USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 789 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 58 MET CE :methyl -106:sc= -0.275 (180deg=-1.66) USER MOD Set 1.2: A 104 SER OG : rot -130:sc= 0.966 USER MOD Single : A 27 SER OG : rot -64:sc= 1.06 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -1.61 K(o=-1.6,f=-0.26) USER MOD Single : A 38 THR OG1 : rot 21:sc= 0.189 USER MOD Single : A 40 SER OG : rot 113:sc= 0.232 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0.737 USER MOD Single : A 43 LYS NZ :NH3+ 141:sc= 0.345 (180deg=0.00391) USER MOD Single : A 45 GLN : amide:sc= -1.24 K(o=-1.2,f=-0.0042) USER MOD Single : A 47 GLN : amide:sc= -0.559 X(o=-0.56,f=-0.57) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 161:sc= 1.17 (180deg=0.822) USER MOD Single : A 57 HIS : no HD1:sc= 0.5 K(o=0.5,f=-5!) USER MOD Single : A 61 SER OG : rot 160:sc= 1.27 USER MOD Single : A 62 GLN : amide:sc= -2.51! K(o=-2.5!,f=0.81) USER MOD Single : A 63 SER OG : rot -9:sc= 1.29 USER MOD Single : A 67 SER OG : rot 91:sc= 0.329 USER MOD Single : A 68 SER OG : rot 34:sc= 0.18 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.601 K(o=-0.6,f=0) USER MOD Single : A 75 SER OG : rot -76:sc= 1.18 USER MOD Single : A 76 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.11) USER MOD Single : A 78 SER OG : rot 180:sc= -0.419 USER MOD Single : A 79 LYS NZ :NH3+ -146:sc= 2.13 (180deg=0.43) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 85 ASN : amide:sc= -0.721 X(o=-0.72,f=-0.54) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 170:sc= 0 USER MOD Single : A 99 TYR OH : rot 26:sc= 0.763 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 103 SER OG : rot 180:sc= -0.505 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -1.42! K(o=-1.4!,f=-0.18) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 1.18 K(o=1.2,f=-3.7!) USER MOD Single : A 120 SER OG : rot -108:sc=-0.00962 USER MOD Single : A 126 HIS : no HD1:sc=-0.00714 X(o=-0.0071,f=-0.0098) USER MOD Single : A 127 SER OG : rot 43:sc= -2.27! USER MOD Single : A 131 THR OG1 : rot 11:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.049 -10.474 -24.794 1.00 0.00 N ATOM 26 CA LEU A 26 -100.436 -9.318 -25.424 1.00 0.00 C ATOM 27 C LEU A 26 -99.954 -9.701 -26.808 1.00 0.00 C ATOM 28 O LEU A 26 -99.315 -10.740 -26.976 1.00 0.00 O ATOM 29 CB LEU A 26 -99.248 -8.796 -24.599 1.00 0.00 C ATOM 30 CG LEU A 26 -99.571 -8.202 -23.218 1.00 0.00 C ATOM 31 CD1 LEU A 26 -99.905 -9.288 -22.206 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.399 -7.380 -22.718 1.00 0.00 C ATOM 0 HA LEU A 26 -101.182 -8.526 -25.487 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.544 -9.617 -24.460 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.736 -8.033 -25.186 1.00 0.00 H new ATOM 0 HG LEU A 26 -100.446 -7.562 -23.329 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -100.128 -8.831 -21.242 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -100.773 -9.851 -22.550 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -99.054 -9.961 -22.100 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.638 -6.964 -21.739 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.517 -8.016 -22.637 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -98.198 -6.569 -23.418 1.00 0.00 H new ATOM 44 N SER A 27 -100.270 -8.893 -27.802 1.00 0.00 N ATOM 45 CA SER A 27 -99.792 -9.144 -29.147 1.00 0.00 C ATOM 46 C SER A 27 -99.486 -7.831 -29.853 1.00 0.00 C ATOM 47 O SER A 27 -100.142 -6.821 -29.605 1.00 0.00 O ATOM 48 CB SER A 27 -100.823 -9.961 -29.930 1.00 0.00 C ATOM 49 OG SER A 27 -102.009 -9.225 -30.165 1.00 0.00 O ATOM 0 H SER A 27 -100.853 -8.062 -27.704 1.00 0.00 H new ATOM 0 HA SER A 27 -98.869 -9.722 -29.093 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.393 -10.271 -30.882 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.063 -10.869 -29.377 1.00 0.00 H new ATOM 0 HG SER A 27 -102.440 -9.017 -29.310 1.00 0.00 H new ATOM 55 N TRP A 28 -98.498 -7.847 -30.738 1.00 0.00 N ATOM 56 CA TRP A 28 -98.035 -6.621 -31.385 1.00 0.00 C ATOM 57 C TRP A 28 -99.101 -5.987 -32.280 1.00 0.00 C ATOM 58 O TRP A 28 -99.020 -4.798 -32.593 1.00 0.00 O ATOM 59 CB TRP A 28 -96.738 -6.856 -32.179 1.00 0.00 C ATOM 60 CG TRP A 28 -96.791 -7.950 -33.218 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.719 -8.949 -33.348 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.840 -8.157 -34.269 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.406 -9.752 -34.417 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.255 -9.286 -35.000 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.678 -7.490 -34.664 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.546 -9.761 -36.103 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.977 -7.963 -35.758 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.412 -9.088 -36.466 1.00 0.00 C ATOM 0 H TRP A 28 -98.002 -8.691 -31.025 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.826 -5.916 -30.580 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.464 -5.924 -32.674 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -95.940 -7.089 -31.474 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.574 -9.086 -32.702 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.942 -10.563 -34.727 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.333 -6.620 -34.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.880 -10.629 -36.651 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -93.077 -7.454 -36.071 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.841 -9.432 -37.316 1.00 0.00 H new ATOM 79 N TYR A 29 -100.110 -6.757 -32.669 1.00 0.00 N ATOM 80 CA TYR A 29 -101.143 -6.233 -33.549 1.00 0.00 C ATOM 81 C TYR A 29 -102.295 -5.610 -32.760 1.00 0.00 C ATOM 82 O TYR A 29 -103.232 -5.076 -33.349 1.00 0.00 O ATOM 83 CB TYR A 29 -101.654 -7.309 -34.522 1.00 0.00 C ATOM 84 CG TYR A 29 -102.226 -8.552 -33.871 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.555 -8.600 -33.471 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.443 -9.686 -33.679 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.086 -9.736 -32.893 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.970 -10.828 -33.104 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.292 -10.846 -32.712 1.00 0.00 C ATOM 90 OH TYR A 29 -103.823 -11.980 -32.140 1.00 0.00 O ATOM 0 H TYR A 29 -100.233 -7.731 -32.393 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.687 -5.441 -34.142 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.421 -6.866 -35.157 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -100.832 -7.606 -35.174 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.184 -7.734 -33.614 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.407 -9.674 -33.984 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.121 -9.754 -32.584 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.350 -11.701 -32.963 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.132 -12.673 -32.085 1.00 0.00 H new ATOM 100 N ASP A 30 -102.215 -5.658 -31.430 1.00 0.00 N ATOM 101 CA ASP A 30 -103.210 -5.004 -30.590 1.00 0.00 C ATOM 102 C ASP A 30 -103.014 -3.494 -30.634 1.00 0.00 C ATOM 103 O ASP A 30 -101.902 -3.007 -30.436 1.00 0.00 O ATOM 104 CB ASP A 30 -103.114 -5.482 -29.137 1.00 0.00 C ATOM 105 CG ASP A 30 -103.629 -6.891 -28.930 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.725 -7.211 -29.431 1.00 0.00 O ATOM 107 OD2 ASP A 30 -102.931 -7.690 -28.265 1.00 0.00 O ATOM 0 H ASP A 30 -101.476 -6.140 -30.917 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.196 -5.264 -30.976 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.074 -5.433 -28.814 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.678 -4.800 -28.500 1.00 0.00 H new ATOM 112 N PRO A 31 -104.088 -2.734 -30.896 1.00 0.00 N ATOM 113 CA PRO A 31 -104.025 -1.266 -30.987 1.00 0.00 C ATOM 114 C PRO A 31 -103.477 -0.628 -29.715 1.00 0.00 C ATOM 115 O PRO A 31 -102.724 0.344 -29.772 1.00 0.00 O ATOM 116 CB PRO A 31 -105.484 -0.856 -31.209 1.00 0.00 C ATOM 117 CG PRO A 31 -106.141 -2.070 -31.770 1.00 0.00 C ATOM 118 CD PRO A 31 -105.450 -3.240 -31.132 1.00 0.00 C ATOM 0 HA PRO A 31 -103.353 -0.937 -31.780 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.954 -0.548 -30.275 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.558 -0.013 -31.896 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -107.208 -2.076 -31.546 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -106.043 -2.102 -32.855 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.936 -3.538 -30.203 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.448 -4.113 -31.785 1.00 0.00 H new ATOM 126 N ASP A 32 -103.841 -1.198 -28.574 1.00 0.00 N ATOM 127 CA ASP A 32 -103.402 -0.686 -27.278 1.00 0.00 C ATOM 128 C ASP A 32 -101.972 -1.110 -26.973 1.00 0.00 C ATOM 129 O ASP A 32 -101.300 -0.498 -26.141 1.00 0.00 O ATOM 130 CB ASP A 32 -104.336 -1.168 -26.166 1.00 0.00 C ATOM 131 CG ASP A 32 -104.548 -2.667 -26.197 1.00 0.00 C ATOM 132 OD1 ASP A 32 -105.439 -3.119 -26.946 1.00 0.00 O ATOM 133 OD2 ASP A 32 -103.827 -3.398 -25.483 1.00 0.00 O ATOM 0 H ASP A 32 -104.443 -2.020 -28.518 1.00 0.00 H new ATOM 0 HA ASP A 32 -103.435 0.403 -27.324 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -103.922 -0.883 -25.199 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -105.299 -0.666 -26.261 1.00 0.00 H new ATOM 138 N PHE A 33 -101.509 -2.148 -27.653 1.00 0.00 N ATOM 139 CA PHE A 33 -100.154 -2.637 -27.470 1.00 0.00 C ATOM 140 C PHE A 33 -99.175 -1.703 -28.167 1.00 0.00 C ATOM 141 O PHE A 33 -99.299 -1.436 -29.368 1.00 0.00 O ATOM 142 CB PHE A 33 -100.021 -4.057 -28.026 1.00 0.00 C ATOM 143 CG PHE A 33 -98.698 -4.709 -27.734 1.00 0.00 C ATOM 144 CD1 PHE A 33 -97.615 -4.522 -28.578 1.00 0.00 C ATOM 145 CD2 PHE A 33 -98.544 -5.515 -26.619 1.00 0.00 C ATOM 146 CE1 PHE A 33 -96.401 -5.126 -28.311 1.00 0.00 C ATOM 147 CE2 PHE A 33 -97.334 -6.122 -26.350 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.261 -5.926 -27.196 1.00 0.00 C ATOM 0 H PHE A 33 -102.056 -2.669 -28.339 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.926 -2.663 -26.405 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.818 -4.674 -27.611 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -100.170 -4.028 -29.105 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -97.721 -3.898 -29.453 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -99.380 -5.670 -25.953 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -95.563 -4.972 -28.975 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -97.227 -6.750 -25.478 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.313 -6.398 -26.985 1.00 0.00 H new ATOM 158 N GLN A 34 -98.200 -1.218 -27.418 1.00 0.00 N ATOM 159 CA GLN A 34 -97.252 -0.256 -27.942 1.00 0.00 C ATOM 160 C GLN A 34 -95.951 -0.949 -28.327 1.00 0.00 C ATOM 161 O GLN A 34 -95.361 -1.684 -27.533 1.00 0.00 O ATOM 162 CB GLN A 34 -96.986 0.845 -26.916 1.00 0.00 C ATOM 163 CG GLN A 34 -96.431 2.123 -27.529 1.00 0.00 C ATOM 164 CD GLN A 34 -96.249 3.238 -26.515 1.00 0.00 C ATOM 165 OE1 GLN A 34 -96.365 4.418 -26.846 1.00 0.00 O ATOM 166 NE2 GLN A 34 -95.962 2.875 -25.275 1.00 0.00 N ATOM 0 H GLN A 34 -98.046 -1.477 -26.443 1.00 0.00 H new ATOM 0 HA GLN A 34 -97.680 0.200 -28.835 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -97.914 1.075 -26.393 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -96.283 0.474 -26.170 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -95.472 1.907 -27.999 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -97.103 2.463 -28.317 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -95.874 1.886 -25.040 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -95.829 3.584 -24.554 1.00 0.00 H new ATOM 175 N ALA A 35 -95.513 -0.712 -29.550 1.00 0.00 N ATOM 176 CA ALA A 35 -94.296 -1.314 -30.060 1.00 0.00 C ATOM 177 C ALA A 35 -93.656 -0.396 -31.085 1.00 0.00 C ATOM 178 O ALA A 35 -94.321 0.494 -31.615 1.00 0.00 O ATOM 179 CB ALA A 35 -94.598 -2.669 -30.678 1.00 0.00 C ATOM 0 H ALA A 35 -95.988 -0.100 -30.214 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.600 -1.459 -29.234 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.676 -3.110 -31.057 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.030 -3.325 -29.923 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.305 -2.545 -31.498 1.00 0.00 H new ATOM 185 N ARG A 36 -92.367 -0.598 -31.337 1.00 0.00 N ATOM 186 CA ARG A 36 -91.642 0.159 -32.354 1.00 0.00 C ATOM 187 C ARG A 36 -90.217 -0.360 -32.447 1.00 0.00 C ATOM 188 O ARG A 36 -89.866 -1.327 -31.789 1.00 0.00 O ATOM 189 CB ARG A 36 -91.630 1.669 -32.049 1.00 0.00 C ATOM 190 CG ARG A 36 -90.487 2.125 -31.146 1.00 0.00 C ATOM 191 CD ARG A 36 -90.697 1.737 -29.697 1.00 0.00 C ATOM 192 NE ARG A 36 -91.528 2.711 -28.998 1.00 0.00 N ATOM 193 CZ ARG A 36 -91.180 3.293 -27.853 1.00 0.00 C ATOM 194 NH1 ARG A 36 -90.078 2.922 -27.212 1.00 0.00 N ATOM 195 NH2 ARG A 36 -91.955 4.235 -27.334 1.00 0.00 N ATOM 0 H ARG A 36 -91.797 -1.287 -30.846 1.00 0.00 H new ATOM 0 HA ARG A 36 -92.155 0.022 -33.306 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -91.573 2.216 -32.990 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.576 1.939 -31.580 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -89.553 1.691 -31.502 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -90.383 3.208 -31.217 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -91.166 