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 115 SER OG : rot -73:sc= 0.636 USER MOD Set 1.2: A 116 ASN : amide:sc= 0.538 K(o=1.2,f=-0.061) USER MOD Set 2.1: A 79 LYS NZ :NH3+ 174:sc= 1.13 (180deg=0) USER MOD Set 2.2: A 82 GLN : amide:sc= 0.969 K(o=2.1,f=-5.2!) USER MOD Set 3.1: A 62 GLN : amide:sc= -3.41! K(o=-3.4!,f=-4.8) USER MOD Set 3.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 47 GLN : amide:sc= -0.0132 X(o=0.11,f=-0.038) USER MOD Set 4.2: A 104 SER OG : rot 59:sc= 0.125 USER MOD Single : A 27 SER OG : rot 153:sc= 0.0276 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.886 K(o=-0.89,f=0) USER MOD Single : A 38 THR OG1 : rot -165:sc= 1.21 USER MOD Single : A 40 SER OG : rot -45:sc= 0.694 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 64:sc= 1.34 USER MOD Single : A 43 LYS NZ :NH3+ 171:sc= 1.82 (180deg=1.78) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -0.0886 K(o=-0.089,f=-0.77) USER MOD Single : A 58 MET CE :methyl 163:sc= -0.116 (180deg=-0.644) USER MOD Single : A 61 SER OG : rot 10:sc=-0.00474 USER MOD Single : A 63 SER OG : rot -10:sc= 0.106 USER MOD Single : A 67 SER OG : rot 180:sc=0.000326 USER MOD Single : A 69 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.02) USER MOD Single : A 70 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.39) USER MOD Single : A 75 SER OG : rot -5:sc= 1.02 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.109 USER MOD Single : A 85 ASN : amide:sc= -0.675 X(o=-0.67,f=-0.71) USER MOD Single : A 91 SER OG : rot 101:sc= 0.458 USER MOD Single : A 97 LYS NZ :NH3+ -125:sc= -0.0328 (180deg=-0.366) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= -1.06 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0.507 K(o=0.51,f=-0.13) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -9:sc= 1.19 USER MOD Single : A 119 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.0047) USER MOD Single : A 120 SER OG : rot -148:sc= -3.02! USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 90:sc= -2.53! USER MOD Single : A 131 THR OG1 : rot 13:sc= -1.72! USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.253 -9.686 -25.457 1.00 0.00 N ATOM 26 CA LEU A 26 -100.241 -8.762 -25.951 1.00 0.00 C ATOM 27 C LEU A 26 -99.700 -9.245 -27.295 1.00 0.00 C ATOM 28 O LEU A 26 -99.183 -10.354 -27.398 1.00 0.00 O ATOM 29 CB LEU A 26 -99.091 -8.644 -24.937 1.00 0.00 C ATOM 30 CG LEU A 26 -99.388 -7.852 -23.649 1.00 0.00 C ATOM 31 CD1 LEU A 26 -100.526 -8.471 -22.853 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.140 -7.771 -22.783 1.00 0.00 C ATOM 0 HA LEU A 26 -100.698 -7.781 -26.084 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.781 -9.650 -24.655 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.242 -8.177 -25.437 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.694 -6.849 -23.946 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -100.703 -7.882 -21.953 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -101.430 -8.485 -23.461 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -100.262 -9.491 -22.573 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.362 -7.209 -21.876 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.816 -8.777 -22.516 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -97.346 -7.269 -23.335 1.00 0.00 H new ATOM 44 N SER A 27 -99.851 -8.433 -28.327 1.00 0.00 N ATOM 45 CA SER A 27 -99.390 -8.804 -29.656 1.00 0.00 C ATOM 46 C SER A 27 -98.906 -7.578 -30.422 1.00 0.00 C ATOM 47 O SER A 27 -99.327 -6.461 -30.131 1.00 0.00 O ATOM 48 CB SER A 27 -100.517 -9.512 -30.405 1.00 0.00 C ATOM 49 OG SER A 27 -101.705 -8.740 -30.389 1.00 0.00 O ATOM 0 H SER A 27 -100.289 -7.513 -28.272 1.00 0.00 H new ATOM 0 HA SER A 27 -98.545 -9.487 -29.565 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.213 -9.696 -31.436 1.00 0.00 H new ATOM 0 HB3 SER A 27 -100.705 -10.484 -29.950 1.00 0.00 H new ATOM 0 HG SER A 27 -102.245 -8.954 -31.178 1.00 0.00 H new ATOM 55 N TRP A 28 -98.040 -7.781 -31.412 1.00 0.00 N ATOM 56 CA TRP A 28 -97.500 -6.661 -32.185 1.00 0.00 C ATOM 57 C TRP A 28 -98.494 -6.177 -33.245 1.00 0.00 C ATOM 58 O TRP A 28 -98.136 -5.458 -34.177 1.00 0.00 O ATOM 59 CB TRP A 28 -96.139 -7.012 -32.814 1.00 0.00 C ATOM 60 CG TRP A 28 -96.144 -8.154 -33.794 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.144 -9.056 -34.024 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.071 -8.517 -34.673 1.00 0.00 C ATOM 63 NE1 TRP A 28 -96.761 -9.946 -34.997 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.492 -9.636 -35.410 1.00 0.00 C ATOM 65 CE3 TRP A 28 -93.791 -7.997 -34.910 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -94.685 -10.245 -36.368 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -92.992 -8.605 -35.863 1.00 0.00 C ATOM 68 CH2 TRP A 28 -93.442 -9.717 -36.579 1.00 0.00 C ATOM 0 H TRP A 28 -97.699 -8.699 -31.697 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.337 -5.838 -31.489 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -95.755 -6.126 -33.320 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -95.440 -7.250 -32.012 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.096 -9.067 -33.515 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.329 -10.714 -35.355 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -93.435 -7.139 -34.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.029 -11.104 -36.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.004 -8.213 -36.056 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -92.794 -10.169 -37.315 1.00 0.00 H new ATOM 79 N TYR A 29 -99.748 -6.569 -33.085 1.00 0.00 N ATOM 80 CA TYR A 29 -100.825 -6.041 -33.902 1.00 0.00 C ATOM 81 C TYR A 29 -101.953 -5.548 -33.002 1.00 0.00 C ATOM 82 O TYR A 29 -103.084 -5.346 -33.446 1.00 0.00 O ATOM 83 CB TYR A 29 -101.327 -7.083 -34.916 1.00 0.00 C ATOM 84 CG TYR A 29 -101.722 -8.418 -34.325 1.00 0.00 C ATOM 85 CD1 TYR A 29 -100.788 -9.438 -34.191 1.00 0.00 C ATOM 86 CD2 TYR A 29 -103.026 -8.666 -33.921 1.00 0.00 C ATOM 87 CE1 TYR A 29 -101.140 -10.665 -33.667 1.00 0.00 C ATOM 88 CE2 TYR A 29 -103.388 -9.892 -33.397 1.00 0.00 C ATOM 89 CZ TYR A 29 -102.441 -10.888 -33.273 1.00 0.00 C ATOM 90 OH TYR A 29 -102.794 -12.110 -32.746 1.00 0.00 O ATOM 0 H TYR A 29 -100.045 -7.256 -32.392 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.445 -5.199 -34.481 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.186 -6.669 -35.443 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -100.547 -7.249 -35.659 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -99.768 -9.267 -34.503 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -103.769 -7.889 -34.018 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -100.400 -11.445 -33.566 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -104.407 -10.070 -33.086 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.747 -12.105 -32.517 1.00 0.00 H new ATOM 100 N ASP A 30 -101.625 -5.342 -31.728 1.00 0.00 N ATOM 101 CA ASP A 30 -102.567 -4.768 -30.774 1.00 0.00 C ATOM 102 C ASP A 30 -102.371 -3.256 -30.720 1.00 0.00 C ATOM 103 O ASP A 30 -101.247 -2.783 -30.578 1.00 0.00 O ATOM 104 CB ASP A 30 -102.379 -5.374 -29.379 1.00 0.00 C ATOM 105 CG ASP A 30 -103.367 -4.820 -28.369 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.560 -5.185 -28.440 1.00 0.00 O ATOM 107 OD2 ASP A 30 -102.957 -4.029 -27.493 1.00 0.00 O ATOM 0 H ASP A 30 -100.711 -5.565 -31.333 1.00 0.00 H new ATOM 0 HA ASP A 30 -103.581 -4.996 -31.103 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.492 -6.456 -29.438 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -101.363 -5.178 -29.035 1.00 0.00 H new ATOM 112 N PRO A 31 -103.462 -2.484 -30.846 1.00 0.00 N ATOM 113 CA PRO A 31 -103.403 -1.015 -30.945 1.00 0.00 C ATOM 114 C PRO A 31 -102.739 -0.330 -29.749 1.00 0.00 C ATOM 115 O PRO A 31 -102.182 0.760 -29.890 1.00 0.00 O ATOM 116 CB PRO A 31 -104.875 -0.601 -31.038 1.00 0.00 C ATOM 117 CG PRO A 31 -105.585 -1.818 -31.515 1.00 0.00 C ATOM 118 CD PRO A 31 -104.844 -2.977 -30.921 1.00 0.00 C ATOM 0 HA PRO A 31 -102.791 -0.714 -31.796 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.256 -0.275 -30.070 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.009 0.231 -31.729 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.627 -1.814 -31.196 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.586 -1.870 -32.604 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.232 -3.242 -29.937 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -104.921 -3.868 -31.545 1.00 0.00 H new ATOM 126 N ASP A 32 -102.797 -0.953 -28.577 1.00 0.00 N ATOM 127 CA ASP A 32 -102.233 -0.335 -27.376 1.00 0.00 C ATOM 128 C ASP A 32 -100.859 -0.895 -27.042 1.00 0.00 C ATOM 129 O ASP A 32 -100.141 -0.336 -26.207 1.00 0.00 O ATOM 130 CB ASP A 32 -103.160 -0.501 -26.167 1.00 0.00 C ATOM 131 CG ASP A 32 -104.222 0.580 -26.083 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.974 1.710 -26.559 1.00 0.00 O ATOM 133 OD2 ASP A 32 -105.312 0.311 -25.529 1.00 0.00 O ATOM 0 H ASP A 32 -103.220 -1.869 -28.430 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.130 0.727 -27.598 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -103.645 -1.476 -26.219 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -102.564 -0.489 -25.254 1.00 0.00 H new ATOM 138 N PHE A 33 -100.485 -1.989 -27.691 1.00 0.00 N ATOM 139 CA PHE A 33 -99.203 -2.616 -27.420 1.00 0.00 C ATOM 140 C PHE A 33 -98.087 -1.840 -28.103 1.00 0.00 C ATOM 141 O PHE A 33 -98.138 -1.581 -29.306 1.00 0.00 O ATOM 142 CB PHE A 33 -99.202 -4.073 -27.884 1.00 0.00 C ATOM 143 CG PHE A 33 -98.143 -4.903 -27.212 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.066 -4.944 -25.830 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.235 -5.647 -27.948 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.109 -5.707 -25.197 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.278 -6.411 -27.316 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.214 -6.442 -25.942 1.00 0.00 C ATOM 0 H PHE A 33 -101.047 -2.456 -28.403 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.033 -2.603 -26.343 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.180 -4.512 -27.686 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.051 -4.105 -28.963 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -98.766 -4.370 -25.240 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.278 -5.628 -29.027 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -97.061 -5.729 -24.118 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.576 -6.987 -27.901 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.463 -7.042 -25.449 1.00 0.00 H new ATOM 158 N GLN A 34 -97.081 -1.461 -27.334 1.00 0.00 N ATOM 159 CA GLN A 34 -96.015 -0.628 -27.855 1.00 0.00 C ATOM 160 C GLN A 34 -94.867 -1.464 -28.395 1.00 0.00 C ATOM 161 O GLN A 34 -94.192 -2.181 -27.653 1.00 0.00 O ATOM 162 CB GLN A 34 -95.513 0.321 -26.770 1.00 0.00 C ATOM 163 CG GLN A 34 -96.587 1.264 -26.264 1.00 0.00 C ATOM 164 CD GLN A 34 -96.108 2.163 -25.140 1.00 0.00 C ATOM 165 OE1 GLN A 34 -96.885 2.547 -24.268 1.00 0.00 O ATOM 166 NE2 GLN A 34 -94.830 2.509 -25.155 1.00 0.00 N ATOM 0 H GLN A 34 -96.981 -1.716 -26.351 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.419 -0.045 -28.683 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.127 -0.263 -25.934 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.680 0.905 -27.162 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -96.939 1.882 -27.090 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -97.440 0.681 -25.917 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -94.218 2.169 -25.897 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -94.457 3.116 -24.425 1.00 0.00 H new ATOM 175 N ALA A 35 -94.658 -1.353 -29.693 1.00 0.00 N ATOM 176 CA ALA A 35 -93.545 -1.994 -30.369 1.00 0.00 C ATOM 177 C ALA A 35 -92.986 -1.041 -31.405 1.00 0.00 C ATOM 178 O ALA A 35 -93.742 -0.307 -32.041 1.00 0.00 O ATOM 179 CB ALA A 35 -93.983 -3.293 -31.027 1.00 0.00 C ATOM 0 H ALA A 35 -95.260 -0.811 -30.313 1.00 0.00 H new ATOM 0 HA ALA A 35 -92.774 -2.237 -29.638 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.131 -3.753 -31.527 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.369 -3.973 -30.268 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -94.763 -3.085 -31.759 1.00 0.00 H new ATOM 185 N ARG A 36 -91.674 -1.026 -31.560 1.00 0.00 N ATOM 186 CA ARG A 36 -91.037 -0.091 -32.468 1.00 0.00 C ATOM 187 C ARG A 36 -89.591 -0.472 -32.707 1.00 0.00 C ATOM 188 O ARG A 36 -89.113 -1.481 -32.200 1.00 0.00 O ATOM 189 CB ARG A 36 -91.097 1.327 -31.895 1.00 0.00 C ATOM 190 CG ARG A 36 -90.371 1.470 -30.563 1.00 0.00 C ATOM 191 CD ARG A 36 -90.426 2.896 -30.042 1.00 0.00 C ATOM 192 NE ARG A 36 -91.799 3.376 -29.892 1.00 0.00 N ATOM 193 CZ ARG A 36 -92.118 4.607 -29.493 1.00 0.00 C ATOM 194 NH1 ARG A 36 -91.167 5.461 -29.130 1.00 0.00 N ATOM 195 NH2 ARG A 36 -93.392 4.975 -29.426 1.00 0.00 N ATOM 0 H ARG A 36 -91.031 -1.649 -31.070 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.573 -0.125 -33.416 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.662 2.021 -32.614 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.140 1.615 -31.765 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.819 0.798 -29.831 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.331 1.166 -30.681 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.917 2.949 -29.080 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -89.886 3.552 -30.725 1.00 0.00 H new ATOM 0 HE ARG A 36 -92.559 2.730 -30.106 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.188 5.175 -29.156 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -91.416 6.402 -28.825 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -94.127 4.315 -29.680 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -93.635 5.917 -29.121 1.00 0.00 H new ATOM 209 N LEU A 37 -88.910 0.342 -33.486 1.00 0.00 N ATOM 210 CA LEU A 37 -87.512 0.124 -33.788 1.00 0.00 C ATOM 211 C LEU A 37 -86.663 1.157 -33.064 1.00 0.00 C ATOM 212 O LEU A 37 -87.070 2.313 -32.927 1.00 0.00 O ATOM 213 CB LEU A 37 -87.315 0.225 -35.290 1.00 0.00 C ATOM 214 CG LEU A 37 -88.356 -0.547 -36.098 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.275 -0.170 -37.557 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.168 -2.043 -35.923 1.00 0.00 C ATOM 0 H LEU A 37 -89.309 1.171 -33.926 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.205 -0.866 -33.452 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.346 1.275 -35.582 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.322 -0.147 -35.543 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.346 -0.282 -35.727 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.023 -0.729 -38.119 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.461 0.898 -37.668 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.282 -0.407 -37.939 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -88.919 -2.575 -36.507 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.173 -2.327 -36.267 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.276 -2.303 -34.870 1.00 0.00 H new ATOM 228 N THR A 38 -85.501 0.747 -32.589 1.00 0.00 N ATOM 229 CA THR A 38 -84.657 1.626 -31.797 1.00 0.00 C ATOM 230 C THR A 38 -83.209 1.587 -32.275 1.00 0.00 C ATOM 231 O THR A 38 -82.895 0.941 -33.281 1.00 0.00 O ATOM 232 CB THR A 38 -84.705 1.236 -30.305 1.00 0.00 C ATOM 233 OG1 THR A 38 -84.388 -0.155 -30.153 1.00 0.00 O ATOM 234 CG2 THR A 38 -86.074 1.519 -29.701 1.00 0.00 C ATOM 0 H THR A 38 -85.120 -0.187 -32.737 1.00 0.00 H new ATOM 0 HA THR A 38 -85.044 2.638 -31.922 1.00 0.00 H new ATOM 0 HB THR A 38 -83.968 1.841 -29.776 1.00 0.00 H new ATOM 0 HG1 THR A 38 -84.649 -0.454 -29.257 1.00 0.00 H new ATOM 0 HG21 THR A 38 -86.074 1.233 -28.649 1.00 0.00 H new ATOM 0 HG22 THR A 38 -86.297 2.582 -29.788 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.832 0.945 -30.233 1.00 0.00 H new ATOM 242 N ARG A 39 -82.343 2.314 -31.557 1.00 0.00 N ATOM 243 CA ARG A 39 -80.886 2.289 -31.752 1.00 0.00 C ATOM 244 C ARG A 39 -80.464 3.029 -33.021 1.00 0.00 C ATOM 245 O ARG A 39 -79.515 3.807 -33.003 1.00 0.00 O ATOM 246 CB ARG A 39 -80.348 0.850 -31.762 1.00 0.00 C ATOM 247 CG ARG A 39 -80.889 -0.014 -30.630 1.00 0.00 C ATOM 248 CD ARG A 39 -80.732 0.657 -29.275 1.00 0.00 C ATOM 249 NE ARG A 39 -81.832 0.308 -28.378 1.00 0.00 N ATOM 250 CZ ARG A 39 -82.068 0.898 -27.208 1.00 0.00 C ATOM 251 NH1 ARG A 39 -81.243 1.823 -26.736 1.00 0.00 N ATOM 252 NH2 ARG A 39 -83.137 0.559 -26.505 1.00 0.00 N ATOM 0 H ARG A 39 -82.639 2.946 -30.813 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.447 2.814 -30.904 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -80.599 0.384 -32.715 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.260 0.878 -31.698 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -81.943 -0.227 -30.809 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -80.367 -0.971 -30.623 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -79.785 0.357 -28.826 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -80.695 1.739 -29.405 1.00 0.00 H new ATOM 0 HE ARG A 39 -82.463 -0.439 -28.668 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -80.416 2.090 -27.271 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -81.435 2.267 -25.838 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -83.776 -0.152 -26.860 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -83.321 1.009 -25.608 1.00 0.00 H new ATOM 266 N SER A 40 -81.178 2.802 -34.111 1.00 0.00 N ATOM 267 CA SER A 40 -80.860 3.436 -35.381 1.00 0.00 C ATOM 268 C SER A 40 -81.613 4.759 -35.525 1.00 0.00 C ATOM 269 O SER A 40 -81.608 5.368 -36.596 1.00 0.00 O ATOM 270 CB SER A 40 -81.212 2.490 -36.535 1.00 0.00 C ATOM 271 OG SER A 40 -80.821 3.030 -37.787 1.00 0.00 O ATOM 0 H SER A 40 -81.986 2.180 -34.142 1.00 0.00 H new ATOM 0 HA SER A 40 -79.791 3.649 -35.411 1.00 0.00 H new ATOM 0 HB2 SER A 40 -80.720 1.529 -36.382 1.00 0.00 H new ATOM 0 HB3 SER A 40 -82.286 2.302 -36.538 1.00 0.00 H new ATOM 0 HG SER A 40 -81.081 3.974 -37.832 1.00 0.00 H new ATOM 277 N ASN A 41 -82.255 5.190 -34.432 1.00 0.00 N ATOM 278 CA ASN A 41 -83.036 6.441 -34.382 1.00 0.00 C ATOM 279 C ASN A 41 -84.353 6.318 -35.150 1.00 0.00 C ATOM 280 O ASN A 41 -85.411 6.693 -34.643 1.00 0.00 O ATOM 281 CB ASN A 41 -82.238 7.643 -34.913 1.00 0.00 C ATOM 282 CG ASN A 41 -81.015 7.965 -34.072 1.00 0.00 C ATOM 283 OD1 ASN A 41 -81.106 8.680 -33.073 1.00 0.00 O ATOM 284 ND2 ASN A 41 -79.858 7.475 -34.488 1.00 0.00 N ATOM 0 H ASN A 41 -82.250 4.680 -33.549 1.00 0.00 H new ATOM 0 HA ASN A 41 -83.260 6.616 -33.330 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -81.924 7.439 -35.937 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -82.889 8.517 -34.947 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -79.001 7.686 -33.976 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -79.823 6.886 -35.320 1.00 0.00 H new ATOM 291 N SER A 42 -84.273 5.804 -36.368 1.00 0.00 N ATOM 292 CA SER A 42 -85.440 5.606 -37.211 1.00 0.00 C ATOM 293 C SER A 42 -86.453 4.680 -36.556 1.00 0.00 C ATOM 294 O SER A 42 -86.192 3.502 -36.334 1.00 0.00 O ATOM 295 CB SER A 42 -84.991 5.067 -38.570 1.00 0.00 C ATOM 296 OG SER A 42 -83.744 4.396 -38.459 1.00 0.00 O ATOM 0 H SER A 42 -83.396 5.512 -36.799 1.00 0.00 H new ATOM 0 HA SER A 42 -85.940 6.564 -37.353 1.00 0.00 H new ATOM 0 HB2 SER A 42 -85.744 4.383 -38.962 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.905 5.888 -39.282 1.00 0.00 H new ATOM 0 HG SER A 42 -83.847 3.607 -37.887 1.00 0.00 H new ATOM 302 N LYS A 43 -87.614 5.234 -36.239 1.00 0.00 N ATOM 303 CA LYS A 43 -88.699 4.456 -35.662 1.00 0.00 C ATOM 304 C LYS A 43 -89.319 3.560 -36.725 1.00 0.00 C ATOM 305 O LYS A 43 -90.065 2.633 -36.418 1.00 0.00 O ATOM 306 CB LYS A 43 -89.763 5.382 -35.061 1.00 0.00 C ATOM 307 CG LYS A 43 -90.304 6.409 -36.044 1.00 0.00 C ATOM 308 CD LYS A 43 -91.383 7.271 -35.411 1.00 0.00 C ATOM 309 CE LYS A 43 -91.841 8.372 -36.351 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.434 7.833 -37.603 1.00 0.00 N ATOM 0 H LYS A 43 -87.829 6.222 -36.372 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.296 3.832 -34.864 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.590 4.777 -34.689 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -89.337 5.902 -34.203 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -89.490 7.043 -36.395 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -90.710 5.899 -36.918 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -92.234 6.647 -35.138 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -91.003 7.713 -34.490 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -92.575 8.998 -35.844 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -90.994 9.011 -36.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -92.868 8.608 -38.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -91.689 7.387 -38.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -93.160 7.126 -37.367 1.00 0.00 H new ATOM 324 N CYS A 44 -89.001 3.846 -37.983 1.00 0.00 N ATOM 325 CA CYS A 44 -89.505 3.053 -39.090 1.00 0.00 C ATOM 326 C CYS A 44 -88.360 2.274 -39.752 1.00 0.00 C ATOM 327 O CYS A 44 -88.531 1.714 -40.828 1.00 0.00 O ATOM 328 CB CYS A 44 -90.226 3.951 -40.110 1.00 0.00 C ATOM 329 SG CYS A 44 -91.009 5.429 -39.379 1.00 0.00 S ATOM 0 H CYS A 44 -88.397 4.621 -38.258 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.227 2.333 -38.706 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.510 4.269 -40.868 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.989 3.363 -40.620 1.00 0.00 H new ATOM 334 N GLN A 45 -87.194 2.224 -39.092 1.00 0.00 N ATOM 335 CA GLN A 45 -86.087 1.369 -39.541 1.00 0.00 C ATOM 336 C GLN A 45 -85.120 1.084 -38.382 1.00 0.00 C ATOM 337 O GLN A 45 -84.572 2.007 -37.788 1.00 0.00 O ATOM 338 CB GLN A 45 -85.335 2.035 -40.699 1.00 0.00 C ATOM 339 CG GLN A 45 -84.267 1.145 -41.318 1.00 0.00 C ATOM 340 CD GLN A 45 -83.609 1.772 -42.528 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.458 2.994 -42.613 1.00 0.00 O ATOM 342 NE2 GLN A 45 -83.226 0.942 -43.485 1.00 0.00 N ATOM 0 H GLN A 45 -86.994 2.763 -38.249 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.504 0.424 -39.888 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -86.050 2.321 -41.470 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.869 2.953 -40.340 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.506 0.925 -40.570 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.715 0.194 -41.606 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -83.369 -0.062 -43.376 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -82.788 1.306 -44.331 1.00 0.00 H new ATOM 351 N GLY A 46 -84.878 -0.191 -38.084 1.00 0.00 N ATOM 352 CA GLY A 46 -84.024 -0.530 -36.957 1.00 0.00 C ATOM 353 C GLY A 46 -84.319 -1.908 -36.397 1.00 0.00 C ATOM 354 O GLY A 46 -85.187 -2.613 -36.904 1.00 0.00 O ATOM 0 H GLY A 46 -85.254 -0.988 -38.597 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -82.981 -0.484 -37.270 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.154 0.213 -36.171 1.00 0.00 H new ATOM 358 N GLN A 47 -83.576 -2.310 -35.375 1.00 0.00 N ATOM 359 CA GLN A 47 -83.845 -3.570 -34.688 1.00 0.00 C ATOM 360 C GLN A 47 -85.138 -3.437 -33.883 1.00 0.00 C ATOM 361 O GLN A 47 -85.413 -2.371 -33.326 1.00 0.00 O ATOM 362 CB GLN A 47 -82.679 -3.941 -33.763 1.00 0.00 C ATOM 363 CG GLN A 47 -82.765 -5.356 -33.200 1.00 0.00 C ATOM 364 CD GLN A 47 -81.751 -5.619 -32.100 1.00 0.00 C ATOM 365 OE1 GLN A 47 -80.657 -5.055 -32.094 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.114 -6.471 -31.152 1.00 0.00 N ATOM 0 H GLN A 47 -82.784 -1.785 -35.003 1.00 0.00 H new ATOM 0 HA GLN A 47 -83.956 -4.364 -35.427 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -81.744 -3.835 -34.313 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -82.644 -3.232 -32.936 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -83.769 -5.526 -32.810 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -82.612 -6.072 -34.007 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -83.030 -6.919 -31.192 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -81.478 -6.679 -30.382 1.00 0.00 H new ATOM 375 N LEU A 48 -85.931 -4.503 -33.834 1.00 0.00 N ATOM 376 CA LEU A 48 -87.234 -4.450 -33.181 1.00 0.00 C ATOM 377 C LEU A 48 -87.099 -4.477 -31.662 1.00 0.00 C ATOM 378 O LEU A 48 -86.328 -5.255 -31.105 1.00 0.00 O ATOM 379 CB LEU A 48 -88.122 -5.609 -33.647 1.00 0.00 C ATOM 380 CG LEU A 48 -89.535 -5.627 -33.049 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.320 -4.396 -33.476 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.275 -6.891 -33.458 1.00 0.00 C ATOM 0 H LEU A 48 -85.695 -5.410 -34.237 1.00 0.00 H new ATOM 0 HA LEU A 48 -87.702 -3.508 -33.465 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.204 -5.569 -34.733 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -87.627 -6.548 -33.399 1.00 0.00 H new ATOM 0 HG LEU A 48 -89.440 -5.615 -31.963 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.318 -4.432 -33.040 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -89.805 -3.499 -33.132 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.400 -4.374 -34.563 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.275 -6.884 -33.024 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.352 -6.932 -34.545 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -89.730 -7.764 -33.099 1.00 0.00 H new ATOM 394 N GLU A 49 -87.858 -3.618 -31.009 1.00 0.00 N ATOM 395 CA GLU A 49 -87.898 -3.548 -29.563 1.00 0.00 C ATOM 396 C GLU A 49 -89.350 -3.399 -29.117 1.00 0.00 C ATOM 397 O GLU A 49 -90.051 -2.484 -29.559 1.00 0.00 O ATOM 398 CB GLU A 49 -87.058 -2.358 -29.087 1.00 0.00 C ATOM 399 CG GLU A 49 -86.835 -2.301 -27.586 1.00 0.00 C ATOM 400 CD GLU A 49 -85.933 -1.152 -27.182 1.00 0.00 C ATOM 401 OE1 GLU A 49 -84.800 -1.069 -27.701 1.00 0.00 O ATOM 402 OE2 GLU A 49 -86.351 -0.315 -26.358 1.00 0.00 O ATOM 0 H GLU A 49 -88.468 -2.944 -31.472 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.484 -4.458 -29.127 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.088 -2.393 -29.584 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.546 -1.436 -29.404 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -87.796 -2.200 -27.082 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.396 -3.240 -27.250 1.00 0.00 H new ATOM 409 N VAL A 50 -89.818 -4.313 -28.279 1.00 0.00 N ATOM 410 CA VAL A 50 -91.220 -4.320 -27.879 1.00 0.00 C ATOM 411 C VAL A 50 -91.349 -4.219 -26.362 1.00 0.00 C ATOM 412 O VAL A 50 -90.583 -4.837 -25.629 1.00 0.00 O ATOM 413 CB VAL A 50 -91.944 -5.593 -28.365 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.445 -5.384 -28.365 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.454 -6.008 -29.745 1.00 0.00 C ATOM 0 H VAL A 50 -89.253 -5.055 -27.865 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.689 -3.453 -28.345 1.00 0.00 H new ATOM 0 HB VAL A 50 -91.711 -6.401 -27.672 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.939 -6.292 -28.711 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.780 -5.151 -27.354 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -93.697 -4.558 -29.030 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -91.981 -6.908 -30.063 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -91.646 -5.205 -30.456 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.383 -6.209 -29.706 1.00 0.00 H new ATOM 425 N TYR A 51 -92.323 -3.448 -25.901 1.00 0.00 N ATOM 426 CA TYR A 51 -92.498 -3.206 -24.475 1.00 0.00 C ATOM 427 C TYR A 51 -93.501 -4.184 -23.871 1.00 0.00 C ATOM 428 O TYR A 51 -94.708 -4.025 -24.040 1.00 0.00 O ATOM 429 CB TYR A 51 -92.968 -1.766 -24.245 1.00 0.00 C ATOM 430 CG TYR A 51 -93.094 -1.387 -22.785 1.00 0.00 C ATOM 431 CD1 TYR A 51 -91.970 -1.283 -21.976 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.335 -1.129 -22.217 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.079 -0.937 -20.645 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.451 -0.781 -20.886 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.320 -0.685 -20.104 1.00 0.00 C ATOM 436 OH TYR A 51 -93.433 -0.343 -18.775 1.00 0.00 O ATOM 0 H TYR A 51 -93.006 -2.978 -26.495 1.00 0.00 H new ATOM 0 HA TYR A 51 -91.537 -3.357 -23.983 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.268 -1.084 -24.728 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -93.934 -1.628 -24.731 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -90.994 -1.476 -22.396 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.224 -1.202 -22.826 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.194 -0.864 -20.030 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.424 -0.585 -20.459 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.377 -0.198 -18.554 1.00 0.00 H new ATOM 446 N LEU A 52 -93.000 -5.198 -23.172 1.00 0.00 N ATOM 447 CA LEU A 52 -93.869 -6.166 -22.512 1.00 0.00 C ATOM 448 C LEU A 52 -93.264 -6.634 -21.213 1.00 0.00 C ATOM 449 O LEU A 52 -92.048 -6.800 -21.109 1.00 0.00 O ATOM 450 CB LEU A 52 -94.159 -7.368 -23.402 1.00 0.00 C ATOM 451 CG LEU A 52 -92.956 -8.236 -23.805 1.00 0.00 C ATOM 452 CD1 LEU A 52 -93.424 -9.624 -24.210 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.177 -7.603 -24.951 1.00 0.00 C ATOM 0 H LEU A 52 -92.002 -5.370 -23.048 1.00 0.00 H new ATOM 0 HA LEU A 52 -94.811 -5.657 -22.308 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.881 -8.004 -22.890 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.640 -7.009 -24.312 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.295 -8.312 -22.942 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -92.563 -10.230 -24.493 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.938 -10.094 -23.371 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -94.107 -9.545 -25.056 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.333 -8.241 -25.213 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.830 -7.492 -25.817 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -91.811 -6.623 -24.644 1.00 0.00 H new ATOM 465 N LYS A 53 -94.132 -6.841 -20.225 1.00 0.00 N ATOM 466 CA LYS A 53 -93.710 -7.158 -18.867 1.00 0.00 C ATOM 467 C LYS A 53 -92.704 -6.121 -18.390 1.00 0.00 C ATOM 468 O LYS A 53 -91.785 -6.434 -17.645 1.00 0.00 O ATOM 469 CB LYS A 53 -93.125 -8.573 -18.781 1.00 0.00 C ATOM 470 CG LYS A 53 -94.103 -9.659 -19.208 1.00 0.00 C ATOM 471 CD LYS A 53 -93.687 -11.024 -18.681 1.00 0.00 C ATOM 472 CE LYS A 53 -93.762 -11.071 -17.162 1.00 0.00 C ATOM 473 NZ LYS A 53 -93.400 -12.405 -16.622 1.00 0.00 N ATOM 0 H LYS A 53 -95.144 -6.793 -20.345 1.00 0.00 H new ATOM 0 HA LYS A 53 -94.583 -7.131 -18.215 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -92.235 -8.629 -19.408 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.806 -8.764 -17.757 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -95.101 -9.416 -18.843 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -94.161 -9.690 -20.296 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -94.333 -11.793 -19.104 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -92.671 -11.248 -19.005 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -93.093 -10.318 -16.744 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -94.772 -10.814 -16.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -93.465 -12.389 -15.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -94.053 -13.121 -16.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -92.427 -12.641 -16.904 1.00 0.00 H new ATOM 487 N ASP A 54 -92.875 -4.901 -18.912 1.00 0.00 N ATOM 488 CA ASP A 54 -92.104 -3.699 -18.520 1.00 0.00 C ATOM 489 C ASP A 54 -90.713 -3.704 -19.142 1.00 0.00 C ATOM 490 O ASP A 54 -89.973 -2.724 -19.049 1.00 0.00 O ATOM 491 CB ASP A 54 -92.035 -3.480 -16.984 1.00 0.00 C ATOM 492 CG ASP A 54 -90.881 -4.178 -16.264 1.00 0.00 C ATOM 493 OD1 ASP A 54 -89.709 -3.788 -16.455 1.00 0.00 O ATOM 494 OD2 ASP A 54 -91.149 -5.098 -15.457 1.00 0.00 O ATOM 0 H ASP A 54 -93.568 -4.710 -19.636 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.656 -2.848 -18.919 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.964 -2.409 -16.791 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.972 -3.822 -16.545 1.00 0.00 H new ATOM 499 N GLY A 55 -90.380 -4.795 -19.807 1.00 0.00 N ATOM 500 CA GLY A 55 -89.130 -4.882 -20.522 1.00 0.00 C ATOM 501 C GLY A 55 -89.253 -4.371 -21.929 1.00 0.00 C ATOM 502 O GLY A 55 -90.009 -4.931 -22.728 1.00 0.00 O ATOM 0 H GLY A 55 -90.961 -5.631 -19.864 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -88.368 -4.309 -19.993 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -88.794 -5.919 -20.540 1.00 0.00 H new ATOM 506 N TRP A 56 -88.546 -3.287 -22.231 1.00 0.00 N ATOM 507 CA TRP A 56 -88.352 -2.887 -23.612 1.00 0.00 C ATOM 508 C TRP A 56 -87.426 -3.898 -24.255 1.00 0.00 C ATOM 509 O TRP A 56 -86.214 -3.705 -24.344 1.00 0.00 O ATOM 510 CB TRP A 56 -87.790 -1.468 -23.729 1.00 0.00 C ATOM 511 CG TRP A 56 -88.856 -0.421 -23.845 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.240 0.477 -22.894 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.682 -0.171 -24.990 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.257 1.270 -23.376 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.544 0.891 -24.661 1.00 0.00 C ATOM 516 CE3 TRP A 56 -89.775 -0.745 -26.260 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.488 1.390 -25.559 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.709 -0.250 -27.150 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.555 0.808 -26.797 1.00 0.00 C ATOM 0 H TRP A 56 -88.104 -2.678 -21.543 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.314 -2.868 -24.125 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.173 -1.255 -22.856 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.138 -1.413 -24.601 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -88.809 0.555 -21.907 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.721 2.018 -22.860 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.128 -1.562 -26.542 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.142 2.205 -25.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -90.788 -0.687 -28.135 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.275 1.172 -27.515 1.00 0.00 H new ATOM 530 N HIS A 57 -88.016 -5.007 -24.642 1.00 0.00 N ATOM 531 CA HIS A 57 -87.271 -6.163 -25.063 1.00 0.00 C ATOM 532 C HIS A 57 -86.819 -6.021 -26.509 1.00 0.00 C ATOM 533 O HIS A 57 -87.635 -6.102 -27.427 1.00 0.00 O ATOM 534 CB HIS A 57 -88.126 -7.426 -24.900 1.00 0.00 C ATOM 535 CG HIS A 57 -88.278 -7.867 -23.477 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.413 -8.486 -22.995 1.00 0.00 N ATOM 537 CD2 HIS A 57 -87.427 -7.781 -22.427 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.251 -8.756 -21.712 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.056 -8.341 -21.346 1.00 0.00 N ATOM 0 H HIS A 57 -89.028 -5.129 -24.672 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.384 -6.247 -24.435 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.114 -7.243 -25.322 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -87.678 -8.235 -25.477 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -86.436 -7.351 -22.439 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.976 -9.236 -21.071 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -87.662 -8.423 -20.409 1.00 0.00 H new ATOM 548 N MET A 58 -85.531 -5.779 -26.707 1.00 0.00 N ATOM 549 CA MET A 58 -84.968 -5.749 -28.050 1.00 0.00 C ATOM 550 C MET A 58 -84.988 -7.157 -28.620 1.00 0.00 C ATOM 551 O MET A 58 -84.134 -7.975 -28.306 1.00 0.00 O ATOM 552 CB MET A 58 -83.533 -5.220 -28.037 1.00 0.00 C ATOM 553 CG MET A 58 -83.388 -3.825 -27.453 1.00 0.00 C ATOM 554 SD MET A 58 -81.666 -3.298 -27.331 1.00 0.00 S ATOM 555 CE MET A 58 -81.180 -3.357 -29.054 1.00 0.00 C ATOM 0 H MET A 58 -84.859 -5.602 -25.960 1.00 0.00 H new ATOM 0 HA MET A 58 -85.567 -5.080 -28.668 1.00 0.00 H new ATOM 0 HB2 MET A 58 -82.910 -5.907 -27.465 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.150 -5.216 -29.058 1.00 0.00 H new ATOM 0 HG2 MET A 58 -83.938 -3.117 -28.073 1.00 0.00 H new ATOM 0 HG3 MET A 58 -83.842 -3.801 -26.463 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.263 -2.785 -29.193 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.010 -4.393 -29.349 1.00 0.00 H new ATOM 0 HE3 MET A 58 -81.971 -2.929 -29.670 1.00 0.00 H new ATOM 565 N VAL A 59 -85.966 -7.450 -29.440 1.00 0.00 N ATOM 566 CA VAL A 59 -86.162 -8.806 -29.901 1.00 0.00 C ATOM 567 C VAL A 59 -85.575 -8.992 -31.295 1.00 0.00 C ATOM 568 O VAL A 59 -85.474 -8.040 -32.068 1.00 0.00 O ATOM 569 CB VAL A 59 -87.658 -9.179 -29.885 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.440 -8.370 -30.902 1.00 0.00 C ATOM 571 CG2 VAL A 59 -87.836 -10.661 -30.115 1.00 0.00 C ATOM 0 H VAL A 59 -86.637 -6.773 -29.802 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.638 -9.475 -29.219 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.056 -8.936 -28.900 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.491 -8.657 -30.865 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.346 -7.309 -30.673 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.046 -8.562 -31.900 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -88.898 -10.906 -30.101 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -87.414 -10.932 -31.083 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.325 -11.215 -29.328 1.00 0.00 H new ATOM 581 N CYS A 60 -85.175 -10.215 -31.615 1.00 0.00 N ATOM 582 CA CYS A 60 -84.569 -10.487 -32.907 1.00 0.00 C ATOM 583 C CYS A 60 -85.601 -10.845 -33.978 1.00 0.00 C ATOM 584 O CYS A 60 -85.295 -11.590 -34.910 1.00 0.00 O ATOM 585 CB CYS A 60 -83.490 -11.568 -32.800 1.00 0.00 C ATOM 586 SG CYS A 60 -83.758 -12.899 -31.621 1.00 0.00 S ATOM 0 H CYS A 60 -85.259 -11.027 -31.003 1.00 0.00 H new ATOM 0 HA CYS A 60 -84.092 -9.560 -33.226 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.362 -12.014 -33.786 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.549 -11.079 -32.547 1.00 0.00 H new ATOM 591 N SER A 61 -86.811 -10.293 -33.834 1.00 0.00 N ATOM 592 CA SER A 61 -87.845 -10.321 -34.880 1.00 0.00 C ATOM 593 C SER A 61 -88.435 -11.725 -35.108 1.00 0.00 C ATOM 594 O SER A 61 -89.627 -11.939 -34.896 1.00 0.00 O ATOM 595 CB SER A 61 -87.283 -9.761 -36.191 1.00 0.00 C ATOM 596 OG SER A 61 -88.309 -9.559 -37.141 1.00 0.00 O ATOM 0 H SER A 61 -87.104 -9.811 -32.984 1.00 0.00 H new ATOM 0 HA SER A 61 -88.664 -9.692 -34.531 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.772 -8.818 -35.997 1.00 0.00 H new ATOM 0 HB3 SER A 61 -86.540 -10.449 -36.595 1.00 0.00 H new ATOM 0 HG SER A 61 -89.181 -9.671 -36.709 1.00 0.00 H new ATOM 602 N GLN A 62 -87.592 -12.680 -35.509 1.00 0.00 N ATOM 603 CA GLN A 62 -88.042 -14.020 -35.902 1.00 0.00 C ATOM 604 C GLN A 62 -88.575 -14.816 -34.719 1.00 0.00 C ATOM 605 O GLN A 62 -89.039 -15.946 -34.877 1.00 0.00 O ATOM 606 CB GLN A 62 -86.897 -14.784 -36.582 1.00 0.00 C ATOM 607 CG GLN A 62 -85.669 -15.015 -35.701 1.00 0.00 C ATOM 608 CD GLN A 62 -85.746 -16.283 -34.868 1.00 0.00 C ATOM 609 OE1 GLN A 62 -86.198 -16.271 -33.723 1.00 0.00 O ATOM 610 NE2 GLN A 62 -85.300 -17.386 -35.446 1.00 0.00 N ATOM 0 H GLN A 62 -86.582 -12.548 -35.571 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.864 -13.895 -36.607 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -87.273 -15.750 -36.918 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.590 -14.234 -37.472 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.782 -15.059 -36.333 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -85.544 -14.161 -35.036 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.933 -17.351 -36.397 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.323 -18.272 -34.941 1.00 0.00 H new ATOM 619 N SER A 63 -88.500 -14.224 -33.539 1.00 0.00 N ATOM 620 CA SER A 63 -88.993 -14.851 -32.330 1.00 0.00 C ATOM 621 C SER A 63 -90.491 -15.143 -32.459 1.00 0.00 C ATOM 622 O SER A 63 -91.145 -14.619 -33.363 1.00 0.00 O ATOM 623 CB SER A 63 -88.730 -13.926 -31.152 1.00 0.00 C ATOM 624 OG SER A 63 -87.345 -13.647 -31.029 1.00 0.00 O ATOM 0 H SER A 63 -88.097 -13.298 -33.395 1.00 0.00 H new ATOM 0 HA SER A 63 -88.476 -15.797 -32.169 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.282 -12.996 -31.284 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.096 -14.386 -30.234 1.00 0.00 H new ATOM 0 HG SER A 63 -86.838 -14.235 -31.627 1.00 0.00 H new ATOM 630 N TRP A 64 -91.027 -15.971 -31.557 1.00 0.00 N ATOM 631 CA TRP A 64 -92.448 -16.348 -31.574 1.00 0.00 C ATOM 632 C TRP A 64 -92.782 -17.267 -32.752 1.00 0.00 C ATOM 633 O TRP A 64 -92.925 -18.476 -32.583 1.00 0.00 O ATOM 634 CB TRP A 64 -93.366 -15.116 -31.630 1.00 0.00 C ATOM 635 CG TRP A 64 -93.309 -14.244 -30.415 1.00 0.00 C ATOM 636 CD1 TRP A 64 -93.939 -14.463 -29.229 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.598 -13.007 -30.273 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.666 -13.443 -28.354 1.00 0.00 N ATOM 639 CE2 TRP A 64 -92.844 -12.536 -28.972 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.777 -12.252 -31.117 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.298 -11.345 -28.496 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.233 -11.074 -30.642 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.495 -10.629 -29.341 1.00 0.00 C ATOM 0 H TRP A 64 -90.494 -16.397 -30.799 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.625 -16.885 -30.642 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -93.100 -14.520 -32.503 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.393 -15.450 -31.774 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.563 -15.316 -29.009 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.017 -13.371 -27.399 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.572 -12.584 -32.