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 110 GLN : amide:sc= -0.319 X(o=-0.45,f=-0.24) USER MOD Set 1.2: A 113 SER OG : rot -110:sc= -0.132 USER MOD Set 2.1: A 58 MET CE :methyl 174:sc= -2.13 (180deg=-2.32) USER MOD Set 2.2: A 104 SER OG : rot 180:sc= -0.0247 USER MOD Set 3.1: A 43 LYS NZ :NH3+ -105:sc= 0.225 (180deg=0) USER MOD Set 3.2: A 85 ASN : amide:sc= -0.701 K(o=-0.48,f=-3.6) USER MOD Set 4.1: A 62 GLN : amide:sc= -3.13! C(o=-2!,f=-6.6!) USER MOD Set 4.2: A 63 SER OG : rot -5:sc= 0.237 USER MOD Set 4.3: A 67 SER OG : rot -129:sc= 0.869 USER MOD Set 5.1: A 27 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -2.09! C(o=-2.1!,f=-7!) USER MOD Single : A 38 THR OG1 : rot 178:sc= -0.273 USER MOD Single : A 40 SER OG : rot -147:sc= 0.456 USER MOD Single : A 41 ASN : amide:sc= -0.0584 K(o=-0.058,f=-2.3!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.12) USER MOD Single : A 47 GLN : amide:sc= -0.757 X(o=-0.76,f=-0.61) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 172:sc=-0.00145 (180deg=-0.0967) USER MOD Single : A 57 HIS : no HD1:sc= -3.46! K(o=-3.5!,f=-1.8) USER MOD Single : A 61 SER OG : rot 103:sc= 0.282 USER MOD Single : A 68 SER OG : rot 61:sc= 1.17 USER MOD Single : A 69 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0105) USER MOD Single : A 70 GLN : amide:sc= -0.806 K(o=-0.81,f=0) USER MOD Single : A 75 SER OG : rot -4:sc= 1.07 USER MOD Single : A 76 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.16) USER MOD Single : A 78 SER OG : rot 92:sc= 0.00745 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.7 K(o=-0.7,f=0) USER MOD Single : A 91 SER OG : rot 115:sc= 0.147 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot -99:sc= -2.67! USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.649 USER MOD Single : A 102 GLN : amide:sc= -5.76! K(o=-5.8!,f=-1.2) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.398 K(o=-0.4,f=-5.4!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 1.11 K(o=1.1,f=-3.3!) USER MOD Single : A 120 SER OG : rot -170:sc= -0.153 USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 19:sc= 0.517 USER MOD Single : A 131 THR OG1 : rot -98:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.125 -8.905 -24.821 1.00 0.00 N ATOM 26 CA LEU A 26 -99.804 -8.537 -25.336 1.00 0.00 C ATOM 27 C LEU A 26 -99.602 -9.062 -26.754 1.00 0.00 C ATOM 28 O LEU A 26 -99.133 -10.178 -26.955 1.00 0.00 O ATOM 29 CB LEU A 26 -98.693 -9.073 -24.423 1.00 0.00 C ATOM 30 CG LEU A 26 -98.767 -8.627 -22.960 1.00 0.00 C ATOM 31 CD1 LEU A 26 -97.678 -9.301 -22.145 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.646 -7.115 -22.849 1.00 0.00 C ATOM 0 HA LEU A 26 -99.752 -7.448 -25.356 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.716 -10.162 -24.454 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -97.731 -8.763 -24.831 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.738 -8.924 -22.563 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -97.744 -8.973 -21.108 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -97.804 -10.383 -22.193 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -96.702 -9.032 -22.549 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.701 -6.822 -21.801 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.691 -6.795 -23.266 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.459 -6.643 -23.401 1.00 0.00 H new ATOM 44 N SER A 27 -99.970 -8.268 -27.737 1.00 0.00 N ATOM 45 CA SER A 27 -99.839 -8.678 -29.124 1.00 0.00 C ATOM 46 C SER A 27 -99.453 -7.494 -29.993 