0.754 -29.647 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -89.732 1.656 -29.197 1.00 0.00 H new ATOM 0 HE ARG A 36 -92.427 2.960 -29.410 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -89.488 2.184 -27.597 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.821 3.375 -26.335 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -92.813 4.510 -27.812 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -91.693 4.685 -26.457 1.00 0.00 H new ATOM 209 N LEU A 37 -89.407 0.267 -33.275 1.00 0.00 N ATOM 210 CA LEU A 37 -88.025 -0.129 -33.421 1.00 0.00 C ATOM 211 C LEU A 37 -87.152 0.568 -32.395 1.00 0.00 C ATOM 212 O LEU A 37 -87.450 1.680 -31.952 1.00 0.00 O ATOM 213 CB LEU A 37 -87.547 0.206 -34.820 1.00 0.00 C ATOM 214 CG LEU A 37 -88.488 -0.277 -35.908 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.189 0.425 -37.207 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.357 -1.778 -36.067 1.00 0.00 C ATOM 0 H LEU A 37 -89.685 1.056 -33.859 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.951 -1.204 -33.257 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.427 1.286 -34.906 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.564 -0.238 -34.976 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.514 -0.043 -35.624 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -88.872 0.069 -37.979 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.317 1.500 -37.078 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.162 0.215 -37.506 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.034 -2.122 -36.849 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.331 -2.027 -36.340 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.611 -2.267 -35.127 1.00 0.00 H new ATOM 228 N THR A 38 -86.088 -0.103 -32.011 1.00 0.00 N ATOM 229 CA THR A 38 -85.111 0.462 -31.111 1.00 0.00 C ATOM 230 C THR A 38 -84.393 1.618 -31.791 1.00 0.00 C ATOM 231 O THR A 38 -83.942 1.478 -32.933 1.00 0.00 O ATOM 232 CB THR A 38 -84.092 -0.608 -30.697 1.00 0.00 C ATOM 233 OG1 THR A 38 -83.420 -1.108 -31.863 1.00 0.00 O ATOM 234 CG2 THR A 38 -84.796 -1.749 -29.985 1.00 0.00 C ATOM 0 H THR A 38 -85.878 -1.054 -32.314 1.00 0.00 H new ATOM 0 HA THR A 38 -85.622 0.828 -30.220 1.00 0.00 H new ATOM 0 HB THR A 38 -83.363 -0.163 -30.020 1.00 0.00 H new ATOM 0 HG1 THR A 38 -83.507 -0.461 -32.594 1.00 0.00 H new ATOM 0 HG21 THR A 38 -84.065 -2.503 -29.695 1.00 0.00 H new ATOM 0 HG22 THR A 38 -85.297 -1.368 -29.095 1.00 0.00 H new ATOM 0 HG23 THR A 38 -85.532 -2.196 -30.653 1.00 0.00 H new ATOM 242 N ARG A 39 -84.310 2.752 -31.102 1.00 0.00 N ATOM 243 CA ARG A 39 -83.680 3.944 -31.657 1.00 0.00 C ATOM 244 C ARG A 39 -82.219 3.679 -32.031 1.00 0.00 C ATOM 245 O ARG A 39 -81.314 3.735 -31.196 1.00 0.00 O ATOM 246 CB ARG A 39 -83.792 5.121 -30.682 1.00 0.00 C ATOM 247 CG ARG A 39 -83.275 4.825 -29.282 1.00 0.00 C ATOM 248 CD ARG A 39 -83.228 6.084 -28.431 1.00 0.00 C ATOM 249 NE ARG A 39 -82.462 7.144 -29.082 1.00 0.00 N ATOM 250 CZ ARG A 39 -81.165 7.367 -28.870 1.00 0.00 C ATOM 251 NH1 ARG A 39 -80.495 6.642 -27.982 1.00 0.00 N ATOM 252 NH2 ARG A 39 -80.547 8.334 -29.531 1.00 0.00 N ATOM 0 H ARG A 39 -84.672 2.870 -30.156 1.00 0.00 H new ATOM 0 HA ARG A 39 -84.211 4.207 -32.571 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -83.240 5.969 -31.089 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -84.837 5.424 -30.614 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -83.917 4.085 -28.804 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -82.278 4.389 -29.345 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -84.243 6.433 -28.239 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -82.782 5.854 -27.463 1.00 0.00 H new ATOM 0 HE ARG A 39 -82.950 7.752 -29.740 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -80.973 5.909 -27.457 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -79.503 6.818 -27.825 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.063 8.905 -30.200 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -79.555 8.507 -29.371 1.00 0.00 H new ATOM 266 N SER A 40 -82.012 3.354 -33.294 1.00 0.00 N ATOM 267 CA SER A 40 -80.689 3.080 -33.815 1.00 0.00 C ATOM 268 C SER A 40 -80.273 4.197 -34.761 1.00 0.00 C ATOM 269 O SER A 40 -79.372 4.979 -34.461 1.00 0.00 O ATOM 270 CB SER A 40 -80.699 1.726 -34.531 1.00 0.00 C ATOM 271 OG SER A 40 -81.778 1.649 -35.448 1.00 0.00 O ATOM 0 H SER A 40 -82.757 3.273 -33.986 1.00 0.00 H new ATOM 0 HA SER A 40 -79.966 3.036 -33.000 1.00 0.00 H new ATOM 0 HB2 SER A 40 -79.756 1.582 -35.059 1.00 0.00 H new ATOM 0 HB3 SER A 40 -80.780 0.923 -33.799 1.00 0.00 H new ATOM 0 HG SER A 40 -81.428 1.618 -36.363 1.00 0.00 H new ATOM 277 N ASN A 41 -80.937 4.263 -35.903 1.00 0.00 N ATOM 278 CA ASN A 41 -80.745 5.361 -36.840 1.00 0.00 C ATOM 279 C ASN A 41 -82.089 5.919 -37.285 1.00 0.00 C ATOM 280 O ASN A 41 -82.167 7.016 -37.840 1.00 0.00 O ATOM 281 CB ASN A 41 -79.935 4.914 -38.063 1.00 0.00 C ATOM 282 CG ASN A 41 -78.464 4.708 -37.753 1.00 0.00 C ATOM 283 OD1 ASN A 41 -78.031 3.605 -37.422 1.00 0.00 O ATOM 284 ND2 ASN A 41 -77.683 5.772 -37.856 1.00 0.00 N ATOM 0 H ASN A 41 -81.617 3.566 -36.206 1.00 0.00 H new ATOM 0 HA ASN A 41 -80.185 6.142 -36.326 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.353 3.985 -38.450 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.034 5.661 -38.851 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -76.685 5.694 -37.658 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -78.079 6.670 -38.133 1.00 0.00 H new ATOM 291 N SER A 42 -83.151 5.167 -37.028 1.00 0.00 N ATOM 292 CA SER A 42 -84.480 5.577 -37.437 1.00 0.00 C ATOM 293 C SER A 42 -85.541 4.969 -36.541 1.00 0.00 C ATOM 294 O SER A 42 -85.405 3.846 -36.065 1.00 0.00 O ATOM 295 CB SER A 42 -84.726 5.176 -38.894 1.00 0.00 C ATOM 296 OG SER A 42 -85.998 5.618 -39.346 1.00 0.00 O ATOM 0 H SER A 42 -83.114 4.273 -36.539 1.00 0.00 H new ATOM 0 HA SER A 42 -84.544 6.661 -37.347 1.00 0.00 H new ATOM 0 HB2 SER A 42 -83.946 5.600 -39.526 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.660 4.092 -38.991 1.00 0.00 H new ATOM 0 HG SER A 42 -86.125 5.349 -40.280 1.00 0.00 H new ATOM 302 N LYS A 43 -86.590 5.737 -36.298 1.00 0.00 N ATOM 303 CA LYS A 43 -87.785 5.220 -35.654 1.00 0.00 C ATOM 304 C LYS A 43 -88.509 4.285 -36.617 1.00 0.00 C ATOM 305 O LYS A 43 -89.395 3.526 -36.227 1.00 0.00 O ATOM 306 CB LYS A 43 -88.707 6.373 -35.241 1.00 0.00 C ATOM 307 CG LYS A 43 -89.002 7.341 -36.377 1.00 0.00 C ATOM 308 CD LYS A 43 -89.958 8.448 -35.960 1.00 0.00 C ATOM 309 CE LYS A 43 -91.357 7.917 -35.701 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.344 9.019 -35.568 1.00 0.00 N ATOM 0 H LYS A 43 -86.637 6.727 -36.539 1.00 0.00 H new ATOM 0 HA LYS A 43 -87.503 4.669 -34.757 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -89.646 5.963 -34.868 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -88.248 6.919 -34.417 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.069 7.783 -36.726 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -89.429 6.793 -37.217 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -89.581 8.934 -35.060 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.996 9.208 -36.740 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -91.654 7.258 -36.517 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -91.356 7.317 -34.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -93.234 8.746 -36.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -92.522 9.206 -34.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -91.968 9.878 -36.018 1.00 0.00 H new ATOM 324 N CYS A 44 -88.112 4.353 -37.884 1.00 0.00 N ATOM 325 CA CYS A 44 -88.692 3.515 -38.915 1.00 0.00 C ATOM 326 C CYS A 44 -87.631 2.553 -39.480 1.00 0.00 C ATOM 327 O CYS A 44 -87.803 1.997 -40.561 1.00 0.00 O ATOM 328 CB CYS A 44 -89.301 4.384 -40.030 1.00 0.00 C ATOM 329 SG CYS A 44 -89.930 6.000 -39.460 1.00 0.00 S ATOM 0 H CYS A 44 -87.385 4.986 -38.218 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.492 2.918 -38.477 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -88.546 4.551 -40.798 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.117 3.834 -40.499 1.00 0.00 H new ATOM 334 N GLN A 45 -86.537 2.349 -38.726 1.00 0.00 N ATOM 335 CA GLN A 45 -85.560 1.284 -39.025 1.00 0.00 C ATOM 336 C GLN A 45 -84.802 0.880 -37.750 1.00 0.00 C ATOM 337 O GLN A 45 -84.189 1.725 -37.100 1.00 0.00 O ATOM 338 CB GLN A 45 -84.562 1.735 -40.100 1.00 0.00 C ATOM 339 CG GLN A 45 -83.507 0.686 -40.424 1.00 0.00 C ATOM 340 CD GLN A 45 -82.484 1.165 -41.436 1.00 0.00 C ATOM 341 OE1 GLN A 45 -81.928 0.372 -42.194 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.225 2.463 -41.453 1.00 0.00 N ATOM 0 H GLN A 45 -86.306 2.907 -37.904 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.111 0.423 -39.404 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.108 1.984 -41.010 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.067 2.647 -39.766 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -82.994 0.399 -39.506 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -83.998 -0.208 -40.808 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -82.708 3.088 -40.808 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.543 2.838 -42.112 1.00 0.00 H new ATOM 351 N GLY A 46 -84.826 -0.413 -37.409 1.00 0.00 N ATOM 352 CA GLY A 46 -84.169 -0.872 -36.188 1.00 0.00 C ATOM 353 C GLY A 46 -84.656 -2.242 -35.727 1.00 0.00 C ATOM 354 O GLY A 46 -85.479 -2.868 -36.389 1.00 0.00 O ATOM 0 H GLY A 46 -85.285 -1.145 -37.951 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.093 -0.913 -36.355 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.342 -0.145 -35.394 1.00 0.00 H new ATOM 358 N GLN A 47 -84.107 -2.730 -34.614 1.00 0.00 N ATOM 359 CA GLN A 47 -84.582 -3.977 -34.006 1.00 0.00 C ATOM 360 C GLN A 47 -85.967 -3.769 -33.404 1.00 0.00 C ATOM 361 O GLN A 47 -86.356 -2.639 -33.115 1.00 0.00 O ATOM 362 CB GLN A 47 -83.621 -4.457 -32.913 1.00 0.00 C ATOM 363 CG GLN A 47 -82.248 -4.864 -33.424 1.00 0.00 C ATOM 364 CD GLN A 47 -82.296 -6.044 -34.375 1.00 0.00 C ATOM 365 OE1 GLN A 47 -82.227 -7.200 -33.957 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.386 -5.761 -35.663 1.00 0.00 N ATOM 0 H GLN A 47 -83.336 -2.284 -34.116 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.630 -4.736 -34.787 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.501 -3.663 -32.176 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -84.070 -5.306 -32.397 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.788 -4.015 -33.930 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.610 -5.113 -32.576 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -82.441 -4.790 -35.969 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.400 -6.514 -36.351 1.00 0.00 H new ATOM 375 N LEU A 48 -86.708 -4.849 -33.205 1.00 0.00 N ATOM 376 CA LEU A 48 -88.063 -4.741 -32.682 1.00 0.00 C ATOM 377 C LEU A 48 -88.067 -4.595 -31.163 1.00 0.00 C ATOM 378 O LEU A 48 -87.573 -5.457 -30.435 1.00 0.00 O ATOM 379 CB LEU A 48 -88.905 -5.945 -33.103 1.00 0.00 C ATOM 380 CG LEU A 48 -90.380 -5.886 -32.689 1.00 0.00 C ATOM 381 CD1 LEU A 48 -91.063 -4.676 -33.305 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.100 -7.163 -33.096 1.00 0.00 C ATOM 0 H LEU A 48 -86.398 -5.802 -33.395 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.506 -3.840 -33.106 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.852 -6.044 -34.187 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.461 -6.845 -32.679 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.425 -5.792 -31.604 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -92.109 -4.653 -32.998 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.566 -3.767 -32.967 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -91.005 -4.739 -34.392 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.146 -7.103 -32.794 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.041 -7.285 -34.178 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.630 -8.017 -32.608 1.00 0.00 H new ATOM 394 N GLU A 49 -88.624 -3.486 -30.710 1.00 0.00 N ATOM 395 CA GLU A 49 -88.783 -3.196 -29.296 1.00 0.00 C ATOM 396 C GLU A 49 -90.271 -3.192 -28.953 1.00 0.00 C ATOM 397 O GLU A 49 -91.027 -2.342 -29.429 1.00 0.00 O ATOM 398 CB GLU A 49 -88.160 -1.835 -28.979 1.00 0.00 C ATOM 399 CG GLU A 49 -88.198 -1.462 -27.509 1.00 0.00 C ATOM 400 CD GLU A 49 -87.688 -0.057 -27.250 1.00 0.00 C ATOM 401 OE1 GLU A 49 -88.304 0.912 -27.746 1.00 0.00 O ATOM 402 OE2 GLU A 49 -86.663 0.090 -26.552 1.00 0.00 O ATOM 0 H GLU A 49 -88.983 -2.753 -31.321 1.00 0.00 H new ATOM 0 HA GLU A 49 -88.280 -3.957 -28.700 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -87.123 -1.835 -29.316 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -88.681 -1.067 -29.551 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -89.221 -1.546 -27.143 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -87.597 -2.173 -26.942 1.00 0.00 H new ATOM 409 N VAL A 50 -90.694 -4.152 -28.151 1.00 0.00 N ATOM 410 CA VAL A 50 -92.107 -4.299 -27.818 1.00 0.00 C ATOM 411 C VAL A 50 -92.334 -4.190 -26.315 1.00 0.00 C ATOM 412 O VAL A 50 -91.584 -4.760 -25.526 1.00 0.00 O ATOM 413 CB VAL A 50 -92.663 -5.645 -28.335 1.00 0.00 C ATOM 414 CG1 VAL A 50 -92.890 -5.588 -29.837 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.716 -6.787 -27.996 1.00 0.00 C ATOM 0 H