 61.14 H new ATOM 0 HB3 PRO A 165 0.889 -0.407 10.642 1.00 61.14 H new ATOM 0 HG2 PRO A 165 0.858 -1.161 13.539 1.00 71.04 H new ATOM 0 HG3 PRO A 165 1.760 -1.881 12.220 1.00 71.04 H new ATOM 0 HD2 PRO A 165 2.773 0.008 14.111 1.00 25.15 H new ATOM 0 HD3 PRO A 165 3.594 -0.536 12.662 1.00 25.15 H new ATOM 2555 N PRO A 166 -0.550 3.148 12.709 1.00 64.43 N ATOM 2556 CA PRO A 166 -1.507 3.777 13.644 1.00 64.20 C ATOM 2557 C PRO A 166 -2.693 2.838 13.952 1.00 41.33 C ATOM 2558 O PRO A 166 -3.068 2.000 13.129 1.00 35.31 O ATOM 2559 CB PRO A 166 -1.959 5.069 12.912 1.00 14.10 C ATOM 2560 CG PRO A 166 -1.623 4.844 11.468 1.00 70.01 C ATOM 2561 CD PRO A 166 -0.427 3.924 11.443 1.00 33.35 C ATOM 0 HA PRO A 166 -1.064 3.993 14.616 1.00 64.20 H new ATOM 0 HB2 PRO A 166 -3.027 5.243 13.045 1.00 14.10 H new ATOM 0 HB3 PRO A 166 -1.442 5.945 13.304 1.00 14.10 H new ATOM 0 HG2 PRO A 166 -2.466 4.399 10.939 1.00 70.01 H new ATOM 0 HG3 PRO A 166 -1.397 5.787 10.971 1.00 70.01 H new ATOM 0 HD2 PRO A 166 -0.443 3.271 10.570 1.00 33.35 H new ATOM 0 HD3 PRO A 166 0.508 4.484 11.406 1.00 33.35 H new ATOM 2569 N GLU A 167 -3.254 2.985 15.155 1.00 40.44 N ATOM 2570 CA GLU A 167 -4.358 2.139 15.657 1.00 1.24 C ATOM 2571 C GLU A 167 -5.661 2.383 14.875 1.00 64.22 C ATOM 2572 O GLU A 167 -6.527 1.506 14.807 1.00 43.01 O ATOM 2573 CB GLU A 167 -4.561 2.396 17.166 1.00 1.11 C ATOM 2574 CG GLU A 167 -3.295 2.157 18.015 1.00 35.40 C ATOM 2575 CD GLU A 167 -3.424 2.671 19.452 1.00 14.13 C ATOM 2576 OE1 GLU A 167 -3.388 3.907 19.646 1.00 54.13 O ATOM 2577 OE2 GLU A 167 -3.573 1.857 20.390 1.00 51.32 O ATOM 0 H GLU A 167 -2.957 3.699 15.820 1.00 40.44 H new ATOM 0 HA GLU A 167 -4.088 1.094 15.506 1.00 1.24 H new ATOM 0 HB2 GLU A 167 -4.894 3.424 17.308 1.00 1.11 H new ATOM 0 HB3 GLU A 167 -5.359 1.749 17.531 1.00 1.11 H new ATOM 0 HG2 GLU A 167 -3.076 1.089 18.037 1.00 35.40 H new ATOM 0 HG3 GLU A 167 -2.447 2.646 17.536 1.00 35.40 H new ATOM 2584 N SER A 168 -5.767 3.575 14.272 1.00 41.34 N ATOM 2585 CA SER A 168 -6.914 3.978 13.438 1.00 1.22 C ATOM 2586 C SER A 168 -6.868 3.296 12.044 1.00 43.33 C ATOM 2587 O SER A 168 -7.881 3.221 11.340 1.00 44.13 O ATOM 2588 CB SER A 168 -6.911 5.514 13.316 1.00 44.10 C ATOM 2589 OG SER A 168 -6.913 6.136 14.603 1.00 62.40 O ATOM 0 H SER A 168 -5.051 4.297 14.349 1.00 41.34 H new ATOM 0 HA SER A 168 -7.841 3.652 13.909 1.00 1.22 H new ATOM 0 HB2 SER A 168 -6.033 5.835 12.756 1.00 44.10 H new ATOM 0 HB3 SER A 168 -7.785 5.838 12.751 1.00 44.10 H new ATOM 0 HG SER A 168 -6.909 7.110 14.496 1.00 62.40 H new ATOM 2595 N ASN A 169 -5.693 2.740 11.714 1.00 42.13 N ATOM 