1.00 0.00 C ATOM 47 O SER A 27 -99.949 -6.395 -29.790 1.00 0.00 O ATOM 48 CB SER A 27 -101.155 -9.287 -29.608 1.00 0.00 C ATOM 49 OG SER A 27 -101.530 -10.390 -28.803 1.00 0.00 O ATOM 0 H SER A 27 -100.362 -7.336 -27.605 1.00 0.00 H new ATOM 0 HA SER A 27 -99.052 -9.428 -29.199 1.00 0.00 H new ATOM 0 HB2 SER A 27 -101.940 -8.531 -29.584 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.052 -9.607 -30.645 1.00 0.00 H new ATOM 0 HG SER A 27 -102.375 -10.762 -29.131 1.00 0.00 H new ATOM 55 N TRP A 28 -98.581 -7.708 -30.975 1.00 0.00 N ATOM 56 CA TRP A 28 -98.146 -6.601 -31.826 1.00 0.00 C ATOM 57 C TRP A 28 -99.210 -6.248 -32.868 1.00 0.00 C ATOM 58 O TRP A 28 -98.972 -5.466 -33.783 1.00 0.00 O ATOM 59 CB TRP A 28 -96.785 -6.889 -32.480 1.00 0.00 C ATOM 60 CG TRP A 28 -96.761 -7.991 -33.505 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.726 -8.921 -33.769 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.683 -8.269 -34.403 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.313 -9.751 -34.784 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.060 -9.370 -35.189 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.431 -7.685 -34.618 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.230 -9.898 -36.177 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.610 -8.208 -35.596 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.011 -9.305 -36.365 1.00 0.00 C ATOM 0 H TRP A 28 -98.169 -8.614 -31.199 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.015 -5.729 -31.185 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.431 -5.973 -32.953 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.072 -7.137 -31.693 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.674 -8.994 -33.256 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.852 -10.525 -35.173 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.112 -6.838 -34.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.538 -10.745 -36.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.642 -7.763 -35.770 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.345 -9.692 -37.122 1.00 0.00 H new ATOM 79 N TYR A 29 -100.387 -6.838 -32.711 1.00 0.00 N ATOM 80 CA TYR A 29 -101.551 -6.457 -33.493 1.00 0.00 C ATOM 81 C TYR A 29 -102.624 -5.889 -32.564 1.00 0.00 C ATOM 82 O TYR A 29 -103.790 -5.754 -32.938 1.00 0.00 O ATOM 83 CB TYR A 29 -102.090 -7.644 -34.310 1.00 0.00 C ATOM 84 CG TYR A 29 -102.208 -8.949 -33.544 1.00 0.00 C ATOM 85 CD1 TYR A 29 -101.143 -9.840 -33.497 1.00 0.00 C ATOM 86 CD2 TYR A 29 -103.382 -9.295 -32.883 1.00 0.00 C ATOM 87 CE1 TYR A 29 -101.243 -11.037 -32.815 1.00 0.00 C ATOM 88 CE2 TYR A 29 -103.489 -10.493 -32.199 1.00 0.00 C ATOM 89 CZ TYR A 29 -102.417 -11.359 -32.169 1.00 0.00 C ATOM 90 OH TYR A 29 -102.515 -12.552 -31.486 1.00 0.00 O ATOM 0 H TYR A 29 -100.560 -7.589 -32.042 1.00 0.00 H new ATOM 0 HA TYR A 29 -101.259 -5.687 -34.208 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -103.072 -7.380 -34.702 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.437 -7.802 -35.168 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -100.221 -9.592 -34.002 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -104.223 -8.618 -32.904 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -100.405 -11.718 -32.788 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -104.407 -10.748 -31.691 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.406 -12.627 -31.085 1.00 0.00 H new ATOM 100 N ASP A 30 -102.204 -5.555 -31.346 1.00 0.00 N ATOM 101 CA ASP A 30 -103.082 -4.931 -30.360 1.00 0.00 C ATOM 102 C ASP A 30 -103.003 -3.414 -30.510 1.00 0.00 C ATOM 103 O ASP A 30 -101.909 -2.852 -30.583 1.00 0.00 O ATOM 104 CB ASP A 30 -102.662 -5.344 -28.943 1.00 0.00 C ATOM 105 CG ASP A 30 -103.597 -4.834 -27.860 1.00 0.00 C ATOM 106 OD1 ASP A 30 -103.578 -3.621 -27.561 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.342 -5.653 -27.283 1.00 0.00 O ATOM 0 H ASP A 30 -101.251 -5.708 -31.016 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.108 -5.260 -30.526 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.616 -6.432 -28.889 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -101.656 -4.972 -28.748 1.00 0.00 H new ATOM 112 N PRO A 31 -104.156 -2.734 -30.555 1.00 0.00 N ATOM 113 CA PRO A 31 -104.220 -1.288 -30.805 1.00 0.00 C ATOM 114 C PRO A 31 -103.560 -0.454 -29.707 1.00 0.00 C ATOM 115 O PRO A 31 -103.236 0.716 -29.917 1.00 0.00 O ATOM 116 CB PRO A 31 -105.723 -0.999 -30.857 1.00 0.00 C ATOM 117 CG PRO A 31 -106.354 -2.118 -30.105 1.00 0.00 C ATOM 118 CD PRO A 31 -105.494 -3.319 -30.364 1.00 0.00 C ATOM 0 HA PRO A 31 -103.681 -1.022 -31.714 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.956 -0.036 -30.402 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -106.083 -0.961 -31.885 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.403 -1.895 -29.039 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -107.376 -2.289 -30.442 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.513 -4.017 -29.527 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.824 -3.869 -31.246 1.00 0.00 H new ATOM 126 N ASP A 32 -103.357 -1.052 -28.545 1.00 0.00 N ATOM 127 CA ASP A 32 -102.785 -0.332 -27.411 1.00 0.00 C ATOM 128 C ASP A 32 -101.321 -0.707 -27.197 1.00 0.00 C ATOM 129 O ASP A 32 -100.563 0.039 -26.572 1.00 0.00 O ATOM 130 CB ASP A 32 -103.592 -0.623 -26.144 1.00 0.00 C ATOM 131 CG ASP A 32 -103.010 0.045 -24.916 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.234 1.259 -24.735 1.00 0.00 O ATOM 133 OD2 ASP A 32 -102.337 -0.642 -24.120 1.00 0.00 O ATOM 0 H ASP A 32 -103.578 -2.030 -28.359 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.831 0.735 -27.631 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.618 -0.284 -26.286 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.632 -1.700 -25.983 1.00 0.00 H new ATOM 138 N PHE A 33 -100.924 -1.840 -27.756 1.00 0.00 N ATOM 139 CA PHE A 33 -99.589 -2.390 -27.535 1.00 0.00 C ATOM 140 C PHE A 33 -98.507 -1.437 -28.034 1.00 0.00 C ATOM 141 O PHE A 33 -98.530 -1.004 -29.188 1.00 0.00 O ATOM 142 CB PHE A 33 -99.465 -3.734 -28.246 1.00 0.00 C ATOM 143 CG PHE A 33 -98.299 -4.569 -27.794 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.241 -5.047 -26.493 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.272 -4.900 -28.669 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.185 -5.834 -26.076 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.227 -5.681 -28.253 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.177 -6.150 -26.961 1.00 0.00 C ATOM 0 H PHE A 33 -101.511 -2.403 -28.372 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.449 -2.526 -26.463 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.384 -4.300 -28.091 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.376 -3.558 -29.318 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.030 -4.801 -25.798 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.298 -4.538 -29.686 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -97.150 -6.200 -25.061 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.436 -5.931 -28.945 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.349 -6.765 -26.641 1.00 0.00 H new ATOM 158 N GLN A 34 -97.577 -1.101 -27.151 1.00 0.00 N ATOM 159 CA GLN A 34 -96.469 -0.231 -27.511 1.00 0.00 C ATOM 160 C GLN A 34 -95.301 -1.024 -28.060 1.00 0.00 C ATOM 161 O GLN A 34 -94.857 -2.008 -27.464 1.00 0.00 O ATOM 162 CB GLN A 34 -96.011 0.605 -26.318 1.00 0.00 C ATOM 163 CG GLN A 34 -96.904 1.796 -26.024 1.00 0.00 C ATOM 164 CD GLN A 34 -96.922 2.822 -27.145 1.00 0.00 C ATOM 165 OE1 GLN A 34 -96.775 2.494 -28.322 1.00 0.00 O ATOM 166 NE2 GLN A 34 -97.093 4.080 -26.781 1.00 0.00 N ATOM 0 H GLN A 34 -97.569 -1.418 -26.181 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.830 0.440 -28.290 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.969 -0.032 -25.435 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.997 0.960 -26.503 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -97.920 1.445 -25.845 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.567 2.277 -25.106 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -97.212 4.314 -25.795 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -97.106 4.817 -27.486 1.00 0.00 H new ATOM 175 N ALA A 35 -94.802 -0.570 -29.193 1.00 0.00 N ATOM 176 CA ALA A 35 -93.701 -1.224 -29.878 1.00 0.00 C ATOM 177 C ALA A 35 -93.063 -0.253 -30.851 1.00 0.00 C ATOM 178 O ALA A 35 -93.731 0.659 -31.339 1.00 0.00 O ATOM 179 CB ALA A 35 -94.188 -2.464 -30.609 1.00 0.00 C ATOM 0 H ALA A 35 -95.148 0.264 -29.667 1.00 0.00 H new ATOM 0 HA ALA A 35 -92.959 -1.534 -29.143 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.349 -2.940 -31.116 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.623 -3.161 -29.893 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -94.942 -2.181 -31.343 1.00 0.00 H new ATOM 185 N ARG A 36 -91.781 -0.439 -31.130 1.00 0.00 N ATOM 186 CA ARG A 36 -91.057 0.493 -31.981 1.00 0.00 C ATOM 187 C ARG A 36 -89.689 -0.052 -32.346 1.00 0.00 C ATOM 188 O ARG A 36 -89.329 -1.168 -31.980 1.00 0.00 O ATOM 189 CB ARG A 36 -90.863 1.822 -31.243 1.00 0.00 C ATOM 190 CG ARG A 36 -89.970 1.661 -30.019 1.00 0.00 C ATOM 191 CD ARG A 36 -89.673 2.969 -29.311 1.00 0.00 C ATOM 192 NE ARG A 36 -88.670 2.766 -28.264 1.00 0.00 N ATOM 193 CZ ARG A 36 -88.531 3.527 -27.180 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.313 4.583 -26.985 1.00 0.00 N ATOM 195 NH2 ARG A 36 -87.601 3.217 -26.285 1.00 0.00 N ATOM 0 H ARG A 36 -91.225 -1.220 -30.783 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.641 0.639 -32.890 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.423 2.554 -31.921 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -91.833 2.213 -30.937 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.448 0.978 -29.317 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.030 1.200 -30.323 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.314 3.706 -30.030 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.588 3.370 -28.874 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.028 1.981 -28.373 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.031 4.820 -27.670 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.196 5.157 -26.150 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.003 2.404 -26.432 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -87.484 3.792 -25.451 1.00 0.00 H new ATOM 209 N LEU A 37 -88.937 0.750 -33.074 1.00 0.00 N ATOM 210 CA LEU A 37 -87.569 0.421 -33.416 1.00 0.00 C ATOM 211 C LEU A 37 -86.622 1.365 -32.691 1.00 0.00 C ATOM 