VAL A 50 -90.083 -4.843 -27.716 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.641 -3.487 -28.310 1.00 0.00 H new ATOM 0 HB VAL A 50 -93.618 -5.826 -27.841 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.282 -6.545 -30.182 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.606 -4.799 -30.067 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.946 -5.380 -30.340 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.128 -7.724 -28.370 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.747 -6.606 -28.461 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -91.594 -6.850 -26.915 1.00 0.00 H new ATOM 425 N TYR A 51 -93.364 -3.453 -25.918 1.00 0.00 N ATOM 426 CA TYR A 51 -93.660 -3.258 -24.505 1.00 0.00 C ATOM 427 C TYR A 51 -94.566 -4.367 -23.991 1.00 0.00 C ATOM 428 O TYR A 51 -95.779 -4.331 -24.208 1.00 0.00 O ATOM 429 CB TYR A 51 -94.333 -1.901 -24.283 1.00 0.00 C ATOM 430 CG TYR A 51 -94.569 -1.567 -22.830 1.00 0.00 C ATOM 431 CD1 TYR A 51 -93.530 -1.620 -21.911 1.00 0.00 C ATOM 432 CD2 TYR A 51 -95.826 -1.193 -22.379 1.00 0.00 C ATOM 433 CE1 TYR A 51 -93.738 -1.311 -20.583 1.00 0.00 C ATOM 434 CE2 TYR A 51 -96.044 -0.882 -21.051 1.00 0.00 C ATOM 435 CZ TYR A 51 -94.995 -0.943 -20.159 1.00 0.00 C ATOM 436 OH TYR A 51 -95.205 -0.633 -18.834 1.00 0.00 O ATOM 0 H TYR A 51 -94.007 -2.981 -26.554 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.720 -3.285 -23.954 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -93.715 -1.122 -24.729 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -95.288 -1.890 -24.808 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -92.543 -1.908 -22.241 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -96.648 -1.144 -23.078 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -92.920 -1.357 -19.880 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -97.029 -0.593 -20.714 1.00 0.00 H new ATOM 0 HH TYR A 51 -96.145 -0.393 -18.699 1.00 0.00 H new ATOM 446 N LEU A 52 -93.988 -5.354 -23.318 1.00 0.00 N ATOM 447 CA LEU A 52 -94.777 -6.474 -22.825 1.00 0.00 C ATOM 448 C LEU A 52 -94.138 -7.144 -21.635 1.00 0.00 C ATOM 449 O LEU A 52 -92.912 -7.130 -21.485 1.00 0.00 O ATOM 450 CB LEU A 52 -95.045 -7.493 -23.941 1.00 0.00 C ATOM 451 CG LEU A 52 -93.886 -8.391 -24.453 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.599 -7.617 -24.678 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.650 -9.580 -23.534 1.00 0.00 C ATOM 0 H LEU A 52 -92.992 -5.402 -23.104 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.731 -6.065 -22.492 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.841 -8.153 -23.596 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -95.435 -6.944 -24.798 1.00 0.00 H new ATOM 0 HG LEU A 52 -94.203 -8.770 -25.425 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.824 -8.295 -25.035 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.769 -6.837 -25.420 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -92.279 -7.163 -23.740 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.832 -10.185 -23.925 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -93.393 -9.224 -22.536 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -94.555 -10.185 -23.481 1.00 0.00 H new ATOM 465 N LYS A 53 -95.001 -7.698 -20.781 1.00 0.00 N ATOM 466 CA LYS A 53 -94.602 -8.507 -19.631 1.00 0.00 C ATOM 467 C LYS A 53 -93.960 -7.655 -18.547 1.00 0.00 C ATOM 468 O LYS A 53 -94.172 -7.898 -17.355 1.00 0.00 O ATOM 469 CB LYS A 53 -93.655 -9.631 -20.066 1.00 0.00 C ATOM 470 CG LYS A 53 -93.417 -10.687 -19.002 1.00 0.00 C ATOM 471 CD LYS A 53 -92.496 -11.780 -19.517 1.00 0.00 C ATOM 472 CE LYS A 53 -92.380 -12.929 -18.531 1.00 0.00 C ATOM 473 NZ LYS A 53 -93.676 -13.632 -18.336 1.00 0.00 N ATOM 0 H LYS A 53 -96.012 -7.595 -20.872 1.00 0.00 H new ATOM 0 HA LYS A 53 -95.503 -8.954 -19.211 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -94.063 -10.112 -20.955 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.697 -9.195 -20.351 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -92.980 -10.225 -18.117 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -94.369 -11.122 -18.697 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -92.873 -12.154 -20.469 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -91.507 -11.363 -19.707 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -91.633 -13.638 -18.888 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -92.026 -12.549 -17.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -93.503 -14.574 -17.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -94.276 -13.081 -17.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -94.157 -13.734 -19.252 1.00 0.00 H new ATOM 487 N ASP A 54 -93.211 -6.641 -18.967 1.00 0.00 N ATOM 488 CA ASP A 54 -92.421 -5.822 -18.037 1.00 0.00 C ATOM 489 C ASP A 54 -91.489 -4.884 -18.782 1.00 0.00 C ATOM 490 O ASP A 54 -91.147 -3.808 -18.293 1.00 0.00 O ATOM 491 CB ASP A 54 -91.562 -6.709 -17.120 1.00 0.00 C ATOM 492 CG ASP A 54 -90.398 -7.365 -17.851 1.00 0.00 C ATOM 493 OD1 ASP A 54 -90.637 -8.262 -18.689 1.00 0.00 O ATOM 494 OD2 ASP A 54 -89.237 -6.980 -17.600 1.00 0.00 O ATOM 0 H ASP A 54 -93.130 -6.362 -19.945 1.00 0.00 H new ATOM 0 HA ASP A 54 -93.132 -5.244 -17.446 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.175 -6.106 -16.298 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.190 -7.483 -16.679 1.00 0.00 H new ATOM 499 N GLY A 55 -91.072 -5.300 -19.961 1.00 0.00 N ATOM 500 CA GLY A 55 -90.000 -4.610 -20.637 1.00 0.00 C ATOM 501 C GLY A 55 -90.322 -4.242 -22.051 1.00 0.00 C ATOM 502 O GLY A 55 -91.059 -4.959 -22.731 1.00 0.00 O ATOM 0 H GLY A 55 -91.455 -6.101 -20.463 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.755 -3.705 -20.082 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.111 -5.240 -20.628 1.00 0.00 H new ATOM 506 N TRP A 56 -89.803 -3.101 -22.476 1.00 0.00 N ATOM 507 CA TRP A 56 -89.633 -2.838 -23.887 1.00 0.00 C ATOM 508 C TRP A 56 -88.578 -3.797 -24.392 1.00 0.00 C ATOM 509 O TRP A 56 -87.412 -3.443 -24.558 1.00 0.00 O ATOM 510 CB TRP A 56 -89.216 -1.390 -24.139 1.00 0.00 C ATOM 511 CG TRP A 56 -90.362 -0.432 -24.088 1.00 0.00 C ATOM 512 CD1 TRP A 56 -90.762 0.326 -23.027 1.00 0.00 C ATOM 513 CD2 TRP A 56 -91.266 -0.141 -25.154 1.00 0.00 C ATOM 514 NE1 TRP A 56 -91.860 1.074 -23.373 1.00 0.00 N ATOM 515 CE2 TRP A 56 -92.186 0.805 -24.674 1.00 0.00 C ATOM 516 CE3 TRP A 56 -91.380 -0.586 -26.470 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -93.209 1.311 -25.466 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -92.396 -0.086 -27.255 1.00 0.00 C ATOM 519 CH2 TRP A 56 -93.300 0.854 -26.751 1.00 0.00 C ATOM 0 H TRP A 56 -89.494 -2.347 -21.862 1.00 0.00 H new ATOM 0 HA TRP A 56 -90.576 -2.984 -24.415 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -88.473 -1.098 -23.397 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -88.736 -1.321 -25.115 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -90.285 0.336 -22.058 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -92.352 1.724 -22.760 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -90.684 -1.310 -26.867 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -93.907 2.039 -25.080 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -92.496 -0.425 -28.275 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -94.087 1.227 -27.390 1.00 0.00 H new ATOM 530 N HIS A 57 -88.992 -5.037 -24.563 1.00 0.00 N ATOM 531 CA HIS A 57 -88.067 -6.115 -24.799 1.00 0.00 C ATOM 532 C HIS A 57 -87.506 -6.042 -26.208 1.00 0.00 C ATOM 533 O HIS A 57 -88.260 -6.059 -27.182 1.00 0.00 O ATOM 534 CB HIS A 57 -88.746 -7.470 -24.563 1.00 0.00 C ATOM 535 CG HIS A 57 -88.851 -7.846 -23.111 1.00 0.00 C ATOM 536 ND1 HIS A 57 -87.752 -8.112 -22.321 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.932 -7.989 -22.303 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.151 -8.403 -21.096 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.466 -8.334 -21.056 1.00 0.00 N ATOM 0 H HIS A 57 -89.972 -5.319 -24.542 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.241 -6.015 -24.095 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.746 -7.446 -24.997 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.188 -8.243 -25.091 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -90.966 -7.857 -22.587 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -87.507 -8.655 -20.266 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -90.044 -8.508 -20.234 1.00 0.00 H new ATOM 548 N MET A 58 -86.189 -5.930 -26.314 1.00 0.00 N ATOM 549 CA MET A 58 -85.533 -5.924 -27.611 1.00 0.00 C ATOM 550 C MET A 58 -85.449 -7.350 -28.134 1.00 0.00 C ATOM 551 O MET A 58 -84.642 -8.151 -27.653 1.00 0.00 O ATOM 552 CB MET A 58 -84.122 -5.322 -27.524 1.00 0.00 C ATOM 553 CG MET A 58 -84.063 -3.964 -26.834 1.00 0.00 C ATOM 554 SD MET A 58 -84.115 -4.092 -25.032 1.00 0.00 S ATOM 555 CE MET A 58 -82.586 -4.970 -24.710 1.00 0.00 C ATOM 0 H MET A 58 -85.557 -5.842 -25.519 1.00 0.00 H new ATOM 0 HA MET A 58 -86.120 -5.306 -28.291 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.475 -6.017 -26.989 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.719 -5.223 -28.532 1.00 0.00 H new ATOM 0 HG2 MET A 58 -83.149 -3.450 -27.131 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.898 -3.352 -27.175 1.00 0.00 H new ATOM 0 HE1 MET A 58 -82.809 -6.003 -24.442 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.962 -4.954 -25.604 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.056 -4.488 -23.888 1.00 0.00 H new ATOM 565 N VAL A 59 -86.296 -7.669 -29.099 1.00 0.00 N ATOM 566 CA VAL A 59 -86.384 -9.029 -29.605 1.00 0.00 C ATOM 567 C VAL A 59 -85.477 -9.213 -30.814 1.00 0.00 C ATOM 568 O VAL A 59 -84.814 -8.276 -31.256 1.00 0.00 O ATOM 569 CB VAL A 59 -87.829 -9.400 -30.000 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.797 -9.106 -28.867 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.246 -8.666 -31.259 1.00 0.00 C ATOM 0 H VAL A 59 -86.930 -7.007 -29.546 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.062 -9.688 -28.799 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.857 -10.471 -30.200 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.808 -9.377 -29.172 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.516 -9.686 -27.988 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.763 -8.043 -28.626 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.268 -8.942 -31.520 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.193 -7.591 -31.088 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.577 -8.937 -32.076 1.00 0.00 H new ATOM 581 N CYS A 60 -85.456 -10.422 -31.356 1.00 0.00 N ATOM 582 CA CYS A 60 -84.656 -10.701 -32.537 1.00 0.00 C ATOM 583 C CYS A 60 -85.532 -10.714 -33.792 1.00 0.00 C ATOM 584 O CYS A 60 -85.133 -11.236 -34.837 1.00 0.00 O ATOM 585 CB CYS A 60 -83.912 -12.026 -32.371 1.00 0.00 C ATOM 586 SG CYS A 60 -84.953 -13.508 -32.437 1.00 0.00 S ATOM 0 H CYS A 60 -85.981 -11.220 -30.999 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.918 -9.908 -32.654 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.154 -12.099 -33.151 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -83.387 -12.012 -31.416 1.00 0.00 H new ATOM 591 N SER A 61 -86.730 -10.133 -33.658 1.00 0.00 N ATOM 592 CA SER A 61 -87.680 -9.941 -34.761 1.00 0.00 C ATOM 593 C SER A 61 -88.384 -11.240 -35.178 1.00 0.00 C ATOM 594 O SER A 61 -89.604 -11.261 -35.319 1.00 0.00 O ATOM 595 CB SER A 61 -86.991 -9.280 -35.957 1.00 0.00 C ATOM 596 OG SER A 61 -86.490 -8.002 -35.597 1.00 0.00 O ATOM 0 H SER A 61 -87.073 -9.777 -32.766 1.00 0.00 H new ATOM 0 HA SER A 61 -88.460 -9.275 -34.392 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.175 -9.911 -36.309 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.696 -9.182 -36.782 1.00 0.00 H new ATOM 0 HG SER A 61 -85.801 -7.728 -36.238 1.00 0.00 H new ATOM 602 N GLN A 62 -87.629 -12.321 -35.362 1.00 0.00 N ATOM 603 CA GLN A 62 -88.217 -13.590 -35.795 1.00 0.00 C ATOM 604 C GLN A 62 -88.676 -14.418 -34.596 1.00 0.00 C ATOM 605 O GLN A 62 -89.074 -15.576 -34.745 1.00 0.00 O ATOM 606 CB GLN A 62 -87.220 -14.385 -36.650 1.00 0.00 C ATOM 607 CG GLN A 62 -86.025 -14.923 -35.881 1.00 0.00 C ATOM 608 CD GLN A 62 -86.131 -16.408 -35.570 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.660 -16.871 -34.536 1.00 0.00 O ATOM 610 NE2 GLN A 62 -86.709 -17.172 -36.486 1.00 0.00 N ATOM 0 H GLN A 62 -86.619 -12.346 -35.220 1.00 0.00 H new ATOM 0 HA GLN A 62 -89.092 -13.365 -36.405 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -87.744 -15.220 -37.115 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.860 -13.746 -37.456 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -85.119 -14.743 -36.459 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -85.923 -14.369 -34.948 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -87.090 -16.752 -37.334 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -86.773 -18.180 -36.343 1.00 0.00 H new ATOM 619 N SER A 63 -88.625 -13.811 -33.413 1.00 0.00 N ATOM 620 CA SER A 63 -89.064 -14.457 -32.182 1.00 0.00 C ATOM 621 C SER A 63 -90.532 -14.888 -32.296 1.00 0.00 C ATOM 622 O SER A 63 -91.255 -14.388 -33.163 1.00 0.00 O ATOM 623 CB SER A 63 -88.885 -13.490 -31.015 1.00 0.00 C ATOM 624 OG SER A 63 -87.550 -13.007 -30.958 1.00 0.00 O ATOM 0 H SER A 63 -88.279 -12.860 -33.282 1.00 0.00 H new ATOM 0 HA SER A 63 -88.461 -15.348 -32.010 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.575 -12.653 -31.122 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.135 -13.992 -30.080 1.00 0.00 H new ATOM 0 HG SER A 63 -86.993 -13.511 -31.587 1.00 0.00 H new ATOM 630 N TRP A 64 -90.961 -15.809 -31.425 1.00 0.00 N ATOM 631 CA TRP A 64 -92.333 -16.330 -31.435 1.00 0.00 C ATOM 632 C TRP A 64 -92.588 -17.210 -32.657 1.00 0.00 C ATOM 633 O TRP A 64 -92.531 -18.435 -32.567 1.00 0.00 O ATOM 634 CB TRP A 64 -93.378 -15.205 -31.398 1.00 0.00 C ATOM 635 CG TRP A 64 -93.379 -14.403 -30.133 1.00 0.00 C ATOM 636 CD1 TRP A 64 -93.943 -14.755 -28.944 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.801 -13.106 -29.938 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.753 -13.760 -28.019 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.054 -12.735 -28.603 1.00 0.00 C ATOM 640 CE3 TRP A 64 -92.093 -12.223 -30.757 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.622 -11.521 -28.075 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.663 -11.019 -30.232 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.929 -10.678 -28.899 1.00 0.00 C ATOM 0 H TRP A 64 -90.371 -16.212 -30.697 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.436 -16.931 -30.531 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -93.202 -14.534 -32.239 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.367 -15.640 -31.539 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.464 -15.682 -28.757 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.079 -13.779 -27.053 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.885 -12.478 -31.