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.502 -10.999 -27.493 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.595 -10.487 -31.285 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.055 -9.704 -28.998 1.00 0.00 H new ATOM 654 N GLY A 65 -92.888 -16.684 -33.942 1.00 0.00 N ATOM 655 CA GLY A 65 -93.363 -17.417 -35.103 1.00 0.00 C ATOM 656 C GLY A 65 -92.288 -18.241 -35.773 1.00 0.00 C ATOM 657 O GLY A 65 -92.597 -19.163 -36.528 1.00 0.00 O ATOM 0 H GLY A 65 -92.651 -15.709 -34.124 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -94.178 -18.074 -34.800 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -93.774 -16.712 -35.826 1.00 0.00 H new ATOM 661 N ARG A 66 -91.026 -17.892 -35.516 1.00 0.00 N ATOM 662 CA ARG A 66 -89.882 -18.628 -36.064 1.00 0.00 C ATOM 663 C ARG A 66 -89.845 -18.524 -37.587 1.00 0.00 C ATOM 664 O ARG A 66 -89.207 -19.337 -38.257 1.00 0.00 O ATOM 665 CB ARG A 66 -89.936 -20.101 -35.634 1.00 0.00 C ATOM 666 CG ARG A 66 -89.914 -20.296 -34.127 1.00 0.00 C ATOM 667 CD ARG A 66 -88.592 -19.852 -33.531 1.00 0.00 C ATOM 668 NE ARG A 66 -87.482 -20.678 -34.000 1.00 0.00 N ATOM 669 CZ ARG A 66 -86.200 -20.405 -33.783 1.00 0.00 C ATOM 670 NH1 ARG A 66 -85.842 -19.306 -33.131 1.00 0.00 N ATOM 671 NH2 ARG A 66 -85.272 -21.230 -34.236 1.00 0.00 N ATOM 0 H ARG A 66 -90.768 -17.099 -34.928 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.971 -18.179 -35.668 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -90.841 -20.556 -36.038 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -89.090 -20.630 -36.073 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -90.728 -19.730 -33.673 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.086 -21.346 -33.892 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -88.406 -18.810 -33.793 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.648 -19.902 -32.444 1.00 0.00 H new ATOM 0 HE ARG A 66 -87.706 -21.521 -34.529 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -86.554 -18.660 -32.790 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -84.855 -19.107 -32.970 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -85.542 -22.070 -34.748 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -84.286 -21.027 -34.073 1.00 0.00 H new ATOM 685 N SER A 67 -90.504 -17.496 -38.117 1.00 0.00 N ATOM 686 CA SER A 67 -90.626 -17.304 -39.558 1.00 0.00 C ATOM 687 C SER A 67 -89.254 -17.255 -40.233 1.00 0.00 C ATOM 688 O SER A 67 -88.936 -18.111 -41.060 1.00 0.00 O ATOM 689 CB SER A 67 -91.397 -16.017 -39.836 1.00 0.00 C ATOM 690 OG SER A 67 -92.593 -15.966 -39.072 1.00 0.00 O ATOM 0 H SER A 67 -90.966 -16.776 -37.561 1.00 0.00 H new ATOM 0 HA SER A 67 -91.168 -18.153 -39.974 1.00 0.00 H new ATOM 0 HB2 SER A 67 -90.772 -15.156 -39.598 1.00 0.00 H new ATOM 0 HB3 SER A 67 -91.636 -15.954 -40.898 1.00 0.00 H new ATOM 0 HG SER A 67 -93.069 -15.132 -39.265 1.00 0.00 H new ATOM 696 N SER A 68 -88.449 -16.255 -39.867 1.00 0.00 N ATOM 697 CA SER A 68 -87.103 -16.085 -40.419 1.00 0.00 C ATOM 698 C SER A 68 -87.144 -15.963 -41.946 1.00 0.00 C ATOM 699 O SER A 68 -86.275 -16.481 -42.652 1.00 0.00 O ATOM 700 CB SER A 68 -86.218 -17.261 -39.995 1.00 0.00 C ATOM 701 OG SER A 68 -86.302 -17.477 -38.593 1.00 0.00 O ATOM 0 H SER A 68 -88.710 -15.544 -39.184 1.00 0.00 H new ATOM 0 HA SER A 68 -86.680 -15.161 -40.025 1.00 0.00 H new ATOM 0 HB2 SER A 68 -86.525 -18.162 -40.525 1.00 0.00 H new ATOM 0 HB3 SER A 68 -85.184 -17.063 -40.275 1.00 0.00 H new ATOM 0 HG SER A 68 -85.731 -18.233 -38.344 1.00 0.00 H new ATOM 707 N LYS A 69 -88.158 -15.263 -42.445 1.00 0.00 N ATOM 708 CA LYS A 69 -88.324 -15.061 -43.877 1.00 0.00 C ATOM 709 C LYS A 69 -88.095 -13.598 -44.228 1.00 0.00 C ATOM 710 O LYS A 69 -88.582 -12.705 -43.534 1.00 0.00 O ATOM 711 CB LYS A 69 -89.727 -15.481 -44.326 1.00 0.00 C ATOM 712 CG LYS A 69 -90.074 -16.928 -44.009 1.00 0.00 C ATOM 713 CD LYS A 69 -91.486 -17.274 -44.462 1.00 0.00 C ATOM 714 CE LYS A 69 -92.518 -16.333 -43.856 1.00 0.00 C ATOM 715 NZ LYS A 69 -93.907 -16.722 -44.214 1.00 0.00 N ATOM 0 H LYS A 69 -88.880 -14.824 -41.873 1.00 0.00 H new ATOM 0 HA LYS A 69 -87.590 -15.679 -44.395 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -90.460 -14.830 -43.849 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -89.815 -15.325 -45.401 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -89.361 -17.590 -44.499 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -89.982 -17.099 -42.936 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -91.542 -17.224 -45.549 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -91.718 -18.300 -44.178 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -92.411 -16.329 -42.771 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -92.327 -15.316 -44.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -94.579 -16.096 -43.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -94.037 -16.636 -45.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -94.077 -17.706 -43.924 1.00 0.00 H new ATOM 729 N GLN A 70 -87.354 -13.364 -45.297 1.00 0.00 N ATOM 730 CA GLN A 70 -87.036 -12.012 -45.732 1.00 0.00 C ATOM 731 C GLN A 70 -88.065 -11.505 -46.737 1.00 0.00 C ATOM 732 O GLN A 70 -88.311 -12.147 -47.761 1.00 0.00 O ATOM 733 CB GLN A 70 -85.636 -11.958 -46.360 1.00 0.00 C ATOM 734 CG GLN A 70 -84.476 -12.006 -45.364 1.00 0.00 C ATOM 735 CD GLN A 70 -84.397 -13.302 -44.579 1.00 0.00 C ATOM 736 OE1 GLN A 70 -84.941 -13.416 -43.482 1.00 0.00 O ATOM 737 NE2 GLN A 70 -83.718 -14.292 -45.138 1.00 0.00 N ATOM 0 H GLN A 70 -86.958 -14.098 -45.885 1.00 0.00 H new ATOM 0 HA GLN A 70 -87.057 -11.370 -44.852 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -85.534 -12.792 -47.054 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.553 -11.043 -46.947 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -83.540 -11.861 -45.903 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -84.574 -11.175 -44.666 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -83.280 -14.159 -46.050 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -83.633 -15.187 -44.657 1.00 0.00 H new ATOM 746 N TRP A 71 -88.666 -10.355 -46.423 1.00 0.00 N ATOM 747 CA TRP A 71 -89.584 -9.661 -47.334 1.00 0.00 C ATOM 748 C TRP A 71 -90.876 -10.436 -47.592 1.00 0.00 C ATOM 749 O TRP A 71 -91.063 -11.557 -47.111 1.00 0.00 O ATOM 750 CB TRP A 71 -88.912 -9.391 -48.685 1.00 0.00 C ATOM 751 CG TRP A 71 -87.769 -8.422 -48.631 1.00 0.00 C ATOM 752 CD1 TRP A 71 -86.448 -8.724 -48.472 1.00 0.00 C ATOM 753 CD2 TRP A 71 -87.845 -6.998 -48.755 1.00 0.00 C ATOM 754 NE1 TRP A 71 -85.698 -7.574 -48.490 1.00 0.00 N ATOM 755 CE2 TRP A 71 -86.532 -6.500 -48.658 1.00 0.00 C ATOM 756 CE3 TRP A 71 -88.895 -6.095 -48.936 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -86.246 -5.139 -48.740 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -88.611 -4.747 -49.015 1.00 0.00 C ATOM 759 CH2 TRP A 71 -87.295 -4.279 -48.916 1.00 0.00 C ATOM 0 H TRP A 71 -88.531 -9.878 -45.532 1.00 0.00 H new ATOM 0 HA TRP A 71 -89.838 -8.726 -46.834 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -88.551 -10.336 -49.092 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -89.661 -9.010 -49.379 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -86.051 -9.721 -48.350 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -84.684 -7.527 -48.394 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -89.913 -6.446 -49.013 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -85.232 -4.776 -48.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -89.417 -4.042 -49.155 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -87.104 -3.218 -48.980 1.00 0.00 H new ATOM 770 N GLU A 72 -91.764 -9.784 -48.344 1.00 0.00 N ATOM 771 CA GLU A 72 -92.956 -10.405 -48.929 1.00 0.00 C ATOM 772 C GLU A 72 -94.044 -10.689 -47.895 1.00 0.00 C ATOM 773 O GLU A 72 -95.084 -10.031 -47.884 1.00 0.00 O ATOM 774 CB GLU A 72 -92.583 -11.689 -49.682 1.00 0.00 C ATOM 775 CG GLU A 72 -91.531 -11.480 -50.762 1.00 0.00 C ATOM 776 CD GLU A 72 -91.932 -10.432 -51.775 1.00 0.00 C ATOM 777 OE1 GLU A 72 -92.570 -10.790 -52.785 1.00 0.00 O ATOM 778 OE2 GLU A 72 -91.613 -9.241 -51.570 1.00 0.00 O ATOM 0 H GLU A 72 -91.675 -8.793 -48.568 1.00 0.00 H new ATOM 0 HA GLU A 72 -93.370 -9.684 -49.634 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -92.216 -12.426 -48.967 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -93.481 -12.107 -50.137 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -90.591 -11.187 -50.295 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -91.351 -12.425 -51.275 1.00 0.00 H new ATOM 785 N ASP A 73 -93.801 -11.657 -47.030 1.00 0.00 N ATOM 786 CA ASP A 73 -94.821 -12.108 -46.081 1.00 0.00 C ATOM 787 C ASP A 73 -94.827 -11.266 -44.797 1.00 0.00 C ATOM 788 O ASP A 73 -95.888 -10.799 -44.386 1.00 0.00 O ATOM 789 CB ASP A 73 -94.641 -13.597 -45.762 1.00 0.00 C ATOM 790 CG ASP A 73 -95.675 -14.117 -44.787 1.00 0.00 C ATOM 791 OD1 ASP A 73 -96.870 -14.163 -45.146 1.00 0.00 O ATOM 792 OD2 ASP A 73 -95.295 -14.509 -43.663 1.00 0.00 O ATOM 0 H ASP A 73 -92.911 -12.149 -46.959 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.792 -11.970 -46.556 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -94.699 -14.172 -46.687 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -93.645 -13.758 -45.349 1.00 0.00 H new ATOM 797 N PRO A 74 -93.657 -11.093 -44.127 1.00 0.00 N ATOM 798 CA PRO A 74 -93.490 -10.207 -42.963 1.00 0.00 C ATOM 799 C PRO A 74 -94.308 -8.911 -43.013 1.00 0.00 C ATOM 800 O PRO A 74 -93.874 -7.917 -43.593 1.00 0.00 O ATOM 801 CB PRO A 74 -92.019 -9.888 -43.039 1.00 0.00 C ATOM 802 CG PRO A 74 -91.425 -11.183 -43.432 1.00 0.00 C ATOM 803 CD PRO A 74 -92.389 -11.792 -44.412 1.00 0.00 C ATOM 0 HA PRO A 74 -93.835 -10.685 -42.046 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -91.811 -9.108 -43.772 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.631 -9.538 -42.082 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -90.443 -11.042 -43.884 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -91.287 -11.830 -42.565 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -92.067 -11.636 -45.442 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -92.483 -12.868 -44.267 1.00 0.00 H new ATOM 811 N SER A 75 -95.498 -8.938 -42.428 1.00 0.00 N ATOM 812 CA SER A 75 -96.355 -7.754 -42.363 1.00 0.00 C ATOM 813 C SER A 75 -97.350 -7.867 -41.209 1.00 0.00 C ATOM 814 O SER A 75 -98.393 -7.222 -41.205 1.00 0.00 O ATOM 815 CB SER A 75 -97.106 -7.569 -43.690 1.00 0.00 C ATOM 816 OG SER A 75 -96.211 -7.275 -44.749 1.00 0.00 O ATOM 0 H SER A 75 -95.896 -9.768 -41.989 1.00 0.00 H new ATOM 0 HA SER A 75 -95.722 -6.884 -42.188 1.00 0.00 H new ATOM 0 HB2 SER A 75 -97.665 -8.475 -43.924 1.00 0.00 H new ATOM 0 HB3 SER A 75 -97.833 -6.763 -43.590 1.00 0.00 H new ATOM 0 HG SER A 75 -95.305 -7.169 -44.391 1.00 0.00 H new ATOM 822 N GLN A 76 -96.989 -8.646 -40.198 1.00 0.00 N ATOM 823 CA GLN A 76 -97.913 -8.980 -39.115 1.00 0.00 C ATOM 824 C GLN A 76 -97.926 -7.903 -38.026 1.00 0.00 C ATOM 825 O GLN A 76 -98.380 -8.151 -36.913 1.00 0.00 O ATOM 826 CB GLN A 76 -97.510 -10.323 -38.496 1.00 0.00 C ATOM 827 CG GLN A 76 -97.267 -11.422 -39.517 1.00 0.00 C ATOM 828 CD GLN A 76 -98.505 -11.775 -40.315 1.00 0.00 C ATOM 829 OE1 GLN A 76 -98.779 -11.183 -41.359 1.00 0.00 O ATOM 830 NE2 GLN A 76 -99.250 -12.753 -39.833 1.00 0.00 N ATOM 0 H GLN A 76 -96.062 -9.061 -40.103 1.00 0.00 H new ATOM 0 HA GLN A 76 -98.916 -9.043 -39.538 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -96.605 -10.183 -37.905 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.293 -10.645 -37.809 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -96.479 -11.107 -40.201 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -96.906 -12.313 -39.004 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -98.984 -13.216 -38.964 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -100.091 -13.046 -40.330 1.00 0.00 H new ATOM 839 