212 O LEU A 37 -86.884 2.567 -32.610 1.00 0.00 O ATOM 213 CB LEU A 37 -87.383 0.540 -34.921 1.00 0.00 C ATOM 214 CG LEU A 37 -88.465 -0.155 -35.736 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.368 0.243 -37.192 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.349 -1.657 -35.581 1.00 0.00 C ATOM 0 H LEU A 37 -89.257 1.645 -33.444 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.348 -0.602 -33.111 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.361 1.596 -35.192 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.414 0.121 -35.191 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.441 0.157 -35.364 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.149 -0.263 -37.760 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.494 1.322 -37.283 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.392 -0.043 -37.583 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.127 -2.145 -36.168 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.371 -1.985 -35.933 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.465 -1.924 -34.531 1.00 0.00 H new ATOM 228 N THR A 38 -85.534 0.834 -32.161 1.00 0.00 N ATOM 229 CA THR A 38 -84.592 1.652 -31.413 1.00 0.00 C ATOM 230 C THR A 38 -83.166 1.145 -31.608 1.00 0.00 C ATOM 231 O THR A 38 -82.935 0.219 -32.393 1.00 0.00 O ATOM 232 CB THR A 38 -84.937 1.696 -29.909 1.00 0.00 C ATOM 233 OG1 THR A 38 -86.238 1.145 -29.675 1.00 0.00 O ATOM 234 CG2 THR A 38 -84.913 3.131 -29.399 1.00 0.00 C ATOM 0 H THR A 38 -85.281 -0.152 -32.233 1.00 0.00 H new ATOM 0 HA THR A 38 -84.666 2.667 -31.803 1.00 0.00 H new ATOM 0 HB THR A 38 -84.190 1.106 -29.378 1.00 0.00 H new ATOM 0 HG1 THR A 38 -86.426 1.146 -28.713 1.00 0.00 H new ATOM 0 HG21 THR A 38 -85.158 3.144 -28.337 1.00 0.00 H new ATOM 0 HG22 THR A 38 -83.919 3.553 -29.547 1.00 0.00 H new ATOM 0 HG23 THR A 38 -85.644 3.724 -29.948 1.00 0.00 H new ATOM 242 N ARG A 39 -82.211 1.765 -30.897 1.00 0.00 N ATOM 243 CA ARG A 39 -80.775 1.523 -31.097 1.00 0.00 C ATOM 244 C ARG A 39 -80.360 1.974 -32.495 1.00 0.00 C ATOM 245 O ARG A 39 -79.234 1.758 -32.935 1.00 0.00 O ATOM 246 CB ARG A 39 -80.418 0.048 -30.876 1.00 0.00 C ATOM 247 CG ARG A 39 -80.751 -0.452 -29.479 1.00 0.00 C ATOM 248 CD ARG A 39 -79.981 0.300 -28.405 1.00 0.00 C ATOM 249 NE ARG A 39 -80.379 -0.120 -27.061 1.00 0.00 N ATOM 250 CZ ARG A 39 -79.846 0.356 -25.937 1.00 0.00 C ATOM 251 NH1 ARG A 39 -78.880 1.264 -25.983 1.00 0.00 N ATOM 252 NH2 ARG A 39 -80.292 -0.078 -24.766 1.00 0.00 N ATOM 0 H ARG A 39 -82.414 2.448 -30.167 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.226 2.106 -30.358 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -80.950 -0.560 -31.608 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.353 -0.092 -31.059 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -81.821 -0.344 -29.301 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -80.523 -1.516 -29.411 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -78.912 0.131 -28.538 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -80.151 1.371 -28.517 1.00 0.00 H new ATOM 0 HE ARG A 39 -81.113 -0.824 -26.980 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -78.541 1.602 -26.883 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -78.477 1.624 -25.118 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.039 -0.772 -24.730 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -79.888 0.282 -23.901 1.00 0.00 H new ATOM 266 N SER A 40 -81.299 2.609 -33.169 1.00 0.00 N ATOM 267 CA SER A 40 -81.106 3.138 -34.497 1.00 0.00 