2596 CA ASN A 169 -5.421 2.042 10.445 1.00 12.13 C ATOM 2597 C ASN A 169 -5.815 0.550 10.541 1.00 44.41 C ATOM 2598 O ASN A 169 -5.890 -0.155 9.525 1.00 71.22 O ATOM 2599 CB ASN A 169 -3.910 2.217 10.129 1.00 13.21 C ATOM 2600 CG ASN A 169 -3.406 1.440 8.921 1.00 52.12 C ATOM 2601 OD1 ASN A 169 -2.845 0.349 9.046 1.00 50.01 O ATOM 2602 ND2 ASN A 169 -3.633 1.981 7.748 1.00 2.13 N ATOM 0 H ASN A 169 -4.885 2.763 12.336 1.00 42.13 H new ATOM 0 HA ASN A 169 -6.019 2.466 9.638 1.00 12.13 H new ATOM 0 HB2 ASN A 169 -3.709 3.276 9.969 1.00 13.21 H new ATOM 0 HB3 ASN A 169 -3.335 1.912 11.003 1.00 13.21 H new ATOM 0 HD21 ASN A 169 -3.343 1.497 6.898 1.00 2.13 H new ATOM 0 HD22 ASN A 169 -4.100 2.886 7.685 1.00 2.13 H new ATOM 2609 N TRP A 170 -6.097 0.087 11.772 1.00 74.15 N ATOM 2610 CA TRP A 170 -6.426 -1.318 12.044 1.00 11.21 C ATOM 2611 C TRP A 170 -7.877 -1.612 11.613 1.00 31.24 C ATOM 2612 O TRP A 170 -8.831 -1.065 12.184 1.00 11.05 O ATOM 2613 CB TRP A 170 -6.221 -1.648 13.549 1.00 41.24 C ATOM 2614 CG TRP A 170 -4.802 -1.455 14.067 1.00 51.52 C ATOM 2615 CD1 TRP A 170 -3.691 -1.066 13.362 1.00 1.41 C ATOM 2616 CD2 TRP A 170 -4.353 -1.657 15.420 1.00 13.03 C ATOM 2617 NE1 TRP A 170 -2.598 -0.998 14.192 1.00 74.23 N ATOM 2618 CE2 TRP A 170 -2.978 -1.361 15.460 1.00 54.12 C ATOM 2619 CE3 TRP A 170 -4.987 -2.051 16.603 1.00 31.52 C ATOM 2620 CZ2 TRP A 170 -2.229 -1.445 16.636 1.00 1.34 C ATOM 2621 CZ3 TRP A 170 -4.243 -2.143 17.765 1.00 12.53 C ATOM 2622 CH2 TRP A 170 -2.878 -1.840 17.776 1.00 54.20 C ATOM 0 H TRP A 170 -6.102 0.678 12.603 1.00 74.15 H new ATOM 0 HA TRP A 170 -5.755 -1.953 11.466 1.00 11.21 H new ATOM 0 HB2 TRP A 170 -6.893 -1.023 14.137 1.00 41.24 H new ATOM 0 HB3 TRP A 170 -6.516 -2.683 13.721 1.00 41.24 H new ATOM 0 HD1 TRP A 170 -3.677 -0.845 12.305 1.00 1.41 H new ATOM 0 HE1 TRP A 170 -1.657 -0.722 13.911 1.00 74.23 H new ATOM 0 HE3 TRP A 170 -6.042 -2.280 16.609 1.00 31.52 H new ATOM 0 HZ2 TRP A 170 -1.176 -1.207 16.646 1.00 1.34 H new ATOM 0 HZ3 TRP A 170 -4.725 -2.454 18.680 1.00 12.53 H new ATOM 0 HH2 TRP A 170 -2.325 -1.919 18.700 1.00 54.20 H new ATOM 2633 N LEU A 171 -8.026 -2.463 10.591 1.00 10.11 N ATOM 2634 CA LEU A 171 -9.326 -2.885 10.068 1.00 1.12 C ATOM 2635 C LEU A 171 -9.734 -4.159 10.812 1.00 23.14 C ATOM 2636 O LEU A 171 -9.015 -5.166 10.750 1.00 64.55 O ATOM 2637 CB LEU A 171 -9.234 -3.163 8.533 1.00 71.05 C ATOM 2638 CG LEU A 171 -8.474 -2.104 7.669 1.00 64.54 C ATOM 2639 CD1 LEU A 171 -8.459 -2.496 6.174 1.00 72.35 C ATOM 2640 CD2 LEU A 171 -9.050 -0.695 7.861 1.00 64.41 C ATOM 0 H LEU A 171 -7.236 -2.882 10.100 1.00 10.11 H new ATOM 