N ALA A 77 -97.458 -6.705 -38.354 1.00 0.00 N ATOM 840 CA ALA A 77 -97.292 -5.657 -37.348 1.00 0.00 C ATOM 841 C ALA A 77 -97.696 -4.285 -37.884 1.00 0.00 C ATOM 842 O ALA A 77 -97.188 -3.244 -37.437 1.00 0.00 O ATOM 843 CB ALA A 77 -95.852 -5.635 -36.868 1.00 0.00 C ATOM 0 H ALA A 77 -97.188 -6.434 -39.300 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.953 -5.884 -36.511 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.730 -4.853 -36.118 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.600 -6.601 -36.430 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.190 -5.435 -37.711 1.00 0.00 H new ATOM 849 N SER A 78 -98.637 -4.284 -38.821 1.00 0.00 N ATOM 850 CA SER A 78 -99.121 -3.048 -39.425 1.00 0.00 C ATOM 851 C SER A 78 -99.594 -2.064 -38.359 1.00 0.00 C ATOM 852 O SER A 78 -99.461 -0.853 -38.514 1.00 0.00 O ATOM 853 CB SER A 78 -100.269 -3.356 -40.386 1.00 0.00 C ATOM 854 OG SER A 78 -99.911 -4.393 -41.282 1.00 0.00 O ATOM 0 H SER A 78 -99.082 -5.129 -39.180 1.00 0.00 H new ATOM 0 HA SER A 78 -98.297 -2.591 -39.972 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.154 -3.647 -39.821 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.530 -2.459 -40.947 1.00 0.00 H new ATOM 0 HG SER A 78 -100.660 -4.576 -41.887 1.00 0.00 H new ATOM 860 N LYS A 79 -100.109 -2.603 -37.261 1.00 0.00 N ATOM 861 CA LYS A 79 -100.692 -1.791 -36.208 1.00 0.00 C ATOM 862 C LYS A 79 -99.632 -0.987 -35.457 1.00 0.00 C ATOM 863 O LYS A 79 -99.852 0.183 -35.145 1.00 0.00 O ATOM 864 CB LYS A 79 -101.475 -2.675 -35.234 1.00 0.00 C ATOM 865 CG LYS A 79 -102.216 -1.893 -34.157 1.00 0.00 C ATOM 866 CD LYS A 79 -103.199 -0.894 -34.751 1.00 0.00 C ATOM 867 CE LYS A 79 -104.275 -1.581 -35.578 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.190 -0.604 -36.222 1.00 0.00 N ATOM 0 H LYS A 79 -100.133 -3.606 -37.079 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.372 -1.080 -36.677 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.193 -3.272 -35.796 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -100.787 -3.372 -34.756 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -102.752 -2.587 -33.509 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -101.496 -1.365 -33.532 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.667 -0.324 -33.948 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -102.660 -0.182 -35.376 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -103.805 -2.197 -36.344 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -104.851 -2.251 -34.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.844 -1.106 -36.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -105.733 -0.103 -35.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.634 0.082 -36.771 1.00 0.00 H new ATOM 882 N VAL A 80 -98.479 -1.592 -35.180 1.00 0.00 N ATOM 883 CA VAL A 80 -97.466 -0.917 -34.393 1.00 0.00 C ATOM 884 C VAL A 80 -96.764 0.163 -35.205 1.00 0.00 C ATOM 885 O VAL A 80 -96.491 1.244 -34.687 1.00 0.00 O ATOM 886 CB VAL A 80 -96.440 -1.892 -33.786 1.00 0.00 C ATOM 887 CG1 VAL A 80 -97.120 -2.821 -32.794 1.00 0.00 C ATOM 888 CG2 VAL A 80 -95.712 -2.689 -34.857 1.00 0.00 C ATOM 0 H VAL A 80 -98.231 -2.533 -35.486 1.00 0.00 H new ATOM 0 HA VAL A 80 -97.988 -0.442 -33.562 1.00 0.00 H new ATOM 0 HB VAL A 80 -95.691 -1.300 -33.260 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -96.384 -3.505 -32.372 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -97.569 -2.233 -31.994 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -97.896 -3.392 -33.304 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -94.998 -3.364 -34.386 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -96.434 -3.268 -35.433 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -95.182 -2.006 -35.521 1.00 0.00 H new ATOM 898 N CYS A 81 -96.489 -0.101 -36.481 1.00 0.00 N ATOM 899 CA CYS A 81 -95.897 0.937 -37.319 1.00 0.00 C ATOM 900 C CYS A 81 -96.937 2.000 -37.647 1.00 0.00 C ATOM 901 O CYS A 81 -96.592 3.156 -37.863 1.00 0.00 O ATOM 902 CB CYS A 81 -95.272 0.361 -38.591 1.00 0.00 C ATOM 903 SG CYS A 81 -94.053 -0.939 -38.257 1.00 0.00 S ATOM 0 H CYS A 81 -96.660 -0.993 -36.944 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.087 1.401 -36.756 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -96.061 -0.043 -39.226 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.793 1.165 -39.150 1.00 0.00 H new ATOM 908 N GLN A 82 -98.213 1.615 -37.654 1.00 0.00 N ATOM 909 CA GLN A 82 -99.297 2.583 -37.786 1.00 0.00 C ATOM 910 C GLN A 82 -99.298 3.519 -36.583 1.00 0.00 C ATOM 911 O GLN A 82 -99.491 4.727 -36.716 1.00 0.00 O ATOM 912 CB GLN A 82 -100.653 1.879 -37.900 1.00 0.00 C ATOM 913 CG GLN A 82 -101.823 2.843 -38.004 1.00 0.00 C ATOM 914 CD GLN A 82 -103.162 2.146 -38.150 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.371 1.043 -37.642 1.00 0.00 O ATOM 916 NE2 GLN A 82 -104.083 2.797 -38.837 1.00 0.00 N ATOM 0 H GLN A 82 -98.518 0.645 -37.570 1.00 0.00 H new ATOM 0 HA GLN A 82 -99.135 3.159 -38.697 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.646 1.231 -38.777 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.796 1.237 -37.031 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.845 3.475 -37.116 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.668 3.501 -38.859 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -103.868 3.709 -39.241 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -105.009 2.388 -38.963 1.00 0.00 H new ATOM 925 N ARG A 83 -99.058 2.950 -35.407 1.00 0.00 N ATOM 926 CA ARG A 83 -98.928 3.733 -34.187 1.00 0.00 C ATOM 927 C ARG A 83 -97.721 4.663 -34.288 1.00 0.00 C ATOM 928 O ARG A 83 -97.701 5.742 -33.699 1.00 0.00 O ATOM 929 CB ARG A 83 -98.784 2.807 -32.973 1.00 0.00 C ATOM 930 CG ARG A 83 -98.653 3.534 -31.639 1.00 0.00 C ATOM 931 CD ARG A 83 -99.972 4.150 -31.186 1.00 0.00 C ATOM 932 NE ARG A 83 -100.426 5.234 -32.059 1.00 0.00 N ATOM 933 CZ ARG A 83 -101.647 5.769 -32.006 1.00 0.00 C ATOM 934 NH1 ARG A 83 -102.527 5.351 -31.106 1.00 0.00 N ATOM 935 NH2 ARG A 83 -101.989 6.729 -32.854 1.00 0.00 N ATOM 0 H ARG A 83 -98.949 1.945 -35.274 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.827 4.336 -34.059 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -99.650 2.147 -32.930 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -97.908 2.174 -33.116 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -98.301 2.836 -30.880 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -97.900 4.317 -31.726 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -100.737 3.374 -31.152 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -99.859 4.531 -30.171 1.00 0.00 H new ATOM 0 HE ARG A 83 -99.770 5.602 -32.748 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -102.272 4.615 -30.447 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -103.458 5.766 -31.073 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -101.318 7.059 -33.548 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -102.923 7.137 -32.813 1.00 0.00 H new ATOM 949 N LEU A 84 -96.727 4.240 -35.061 1.00 0.00 N ATOM 950 CA LEU A 84 -95.519 5.025 -35.269 1.00 0.00 C ATOM 951 C LEU A 84 -95.671 5.904 -36.501 1.00 0.00 C ATOM 952 O LEU A 84 -94.729 6.588 -36.897 1.00 0.00 O ATOM 953 CB LEU A 84 -94.315 4.102 -35.458 1.00 0.00 C ATOM 954 CG LEU A 84 -94.034 3.139 -34.308 1.00 0.00 C ATOM 955 CD1 LEU A 84 -92.966 2.141 -34.713 1.00 0.00 C ATOM 956 CD2 LEU A 84 -93.605 3.902 -33.065 1.00 0.00 C ATOM 0 H LEU A 84 -96.736 3.349 -35.558 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.361 5.652 -34.392 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.466 3.520 -36.367 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.430 4.718 -35.617 1.00 0.00 H new ATOM 0 HG LEU A 84 -94.950 2.596 -34.076 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.773 1.459 -33.885 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.308 1.574 -35.579 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -92.049 2.672 -34.966 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -93.409 3.199 -32.256 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.699 4.469 -33.280 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.399 4.587 -32.766 1.00 0.00 H new ATOM 968 N ASN A 85 -96.870 5.865 -37.092 1.00 0.00 N ATOM 969 CA ASN A 85 -97.184 6.551 -38.352 1.00 0.00 C ATOM 970 C ASN A 85 -96.061 6.386 -39.380 1.00 0.00 C ATOM 971 O ASN A 85 -95.589 7.348 -39.989 1.00 0.00 O ATOM 972 CB ASN A 85 -97.557 8.030 -38.133 1.00 0.00 C ATOM 973 CG ASN A 85 -96.499 8.861 -37.423 1.00 0.00 C ATOM 974 OD1 ASN A 85 -96.465 8.927 -36.191 1.00 0.00 O ATOM 975 ND2 ASN A 85 -95.651 9.523 -38.190 1.00 0.00 N ATOM 0 H ASN A 85 -97.660 5.350 -36.704 1.00 0.00 H new ATOM 0 HA ASN A 85 -98.069 6.068 -38.765 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -97.764 8.484 -39.102 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -98.480 8.075 -37.556 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.936 10.115 -37.767 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.711 9.442 -39.205 1.00 0.00 H new ATOM 982 N CYS A 86 -95.650 5.138 -39.565 1.00 0.00 N ATOM 983 CA CYS A 86 -94.628 4.785 -40.542 1.00 0.00 C ATOM 984 C CYS A 86 -95.263 4.062 -41.728 1.00 0.00 C ATOM 985 O CYS A 86 -94.571 3.467 -42.551 1.00 0.00 O ATOM 986 CB CYS A 86 -93.557 3.899 -39.890 1.00 0.00 C ATOM 987 SG CYS A 86 -92.683 4.698 -38.509 1.00 0.00 S ATOM 0 H CYS A 86 -96.016 4.342 -39.042 1.00 0.00 H new ATOM 0 HA CYS A 86 -94.154 5.698 -40.902 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -94.026 2.984 -39.530 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.830 3.607 -40.648 1.00 0.00 H new ATOM 992 N GLY A 87 -96.588 4.133 -41.806 1.00 0.00 N ATOM 993 CA GLY A 87 -97.313 3.505 -42.892 1.00 0.00 C ATOM 994 C GLY A 87 -97.541 2.027 -42.663 1.00 0.00 C ATOM 995 O GLY A 87 -98.165 1.626 -41.678 1.00 0.00 O ATOM 0 H GLY A 87 -97.176 4.619 -41.129 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -98.275 4.002 -43.017 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.760 3.644 -43.821 1.00 0.00 H new ATOM 999 N ASP A 88 -97.028 1.218 -43.575 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.159 -0.233 -43.496 1.00 0.00 C ATOM 1001 C ASP A 88 -96.142 -0.788 -42.503 1.00 0.00 C ATOM 1002 O ASP A 88 -95.285 -0.046 -42.022 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.962 -0.842 -44.887 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.110 -0.524 -45.823 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -99.147 -1.212 -45.754 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -97.978 0.417 -46.630 1.00 0.00 O ATOM 0 H ASP A 88 -96.510 1.545 -44.390 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.157 -0.496 -43.144 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.032 -0.468 -45.316 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.859 -1.923 -44.796 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.214 -2.085 -42.142 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.296 -2.639 -41.165 1.00 0.00 C ATOM 1013 C PRO A 89 -93.910 -2.872 -41.693 1.00 0.00 C ATOM 1014 O PRO A 89 -93.676 -3.034 -42.889 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.899 -3.971 -40.780 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.702 -4.375 -41.957 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.180 -3.099 -42.613 1.00 0.00 C ATOM 0 HA PRO A 89 -95.180 -1.938 -40.339 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.126 -4.706 -40.557 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.520 -3.882 -39.889 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.103 -4.966 -42.650 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.546 -4.995 -41.656 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.177 -3.181 -43.700 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.199 -2.852 -42.315 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.011 -2.830 -40.751 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.647 -3.229 -40.902 1.00 0.00 C ATOM 1027 C LEU A 90 -91.492 -4.475 -41.741 1.00 0.00 C ATOM 1028 O LEU A 90 -91.957 -5.558 -41.390 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.005 -3.430 -39.523 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.949 -3.340 -38.312 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.060 -4.362 -38.399 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.189 -3.516 -37.013 1.00 0.00 C ATOM 0 H LEU A 90 -93.224 -2.499 -39.810 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.134 -2.427 -41.433 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.523 -4.408 -39.509 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.219 -2.685 -39.400 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.394 -2.345 -38.327 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.708 -4.270 -37.527 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.643 -4.190 -39.304 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.631 -5.364 -38.428 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.882 -3.448 -36.174 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.704 -4.492 -37.005 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.434 -2.735 -36.925 1.00 0.00 H new ATOM 1044 N SER A 91 -90.873 -4.273 -42.875 1.00 0.00 N ATOM 1045 CA SER A 91 -90.375 -5.366 -43.684 1.00 0.00 C ATOM 1046 C SER A 91 -89.270 -6.077 -42.908 1.00 0.00 C ATOM 1047 O SER A 91 -88.427 -5.425 -42.285 1.00 0.00 O ATOM 1048 CB SER A 91 -89.847 -4.841 -45.022 