C ATOM 268 C SER A 40 -81.792 4.495 -34.557 1.00 0.00 C ATOM 269 O SER A 40 -82.676 4.774 -33.745 1.00 0.00 O ATOM 270 CB SER A 40 -81.706 2.181 -35.535 1.00 0.00 C ATOM 271 OG SER A 40 -81.281 0.849 -35.296 1.00 0.00 O ATOM 0 H SER A 40 -82.235 2.773 -32.798 1.00 0.00 H new ATOM 0 HA SER A 40 -80.044 3.246 -34.720 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.794 2.233 -35.498 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.406 2.489 -36.537 1.00 0.00 H new ATOM 0 HG SER A 40 -81.205 0.372 -36.149 1.00 0.00 H new ATOM 277 N ASN A 41 -81.395 5.341 -35.488 1.00 0.00 N ATOM 278 CA ASN A 41 -81.967 6.681 -35.570 1.00 0.00 C ATOM 279 C ASN A 41 -83.086 6.723 -36.601 1.00 0.00 C ATOM 280 O ASN A 41 -83.483 7.791 -37.074 1.00 0.00 O ATOM 281 CB ASN A 41 -80.883 7.716 -35.889 1.00 0.00 C ATOM 282 CG ASN A 41 -79.937 7.937 -34.720 1.00 0.00 C ATOM 283 OD1 ASN A 41 -79.675 7.028 -33.927 1.00 0.00 O ATOM 284 ND2 ASN A 41 -79.421 9.149 -34.598 1.00 0.00 N ATOM 0 H ASN A 41 -80.688 5.133 -36.193 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.393 6.933 -34.599 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.313 7.387 -36.758 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -81.354 8.662 -36.157 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -78.784 9.357 -33.829 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -79.660 9.876 -35.273 1.00 0.00 H new ATOM 291 N SER A 42 -83.606 5.550 -36.919 1.00 0.00 N ATOM 292 CA SER A 42 -84.707 5.416 -37.851 1.00 0.00 C ATOM 293 C SER A 42 -85.940 4.888 -37.133 1.00 0.00 C ATOM 294 O SER A 42 -85.947 3.768 -36.633 1.00 0.00 O ATOM 295 CB SER A 42 -84.307 4.483 -38.994 1.00 0.00 C ATOM 296 OG SER A 42 -83.118 4.932 -39.626 1.00 0.00 O ATOM 0 H SER A 42 -83.275 4.664 -36.537 1.00 0.00 H new ATOM 0 HA SER A 42 -84.946 6.395 -38.267 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.160 3.474 -38.609 1.00 0.00 H new ATOM 0 HB3 SER A 42 -85.114 4.431 -39.725 1.00 0.00 H new ATOM 0 HG SER A 42 -82.882 4.318 -40.352 1.00 0.00 H new ATOM 302 N LYS A 43 -86.976 5.714 -37.069 1.00 0.00 N ATOM 303 CA LYS A 43 -88.228 5.318 -36.439 1.00 0.00 C ATOM 304 C LYS A 43 -88.863 4.177 -37.215 1.00 0.00 C ATOM 305 O LYS A 43 -89.580 3.350 -36.658 1.00 0.00 O ATOM 306 CB LYS A 43 -89.208 6.493 -36.387 1.00 0.00 C ATOM 307 CG LYS A 43 -88.680 7.717 -35.655 1.00 0.00 C ATOM 308 CD LYS A 43 -89.710 8.839 -35.633 1.00 0.00 C ATOM 309 CE LYS A 43 -90.071 9.302 -37.037 1.00 0.00 C ATOM 310 NZ LYS A 43 -91.079 10.394 -37.019 1.00 0.00 N ATOM 0 H LYS A 43 -86.974 6.662 -37.446 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.006 4.996 -35.422 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -89.469 6.778 -37.406 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -90.127 6.163 -35.903 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.414 7.445 -34.633 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -87.768 8.067 -36.139 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -90.609 8.497 -35.121 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.318 9.681 -35.062 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -89.172 9.646 -37.548 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -90.459 8.459 -37.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -92.006 10.016 -37.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -91.144 10.790 -36.