0 HA LEU A 171 -10.067 -2.100 10.219 1.00 1.12 H new ATOM 0 HB2 LEU A 171 -8.749 -4.129 8.391 1.00 71.05 H new ATOM 0 HB3 LEU A 171 -10.248 -3.255 8.143 1.00 71.05 H new ATOM 0 HG LEU A 171 -7.442 -2.089 8.020 1.00 64.54 H new ATOM 0 HD11 LEU A 171 -7.923 -1.737 5.604 1.00 72.35 H new ATOM 0 HD12 LEU A 171 -7.961 -3.458 6.055 1.00 72.35 H new ATOM 0 HD13 LEU A 171 -9.483 -2.569 5.807 1.00 72.35 H new ATOM 0 HD21 LEU A 171 -8.495 0.012 7.244 1.00 64.41 H new ATOM 0 HD22 LEU A 171 -10.099 -0.688 7.567 1.00 64.41 H new ATOM 0 HD23 LEU A 171 -8.965 -0.407 8.909 1.00 64.41 H new ATOM 2652 N GLU A 172 -10.869 -4.124 11.527 1.00 71.23 N ATOM 2653 CA GLU A 172 -11.397 -5.298 12.244 1.00 11.52 C ATOM 2654 C GLU A 172 -12.303 -6.100 11.275 1.00 4.34 C ATOM 2655 O GLU A 172 -13.451 -6.436 11.578 1.00 73.43 O ATOM 2656 CB GLU A 172 -12.161 -4.811 13.515 1.00 11.23 C ATOM 2657 CG GLU A 172 -12.320 -5.856 14.640 1.00 22.25 C ATOM 2658 CD GLU A 172 -10.990 -6.245 15.322 1.00 42.13 C ATOM 2659 OE1 GLU A 172 -10.328 -5.356 15.911 1.00 14.01 O ATOM 2660 OE2 GLU A 172 -10.605 -7.430 15.289 1.00 34.43 O ATOM 0 H GLU A 172 -11.444 -3.288 11.625 1.00 71.23 H new ATOM 0 HA GLU A 172 -10.597 -5.959 12.577 1.00 11.52 H new ATOM 0 HB2 GLU A 172 -11.639 -3.944 13.920 1.00 11.23 H new ATOM 0 HB3 GLU A 172 -13.153 -4.474 13.214 1.00 11.23 H new ATOM 0 HG2 GLU A 172 -13.003 -5.464 15.394 1.00 22.25 H new ATOM 0 HG3 GLU A 172 -12.782 -6.753 14.227 1.00 22.25 H new ATOM 2667 N THR A 173 -11.722 -6.395 10.100 1.00 12.50 N ATOM 2668 CA THR A 173 -12.345 -7.140 9.005 1.00 22.01 C ATOM 2669 C THR A 173 -11.222 -7.654 8.072 1.00 33.35 C ATOM 2670 O THR A 173 -10.142 -7.047 7.998 1.00 25.32 O ATOM 2671 CB THR A 173 -13.363 -6.260 8.212 1.00 13.32 C ATOM 2672 OG1 THR A 173 -13.976 -7.042 7.176 1.00 12.55 O ATOM 2673 CG2 THR A 173 -12.719 -5.001 7.592 1.00 23.11 C ATOM 0 H THR A 173 -10.768 -6.107 9.883 1.00 12.50 H new ATOM 0 HA THR A 173 -12.910 -7.977 9.415 1.00 22.01 H new ATOM 0 HB THR A 173 -14.110 -5.919 8.929 1.00 13.32 H new ATOM 0 HG1 THR A 173 -14.213 -6.460 6.424 1.00 12.55 H new ATOM 0 HG21 THR A 173 -13.477 -4.432 7.054 1.00 23.11 H new ATOM 0 HG22 THR A 173 -12.294 -4.383 8.383 1.00 23.11 H new ATOM 0 HG23 THR A 173 -11.931 -5.299 6.901 1.00 23.11 H new ATOM 2681 N ALA A 174 -11.473 -8.777 7.380 1.00 23.13 N ATOM 2682 CA ALA A 174 -10.456 -9.451 6.552 1.00 65.14 C ATOM 2683 C ALA A 174 -10.655 -9.091 5.076 1.00 62.53 C ATOM 2684 O ALA A 174 -11.789 -9.097 4.572 1.00 75.04 O ATOM 2685 CB ALA A 174 -10.523 -10.970 6.763 1.00 54.20 C ATOM 0 H ALA A 174 -12.381 -9.242 7.377 1.00 23.13 H new ATOM 0 