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.827 -11.254 -27.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -91.114 -10.331 -30.858 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.580 -9.731 -28.515 1.00 0.00 H new ATOM 654 N GLY A 65 -92.840 -16.569 -33.797 1.00 0.00 N ATOM 655 CA GLY A 65 -93.234 -17.278 -35.000 1.00 0.00 C ATOM 656 C GLY A 65 -92.180 -18.242 -35.494 1.00 0.00 C ATOM 657 O GLY A 65 -92.486 -19.396 -35.797 1.00 0.00 O ATOM 0 H GLY A 65 -92.776 -15.557 -33.907 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -94.156 -17.826 -34.806 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -93.453 -16.555 -35.785 1.00 0.00 H new ATOM 661 N ARG A 66 -90.937 -17.763 -35.587 1.00 0.00 N ATOM 662 CA ARG A 66 -89.812 -18.596 -36.011 1.00 0.00 C ATOM 663 C ARG A 66 -90.046 -19.169 -37.410 1.00 0.00 C ATOM 664 O ARG A 66 -89.544 -20.243 -37.735 1.00 0.00 O ATOM 665 CB ARG A 66 -89.600 -19.737 -35.013 1.00 0.00 C ATOM 666 CG ARG A 66 -89.243 -19.271 -33.613 1.00 0.00 C ATOM 667 CD ARG A 66 -89.486 -20.367 -32.590 1.00 0.00 C ATOM 668 NE ARG A 66 -90.912 -20.655 -32.431 1.00 0.00 N ATOM 669 CZ ARG A 66 -91.407 -21.862 -32.166 1.00 0.00 C ATOM 670 NH1 ARG A 66 -90.595 -22.909 -32.030 1.00 0.00 N ATOM 671 NH2 ARG A 66 -92.717 -22.022 -32.031 1.00 0.00 N ATOM 0 H ARG A 66 -90.685 -16.798 -35.373 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.920 -17.970 -36.042 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -90.508 -20.338 -34.965 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -88.807 -20.387 -35.382 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -88.196 -18.968 -33.584 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -89.836 -18.393 -33.357 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -88.964 -21.273 -32.897 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -89.066 -20.068 -31.630 1.00 0.00 H new ATOM 0 HE ARG A 66 -91.569 -19.881 -32.530 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -89.587 -22.789 -32.129 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -90.981 -23.831 -31.827 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -93.341 -21.222 -32.130 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -93.100 -22.945 -31.828 1.00 0.00 H new ATOM 685 N SER A 67 -90.803 -18.443 -38.231 1.00 0.00 N ATOM 686 CA SER A 67 -91.160 -18.902 -39.571 1.00 0.00 C ATOM 687 C SER A 67 -89.920 -19.229 -40.401 1.00 0.00 C ATOM 688 O SER A 67 -89.849 -20.278 -41.042 1.00 0.00 O ATOM 689 CB SER A 67 -91.993 -17.829 -40.268 1.00 0.00 C ATOM 690 OG SER A 67 -93.025 -17.365 -39.413 1.00 0.00 O ATOM 0 H SER A 67 -91.183 -17.528 -37.989 1.00 0.00 H new ATOM 0 HA SER A 67 -91.743 -19.818 -39.477 1.00 0.00 H new ATOM 0 HB2 SER A 67 -91.353 -16.996 -40.560 1.00 0.00 H new ATOM 0 HB3 SER A 67 -92.426 -18.234 -41.183 1.00 0.00 H new ATOM 0 HG SER A 67 -92.702 -16.596 -38.898 1.00 0.00 H new ATOM 696 N SER A 68 -88.943 -18.330 -40.378 1.00 0.00 N ATOM 697 CA SER A 68 -87.707 -18.523 -41.123 1.00 0.00 C ATOM 698 C SER A 68 -86.652 -17.516 -40.662 1.00 0.00 C ATOM 699 O SER A 68 -86.850 -16.808 -39.669 1.00 0.00 O ATOM 700 CB SER A 68 -87.970 -18.371 -42.627 1.00 0.00 C ATOM 701 OG SER A 68 -86.850 -18.787 -43.393 1.00 0.00 O ATOM 0 H SER A 68 -88.984 -17.458 -39.850 1.00 0.00 H new ATOM 0 HA SER A 68 -87.333 -19.529 -40.934 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.843 -18.960 -42.907 1.00 0.00 H new ATOM 0 HB3 SER A 68 -88.202 -17.330 -42.854 1.00 0.00 H new ATOM 0 HG SER A 68 -86.402 -19.532 -42.940 1.00 0.00 H new ATOM 707 N LYS A 69 -85.538 -17.467 -41.384 1.00 0.00 N ATOM 708 CA LYS A 69 -84.463 -16.526 -41.094 1.00 0.00 C ATOM 709 C LYS A 69 -84.664 -15.244 -41.897 1.00 0.00 C ATOM 710 O LYS A 69 -84.017 -14.229 -41.651 1.00 0.00 O ATOM 711 CB LYS A 69 -83.106 -17.157 -41.421 1.00 0.00 C ATOM 712 CG LYS A 69 -82.789 -18.385 -40.579 1.00 0.00 C ATOM 713 CD LYS A 69 -81.549 -19.111 -41.084 1.00 0.00 C ATOM 714 CE LYS A 69 -80.302 -18.243 -40.993 1.00 0.00 C ATOM 715 NZ LYS A 69 -79.111 -18.933 -41.556 1.00 0.00 N ATOM 0 H LYS A 69 -85.355 -18.075 -42.182 1.00 0.00 H new ATOM 0 HA LYS A 69 -84.482 -16.280 -40.032 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -83.088 -17.434 -42.475 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -82.323 -16.413 -41.273 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -82.638 -18.086 -39.542 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -83.640 -19.066 -40.594 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -81.400 -20.021 -40.503 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -81.704 -19.415 -42.119 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -80.469 -17.309 -41.529 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -80.114 -17.984 -39.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -78.280 -18.312 -41.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -78.937 -19.812 -41.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -79.281 -19.158 -42.557 1.00 0.00 H new ATOM 729 N GLN A 70 -85.566 -15.310 -42.865 1.00 0.00 N ATOM 730 CA GLN A 70 -85.946 -14.146 -43.650 1.00 0.00 C ATOM 731 C GLN A 70 -87.417 -14.269 -44.021 1.00 0.00 C ATOM 732 O GLN A 70 -87.796 -15.119 -44.828 1.00 0.00 O ATOM 733 CB GLN A 70 -85.078 -14.028 -44.905 1.00 0.00 C ATOM 734 CG GLN A 70 -85.207 -12.683 -45.609 1.00 0.00 C ATOM 735 CD GLN A 70 -84.191 -12.506 -46.723 1.00 0.00 C ATOM 736 OE1 GLN A 70 -83.734 -11.391 -46.991 1.00 0.00 O ATOM 737 NE2 GLN A 70 -83.847 -13.594 -47.394 1.00 0.00 N ATOM 0 H GLN A 70 -86.053 -16.167 -43.127 1.00 0.00 H new ATOM 0 HA GLN A 70 -85.791 -13.242 -43.061 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -84.035 -14.188 -44.632 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.350 -14.821 -45.601 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -86.212 -12.588 -46.021 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -85.084 -11.882 -44.880 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -84.248 -14.497 -47.141 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -83.181 -13.529 -48.164 1.00 0.00 H new ATOM 746 N TRP A 71 -88.242 -13.440 -43.404 1.00 0.00 N ATOM 747 CA TRP A 71 -89.688 -13.540 -43.552 1.00 0.00 C ATOM 748 C TRP A 71 -90.154 -12.792 -44.790 1.00 0.00 C ATOM 749 O TRP A 71 -89.662 -11.703 -45.092 1.00 0.00 O ATOM 750 CB TRP A 71 -90.393 -12.981 -42.313 1.00 0.00 C ATOM 751 CG TRP A 71 -90.109 -13.745 -41.049 1.00 0.00 C ATOM 752 CD1 TRP A 71 -88.954 -14.395 -40.716 1.00 0.00 C ATOM 753 CD2 TRP A 71 -90.996 -13.918 -39.938 1.00 0.00 C ATOM 754 NE1 TRP A 71 -89.073 -14.968 -39.475 1.00 0.00 N ATOM 755 CE2 TRP A 71 -90.317 -14.687 -38.975 1.00 0.00 C ATOM 756 CE3 TRP A 71 -92.300 -13.498 -39.666 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -90.900 -15.042 -37.760 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -92.876 -13.851 -38.463 1.00 0.00 C ATOM 759 CH2 TRP A 71 -92.177 -14.616 -37.522 1.00 0.00 C ATOM 0 H TRP A 71 -87.934 -12.685 -42.791 1.00 0.00 H new ATOM 0 HA TRP A 71 -89.944 -14.594 -43.661 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.091 -11.943 -42.173 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.469 -12.979 -42.490 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -88.074 -14.450 -41.340 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -88.353 -15.514 -39.002 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -92.848 -12.907 -40.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -90.362 -15.632 -37.033 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -93.884 -13.531 -38.243 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -92.656 -14.875 -36.589 1.00 0.00 H new ATOM 770 N GLU A 72 -91.101 -13.379 -45.503 1.00 0.00 N ATOM 771 CA GLU A 72 -91.644 -12.758 -46.703 1.00 0.00 C ATOM 772 C GLU A 72 -92.840 -11.875 -46.362 1.00 0.00 C ATOM 773 O GLU A 72 -93.255 -11.035 -47.161 1.00 0.00 O ATOM 774 CB GLU A 72 -92.053 -13.824 -47.718 1.00 0.00 C ATOM 775 CG GLU A 72 -93.099 -14.793 -47.197 1.00 0.00 C ATOM 776 CD GLU A 72 -93.502 -15.817 -48.234 1.00 0.00 C ATOM 777 OE1 GLU A 72 -94.430 -15.534 -49.020 1.00 0.00 O ATOM 778 OE2 GLU A 72 -92.891 -16.906 -48.271 1.00 0.00 O ATOM 0 H GLU A 72 -91.511 -14.284 -45.273 1.00 0.00 H new ATOM 0 HA GLU A 72 -90.866 -12.133 -47.142 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -92.438 -13.333 -48.612 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.168 -14.385 -48.019 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -92.710 -15.305 -46.317 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -93.980 -14.236 -46.879 1.00 0.00 H new ATOM 785 N ASP A 73 -93.390 -12.069 -45.174 1.00 0.00 N ATOM 786 CA ASP A 73 -94.537 -11.291 -44.734 1.00 0.00 C ATOM 787 C ASP A 73 -94.188 -10.501 -43.479 1.00 0.00 C ATOM 788 O ASP A 73 -94.072 -11.064 -42.391 1.00 0.00 O ATOM 789 CB ASP A 73 -95.737 -12.200 -44.463 1.00 0.00 C ATOM 790 CG ASP A 73 -96.986 -11.412 -44.117 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.057 -10.858 -43.001 1.00 0.00 O ATOM 792 OD2 ASP A 73 -97.905 -11.344 -44.962 1.00 0.00 O ATOM 0 H ASP A 73 -93.061 -12.758 -44.498 1.00 0.00 H new ATOM 0 HA ASP A 73 -94.803 -10.595 -45.530 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -95.930 -12.816 -45.341 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.499 -12.879 -43.644 1.00 0.00 H new ATOM 797 N PRO A 74 -93.976 -9.191 -43.629 1.00 0.00 N ATOM 798 CA PRO A 74 -93.640 -8.295 -42.530 1.00 0.00 C ATOM 799 C PRO A 74 -94.839 -7.511 -41.996 1.00 0.00 C ATOM 800 O PRO A 74 -94.681 -6.409 -41.468 1.00 0.00 O ATOM 801 CB PRO A 74 -92.675 -7.364 -43.228 1.00 0.00 C ATOM 802 CG PRO A 74 -93.343 -7.141 -44.529 1.00 0.00 C ATOM 803 CD PRO A 74 -93.985 -8.456 -44.903 1.00 0.00 C ATOM 0 HA PRO A 74 -93.258 -8.816 -41.652 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.536 -6.434 -42.677 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.690 -7.814 -43.348 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.090 -6.351 -44.453 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -92.625 -6.829 -45.287 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -94.997 -8.319 -45.285 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.420 -8.977 -45.676 1.00 0.00 H new ATOM 811 N SER A 75 -96.038 -8.065 -42.123 1.00 0.00 N ATOM 812 CA SER A 75 -97.223 -7.356 -41.700 1.00 0.00 C ATOM 813 C SER A 75 -97.486 -7.613 -40.219 1.00 0.00 C ATOM 814 O SER A 75 -96.549 -7.848 -39.451 1.00 0.00 O ATOM 815 CB SER A 75 -98.425 -7.770 -42.558 1.00 0.00 C ATOM 816 OG SER A 75 -98.789 -9.124 -42.341 1.00 0.00 O ATOM 0 H SER A 75 -96.208 -8.993 -42.512 1.00 0.00 H new ATOM 0 HA SER A 75 -97.067 -6.286 -41.836 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.273 -7.125 -42.329 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.187 -7.622 -43.611 1.00 0.00 H new ATOM 0 HG SER A 75 -98.151 -9.711 -42.797 1.00 0.00 H new ATOM 822 N GLN A 76 -98.760 -7.562 -39.837 1.00 0.00 N ATOM 823 CA GLN A 76 -99.202 -7.683 -38.448 1.00 0.00 C ATOM 824 C GLN A 76 -98.842 -6.440 -37.630 1.00 0.00 C ATOM 825 O GLN A 76 -99.664 -5.921 -36.872 1.00 0.00 O ATOM 826 CB GLN A 76 -98.625 -8.944 -37.807 1.00 0.00 C ATOM 827 CG GLN A 76 -99.092 -10.230 -38.469 1.00 0.00 C ATOM 828 CD GLN A 76 -100.582 -10.469 -38.320 1.00 0.00 C ATOM 829 OE1 GLN A 76 -101.220 -11.057 -39.194 1.00 0.00 O ATOM 830 NE2 GLN A 76 -101.148 -10.025 -37.210 1.00 0.00 N ATOM 0 H GLN A 76 -99.529 -7.433 -40.495 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.289 -7.765 -38.453 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.537 -8.898 -37.849 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.903 -8.966 -36.753 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.839 -10.198 -39.529 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -98.550 -11.071 -38.037 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.586 -9.542 -36.509 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -102.146 -10.165 -37.055 1.00 0.00 H new ATOM 839 N ALA A 77 -97.622 -5.952 -37.800 1.00 0.00 N ATOM 840 CA ALA A 77 -97.167 -4.752 -37.121 1.00 0.00 C ATOM 841 C ALA A 77 -97.492 -3.506 -37.942 1.00 0.00 C ATOM 842 O ALA A 77 -96.926 -2.436 -37.715 1.00 0.00 O ATOM 843 CB ALA A 77 -95.673 -4.835 -36.852 1.00 0.00 C ATOM 0 H ALA A 77 -96.924 -6.376 -38.410 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.692 -4.677 -36.169 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.344 -3.929 -36.343 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.464 -5.701 -36.224 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.138 -4.934 -37.797 1.00 0.00 H new ATOM 849 N SER A 78 -98.413 -3.653 -38.890 1.00 0.00 N ATOM 850 CA SER A 78 -98.858 -2.541 -39.720 1.00 0.00 C ATOM 851 C SER A 78 -99.366 -1.398 -38.848 1.00 0.00 C ATOM 852 O SER A 78 -98.990 -0.241 -39.030 1.00 0.00 O ATOM 853 CB SER A 78 -99.965 -3.023 -40.662 1.00 0.00 C ATOM 854 OG SER A 78 -99.591 -4.234 -41.301 1.00 0.00 O ATOM 0 H SER A 78 -98.869 -4.541 -39.103 1.00 0.00 H new ATOM 0 HA SER A 78 -98.018 -2.174 -40.309 1.00 0.00 H new ATOM 0 HB2 SER A 78 -100.887 -3.173 -40.100 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.169 -2.259 -41.412 1.00 0.00 H new ATOM 0 HG SER A 78 -100.312 -4.526 -41.897 1.00 0.00 H new ATOM 860 N LYS A 79 -100.191 -1.754 -37.870 1.00 0.00 N ATOM 861 CA LYS A 79 -100.736 -0.801 -36.908 1.00 0.00 C ATOM 862 C LYS A 79 -99.611 -0.106 -36.138 1.00 0.00 C ATOM 863 O LYS A 79 -99.720 1.064 -35.775 1.00 0.00 O ATOM 864 CB LYS A 79 -101.691 -1.552 -35.960 1.00 0.00 C ATOM 865 CG LYS A 79 -102.218 -0.752 -34.770 1.00 0.00 C ATOM 866 CD LYS A 79 -101.249 -0.761 -33.590 1.00 0.00 C ATOM 867 CE LYS A 79 -100.845 -2.177 -33.213 1.00 0.00 C ATOM 868 NZ LYS A 79 -99.888 -2.207 -32.073 1.00 0.00 N ATOM 0 H LYS A 79 -100.502 -2.714 -37.721 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.291 -0.022 -37.430 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.543 -1.906 -36.540 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.175 -2.434 -35.580 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -102.401 0.277 -35.079 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -103.176 -1.164 -34.454 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -100.360 -0.183 -33.843 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -101.713 -0.273 -32.733 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -101.735 -2.749 -32.952 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -100.394 -2.666 -34.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -99.226 -2.999 -32.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -99.357 -1.313 -32.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -100.412 -2.329 -31.183 1.00 0.00 H new ATOM 882 N VAL A 80 -98.523 -0.834 -35.917 1.00 0.00 N ATOM 883 CA VAL A 80 -97.404 -0.339 -35.130 1.00 0.00 C ATOM 884 C VAL A 80 -96.736 0.858 -35.809 1.00 0.00 C ATOM 885 O VAL A 80 -96.725 1.965 -35.266 1.00 0.00 O ATOM 886 CB VAL A 80 -96.368 -1.464 -34.902 1.00 0.00 C ATOM 887 CG1 VAL A 80 -95.124 -0.948 -34.199 1.00 0.00 C ATOM 888 CG2 VAL A 80 -96.990 -2.607 -34.111 1.00 0.00 C ATOM 0 H VAL A 80 -98.393 -1.779 -36.277 1.00 0.00 H new ATOM 0 HA VAL A 80 -97.793 -0.011 -34.166 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.064 -1.835 -35.881 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -94.420 -1.768 -34.057 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -94.659 -0.171 -34.806 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -95.400 -0.534 -33.229 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -96.248 -3.391 -33.959 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -97.330 -2.237 -33.144 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -97.838 -3.012 -34.663 1.00 0.00 H new ATOM 898 N CYS A 81 -96.218 0.650 -37.012 1.00 0.00 N ATOM 899 CA CYS A 81 -95.501 1.707 -37.712 1.00 0.00 C ATOM 900 C CYS A 81 -96.455 2.788 -38.206 1.00 0.00 C ATOM 901 O CYS A 81 -96.075 3.954 -38.313 1.00 0.00 O ATOM 902 CB CYS A 81 -94.676 1.127 -38.858 1.00 0.00 C ATOM 903 SG CYS A 81 -93.469 -0.112 -38.301 1.00 0.00 S ATOM 0 H CYS A 81 -96.280 -0.233 -37.520 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.815 2.177 -37.007 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.346 0.672 -39.588 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.151 1.935 -39.367 1.00 0.00 H new ATOM 908 N GLN A 82 -97.699 2.405 -38.477 1.00 0.00 N ATOM 909 CA GLN A 82 -98.726 3.366 -38.861 1.00 0.00 C ATOM 910 C GLN A 82 -98.950 4.361 -37.727 1.00 0.00 C ATOM 911 O GLN A 82 -99.103 5.564 -37.952 1.00 0.00 O ATOM 912 CB GLN A 82 -100.033 2.647 -39.196 1.00 0.00 C ATOM 913 CG GLN A 82 -101.115 3.567 -39.735 1.00 0.00 C ATOM 914 CD GLN A 82 -102.426 2.848 -39.980 1.00 0.00 C ATOM 915 OE1 GLN A 82 -102.765 1.890 -39.288 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.171 3.309 -40.969 1.00 0.00 N ATOM 0 H GLN A 82 -98.019 1.437 -38.438 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.391 3.903 -39.748 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -99.831 1.868 -39.932 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.404 2.150 -38.300 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.278 4.381 -39.029 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -100.772 4.017 -40.667 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.852 4.107 -41.519 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.065 2.867 -41.183 1.00 0.00 H new ATOM 925 N ARG A 83 -98.939 3.850 -36.504 1.00 0.00 N ATOM 926 CA ARG A 83 -99.094 4.681 -35.322 1.00 0.00 C ATOM 927 C ARG A 83 -97.851 5.547 -35.104 1.00 0.00 C ATOM 928 O ARG A 83 -97.928 6.621 -34.506 1.00 0.00 O ATOM 929 CB ARG A 83 -99.379 3.804 -34.098 1.00 0.00 C ATOM 930 CG ARG A 83 -99.505 4.580 -32.799 1.00 0.00 C ATOM 931 CD ARG A 83 -100.146 3.741 -31.706 1.00 0.00 C ATOM 932 NE ARG A 83 -101.565 3.512 -31.956 1.00 0.00 N ATOM 933 CZ ARG A 83 -102.539 3.960 -31.164 1.00 0.00 C ATOM 934 NH1 ARG A 83 -102.247 4.728 -30.121 1.00 0.00 N ATOM 935 NH2 ARG A 83 -103.803 3.664 -31.436 1.00 0.00 N ATOM 0 H ARG A 83 -98.823 2.856 -36.305 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.942 5.350 -35.470 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.301 3.248 -34.268 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.579 3.070 -33.995 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -98.518 4.909 -32.474 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -100.101 5.477 -32.967 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -99.631 2.783 -31.635 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -100.023 4.241 -30.745 1.00 0.00 H new ATOM 0 HE ARG A 83 -101.827 2.978 -32.785 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -101.277 4.975 -29.926 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -102.993 5.071 -29.515 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -104.029 3.094 -32.251 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -104.549 4.007 -30.830 1.00 0.00 H new ATOM 949 N LEU A 84 -96.708 5.090 -35.610 1.00 0.00 N ATOM 950 CA LEU A 84 -95.481 5.884 -35.550 1.00 0.00 C ATOM 951 C LEU A 84 -95.298 6.709 -36.817 1.00 0.00 C ATOM 952 O LEU A 84 -94.213 7.233 -37.069 1.00 0.00 O ATOM 953 CB LEU A 84 -94.256 5.000 -35.339 1.00 0.00 C ATOM 954 CG LEU A 84 -93.894 4.734 -33.880 1.00 0.00 C ATOM 955 CD1 LEU A 84 -94.722 3.592 -33.312 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.407 4.457 -33.756 1.00 0.00 C ATOM 0 H LEU A 84 -96.605 4.182 -36.063 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.579 6.557 -34.698 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.427 4.045 -35.835 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.402 5.466 -35.830 1.00 0.00 H new ATOM 0 HG LEU A 84 -94.126 5.623 -33.294 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -94.444 3.423 -32.272 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -95.780 3.847 -33.368 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -94.536 2.686 -33.889 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -92.158 4.268 -32.712 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.149 3.583 -34.354 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -91.845 5.320 -34.113 1.00 0.00 H new ATOM 968 N ASN A 85 -96.377 6.812 -37.598 1.00 0.00 N ATOM 969 CA ASN A 85 -96.411 7.562 -38.866 1.00 0.00 C ATOM 970 C ASN A 85 -95.222 7.240 -39.779 1.00 0.00 C ATOM 971 O ASN A 85 -94.820 8.061 -40.601 1.00 0.00 O ATOM 972 CB ASN A 85 -96.538 9.088 -38.642 1.00 0.00 C ATOM 973 CG ASN A 85 -95.354 9.735 -37.938 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.345 10.062 -38.563 1.00 0.00 O ATOM 975 ND2 ASN A 85 -95.488 9.968 -36.640 1.00 0.00 N ATOM 0 H ASN A 85 -97.268 6.371 -37.367 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.311 7.226 -39.381 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.675 9.572 -39.609 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.438 9.281 -38.058 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.740 10.433 -36.125 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -96.339 9.682 -36.156 1.00 0.00 H new ATOM 982 N CYS A 86 -94.693 6.026 -39.668 1.00 0.00 N ATOM 983 CA CYS A 86 -93.636 5.569 -40.564 1.00 0.00 C ATOM 984 C CYS A 86 -94.258 4.811 -41.733 1.00 0.00 C ATOM 985 O CYS A 86 -93.564 4.174 -42.521 1.00 0.00 O ATOM 986 CB CYS A 86 -92.625 4.681 -39.819 1.00 0.00 C ATOM 987 SG CYS A 86 -91.674 5.548 -38.532 1.00 0.00 S ATOM 0 H CYS A 86 -94.978 5.341 -38.968 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.095 6.436 -40.943 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.159 3.848 -39.361 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -91.930 4.255 -40.543 1.00 0.00 H new ATOM 992 N GLY A 87 -95.583 4.889 -41.822 1.00 0.00 N ATOM 993 CA GLY A 87 -96.299 4.287 -42.924 1.00 0.00 C ATOM 994 C GLY A 87 -96.680 2.851 -42.649 1.00 0.00 C ATOM 995 O GLY A 87 -97.245 2.538 -41.602 1.00 0.00 O ATOM 0 H GLY A 87 -96.175 5.364 -41.141 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.200 4.866 -43.128 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -95.682 4.331 -43.821 1.00 0.00 H new ATOM 999 N ASP A 88 -96.363 1.983 -43.592 1.00 0.00 N ATOM 1000 CA ASP A 88 -96.665 0.562 -43.487 1.00 0.00 C ATOM 1001 C ASP A 88 -95.627 -0.110 -42.587 1.00 0.00 C ATOM 1002 O ASP A 88 -94.660 0.539 -42.186 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.693 -0.041 -44.894 1.00 0.00 C ATOM 1004 CG ASP A 88 -97.811 0.549 -45.730 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -97.592 1.600 -46.367 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -98.921 -0.020 -45.733 1.00 0.00 O ATOM 0 H ASP A 88 -95.887 2.242 -44.456 1.00 0.00 H new ATOM 0 HA ASP A 88 -97.643 0.402 -43.033 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -95.737 0.137 -45.386 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.820 -1.121 -44.825 1.00 0.00 H new ATOM 1011 N PRO A 89 -95.800 -1.390 -42.205 1.00 0.00 N ATOM 1012 CA PRO A 89 -94.917 -2.003 -41.226 1.00 0.00 C ATOM 1013 C PRO A 89 -93.527 -2.279 -41.730 1.00 0.00 C ATOM 1014 O PRO A 89 -93.285 -2.514 -42.915 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.586 -3.308 -40.865 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.414 -3.650 -42.045 1.00 0.00 C ATOM 1017 CD PRO A 89 -96.839 -2.335 -42.661 1.00 0.00 C ATOM 0 HA PRO A 89 -94.779 -1.321 -40.387 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -94.850 -4.086 -40.660 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.198 -3.204 -39.969 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -95.847 -4.248 -42.758 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.282 -4.241 -41.753 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -96.878 -2.395 -43.749 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -97.831 -2.035 -42.323 1.00 0.00 H new ATOM 1025 N LEU A 90 -92.633 -2.179 -40.781 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.266 -2.594 -40.884 1.00 0.00 C ATOM 1027 C LEU A 90 -91.071 -3.835 -41.740 1.00 0.00 C ATOM 1028 O LEU A 90 -91.527 -4.928 -41.423 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.694 -2.770 -39.470 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.739 -2.977 -38.348 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.707 -4.096 -38.659 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.074 -3.245 -37.018 1.00 0.00 C ATOM 0 H LEU A 90 -92.856 -1.784 -39.867 1.00 0.00 H new ATOM 0 HA LEU A 90 -90.714 -1.813 -41.407 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.018 -3.625 -39.475 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.096 -1.892 -39.227 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.303 -2.046 -38.288 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.419 -4.199 -37.840 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.244 -3.867 -39.580 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.157 -5.029 -38.782 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.836 -3.386 -36.252 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.463 -4.145 -37.091 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.442 -2.398 -36.750 1.00 0.00 H new ATOM 1044 N SER A 91 -90.429 -3.606 -42.863 1.00 