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -90.793 11.141 -37.684 1.00 0.00 H new ATOM 324 N CYS A 44 -88.587 4.141 -38.509 1.00 0.00 N ATOM 325 CA CYS A 44 -89.207 3.171 -39.387 1.00 0.00 C ATOM 326 C CYS A 44 -88.174 2.168 -39.906 1.00 0.00 C ATOM 327 O CYS A 44 -88.413 1.488 -40.898 1.00 0.00 O ATOM 328 CB CYS A 44 -89.896 3.903 -40.544 1.00 0.00 C ATOM 329 SG CYS A 44 -90.543 5.539 -40.077 1.00 0.00 S ATOM 0 H CYS A 44 -87.936 4.775 -38.972 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.955 2.608 -38.829 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.187 4.021 -41.364 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.716 3.289 -40.917 1.00 0.00 H new ATOM 334 N GLN A 45 -87.033 2.069 -39.214 1.00 0.00 N ATOM 335 CA GLN A 45 -86.027 1.040 -39.508 1.00 0.00 C ATOM 336 C GLN A 45 -85.152 0.786 -38.272 1.00 0.00 C ATOM 337 O GLN A 45 -84.545 1.712 -37.739 1.00 0.00 O ATOM 338 CB GLN A 45 -85.152 1.460 -40.695 1.00 0.00 C ATOM 339 CG GLN A 45 -84.059 0.461 -41.029 1.00 0.00 C ATOM 340 CD GLN A 45 -83.114 0.968 -42.097 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.322 0.745 -43.292 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.070 1.662 -41.673 1.00 0.00 N ATOM 0 H GLN A 45 -86.782 2.690 -38.445 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.546 0.118 -39.771 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.785 1.599 -41.571 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.696 2.425 -40.475 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.492 0.233 -40.126 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.514 -0.471 -41.364 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.936 1.823 -40.675 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.399 2.036 -42.344 1.00 0.00 H new ATOM 351 N GLY A 46 -85.073 -0.468 -37.831 1.00 0.00 N ATOM 352 CA GLY A 46 -84.335 -0.775 -36.615 1.00 0.00 C ATOM 353 C GLY A 46 -84.758 -2.093 -35.999 1.00 0.00 C ATOM 354 O GLY A 46 -85.623 -2.784 -36.528 1.00 0.00 O ATOM 0 H GLY A 46 -85.503 -1.271 -38.289 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.269 -0.807 -36.839 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.484 0.026 -35.891 1.00 0.00 H new ATOM 358 N GLN A 47 -84.125 -2.464 -34.896 1.00 0.00 N ATOM 359 CA GLN A 47 -84.529 -3.654 -34.155 1.00 0.00 C ATOM 360 C GLN A 47 -85.775 -3.351 -33.331 1.00 0.00 C ATOM 361 O GLN A 47 -85.888 -2.264 -32.757 1.00 0.00 O ATOM 362 CB GLN A 47 -83.402 -4.132 -33.236 1.00 0.00 C ATOM 363 CG GLN A 47 -82.264 -4.833 -33.963 1.00 0.00 C ATOM 364 CD GLN A 47 -82.713 -6.098 -34.672 1.00 0.00 C ATOM 365 OE1 GLN A 47 -83.675 -6.745 -34.266 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.006 -6.470 -35.724 1.00 0.00 N ATOM 0 H GLN A 47 -83.333 -1.962 -34.494 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.750 -4.447 -34.870 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.000 -3.275 -32.695 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.818 -4.812 -32.492 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.827 -4.149 -34.691 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.480 -5.081 -33.248 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -81.213 -5.906 -36.031 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.253 -7.321 -36.229 1.00 0.00 H new ATOM 375 N LEU A 48 -86.709 -4.297 -33.279 1.00 0.00 N ATOM 376 CA LEU A 48 -87.939 -4.093 -32.527 1.00 0.00 C ATOM 377 C LEU A 48 -87.665 -4.086 -31.038 1.00 0.00 C ATOM 378 O LEU A 48 -87.373 -5.119 -30.434 1.00 0.00 O ATOM 379 CB LEU A 48 -88.999 -5.159 -32.851 1.00 0.00 C ATOM 380 CG LEU A 48 -90.223 -5.180 -31.927 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.989 -3.870 -32.024 