HA ALA A 174 -9.466 -9.110 6.855 1.00 65.14 H new ATOM 0 HB1 ALA A 174 -9.767 -11.457 6.146 1.00 54.20 H new ATOM 0 HB2 ALA A 174 -10.338 -11.200 7.812 1.00 54.20 H new ATOM 0 HB3 ALA A 174 -11.511 -11.333 6.480 1.00 54.20 H new ATOM 2691 N VAL A 175 -9.542 -8.792 4.390 1.00 1.32 N ATOM 2692 CA VAL A 175 -9.549 -8.413 2.976 1.00 63.20 C ATOM 2693 C VAL A 175 -9.417 -9.678 2.119 1.00 71.44 C ATOM 2694 O VAL A 175 -8.317 -10.159 1.834 1.00 21.25 O ATOM 2695 CB VAL A 175 -8.414 -7.358 2.649 1.00 3.44 C ATOM 2696 CG1 VAL A 175 -8.324 -7.058 1.129 1.00 33.11 C ATOM 2697 CG2 VAL A 175 -8.655 -6.056 3.455 1.00 75.21 C ATOM 0 H VAL A 175 -8.610 -8.807 4.805 1.00 1.32 H new ATOM 0 HA VAL A 175 -10.494 -7.924 2.741 1.00 63.20 H new ATOM 0 HB VAL A 175 -7.458 -7.789 2.946 1.00 3.44 H new ATOM 0 HG11 VAL A 175 -7.533 -6.330 0.948 1.00 33.11 H new ATOM 0 HG12 VAL A 175 -8.100 -7.978 0.589 1.00 33.11 H new ATOM 0 HG13 VAL A 175 -9.275 -6.655 0.781 1.00 33.11 H new ATOM 0 HG21 VAL A 175 -7.870 -5.335 3.225 1.00 75.21 H new ATOM 0 HG22 VAL A 175 -9.624 -5.636 3.186 1.00 75.21 H new ATOM 0 HG23 VAL A 175 -8.640 -6.280 4.522 1.00 75.21 H new ATOM 2707 N THR A 176 -10.573 -10.259 1.791 1.00 54.42 N ATOM 2708 CA THR A 176 -10.691 -11.348 0.826 1.00 54.23 C ATOM 2709 C THR A 176 -11.156 -10.767 -0.520 1.00 61.11 C ATOM 2710 O THR A 176 -12.336 -10.441 -0.695 1.00 63.12 O ATOM 2711 CB THR A 176 -11.691 -12.431 1.360 1.00 32.25 C ATOM 2712 OG1 THR A 176 -12.908 -11.798 1.816 1.00 35.42 O ATOM 2713 CG2 THR A 176 -11.082 -13.253 2.514 1.00 60.20 C ATOM 0 H THR A 176 -11.466 -9.980 2.196 1.00 54.42 H new ATOM 0 HA THR A 176 -9.726 -11.834 0.684 1.00 54.23 H new ATOM 0 HB THR A 176 -11.909 -13.110 0.536 1.00 32.25 H new ATOM 0 HG1 THR A 176 -13.165 -11.092 1.187 1.00 35.42 H new ATOM 0 HG21 THR A 176 -11.806 -13.992 2.856 1.00 60.20 H new ATOM 0 HG22 THR A 176 -10.183 -13.760 2.164 1.00 60.20 H new ATOM 0 HG23 THR A 176 -10.826 -12.588 3.339 1.00 60.20 H new ATOM 2721 N ALA A 177 -10.201 -10.581 -1.441 1.00 11.14 N ATOM 2722 CA ALA A 177 -10.451 -10.017 -2.777 1.00 71.34 C ATOM 2723 C ALA A 177 -9.790 -10.908 -3.830 1.00 40.42 C ATOM 2724 O ALA A 177 -8.571 -11.110 -3.781 1.00 72.34 O ATOM 2725 CB ALA A 177 -9.934 -8.573 -2.840 1.00 64.44 C ATOM 0 H ALA A 177 -9.223 -10.820 -1.279 1.00 11.14 H new ATOM 0 HA ALA A 177 -11.521 -9.988 -2.980 1.00 71.34 H new ATOM 0 HB1 ALA A 177 -10.122 -8.162 -3.832 1.00 64.44 H new ATOM 0 HB2 ALA A 177 -10.449 -7.969 -2.093 1.00 64.44 H new ATOM 0 HB3 ALA A 177 -8.863 -8.561 -2.640 1.00 64.44 H new ATOM 2731 N GLY A 178 -10.612 -11.436 -4.766 1.00 73.52 N ATOM 2732 