0.00 N ATOM 1045 CA SER A 91 -89.947 -4.669 -43.730 1.00 0.00 C ATOM 1046 C SER A 91 -88.864 -5.448 -42.989 1.00 0.00 C ATOM 1047 O SER A 91 -88.094 -4.858 -42.229 1.00 0.00 O ATOM 1048 CB SER A 91 -89.391 -4.057 -45.023 1.00 0.00 C ATOM 1049 OG SER A 91 -89.039 -5.049 -45.970 1.00 0.00 O ATOM 0 H SER A 91 -90.222 -2.669 -43.208 1.00 0.00 H new ATOM 0 HA SER A 91 -90.758 -5.348 -43.992 1.00 0.00 H new ATOM 0 HB2 SER A 91 -90.135 -3.389 -45.457 1.00 0.00 H new ATOM 0 HB3 SER A 91 -88.515 -3.451 -44.790 1.00 0.00 H new ATOM 0 HG SER A 91 -88.691 -4.620 -46.779 1.00 0.00 H new ATOM 1055 N LEU A 92 -88.803 -6.758 -43.190 1.00 0.00 N ATOM 1056 CA LEU A 92 -87.907 -7.584 -42.398 1.00 0.00 C ATOM 1057 C LEU A 92 -86.840 -8.269 -43.247 1.00 0.00 C ATOM 1058 O LEU A 92 -87.098 -8.725 -44.362 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.697 -8.635 -41.619 1.00 0.00 C ATOM 1060 CG LEU A 92 -87.859 -9.496 -40.671 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -87.239 -8.655 -39.569 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.701 -10.613 -40.078 1.00 0.00 C ATOM 0 H LEU A 92 -89.354 -7.263 -43.884 1.00 0.00 H new ATOM 0 HA LEU A 92 -87.397 -6.917 -41.703 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.472 -8.132 -41.041 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -89.203 -9.289 -42.329 1.00 0.00 H new ATOM 0 HG LEU A 92 -87.050 -9.941 -41.250 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -86.650 -9.294 -38.911 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -86.594 -7.895 -40.010 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -88.028 -8.171 -38.993 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -88.087 -11.214 -39.407 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -89.534 -10.184 -39.522 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -89.086 -11.243 -40.880 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.636 -8.317 -42.698 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.539 -9.042 -43.304 1.00 0.00 C ATOM 1076 C GLY A 93 -83.311 -8.945 -42.429 1.00 0.00 C ATOM 1077 O GLY A 93 -83.274 -8.099 -41.543 1.00 0.00 O ATOM 0 H GLY A 93 -85.396 -7.854 -41.821 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.815 -10.087 -43.443 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.325 -8.635 -44.292 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.295 -9.799 -42.628 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.087 -9.786 -41.796 1.00 0.00 C ATOM 1083 C PRO A 94 -80.412 -8.417 -41.795 1.00 0.00 C ATOM 1084 O PRO A 94 -80.131 -7.855 -42.857 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.181 -10.845 -42.440 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.755 -11.084 -43.796 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.231 -10.830 -43.671 1.00 0.00 C ATOM 0 HA PRO A 94 -81.309 -9.996 -40.750 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.151 -10.494 -42.505 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.168 -11.762 -41.851 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.305 -10.418 -44.533 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.561 -12.104 -44.128 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.663 -10.483 -44.610 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.774 -11.731 -43.384 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.166 -7.880 -40.604 1.00 0.00 N ATOM 1096 CA PHE A 95 -79.603 -6.546 -40.473 1.00 0.00 C ATOM 1097 C PHE A 95 -78.349 -6.573 -39.602 1.00 0.00 C ATOM 1098 O PHE A 95 -78.401 -6.255 -38.411 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.654 -5.585 -39.896 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.204 -4.154 -39.784 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -79.542 -3.535 -40.832 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.446 -3.427 -38.625 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -79.132 -2.222 -40.729 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.037 -2.112 -38.520 1.00 0.00 C ATOM 1105 CZ PHE A 95 -79.380 -1.510 -39.574 1.00 0.00 C ATOM 0 H PHE A 95 -80.349 -8.350 -39.718 1.00 0.00 H new ATOM 0 HA PHE A 95 -79.314 -6.188 -41.461 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.545 -5.623 -40.523 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.945 -5.938 -38.907 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -79.345 -4.087 -41.739 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.959 -3.895 -37.798 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -78.617 -1.751 -41.553 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.231 -1.556 -37.615 1.00 0.00 H new ATOM 0 HZ PHE A 95 -79.060 -0.482 -39.494 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.235 -6.983 -40.213 1.00 0.00 N ATOM 1116 CA LEU A 96 -75.937 -7.035 -39.543 1.00 0.00 C ATOM 1117 C LEU A 96 -76.042 -7.758 -38.201 1.00 0.00 C ATOM 1118 O LEU A 96 -76.612 -8.846 -38.113 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.396 -5.614 -39.344 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.180 -4.811 -40.629 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.715 -3.400 -40.305 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -74.175 -5.506 -41.534 1.00 0.00 C ATOM 0 H LEU A 96 -77.209 -7.288 -41.186 1.00 0.00 H new ATOM 0 HA LEU A 96 -75.245 -7.595 -40.172 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -76.088 -5.066 -38.704 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -74.448 -5.675 -38.810 1.00 0.00 H new ATOM 0 HG LEU A 96 -76.132 -4.749 -41.156 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -74.567 -2.844 -41.231 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -75.469 -2.899 -39.698 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -73.776 -3.444 -39.754 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -74.036 -4.919 -42.442 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -73.222 -5.601 -41.014 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -74.546 -6.497 -41.796 1.00 0.00 H new ATOM 1134 N LYS A 97 -75.467 -7.161 -37.170 1.00 0.00 N ATOM 1135 CA LYS A 97 -75.617 -7.658 -35.817 1.00 0.00 C ATOM 1136 C LYS A 97 -75.939 -6.491 -34.894 1.00 0.00 C ATOM 1137 O LYS A 97 -75.085 -5.647 -34.625 1.00 0.00 O ATOM 1138 CB LYS A 97 -74.347 -8.376 -35.364 1.00 0.00 C ATOM 1139 CG LYS A 97 -74.434 -8.952 -33.962 1.00 0.00 C ATOM 1140 CD LYS A 97 -73.167 -9.701 -33.601 1.00 0.00 C ATOM 1141 CE LYS A 97 -73.175 -10.146 -32.151 1.00 0.00 C ATOM 1142 NZ LYS A 97 -71.935 -10.883 -31.795 1.00 0.00 N ATOM 0 H LYS A 97 -74.888 -6.325 -37.248 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.433 -8.380 -35.782 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -74.127 -9.182 -36.064 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -73.511 -7.678 -35.408 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -74.602 -8.148 -33.245 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -75.289 -9.624 -33.894 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -73.061 -10.571 -34.249 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -72.302 -9.062 -33.781 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -73.279 -9.275 -31.504 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -74.041 -10.783 -31.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -71.977 -11.171 -30.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -71.849 -11.728 -32.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -71.110 -10.267 -31.943 1.00 0.00 H new ATOM 1156 N THR A 98 -77.179 -6.427 -34.438 1.00 0.00 N ATOM 1157 CA THR A 98 -77.634 -5.275 -33.675 1.00 0.00 C ATOM 1158 C THR A 98 -77.921 -5.614 -32.209 1.00 0.00 C ATOM 1159 O THR A 98 -77.674 -4.790 -31.327 1.00 0.00 O ATOM 1160 CB THR A 98 -78.897 -4.661 -34.310 1.00 0.00 C ATOM 1161 OG1 THR A 98 -78.747 -4.585 -35.735 1.00 0.00 O ATOM 1162 CG2 THR A 98 -79.156 -3.263 -33.760 1.00 0.00 C ATOM 0 H THR A 98 -77.883 -7.151 -34.580 1.00 0.00 H new ATOM 0 HA THR A 98 -76.818 -4.552 -33.699 1.00 0.00 H new ATOM 0 HB THR A 98 -79.743 -5.302 -34.063 1.00 0.00 H new ATOM 0 HG1 THR A 98 -79.606 -4.347 -36.142 1.00 0.00 H new ATOM 0 HG21 THR A 98 -80.052 -2.850 -34.223 1.00 0.00 H new ATOM 0 HG22 THR A 98 -79.297 -3.317 -32.681 1.00 0.00 H new ATOM 0 HG23 THR A 98 -78.304 -2.621 -33.983 1.00 0.00 H new ATOM 1170 N TYR A 99 -78.432 -6.815 -31.938 1.00 0.00 N ATOM 1171 CA TYR A 99 -78.843 -7.148 -30.576 1.00 0.00 C ATOM 1172 C TYR A 99 -77.641 -7.499 -29.702 1.00 0.00 C ATOM 1173 O TYR A 99 -76.545 -7.765 -30.205 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.898 -8.284 -30.547 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.416 -9.688 -30.909 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -78.333 -10.278 -30.263 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -80.074 -10.434 -31.878 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -77.915 -11.554 -30.576 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.658 -11.717 -32.197 1.00 0.00 C ATOM 1180 CZ TYR A 99 -78.576 -12.270 -31.543 1.00 0.00 C ATOM 1181 OH TYR A 99 -78.155 -13.546 -31.850 1.00 0.00 O ATOM 0 H TYR A 99 -78.569 -7.556 -32.625 1.00 0.00 H new ATOM 0 HA TYR A 99 -79.314 -6.256 -30.162 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -80.328 -8.321 -29.546 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -80.704 -8.016 -31.231 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -77.808 -9.723 -29.499 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.923 -10.008 -32.391 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -77.070 -11.989 -30.062 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -80.179 -12.282 -32.955 1.00 0.00 H new ATOM 0 HH TYR A 99 -77.701 -13.936 -31.074 1.00 0.00 H new ATOM 1191 N THR A 100 -77.861 -7.508 -28.399 1.00 0.00 N ATOM 1192 CA THR A 100 -76.840 -7.910 -27.454 1.00 0.00 C ATOM 1193 C THR A 100 -77.198 -9.267 -26.854 1.00 0.00 C ATOM 1194 O THR A 100 -78.229 -9.412 -26.193 1.00 0.00 O ATOM 1195 CB THR A 100 -76.681 -6.864 -26.337 1.00 0.00 C ATOM 1196 OG1 THR A 100 -76.490 -5.569 -26.921 1.00 0.00 O ATOM 1197 CG2 THR A 100 -75.499 -7.195 -25.433 1.00 0.00 C ATOM 0 H THR A 100 -78.747 -7.238 -27.971 1.00 0.00 H new ATOM 0 HA THR A 100 -75.891 -7.988 -27.984 1.00 0.00 H new ATOM 0 HB THR A 100 -77.586 -6.871 -25.730 1.00 0.00 H new ATOM 0 HG1 THR A 100 -76.390 -4.901 -26.211 1.00 0.00 H new ATOM 0 HG21 THR A 100 -75.413 -6.437 -24.654 1.00 0.00 H new ATOM 0 HG22 THR A 100 -75.654 -8.171 -24.974 1.00 0.00 H new ATOM 0 HG23 THR A 100 -74.583 -7.213 -26.024 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.351 -10.275 -27.096 1.00 0.00 N ATOM 1206 CA PRO A 101 -76.567 -11.655 -26.655 1.00 0.00 C ATOM 1207 C PRO A 101 -76.420 -11.808 -25.145 1.00 0.00 C ATOM 1208 O PRO A 101 -75.539 -12.518 -24.660 1.00 0.00 O ATOM 1209 CB PRO A 101 -75.474 -12.455 -27.383 1.00 0.00 C ATOM 1210 CG PRO A 101 -74.889 -11.517 -28.383 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.097 -10.140 -27.826 1.00 0.00 C ATOM 0 HA PRO A 101 -77.577 -11.995 -26.883 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -74.715 -12.807 -26.684 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -75.892 -13.336 -27.870 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -73.829 -11.720 -28.536 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -75.377 -11.624 -29.352 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.278 -9.840 -27.172 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.166 -9.391 -28.614 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.307 -11.145 -24.422 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.299 -11.133 -22.969 1.00 0.00 C ATOM 1221 C GLN A 102 -78.513 -10.361 -22.475 1.00 0.00 C ATOM 1222 O GLN A 102 -79.358 -10.890 -21.749 1.00 0.00 O ATOM 1223 CB GLN A 102 -76.012 -10.477 -22.446 1.00 0.00 C ATOM 1224 CG GLN A 102 -75.944 -10.358 -20.931 1.00 0.00 C ATOM 1225 CD GLN A 102 -74.696 -9.633 -20.468 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -73.648 -9.702 -21.108 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -74.804 -8.920 -19.359 1.00 0.00 N ATOM 0 H GLN A 102 -78.061 -10.594 -24.832 1.00 0.00 H new ATOM 0 HA GLN A 102 -77.337 -12.157 -22.599 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.156 -11.056 -22.793 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -75.922 -9.482 -22.882 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -76.825 -9.827 -20.570 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -75.968 -11.354 -20.489 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -75.691 -8.889 -18.857 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -74.000 -8.401 -19.006 1.00 0.00 H new ATOM 1236 N SER A 103 -78.601 -9.112 -22.906 1.00 0.00 N ATOM 1237 CA SER A 103 -79.681 -8.228 -22.510 1.00 0.00 C ATOM 1238 C SER A 103 -80.852 -8.313 -23.488 1.00 0.00 C ATOM 1239 O SER A 103 -82.012 -8.168 -23.093 1.00 0.00 O ATOM 1240 CB SER A 103 -79.150 -6.802 -22.430 1.00 0.00 C ATOM 1241 OG SER A 103 -78.371 -6.507 -23.574 1.00 0.00 O ATOM 0 H SER A 103 -77.925 -8.685 -23.540 1.00 0.00 H new ATOM 0 HA SER A 103 -80.052 -8.536 -21.532 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.981 -6.100 -22.356 1.00 0.00 H new ATOM 0 HB3 SER A 103 -78.548 -6.680 -21.530 1.00 0.00 H new ATOM 0 HG SER A 103 -78.036 -5.588 -23.514 1.00 0.00 H new ATOM 1247 N SER A 104 -80.553 -8.544 -24.766 1.00 0.00 N ATOM 1248 CA SER A 104 -81.602 -8.713 -25.760 