1.00 0.00 C ATOM 1049 OG SER A 91 -90.872 -4.179 -45.752 1.00 0.00 O ATOM 0 H SER A 91 -90.698 -3.348 -43.268 1.00 0.00 H new ATOM 0 HA SER A 91 -91.181 -6.068 -43.899 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.020 -4.154 -44.846 1.00 0.00 H new ATOM 0 HB3 SER A 91 -89.453 -5.669 -45.611 1.00 0.00 H new ATOM 0 HG SER A 91 -90.770 -3.209 -45.654 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.302 -7.399 -42.914 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.387 -8.193 -42.107 1.00 0.00 C ATOM 1057 C LEU A 92 -87.088 -8.454 -42.862 1.00 0.00 C ATOM 1058 O LEU A 92 -87.105 -8.921 -44.004 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.068 -9.510 -41.725 1.00 0.00 C ATOM 1060 CG LEU A 92 -88.882 -9.967 -40.279 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.004 -10.915 -39.875 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -87.545 -10.655 -40.110 1.00 0.00 C ATOM 0 H LEU A 92 -89.955 -7.949 -43.472 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.136 -7.642 -41.200 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -90.136 -9.413 -41.920 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.694 -10.294 -42.384 1.00 0.00 H new ATOM 0 HG LEU A 92 -88.911 -9.088 -39.635 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -89.858 -11.232 -38.842 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -90.962 -10.404 -39.966 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.995 -11.788 -40.527 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -87.428 -10.974 -39.074 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -87.498 -11.525 -40.765 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -86.744 -9.962 -40.368 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.970 -8.131 -42.223 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.669 -8.315 -42.838 1.00 0.00 C ATOM 1076 C GLY A 93 -83.548 -8.159 -41.829 1.00 0.00 C ATOM 1077 O GLY A 93 -83.610 -7.273 -40.984 1.00 0.00 O ATOM 0 H GLY A 93 -85.942 -7.741 -41.281 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.617 -9.305 -43.291 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.540 -7.590 -43.641 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.508 -9.008 -41.898 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.421 -9.044 -40.904 1.00 0.00 C ATOM 1083 C PRO A 94 -80.764 -7.688 -40.661 1.00 0.00 C ATOM 1084 O PRO A 94 -80.416 -6.968 -41.599 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.400 -10.025 -41.502 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.814 -10.223 -42.923 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.298 -10.000 -42.960 1.00 0.00 C ATOM 0 HA PRO A 94 -81.806 -9.340 -39.928 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.389 -9.623 -41.441 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.400 -10.970 -40.959 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.298 -9.523 -43.580 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.562 -11.227 -43.266 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.626 -9.628 -43.931 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.850 -10.920 -42.768 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.598 -7.355 -39.388 1.00 0.00 N ATOM 1096 CA PHE A 95 -79.947 -6.121 -38.994 1.00 0.00 C ATOM 1097 C PHE A 95 -78.467 -6.398 -38.717 1.00 0.00 C ATOM 1098 O PHE A 95 -78.104 -7.503 -38.311 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.652 -5.534 -37.763 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.151 -4.181 -37.338 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.303 -3.076 -38.166 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -79.536 -4.011 -36.110 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -79.847 -1.831 -37.772 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -79.082 -2.770 -35.712 1.00 0.00 C ATOM 1105 CZ PHE A 95 -79.237 -1.679 -36.544 1.00 0.00 C ATOM 0 H PHE A 95 -80.910 -7.931 -38.606 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.013 -5.387 -39.797 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.719 -5.462 -37.972 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.537 -6.227 -36.930 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -80.782 -3.190 -39.127 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -79.410 -4.860 -35.455 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -79.968 -0.979 -38.425 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -78.606 -2.652 -34.750 1.00 0.00 H new ATOM 0 HZ PHE A 95 -78.881 -0.708 -36.234 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.620 -5.406 -38.956 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.173 -5.598 -38.880 1.00 0.00 C ATOM 1117 C LEU A 96 -75.703 -5.823 -37.444 1.00 0.00 C ATOM 1118 O LEU A 96 -75.032 -6.816 -37.157 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.424 -4.405 -39.492 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.648 -4.172 -40.990 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -77.002 -3.521 -41.253 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -74.531 -3.318 -41.559 1.00 0.00 C ATOM 0 H LEU A 96 -77.907 -4.459 -39.204 1.00 0.00 H new ATOM 0 HA LEU A 96 -75.944 -6.494 -39.457 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -75.717 -3.503 -38.956 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -74.357 -4.544 -39.321 1.00 0.00 H new ATOM 0 HG LEU A 96 -75.642 -5.142 -41.488 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -77.131 -3.369 -42.325 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -77.796 -4.169 -40.881 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -77.049 -2.559 -40.742 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -74.701 -3.159 -42.624 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -74.512 -2.356 -41.047 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -73.577 -3.824 -41.415 1.00 0.00 H new ATOM 1134 N LYS A 97 -76.054 -4.910 -36.546 1.00 0.00 N ATOM 1135 CA LYS A 97 -75.616 -5.004 -35.156 1.00 0.00 C ATOM 1136 C LYS A 97 -76.253 -6.196 -34.452 1.00 0.00 C ATOM 1137 O LYS A 97 -77.463 -6.411 -34.532 1.00 0.00 O ATOM 1138 CB LYS A 97 -75.913 -3.708 -34.395 1.00 0.00 C ATOM 1139 CG LYS A 97 -74.918 -2.595 -34.694 1.00 0.00 C ATOM 1140 CD LYS A 97 -75.173 -1.362 -33.842 1.00 0.00 C ATOM 1141 CE LYS A 97 -76.391 -0.585 -34.316 1.00 0.00 C ATOM 1142 NZ LYS A 97 -76.191 -0.017 -35.675 1.00 0.00 N ATOM 0 H LYS A 97 -76.638 -4.099 -36.753 1.00 0.00 H new ATOM 0 HA LYS A 97 -74.537 -5.156 -35.164 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -76.917 -3.367 -34.649 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -75.908 -3.913 -33.325 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -73.905 -2.956 -34.516 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -74.980 -2.327 -35.749 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -75.316 -1.662 -32.804 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -74.297 -0.715 -33.869 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -77.261 -1.242 -34.321 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -76.604 0.221 -33.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -76.359 1.009 -35.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -75.217 -0.201 -35.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -76.858 -0.461 -36.338 1.00 0.00 H new ATOM 1156 N THR A 98 -75.415 -6.963 -33.771 1.00 0.00 N ATOM 1157 CA THR A 98 -75.829 -8.199 -33.129 1.00 0.00 C ATOM 1158 C THR A 98 -76.622 -7.935 -31.847 1.00 0.00 C ATOM 1159 O THR A 98 -76.355 -6.976 -31.119 1.00 0.00 O ATOM 1160 CB THR A 98 -74.595 -9.067 -32.808 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.767 -9.172 -33.974 1.00 0.00 O ATOM 1162 CG2 THR A 98 -74.996 -10.461 -32.346 1.00 0.00 C ATOM 0 H THR A 98 -74.426 -6.744 -33.648 1.00 0.00 H new ATOM 0 HA THR A 98 -76.481 -8.729 -33.824 1.00 0.00 H new ATOM 0 HB THR A 98 -74.047 -8.586 -31.998 1.00 0.00 H new ATOM 0 HG1 THR A 98 -72.982 -9.722 -33.769 1.00 0.00 H new ATOM 0 HG21 THR A 98 -74.101 -11.044 -32.129 1.00 0.00 H new ATOM 0 HG22 THR A 98 -75.606 -10.385 -31.446 1.00 0.00 H new ATOM 0 HG23 THR A 98 -75.568 -10.954 -33.132 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.617 -8.780 -31.605 1.00 0.00 N ATOM 1171 CA TYR A 99 -78.421 -8.716 -30.393 1.00 0.00 C ATOM 1172 C TYR A 99 -77.588 -9.115 -29.169 1.00 0.00 C ATOM 1173 O TYR A 99 -76.707 -9.971 -29.255 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.678 -9.601 -30.534 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.424 -11.098 -30.604 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -78.813 -11.678 -31.710 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -79.811 -11.934 -29.562 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -78.591 -13.039 -31.773 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.591 -13.298 -29.621 1.00 0.00 C ATOM 1180 CZ TYR A 99 -78.980 -13.844 -30.729 1.00 0.00 C ATOM 1181 OH TYR A 99 -78.761 -15.202 -30.794 1.00 0.00 O ATOM 0 H TYR A 99 -77.888 -9.528 -32.243 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.751 -7.688 -30.246 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -80.337 -9.402 -29.689 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -80.214 -9.299 -31.434 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -78.506 -11.052 -32.535 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.291 -11.511 -28.692 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -78.113 -13.470 -32.640 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.897 -13.933 -28.802 1.00 0.00 H new ATOM 0 HH TYR A 99 -79.093 -15.626 -29.976 1.00 0.00 H new ATOM 1191 N THR A 100 -77.873 -8.486 -28.034 1.00 0.00 N ATOM 1192 CA THR A 100 -77.084 -8.676 -26.819 1.00 0.00 C ATOM 1193 C THR A 100 -77.863 -9.488 -25.783 1.00 0.00 C ATOM 1194 O THR A 100 -79.040 -9.228 -25.550 1.00 0.00 O ATOM 1195 CB THR A 100 -76.688 -7.311 -26.209 1.00 0.00 C ATOM 1196 OG1 THR A 100 -76.006 -6.518 -27.189 1.00 0.00 O ATOM 1197 CG2 THR A 100 -75.797 -7.475 -24.985 1.00 0.00 C ATOM 0 H THR A 100 -78.651 -7.835 -27.929 1.00 0.00 H new ATOM 0 HA THR A 100 -76.182 -9.224 -27.092 1.00 0.00 H new ATOM 0 HB THR A 100 -77.606 -6.813 -25.896 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.759 -5.654 -26.797 1.00 0.00 H new ATOM 0 HG21 THR A 100 -75.541 -6.493 -24.587 1.00 0.00 H new ATOM 0 HG22 THR A 100 -76.326 -8.049 -24.224 1.00 0.00 H new ATOM 0 HG23 THR A 100 -74.885 -8.001 -25.267 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.212 -10.485 -25.158 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.823 -11.347 -24.133 1.00 0.00 C ATOM 1207 C PRO A 101 -78.135 -10.602 -22.832 1.00 0.00 C ATOM 1208 O PRO A 101 -77.550 -10.890 -21.784 1.00 0.00 O ATOM 1209 CB PRO A 101 -76.764 -12.434 -23.884 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.787 -12.309 -25.001 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.824 -10.870 -25.421 1.00 0.00 C ATOM 0 HA PRO A 101 -78.784 -11.737 -24.469 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.276 -12.292 -22.920 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.217 -13.425 -23.869 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.786 -12.596 -24.678 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.055 -12.965 -25.829 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.122 -10.264 -24.848 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.564 -10.750 -26.473 1.00 0.00 H new ATOM 1219 N GLN A 102 -79.066 -9.656 -22.912 1.00 0.00 N ATOM 1220 CA GLN A 102 -79.475 -8.842 -21.770 1.00 0.00 C ATOM 1221 C GLN A 102 -80.491 -7.805 -22.229 1.00 0.00 C ATOM 1222 O GLN A 102 -81.646 -7.807 -21.799 1.00 0.00 O ATOM 1223 CB GLN A 102 -78.265 -8.143 -21.140 1.00 0.00 C ATOM 1224 CG GLN A 102 -78.611 -7.241 -19.967 1.00 0.00 C ATOM 1225 CD GLN A 102 -77.381 -6.684 -19.286 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -76.864 -7.272 -18.336 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -76.895 -5.554 -19.771 1.00 0.00 N ATOM 0 H GLN A 102 -79.561 -9.431 -23.775 1.00 0.00 H new ATOM 0 HA GLN A 102 -79.925 -9.491 -21.018 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -77.555 -8.900 -20.806 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -77.763 -7.550 -21.904 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -79.234 -6.418 -20.317 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -79.202 -7.802 -19.243 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -77.354 -5.098 -20.560 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -76.061 -5.138 -19.356 1.00 0.00 H new ATOM 1236 N SER A 103 -80.044 -6.930 -23.119 1.00 0.00 N ATOM 1237 CA SER A 103 -80.903 -5.914 -23.697 1.00 0.00 C ATOM 1238 C SER A 103 -81.768 -6.522 -24.793 1.00 0.00 C ATOM 1239 O SER A 103 -82.939 -6.174 -24.944 1.00 0.00 O ATOM 1240 CB SER A 103 -80.042 -4.783 -24.252 1.00 0.00 C ATOM 1241 OG SER A 103 -78.982 -5.304 -25.038 1.00 0.00 O ATOM 0 H SER A 103 -79.082 -6.906 -23.457 1.00 0.00 H new ATOM 0 HA SER A 103 -81.563 -5.512 -22.929 1.00 0.00 H new ATOM 0 HB2 SER A 103 -80.655 -4.114 -24.856 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.637 -4.191 -23.432 1.00 0.00 H new ATOM 0 HG SER A 103 -78.441 -4.566 -25.388 1.00 0.00 H new ATOM 1247 N SER A 104 -81.189 -7.452 -25.541 1.00 0.00 N ATOM 1248 CA SER A 104 -81.914 -8.148 -26.585 1.00 0.00 C ATOM 1249 C SER A 104 -82.303 -9.542 -26.112 1.00 0.00 C ATOM 1250 O SER A 104 -81.703 -10.072 -25.178 1.00 0.00 O ATOM 1251 CB SER A 104 -81.065 -8.246 -27.848 1.00 0.00 C ATOM 1252 OG SER A 104 -80.611 -6.971 -28.266 1.00 0.00 O ATOM 0 H SER A 104 -80.216 -7.740 -25.440 1.00 0.00 H new ATOM 0 HA SER A 104 -82.818 -7.584 -26.814 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.210 -8.896 -27.664 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.649 -8.706 -28.646 1.00 0.00 H new ATOM 0 HG SER A 104 -80.082 -6.561 -27.550 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.306 -10.129 -26.753 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.781 -11.457 -26.390 1.00 0.00 C ATOM 1260 C ILE A 105 -84.378 -12.188 -27.590 1.00 0.00 C ATOM 1261 O ILE A 105 -84.588 -11.597 -28.654 1.00 0.00 O ATOM 1262 CB ILE A 105 -84.847 -11.403 -25.257 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -85.812 -10.218 -25.435 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.189 -11.342 -23.888 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -86.758 -10.354 -26.609 1.00 0.00 C ATOM 0 H ILE A 105 -83.808 -9.703 -27.532 1.00 0.00 H new ATOM 0 HA ILE A 105 -82.908 -12.002 -26.032 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.428 -12.322 -25.325 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.398 -10.102 -24.523 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.229 -9.305 -25.557 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -84.958 -11.305 -23.116 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.570 -12.227 -23.742 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.566 -10.450 -23.823 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.402 -9.476 -26.661 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.183 -10.437 -27.531 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.371 -11.246 -26.481 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.637 -13.473 -27.405 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.427 -14.253 -28.346 1.00 0.00 C ATOM 1279 C ILE A 106 -86.715 -14.652 -27.623 1.00 0.00 C ATOM 1280 O ILE A 106 -86.645 -15.235 -26.541 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.725 -15.565 -28.770 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.473 -15.273 -29.574 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.676 -16.439 -29.585 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.718 -16.513 -29.995 1.00 0.00 C ATOM 0 H ILE A 106 -84.306 -14.004 -26.600 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.590 -13.648 -29.238 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.438 -16.101 -27.866 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.747 -14.706 -30.464 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.812 -14.639 -28.983 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.167 -17.358 -29.875 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.551 -16.684 -28.983 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.990 -15.900 -30.479 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.835 -16.225 -30.566 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.412 -17.071 -29.110 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.362 -17.139 -30.613 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.876 -14.348 -28.157 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.103 -14.810 -27.516 1.00 0.00 C ATOM 1298 C CYS A 107 -89.640 -16.040 -28.246 1.00 0.00 C ATOM 1299 O CYS A 107 -89.225 -16.332 -29.369 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.162 -13.713 -27.467 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.537 -12.059 -27.062 1.00 0.00 S ATOM 0 H CYS A 107 -88.005 -13.800 -29.008 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.865 -15.078 -26.487 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.662 -13.669 -28.434 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -90.916 -13.990 -26.730 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.554 -16.761 -27.616 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.088 -17.987 -28.197 1.00 0.00 C ATOM 1308 C TYR A 108 -92.596 -18.061 -28.006 1.00 0.00 C ATOM 1309 O TYR A 108 -93.213 -17.113 -27.521 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.424 -19.216 -27.575 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.089 -19.576 -28.187 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -89.023 -20.330 -29.348 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.896 -19.172 -27.599 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.810 -20.670 -29.912 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.677 -19.511 -28.156 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.640 -20.259 -29.312 1.00 0.00 C ATOM 1317 OH TYR A 108 -85.429 -20.600 -29.867 1.00 0.00 O ATOM 0 H TYR A 108 -90.942 -16.521 -26.704 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.870 -17.974 -29.265 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.286 -19.040 -26.508 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -91.097 -20.068 -27.673 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.937 -20.658 -29.820 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -87.922 -18.584 -26.693 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -87.778 -21.255 -30.819 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.758 -19.191 -27.687 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.704 -20.231 -29.321 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.175 -19.195 -28.373 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.611 -19.348 -28.333 1.00 0.00 C ATOM 1329 C GLY A 109 -95.183 -19.447 -29.721 1.00 0.00 C ATOM 1330 O GLY A 109 -94.691 -20.210 -30.551 1.00 0.00 O ATOM 0 H GLY A 109 -92.669 -20.018 -28.700 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.869 -20.242 -27.765 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.056 -18.500 -27.812 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.232 -18.695 -29.967 1.00 0.00 N ATOM 1335 CA GLN A 110 -96.795 -18.583 -31.300 1.00 0.00 C ATOM 1336 C GLN A 110 -96.760 -17.132 -31.759 1.00 0.00 C ATOM 1337 O GLN A 110 -96.803 -16.212 -30.937 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.227 -19.127 -31.332 1.00 0.00 C ATOM 1339 CG GLN A 110 -98.310 -20.636 -31.143 1.00 0.00 C ATOM 1340 CD GLN A 110 -97.704 -21.408 -32.300 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -98.395 -21.766 -33.255 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -96.406 -21.662 -32.233 1.00 0.00 N ATOM 0 H GLN A 110 -96.718 -18.147 -29.257 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.194 -19.181 -31.984 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.810 -18.639 -30.551 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -98.686 -18.863 -32.285 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -97.798 -20.911 -30.221 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -99.354 -20.926 -31.026 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -95.866 -21.350 -31.426 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -95.946 -22.170 -32.989 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.667 -16.935 -33.069 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.607 -15.599 -33.647 1.00 0.00 C ATOM 1353 C LEU A 111 -97.860 -14.818 -33.272 1.00 0.00 C ATOM 1354 O LEU A 111 -98.965 -15.163 -33.687 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.456 -15.692 -35.176 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.998 -14.413 -35.897 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -97.118 -13.387 -35.986 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -94.784 -13.815 -35.201 1.00 0.00 C ATOM 0 H LEU A 111 -96.631 -17.690 -33.754 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.739 -15.072 -33.250 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.743 -16.485 -35.401 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -97.415 -15.996 -35.596 1.00 0.00 H new ATOM 0 HG LEU A 111 -95.721 -14.689 -36.914 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -96.756 -12.497 -36.502 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -97.957 -13.811 -36.538 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -97.444 -13.117 -34.982 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -94.473 -12.911 -35.724 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -95.040 -13.568 -34.171 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -93.968 -14.537 -35.209 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.682 -13.780 -32.468 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.804 -12.964 -32.065 1.00 0.00 C ATOM 1372 C GLY A 112 -99.117 -13.092 -30.589 1.00 0.00 C ATOM 1373 O GLY A 112 -100.021 -12.433 -30.082 1.00 0.00 O ATOM 0 H GLY A 112 -96.781 -13.490 -32.089 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.592 -11.921 -32.298 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.682 -13.248 -32.645 1.00 0.00 H new ATOM 1377 N SER A 113 -98.383 -13.943 -29.892 1.00 0.00 N ATOM 1378 CA SER A 113 -98.580 -14.094 -28.461 1.00 0.00 C ATOM 1379 C SER A 113 -97.344 -13.643 -27.688 1.00 0.00 C ATOM 1380 O SER A 113 -96.449 -14.434 -27.395 1.00 0.00 O ATOM 1381 CB SER A 113 -98.924 -15.540 -28.120 1.00 0.00 C ATOM 1382 OG SER A 113 -100.054 -15.981 -28.858 1.00 0.00 O ATOM 0 H SER A 113 -97.653 -14.534 -30.289 1.00 0.00 H new ATOM 0 HA SER A 113 -99.414 -13.458 -28.165 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.070 -16.182 -28.337 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.125 -15.628 -27.052 1.00 0.00 H new ATOM 0 HG SER A 113 -100.255 -16.911 -28.624 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.306 -12.362 -27.366 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.189 -11.773 -26.640 1.00 0.00 C ATOM 1390 C PHE A 114 -96.381 -11.960 -25.142 1.00 0.00 C ATOM 1391 O PHE A 114 -96.489 -10.994 -24.389 1.00 0.00 O ATOM 1392 CB PHE A 114 -96.071 -10.281 -26.970 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.572 -9.991 -28.360 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.091 -10.655 -29.461 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.576 -9.052 -28.561 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.622 -10.390 -30.731 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.107 -8.782 -29.829 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.628 -9.452 -30.914 1.00 0.00 C ATOM 0 H PHE A 114 -98.046 -11.700 -27.599 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.271 -12.275 -26.945 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -97.048 -9.814 -26.843 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.399 -9.814 -26.250 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.872 -11.388 -29.323 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.161 -8.524 -27.715 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.033 -10.916 -31.580 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.331 -8.045 -29.972 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.258 -9.243 -31.907 1.00 0.00 H new ATOM 1408 N SER A 115 -96.456 -13.210 -24.723 1.00 0.00 N ATOM 1409 CA SER A 115 -96.641 -13.524 -23.321 1.00 0.00 C ATOM 1410 C SER A 115 -95.297 -13.560 -22.601 1.00 0.00 C ATOM 1411 O SER A 115 -95.132 -12.945 -21.545 1.00 0.00 O ATOM 1412 CB SER A 115 -97.366 -14.867 -23.164 1.00 0.00 C ATOM 1413 OG SER A 115 -97.583 -15.184 -21.797 1.00 0.00 O ATOM 0 H SER A 115 -96.391 -14.023 -25.335 1.00 0.00 H new ATOM 0 HA SER A 115 -97.255 -12.744 -22.871 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.322 -14.829 -23.686 1.00 0.00 H new ATOM 0 HB3 SER A 115 -96.778 -15.656 -23.633 1.00 0.00 H new ATOM 0 HG SER A 115 -96.733 -15.440 -21.382 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.337 -14.270 -23.183 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.040 -14.473 -22.546 1.00 0.00 C ATOM 1421 C ASN A 116 -91.925 -14.551 -23.582 1.00 0.00 C ATOM 1422 O ASN A 116 -92.164 -14.870 -24.748 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.045 -15.763 -21.710 1.00 0.00 C ATOM 1424 CG ASN A 116 -93.876 -15.655 -20.445 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -95.082 -15.916 -20.453 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -93.237 -15.283 -19.345 1.00 0.00 N ATOM 0 H ASN A 116 -94.432 -14.715 -24.096 1.00 0.00 H new ATOM 0 HA ASN A 116 -92.857 -13.618 -21.895 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -93.428 -16.581 -22.320 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -92.020 -16.018 -21.442 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -93.743 -15.204 -18.463 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -92.239 -15.076 -19.380 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.712 -14.258 -23.147 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.536 -14.399 -23.989 1.00 0.00 C ATOM 1435 C CYS A 117 -88.489 -15.230 -23.260 1.00 0.00 C ATOM 1436 O CYS A 117 -88.725 -15.679 -22.136 1.00 0.00 O ATOM 1437 CB CYS A 117 -88.943 -13.033 -24.334 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.080 -11.868 -25.131 1.00 0.00 S ATOM 0 H CYS A 117 -90.514 -13.918 -22.206 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.832 -14.893 -24.914 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -88.567 -12.578 -23.418 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.086 -13.184 -24.990 1.00 0.00 H new ATOM 1443 N SER A 118 -87.338 -15.426 -23.884 1.00 0.00 N ATOM 1444 CA SER A 118 -86.260 -16.167 -23.257 1.00 0.00 C ATOM 1445 C SER A 118 -84.936 -15.429 -23.419 1.00 0.00 C ATOM 1446 O SER A 118 -84.727 -14.713 -24.408 1.00 0.00 O ATOM 1447 