CA GLY A 178 -10.171 -12.434 -5.748 1.00 40.32 C ATOM 2733 C GLY A 178 -9.550 -13.680 -5.115 1.00 4.41 C ATOM 2734 O GLY A 178 -9.933 -14.075 -4.005 1.00 42.52 O ATOM 0 H GLY A 178 -11.595 -11.178 -4.856 1.00 73.52 H new ATOM 0 HA2 GLY A 178 -11.023 -12.733 -6.358 1.00 40.32 H new ATOM 0 HA3 GLY A 178 -9.444 -11.976 -6.418 1.00 40.32 H new ATOM 2738 N GLU A 179 -8.610 -14.310 -5.836 1.00 75.34 N ATOM 2739 CA GLU A 179 -7.755 -15.375 -5.287 1.00 3.21 C ATOM 2740 C GLU A 179 -6.745 -14.763 -4.291 1.00 13.35 C ATOM 2741 O GLU A 179 -6.383 -13.590 -4.396 1.00 43.35 O ATOM 2742 CB GLU A 179 -7.030 -16.128 -6.447 1.00 54.13 C ATOM 2743 CG GLU A 179 -6.271 -17.410 -6.035 1.00 73.21 C ATOM 2744 CD GLU A 179 -7.165 -18.416 -5.283 1.00 24.12 C ATOM 2745 OE1 GLU A 179 -8.008 -19.079 -5.930 1.00 32.21 O ATOM 2746 OE2 GLU A 179 -7.063 -18.511 -4.039 1.00 32.04 O ATOM 0 H GLU A 179 -8.421 -14.096 -6.815 1.00 75.34 H new ATOM 0 HA GLU A 179 -8.367 -16.101 -4.751 1.00 3.21 H new ATOM 0 HB2 GLU A 179 -7.769 -16.391 -7.204 1.00 54.13 H new ATOM 0 HB3 GLU A 179 -6.324 -15.443 -6.916 1.00 54.13 H new ATOM 0 HG2 GLU A 179 -5.863 -17.888 -6.926 1.00 73.21 H new ATOM 0 HG3 GLU A 179 -5.425 -17.139 -5.403 1.00 73.21 H new ATOM 2753 N ARG A 180 -6.258 -15.578 -3.357 1.00 2.25 N ATOM 2754 CA ARG A 180 -5.429 -15.119 -2.234 1.00 33.05 C ATOM 2755 C ARG A 180 -4.108 -15.891 -2.250 1.00 72.42 C ATOM 2756 O ARG A 180 -4.127 -17.115 -2.446 1.00 64.40 O ATOM 2757 CB ARG A 180 -6.167 -15.396 -0.904 1.00 43.34 C ATOM 2758 CG ARG A 180 -7.527 -14.678 -0.718 1.00 20.21 C ATOM 2759 CD ARG A 180 -8.356 -15.295 0.431 1.00 2.40 C ATOM 2760 NE ARG A 180 -7.547 -15.542 1.642 1.00 40.31 N ATOM 2761 CZ ARG A 180 -7.653 -16.618 2.447 1.00 62.42 C ATOM 2762 NH1 ARG A 180 -8.552 -17.573 2.208 1.00 54.21 N ATOM 2763 NH2 ARG A 180 -6.822 -16.744 3.470 1.00 53.53 N ATOM 0 H ARG A 180 -6.427 -16.584 -3.355 1.00 2.25 H new ATOM 0 HA ARG A 180 -5.238 -14.050 -2.326 1.00 33.05 H new ATOM 0 HB2 ARG A 180 -6.332 -16.470 -0.820 1.00 43.34 H new ATOM 0 HB3 ARG A 180 -5.512 -15.109 -0.082 1.00 43.34 H new ATOM 0 HG2 ARG A 180 -7.354 -13.621 -0.513 1.00 20.21 H new ATOM 0 HG3 ARG A 180 -8.096 -14.734 -1.646 1.00 20.21 H new ATOM 0 HD2 ARG A 180 -9.181 -14.627 0.679 1.00 2.40 H new ATOM 0 HD3 ARG A 180 -8.796 -16.234 0.094 1.00 2.40 H new ATOM 0 HE ARG A 180 -6.850 -14.840 1.890 1.00 40.31 H new ATOM 0 HH11 ARG A 180 -9.175 -17.497 1.404 1.00 54.21 H new ATOM 0 HH12 ARG A 180 -8.617 -18.380 2.829 1.00 54.21 H new ATOM 0 HH21 ARG A 180 -6.112 -16.032 3.641 1.00 53.53 H new ATOM 0 HH22 ARG A 180 -6.892 -17.553 4.087 1.00 53.53 H new