1.00 0.00 C ATOM 1249 C SER A 104 -82.226 -10.096 -25.611 1.00 0.00 C ATOM 1250 O SER A 104 -81.613 -10.993 -25.025 1.00 0.00 O ATOM 1251 CB SER A 104 -81.041 -8.520 -27.165 1.00 0.00 C ATOM 1252 OG SER A 104 -80.380 -7.268 -27.275 1.00 0.00 O ATOM 0 H SER A 104 -79.603 -8.617 -25.130 1.00 0.00 H new ATOM 0 HA SER A 104 -82.373 -7.959 -25.601 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.345 -9.326 -27.398 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.849 -8.576 -27.895 1.00 0.00 H new ATOM 0 HG SER A 104 -80.705 -6.795 -28.070 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.434 -10.280 -26.125 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.143 -11.530 -25.905 1.00 0.00 C ATOM 1260 C ILE A 105 -84.715 -12.116 -27.196 1.00 0.00 C ATOM 1261 O ILE A 105 -84.930 -11.417 -28.185 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.267 -11.374 -24.839 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.179 -10.176 -25.128 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.672 -11.240 -23.445 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.208 -10.419 -26.209 1.00 0.00 C ATOM 0 H ILE A 105 -83.935 -9.592 -26.687 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.401 -12.233 -25.526 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.875 -12.277 -24.889 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.695 -9.898 -24.209 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.561 -9.326 -25.417 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.475 -11.132 -22.716 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -84.087 -12.130 -23.212 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -84.027 -10.362 -23.407 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.809 -9.520 -26.348 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.703 -10.666 -27.143 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.855 -11.246 -25.916 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.929 -13.419 -27.168 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.607 -14.134 -28.233 1.00 0.00 C ATOM 1279 C ILE A 106 -86.812 -14.841 -27.622 1.00 0.00 C ATOM 1280 O ILE A 106 -86.645 -15.819 -26.894 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.697 -15.197 -28.894 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.511 -14.531 -29.584 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.492 -16.030 -29.896 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.518 -15.514 -30.169 1.00 0.00 C ATOM 0 H ILE A 106 -84.633 -14.017 -26.396 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.895 -13.418 -29.003 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.318 -15.858 -28.114 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.881 -13.884 -30.380 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.997 -13.891 -28.867 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -84.838 -16.773 -30.352 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.310 -16.534 -29.382 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.897 -15.379 -30.671 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.702 -14.968 -30.643 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.119 -16.145 -29.374 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.017 -16.137 -30.911 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.013 -14.343 -27.859 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.189 -14.992 -27.298 1.00 0.00 C ATOM 1298 C CYS A 107 -89.604 -16.143 -28.201 1.00 0.00 C ATOM 1299 O CYS A 107 -89.202 -16.206 -29.363 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.360 -14.020 -27.127 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.924 -12.376 -26.502 1.00 0.00 S ATOM 0 H CYS A 107 -88.200 -13.513 -28.421 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.927 -15.362 -26.307 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.856 -13.903 -28.090 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.085 -14.468 -26.447 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.399 -17.051 -27.673 1.00 0.00 N ATOM 1307 CA TYR A 108 -90.826 -18.220 -28.421 1.00 0.00 C ATOM 1308 C TYR A 108 -92.327 -18.407 -28.279 1.00 0.00 C ATOM 1309 O TYR A 108 -93.016 -17.545 -27.734 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.094 -19.464 -27.922 1.00 0.00 C ATOM 1311 CG TYR A 108 -88.628 -19.532 -28.301 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.228 -20.121 -29.492 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.643 -19.016 -27.464 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -86.895 -20.193 -29.844 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.307 -19.084 -27.811 1.00 0.00 C ATOM 1316 CZ TYR A 108 -85.939 -19.674 -29.002 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.611 -19.743 -29.354 1.00 0.00 O ATOM 0 H TYR A 108 -90.766 -17.003 -26.722 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.585 -18.071 -29.473 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.177 -19.506 -26.836 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.598 -20.347 -28.315 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -88.974 -20.531 -30.157 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -87.927 -18.556 -26.529 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.604 -20.655 -30.776 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.554 -18.677 -27.152 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.065 -19.331 -28.653 1.00 0.00 H new ATOM 1327 N GLY A 109 -92.828 -19.527 -28.766 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.241 -19.795 -28.675 1.00 0.00 C ATOM 1329 C GLY A 109 -94.940 -19.578 -29.990 1.00 0.00 C ATOM 1330 O GLY A 109 -94.464 -20.012 -31.040 1.00 0.00 O ATOM 0 H GLY A 109 -92.280 -20.256 -29.223 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.395 -20.823 -28.348 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -94.685 -19.149 -27.917 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.064 -18.898 -29.930 1.00 0.00 N ATOM 1335 CA GLN A 110 -96.837 -18.594 -31.117 1.00 0.00 C ATOM 1336 C GLN A 110 -96.760 -17.099 -31.409 1.00 0.00 C ATOM 1337 O GLN A 110 -96.837 -16.281 -30.487 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.295 -19.021 -30.915 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.017 -19.346 -32.211 1.00 0.00 C ATOM 1340 CD GLN A 110 -98.473 -20.595 -32.881 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -98.498 -20.719 -34.104 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -97.984 -21.535 -32.086 1.00 0.00 N ATOM 0 H GLN A 110 -96.467 -18.542 -29.063 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.427 -19.143 -31.965 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.322 -19.895 -30.264 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -98.831 -18.223 -30.400 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -100.079 -19.480 -32.008 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.927 -18.502 -32.895 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -97.980 -21.397 -31.075 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -97.612 -22.397 -32.484 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.594 -16.747 -32.677 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.499 -15.348 -33.075 1.00 0.00 C ATOM 1353 C LEU A 111 -97.778 -14.608 -32.704 1.00 0.00 C ATOM 1354 O LEU A 111 -98.840 -14.846 -33.282 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.240 -15.235 -34.579 1.00 0.00 C ATOM 1356 CG LEU A 111 -96.029 -13.812 -35.098 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.775 -13.201 -34.491 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.947 -13.810 -36.617 1.00 0.00 C ATOM 0 H LEU A 111 -96.522 -17.411 -33.448 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.663 -14.893 -32.545 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.360 -15.829 -34.826 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -97.082 -15.677 -35.111 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.882 -13.204 -34.798 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.642 -12.189 -34.873 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.874 -13.170 -33.406 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.909 -13.806 -34.759 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.797 -12.790 -36.972 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -95.111 -14.432 -36.937 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.874 -14.206 -37.032 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.675 -13.720 -31.730 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.839 -13.007 -31.263 1.00 0.00 C ATOM 1372 C GLY A 112 -99.125 -13.271 -29.801 1.00 0.00 C ATOM 1373 O GLY A 112 -100.061 -12.713 -29.239 1.00 0.00 O ATOM 0 H GLY A 112 -96.805 -13.481 -31.255 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.693 -11.938 -31.415 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.704 -13.298 -31.859 1.00 0.00 H new ATOM 1377 N SER A 113 -98.334 -14.129 -29.179 1.00 0.00 N ATOM 1378 CA SER A 113 -98.490 -14.383 -27.756 1.00 0.00 C ATOM 1379 C SER A 113 -97.270 -13.888 -26.982 1.00 0.00 C ATOM 1380 O SER A 113 -96.293 -14.610 -26.796 1.00 0.00 O ATOM 1381 CB SER A 113 -98.732 -15.872 -27.494 1.00 0.00 C ATOM 1382 OG SER A 113 -99.865 -16.332 -28.217 1.00 0.00 O ATOM 0 H SER A 113 -97.586 -14.656 -29.630 1.00 0.00 H new ATOM 0 HA SER A 113 -99.362 -13.831 -27.405 1.00 0.00 H new ATOM 0 HB2 SER A 113 -97.852 -16.445 -27.785 1.00 0.00 H new ATOM 0 HB3 SER A 113 -98.883 -16.039 -26.427 1.00 0.00 H new ATOM 0 HG SER A 113 -100.002 -17.286 -28.038 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.336 -12.640 -26.550 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.238 -12.006 -25.835 1.00 0.00 C ATOM 1390 C PHE A 114 -96.377 -12.249 -24.336 1.00 0.00 C ATOM 1391 O PHE A 114 -96.520 -11.311 -23.551 1.00 0.00 O ATOM 1392 CB PHE A 114 -96.227 -10.496 -26.116 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.860 -10.121 -27.527 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.416 -10.779 -28.613 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.952 -9.104 -27.762 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -96.075 -10.430 -29.903 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.608 -8.749 -29.051 1.00 0.00 C ATOM 1398 CZ PHE A 114 -95.169 -9.413 -30.122 1.00 0.00 C ATOM 0 H PHE A 114 -98.149 -12.038 -26.684 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.300 -12.440 -26.181 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -97.214 -10.091 -25.892 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.524 -10.018 -25.433 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -97.126 -11.576 -28.447 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.507 -8.582 -26.928 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.516 -10.952 -30.740 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.900 -7.952 -29.221 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.899 -9.137 -31.131 1.00 0.00 H new ATOM 1408 N SER A 115 -96.365 -13.512 -23.945 1.00 0.00 N ATOM 1409 CA SER A 115 -96.531 -13.876 -22.548 1.00 0.00 C ATOM 1410 C SER A 115 -95.230 -14.408 -21.939 1.00 0.00 C ATOM 1411 O SER A 115 -94.999 -14.277 -20.733 1.00 0.00 O ATOM 1412 CB SER A 115 -97.656 -14.903 -22.418 1.00 0.00 C ATOM 1413 OG SER A 115 -97.529 -15.931 -23.389 1.00 0.00 O ATOM 0 H SER A 115 -96.242 -14.304 -24.576 1.00 0.00 H new ATOM 0 HA SER A 115 -96.797 -12.979 -21.989 1.00 0.00 H new ATOM 0 HB2 SER A 115 -97.640 -15.339 -21.419 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.620 -14.407 -22.534 1.00 0.00 H new ATOM 0 HG SER A 115 -98.260 -16.575 -23.282 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.366 -14.986 -22.770 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.128 -15.586 -22.280 1.00 0.00 C ATOM 1421 C ASN A 116 -92.014 -15.452 -23.317 1.00 0.00 C ATOM 1422 O ASN A 116 -92.257 -15.564 -24.519 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.362 -17.065 -21.942 1.00 0.00 C ATOM 1424 CG ASN A 116 -92.195 -17.702 -21.206 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.292 -18.270 -21.815 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -92.214 -17.620 -19.883 1.00 0.00 N ATOM 0 H ASN A 116 -94.499 -15.052 -23.779 1.00 0.00 H new ATOM 0 HA ASN A 116 -92.820 -15.058 -21.378 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.261 -17.154 -21.331 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -93.547 -17.617 -22.864 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -91.461 -18.037 -19.335 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -92.981 -17.140 -19.413 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.799 -15.198 -22.849 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.648 -15.059 -23.736 1.00 0.00 C ATOM 1435 C CYS A 117 -88.442 -15.820 -23.184 1.00 0.00 C ATOM 1436 O CYS A 117 -88.567 -16.624 -22.261 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.262 -13.587 -23.901 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.538 -12.503 -24.587 1.00 0.00 S ATOM 0 H CYS A 117 -90.583 -15.084 -21.859 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.932 -15.473 -24.703 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -88.969 -13.198 -22.926 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.383 -13.532 -24.544 1.00 0.00 H new ATOM 1443 N SER A 118 -87.274 -15.550 -23.754 1.00 0.00 N ATOM 1444 CA SER A 118 -86.025 -16.139 -23.299 1.00 0.00 C ATOM 1445 C SER A 118 -84.884 -15.207 -23.687 1.00 0.00 C ATOM 1446 O SER A 118 -85.049 -14.376 -24.576 1.00 0.00 O ATOM 1447 CB SER A 118 -85.823 -17.526 -23.920 1.00 0.00 C ATOM 1448 OG SER A 118 -84.666 -18.160 -23.396 1.00 0.00 O ATOM 0 H SER A 118 -87.168 -14.915 -24.546 1.00 0.00 H new ATOM 0 HA SER A 118 -86.049 -16.264 -22.216 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.699 -18.145 -23.726 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.731 -17.433 -25.002 1.00 0.00 H new ATOM 0 HG SER A 118 -84.562 -19.043 -23.808 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.742 -15.321 -23.025 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.613 -14.443 -23.321 1.00 0.00 C ATOM 1456 C HIS A 119 -81.949 -14.838 -24.632 1.00 0.00 C ATOM 1457 O HIS A 119 -81.888 -16.017 -24.982 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.599 -14.433 -22.175 1.00 0.00 C ATOM 1459 CG HIS A 119 -82.033 -13.589 -21.015 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.416 -12.405 -20.671 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -83.043 -13.751 -20.130 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -82.031 -11.879 -19.628 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -83.025 -12.675 -19.280 1.00 0.00 N ATOM 0 H HIS A 119 -83.570 -16.004 -22.287 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.000 -13.430 -23.428 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.436 -15.455 -21.833 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.643 -14.065 -22.547 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.611 -11.999 -21.148 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.737 -14.578 -20.099 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -81.765 -10.952 -19.141 1.00 0.00 H new ATOM 1472 N SER A 120 -81.475 -13.842 -25.361 1.00 0.00 N ATOM 1473 CA SER A 120 -80.905 -14.058 -26.677 1.00 0.00 C ATOM 1474 C SER A 120 -79.411 -14.319 -26.589 1.00 0.00 C ATOM 1475 O SER A 120 -78.684 -13.600 -25.909 1.00 0.00 O ATOM 1476 CB SER A 120 -81.162 -12.837 -27.565 1.00 0.00 C ATOM 1477 OG SER A 120 -80.671 -13.035 -28.880 1.00 0.00 O ATOM 0 H SER A 120 -81.475 -12.868 -25.059 1.00 0.00 H new ATOM 0 HA SER A 120 -81.383 -14.935 -27.113 1.00 0.00 H new ATOM 0 HB2 SER A 120 -82.232 -12.633 -27.603 1.00 0.00 H new ATOM 0 HB3 SER A 120 -80.685 -11.961 -27.126 1.00 0.00 H new ATOM 0 HG SER A 120 -79.871 -12.486 -29.017 1.00 0.00 H new ATOM 1483 N ARG A 121 -78.972 -15.374 -27.248 1.00 0.00 N ATOM 1484 CA ARG A 121 -77.556 -15.619 -27.441 1.00 0.00 C ATOM 1485 C ARG A 121 -77.269 -15.643 -28.936 1.00 0.00 C ATOM 1486 O ARG A 121 -76.839 -14.649 -29.519 1.00 0.00 O ATOM 1487 CB ARG A 121 -77.131 -16.944 -26.801 1.00 0.00 C ATOM 1488 CG ARG A 121 -77.099 -16.931 -25.278 1.00 0.00 C ATOM 1489 CD ARG A 121 -76.072 -15.942 -24.748 1.00 0.00 C ATOM 1490 NE ARG A 121 -75.562 -16.336 -23.433 1.00 0.00 N ATOM 1491 CZ ARG A 121 -74.678 -15.624 -22.735 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -74.318 -14.417 -23.153 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -74.179 -16.107 -21.603 1.00 0.00 N ATOM 0 H ARG A 121 -79.581 -16.080 -27.662 1.00 0.00 H new ATOM 0 HA ARG A 121 -76.986 -14.824 -26.960 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -77.814 -17.727 -27.130 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -76.140 -17.209 -27.170 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -78.086 -16.672 -24.895 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -76.867 -17.930 -24.910 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -75.243 -15.868 -25.452 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -76.523 -14.952 -24.681 1.00 0.00 H new ATOM 0 HE ARG A 121 -75.904 -17.207 -23.027 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -74.718 -14.033 -24.009 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -73.641 -13.873 -22.618 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -74.472 -17.024 -21.267 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -73.502 -15.561 -21.070 1.00 0.00 H new ATOM 1550 N CYS A 125 -82.202 -16.272 -35.262 1.00 0.00 N ATOM 1551 CA CYS A 125 -82.128 -14.858 -35.579 1.00 0.00 C ATOM 1552 C CYS A 125 -80.756 -14.273 -35.293 1.00 0.00 C ATOM 1553 O CYS A 125 -80.354 -14.137 -34.139 1.00 0.00 O ATOM 1554 CB CYS A 125 -83.196 -14.086 -34.803 1.00 0.00 C ATOM 1555 SG CYS A 125 -83.669 -14.858 -33.224 1.00 0.00 S ATOM 0 HA CYS A 125 -82.308 -14.759 -36.649 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.830 -13.078 -34.607 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -84.084 -13.987 -35.428 1.00 0.00 H new ATOM 1560 N HIS A 126 -80.036 -13.934 -36.352 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.818 -13.152 -36.216 1.00 0.00 C ATOM 1562 C HIS A 126 -79.189 -11.677 -36.319 1.00 0.00 C ATOM 1563 O HIS A 126 -78.792 -10.987 -37.253 1.00 0.00 O ATOM 1564 CB HIS A 126 -77.793 -13.534 -37.292 1.00 0.00 C ATOM 1565 CG HIS A 126 -76.442 -12.901 -37.102 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -75.936 -11.942 -37.948 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -75.489 -13.107 -36.160 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -74.732 -11.585 -37.541 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -74.436 -12.277 -36.456 1.00 0.00 N ATOM 0 H HIS A 126 -80.273 -14.187 -37.311 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.355 -13.354 -35.250 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -77.677 -14.618 -37.300 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.183 -13.248 -38.269 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -75.547 -13.796 -35.331 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -74.097 -10.851 -38.015 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -73.568 -12.207 -35.925 1.00 0.00 H new ATOM 1578 N SER A 127 -79.984 -11.233 -35.345 1.00 0.00 N ATOM 1579 CA SER A 127 -80.574 -9.893 -35.322 1.00 0.00 C ATOM 1580 C SER A 127 -81.210 -9.515 -36.662 1.00 0.00 C ATOM 1581 O SER A 127 -80.590 -8.868 -37.510 1.00 0.00 O ATOM 1582 CB SER A 127 -79.564 -8.830 -34.862 1.00 0.00 C ATOM 1583 OG SER A 127 -78.302 -8.979 -35.488 1.00 0.00 O ATOM 0 H SER A 127 -80.240 -11.802 -34.538 1.00 0.00 H new ATOM 0 HA SER A 127 -81.377 -9.922 -34.585 1.00 0.00 H new ATOM 0 HB2 SER A 127 -79.960 -7.838 -35.080 1.00 0.00 H new ATOM 0 HB3 SER A 127 -79.440 -8.894 -33.781 1.00 0.00 H new ATOM 0 HG SER A 127 -78.430 -9.162 -36.442 1.00 0.00 H new ATOM 1589 N LEU A 128 -82.449 -9.954 -36.858 1.00 0.00 N ATOM 1590 CA LEU A 128 -83.197 -9.569 -38.038 1.00 0.00 C ATOM 1591 C LEU A 128 -83.691 -8.141 -37.871 1.00 0.00 C ATOM 1592 O LEU A 128 -84.136 -7.756 -36.792 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.367 -10.520 -38.286 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.978 -11.981 -38.525 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -85.196 -12.794 -38.936 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.886 -12.074 -39.582 1.00 0.00 C ATOM 0 H LEU A 128 -82.949 -10.571 -36.218 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.542 -9.628 -38.907 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -85.039 -10.475 -37.429 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.928 -10.164 -39.150 1.00 0.00 H new ATOM 0 HG LEU A 128 -83.589 -12.394 -37.594 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -84.902 -13.830 -39.102 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.945 -12.751 -38.146 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -85.614 -12.384 -39.855 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.621 -13.119 -39.740 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -83.247 -11.646 -40.517 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.007 -11.523 -39.247 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.600 -7.363 -38.927 1.00 0.00 N ATOM 1609 CA GLY A 129 -83.898 -5.959 -38.836 1.00 0.00 C ATOM 1610 C GLY A 129 -85.218 -5.622 -39.465 1.00 0.00 C ATOM 1611 O GLY A 129 -85.510 -6.037 -40.588 1.00 0.00 O ATOM 0 H GLY A 129 -83.322 -7.682 -39.855 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -83.908 -5.658 -37.788 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.108 -5.388 -39.324 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.021 -4.889 -38.730 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.302 -4.439 -39.215 1.00 0.00 C ATOM 1617 C LEU A 130 -87.219 -2.949 -39.535 1.00 0.00 C ATOM 1618 O LEU A 130 -86.561 -2.191 -38.821 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.374 -4.712 -38.160 1.00 0.00 C ATOM 1620 CG LEU A 130 -88.961 -6.126 -38.163 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.713 -6.402 -36.870 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -89.887 -6.309 -39.356 1.00 0.00 C ATOM 0 H LEU A 130 -85.804 -4.589 -37.780 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.571 -4.979 -40.123 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -87.948 -4.517 -37.176 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.187 -4.000 -38.302 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.138 -6.837 -38.241 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.121 -7.412 -36.895 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.031 -6.307 -36.025 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.527 -5.685 -36.762 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.298 -7.319 -39.346 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.701 -5.586 -39.299 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.327 -6.154 -40.278 1.00 0.00 H new ATOM 1634 N THR A 131 -87.848 -2.527 -40.613 1.00 0.00 N ATOM 1635 CA THR A 131 -87.789 -1.131 -41.004 1.00 0.00 C ATOM 1636 C THR A 131 -89.132 -0.651 -41.548 1.00 0.00 C ATOM 1637 O THR A 131 -89.523 -0.994 -42.660 1.00 0.00 O ATOM 1638 CB THR A 131 -86.648 -0.926 -42.013 1.00 0.00 C ATOM 1639 OG1 THR A 131 -86.525 0.453 -42.385 1.00 0.00 O ATOM 1640 CG2 THR A 131 -86.819 -1.781 -43.262 1.00 0.00 C ATOM 0 H THR A 131 -88.401 -3.123 -41.229 1.00 0.00 H new ATOM 0 HA THR A 131 -87.578 -0.523 -40.124 1.00 0.00 H new ATOM 0 HB THR A 131 -85.734 -1.244 -41.510 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.079 1.002 -41.792 1.00 0.00 H new ATOM 0 HG21 THR A 131 -85.988 -1.600 -43.943 1.00 0.00 H new ATOM 0 HG22 THR A 131 -86.836 -2.834 -42.982 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.756 -1.521 -43.755 1.00 0.00 H new ATOM 1648 N CYS A 132 -89.848 0.115 -40.711 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.242 0.501 -40.965 1.00 0.00 C ATOM 1650 C CYS A 132 -91.455 0.963 -42.391 1.00 0.00 C ATOM 1651 O CYS A 132 -91.103 2.080 -42.764 1.00 0.00 O ATOM 1652 CB CYS A 132 -91.676 1.570 -39.978 1.00 0.00 C ATOM 1653 SG CYS A 132 -91.754 0.957 -38.271 1.00 0.00 S ATOM 0 H CYS A 132 -89.474 0.485 -39.837 1.00 0.00 H new ATOM 0 HA CYS A 132 -91.862 -0.384 -40.824 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -90.981 2.408 -40.027 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -92.655 1.951 -40.268 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.032 0.050 -43.159 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.264 0.200 -44.578 1.00 0.00 C ATOM 1660 C LEU A 133 -90.943 0.194 -45.347 1.00 0.00 C ATOM 1661 O LEU A 133 -90.600 -0.801 -45.988 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.082 1.463 -44.891 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.304 1.757 -46.379 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.000 0.593 -47.069 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.110 3.035 -46.547 1.00 0.00 C ATOM 0 H LEU A 133 -92.361 -0.844 -42.794 1.00 0.00 H new ATOM 0 HA LEU A 133 -92.854 -0.655 -44.907 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.055 1.373 -44.408 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -92.581 2.320 -44.441 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.330 1.891 -46.849 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.145 0.829 -48.123 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.386 -0.303 -46.979 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -94.968 0.418 -46.600 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.261 3.233 -47.608 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.077 2.922 -46.058 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.570 3.868 -46.096 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.208 1.294 -45.261 1.00 0.00 N ATOM 1678 CA GLU A 134 -88.919 1.430 -45.936 1.00 0.00 C ATOM 1679 C GLU A 134 -88.172 2.666 -45.441 1.00 0.00 C ATOM 1680 O GLU A 134 -88.298 3.058 -44.279 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.097 1.475 -47.465 1.00 0.00 C ATOM 1682 CG GLU A 134 -90.200 2.407 -47.963 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.850 3.876 -47.844 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -88.989 4.350 -48.618 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -90.432 4.569 -46.986 1.00 0.00 O ATOM 0 H GLU A 134 -90.485 2.116 -44.724 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.321 0.552 -45.693 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.153 1.781 -47.916 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -89.307 0.466 -47.820 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.416 2.177 -49.006 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -91.112 2.212 -47.398 1.00 0.00 H new