CB SER A 118 -86.167 -17.577 -23.848 1.00 0.00 C ATOM 1448 OG SER A 118 -85.987 -17.541 -25.253 1.00 0.00 O ATOM 0 H SER A 118 -87.129 -15.083 -24.821 1.00 0.00 H new ATOM 0 HA SER A 118 -86.474 -16.253 -22.192 1.00 0.00 H new ATOM 0 HB2 SER A 118 -85.336 -18.111 -23.387 1.00 0.00 H new ATOM 0 HB3 SER A 118 -87.074 -18.133 -23.611 1.00 0.00 H new ATOM 0 HG SER A 118 -86.104 -16.623 -25.574 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.062 -15.587 -22.429 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.734 -14.988 -22.462 1.00 0.00 C ATOM 1456 C HIS A 119 -82.014 -15.390 -23.741 1.00 0.00 C ATOM 1457 O HIS A 119 -81.961 -16.570 -24.078 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.925 -15.433 -21.238 1.00 0.00 C ATOM 1459 CG HIS A 119 -80.618 -14.714 -21.063 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -80.416 -13.759 -20.093 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -79.442 -14.820 -21.730 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -79.180 -13.307 -20.170 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -78.566 -13.934 -21.154 1.00 0.00 N ATOM 0 H HIS A 119 -84.254 -16.130 -21.587 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.835 -13.903 -22.440 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -82.530 -15.284 -20.344 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -81.730 -16.503 -21.316 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -79.233 -15.479 -22.560 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -78.744 -12.551 -19.534 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -77.598 -13.785 -21.440 1.00 0.00 H new ATOM 1472 N SER A 120 -81.474 -14.400 -24.443 1.00 0.00 N ATOM 1473 CA SER A 120 -80.774 -14.612 -25.706 1.00 0.00 C ATOM 1474 C SER A 120 -79.466 -15.392 -25.511 1.00 0.00 C ATOM 1475 O SER A 120 -78.377 -14.817 -25.492 1.00 0.00 O ATOM 1476 CB SER A 120 -80.505 -13.246 -26.333 1.00 0.00 C ATOM 1477 OG SER A 120 -80.299 -12.282 -25.314 1.00 0.00 O ATOM 0 H SER A 120 -81.509 -13.423 -24.151 1.00 0.00 H new ATOM 0 HA SER A 120 -81.397 -15.216 -26.366 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.629 -13.298 -26.979 1.00 0.00 H new ATOM 0 HB3 SER A 120 -81.346 -12.951 -26.960 1.00 0.00 H new ATOM 0 HG SER A 120 -80.623 -11.409 -25.619 1.00 0.00 H new ATOM 1483 N ARG A 121 -79.590 -16.699 -25.328 1.00 0.00 N ATOM 1484 CA ARG A 121 -78.432 -17.557 -25.098 1.00 0.00 C ATOM 1485 C ARG A 121 -78.332 -18.653 -26.158 1.00 0.00 C ATOM 1486 O ARG A 121 -77.237 -19.087 -26.518 1.00 0.00 O ATOM 1487 CB ARG A 121 -78.511 -18.182 -23.702 1.00 0.00 C ATOM 1488 CG ARG A 121 -79.773 -18.997 -23.468 1.00 0.00 C ATOM 1489 CD ARG A 121 -79.787 -19.616 -22.084 1.00 0.00 C ATOM 1490 NE ARG A 121 -78.719 -20.598 -21.910 1.00 0.00 N ATOM 1491 CZ ARG A 121 -78.363 -21.107 -20.733 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -78.953 -20.686 -19.619 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -77.410 -22.032 -20.672 1.00 0.00 N ATOM 0 H ARG A 121 -80.483 -17.191 -25.334 1.00 0.00 H new ATOM 0 HA ARG A 121 -77.536 -16.940 -25.167 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -77.642 -18.823 -23.551 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -78.457 -17.390 -22.955 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -80.648 -18.358 -23.591 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -79.844 -19.783 -24.220 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -79.682 -18.831 -21.335 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -80.751 -20.095 -21.911 1.00 0.00 H new ATOM 0 HE ARG A 121 -78.216 -20.912 -22.740 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -79.680 -19.972 -19.665 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -78.679 -21.077 -18.718 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -76.953 -22.350 -21.526 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -77.136 -22.423 -19.771 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.914 -16.113 -34.073 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.886 -15.316 -34.807 1.00 0.00 C ATOM 1552 C CYS A 125 -81.194 -14.283 -35.689 1.00 0.00 C ATOM 1553 O CYS A 125 -81.853 -13.510 -36.378 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.906 -14.644 -33.874 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.289 -14.154 -32.240 1.00 0.00 S ATOM 0 HA CYS A 125 -82.439 -16.001 -35.450 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -83.296 -13.757 -34.374 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.745 -15.326 -33.734 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.858 -14.270 -35.646 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.040 -13.450 -36.550 1.00 0.00 C ATOM 1562 C HIS A 126 -79.379 -11.969 -36.445 1.00 0.00 C ATOM 1563 O HIS A 126 -79.079 -11.196 -37.355 1.00 0.00 O ATOM 1564 CB HIS A 126 -79.205 -13.914 -38.002 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.622 -15.262 -38.274 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -79.311 -16.274 -38.908 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -77.393 -15.760 -38.009 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -78.534 -17.332 -39.020 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -77.364 -17.047 -38.481 1.00 0.00 N ATOM 0 H HIS A 126 -79.313 -14.825 -34.986 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.002 -13.581 -36.243 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -80.266 -13.931 -38.250 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.735 -13.185 -38.662 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -76.584 -15.240 -37.517 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -78.808 -18.272 -39.475 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -76.567 -17.681 -38.425 1.00 0.00 H new ATOM 1578 N SER A 127 -79.980 -11.585 -35.322 1.00 0.00 N ATOM 1579 CA SER A 127 -80.411 -10.211 -35.095 1.00 0.00 C ATOM 1580 C SER A 127 -81.265 -9.711 -36.262 1.00 0.00 C ATOM 1581 O SER A 127 -81.075 -8.596 -36.748 1.00 0.00 O ATOM 1582 CB SER A 127 -79.194 -9.304 -34.901 1.00 0.00 C ATOM 1583 OG SER A 127 -78.218 -9.939 -34.085 1.00 0.00 O ATOM 0 H SER A 127 -80.181 -12.216 -34.547 1.00 0.00 H new ATOM 0 HA SER A 127 -81.019 -10.185 -34.191 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.760 -9.057 -35.870 1.00 0.00 H new ATOM 0 HB3 SER A 127 -79.504 -8.365 -34.442 1.00 0.00 H new ATOM 0 HG SER A 127 -77.602 -10.451 -34.650 1.00 0.00 H new ATOM 1589 N LEU A 128 -82.195 -10.552 -36.719 1.00 0.00 N ATOM 1590 CA LEU A 128 -83.111 -10.157 -37.779 1.00 0.00 C ATOM 1591 C LEU A 128 -83.824 -8.870 -37.393 1.00 0.00 C ATOM 1592 O LEU A 128 -84.311 -8.729 -36.271 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.129 -11.264 -38.079 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.543 -12.558 -38.655 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.652 -13.542 -38.988 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.701 -12.265 -39.890 1.00 0.00 C ATOM 0 H LEU A 128 -82.330 -11.502 -36.372 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.531 -9.987 -38.686 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.661 -11.504 -37.158 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.867 -10.875 -38.781 1.00 0.00 H new ATOM 0 HG LEU A 128 -82.898 -13.007 -37.900 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -84.218 -14.455 -39.396 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.212 -13.779 -38.083 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -85.323 -13.099 -39.724 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.295 -13.197 -40.283 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -83.322 -11.791 -40.650 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -81.883 -11.597 -39.622 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.868 -7.936 -38.321 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.387 -6.631 -38.028 1.00 0.00 C ATOM 1610 C GLY A 129 -85.695 -6.384 -38.730 1.00 0.00 C ATOM 1611 O GLY A 129 -86.305 -7.310 -39.271 1.00 0.00 O ATOM 0 H GLY A 129 -83.549 -8.064 -39.281 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.526 -6.527 -36.952 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.663 -5.875 -38.330 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.104 -5.135 -38.749 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.381 -4.753 -39.277 1.00 0.00 C ATOM 1617 C LEU A 130 -87.310 -3.300 -39.701 1.00 0.00 C ATOM 1618 O LEU A 130 -86.444 -2.553 -39.247 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.475 -4.980 -38.229 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.056 -6.399 -38.179 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.796 -6.627 -36.877 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -89.992 -6.638 -39.355 1.00 0.00 C ATOM 0 H LEU A 130 -85.551 -4.355 -38.394 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.632 -5.364 -40.144 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.069 -4.737 -37.247 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.288 -4.280 -38.420 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.228 -7.105 -38.241 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.201 -7.639 -36.861 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.109 -6.497 -36.041 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.611 -5.909 -36.791 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.393 -7.650 -39.301 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.812 -5.920 -39.319 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.442 -6.515 -40.288 1.00 0.00 H new ATOM 1634 N THR A 131 -88.180 -2.907 -40.591 1.00 0.00 N ATOM 1635 CA THR A 131 -88.172 -1.555 -41.107 1.00 0.00 C ATOM 1636 C THR A 131 -89.575 -1.164 -41.564 1.00 0.00 C ATOM 1637 O THR A 131 -90.018 -1.578 -42.638 1.00 0.00 O ATOM 1638 CB THR A 131 -87.152 -1.480 -42.254 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.821 -1.503 -41.718 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.340 -0.248 -43.130 1.00 0.00 C ATOM 0 H THR A 131 -88.910 -3.504 -40.979 1.00 0.00 H new ATOM 0 HA THR A 131 -87.879 -0.847 -40.332 1.00 0.00 H new ATOM 0 HB THR A 131 -87.316 -2.349 -42.891 1.00 0.00 H new ATOM 0 HG1 THR A 131 -85.853 -1.768 -40.775 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.592 -0.248 -43.923 1.00 0.00 H new ATOM 0 HG22 THR A 131 -88.337 -0.264 -43.571 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.226 0.651 -42.524 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.288 -0.417 -40.701 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.714 -0.123 -40.894 1.00 0.00 C ATOM 1650 C CYS A 132 -91.981 0.403 -42.283 1.00 0.00 C ATOM 1651 O CYS A 132 -91.670 1.548 -42.612 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.238 0.838 -39.829 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.316 0.095 -38.175 1.00 0.00 S ATOM 0 H CYS A 132 -89.892 -0.004 -39.857 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.258 -1.061 -40.783 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.596 1.718 -39.795 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.233 1.180 -40.114 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.554 -0.487 -43.074 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.798 -0.292 -44.482 1.00 0.00 C ATOM 1660 C LEU A 133 -91.482 -0.236 -45.261 1.00 0.00 C ATOM 1661 O LEU A 133 -91.080 -1.217 -45.891 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.652 0.959 -44.743 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.804 1.366 -46.216 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.430 0.244 -47.034 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.638 2.636 -46.329 1.00 0.00 C ATOM 0 H LEU A 133 -92.871 -1.396 -42.736 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.366 -1.151 -44.839 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.645 0.791 -44.327 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.215 1.795 -44.197 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.810 1.560 -46.618 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.525 0.561 -48.073 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.797 -0.642 -46.981 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -95.416 0.009 -46.634 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.738 2.913 -47.378 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.626 2.461 -45.904 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.147 3.443 -45.785 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.808 0.901 -45.191 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.539 1.095 -45.878 1.00 0.00 C ATOM 1679 C GLU A 134 -88.736 2.202 -45.209 1.00 0.00 C ATOM 1680 O GLU A 134 -89.265 2.932 -44.367 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.757 1.433 -47.354 1.00 0.00 C ATOM 1682 CG GLU A 134 -90.510 2.733 -47.586 1.00 0.00 C ATOM 1683 CD GLU A 134 -90.538 3.125 -49.046 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -89.542 3.702 -49.526 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -91.546 2.844 -49.725 1.00 0.00 O ATOM 0 H GLU A 134 -91.123 1.713 -44.659 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.981 0.161 -45.817 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.788 1.493 -47.849 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.306 0.618 -47.826 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -91.531 2.629 -47.220 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -90.043 3.530 -47.007 1.00 0.00 H new