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.135 -6.347 -32.275 1.00 0.00 C ATOM 0 H LEU A 48 -86.638 -5.202 -33.744 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.333 -3.122 -32.827 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -89.341 -5.006 -33.874 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.524 -6.140 -32.817 1.00 0.00 H new ATOM 0 HG LEU A 48 -89.874 -5.304 -30.902 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.854 -3.904 -31.361 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.339 -3.046 -31.730 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -91.324 -3.720 -33.050 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.998 -6.346 -31.609 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.473 -6.250 -33.307 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.589 -7.283 -32.159 1.00 0.00 H new ATOM 394 N GLU A 49 -87.752 -2.908 -30.461 1.00 0.00 N ATOM 395 CA GLU A 49 -87.771 -2.769 -29.030 1.00 0.00 C ATOM 396 C GLU A 49 -89.222 -2.594 -28.640 1.00 0.00 C ATOM 397 O GLU A 49 -89.855 -1.586 -28.967 1.00 0.00 O ATOM 398 CB GLU A 49 -86.924 -1.572 -28.592 1.00 0.00 C ATOM 399 CG GLU A 49 -86.859 -1.372 -27.088 1.00 0.00 C ATOM 400 CD GLU A 49 -86.006 -0.182 -26.700 1.00 0.00 C ATOM 401 OE1 GLU A 49 -86.400 0.963 -27.012 1.00 0.00 O ATOM 402 OE2 GLU A 49 -84.938 -0.383 -26.086 1.00 0.00 O ATOM 0 H GLU A 49 -87.811 -2.027 -30.971 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.343 -3.642 -28.538 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -85.911 -1.699 -28.974 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.327 -0.669 -29.050 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -87.868 -1.235 -26.699 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.457 -2.271 -26.622 1.00 0.00 H new ATOM 409 N VAL A 50 -89.765 -3.607 -28.001 1.00 0.00 N ATOM 410 CA VAL A 50 -91.189 -3.667 -27.759 1.00 0.00 C ATOM 411 C VAL A 50 -91.482 -3.627 -26.264 1.00 0.00 C ATOM 412 O VAL A 50 -90.733 -4.184 -25.465 1.00 0.00 O ATOM 413 CB VAL A 50 -91.785 -4.935 -28.404 1.00 0.00 C ATOM 414 CG1 VAL A 50 -91.251 -6.205 -27.758 1.00 0.00 C ATOM 415 CG2 VAL A 50 -93.280 -4.895 -28.377 1.00 0.00 C ATOM 0 H VAL A 50 -89.240 -4.403 -27.639 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.658 -2.796 -28.216 1.00 0.00 H new ATOM 0 HB VAL A 50 -91.467 -4.952 -29.447 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -91.696 -7.074 -28.242 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -90.167 -6.242 -27.870 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.506 -6.209 -26.698 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -93.677 -5.800 -28.837 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -93.624 -4.833 -27.344 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -93.631 -4.023 -28.929 1.00 0.00 H new ATOM 425 N TYR A 51 -92.562 -2.959 -25.889 1.00 0.00 N ATOM 426 CA TYR A 51 -92.880 -2.764 -24.487 1.00 0.00 C ATOM 427 C TYR A 51 -94.008 -3.689 -24.056 1.00 0.00 C ATOM 428 O TYR A 51 -95.174 -3.459 -24.377 1.00 0.00 O ATOM 429 CB TYR A 51 -93.268 -1.304 -24.241 1.00 0.00 C ATOM 430 CG TYR A 51 -93.376 -0.924 -22.779 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.521 -1.473 -21.833 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.327 -0.004 -22.349 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.611 -1.120 -20.501 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.421 0.354 -21.018 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.563 -0.209 -20.098 1.00 0.00 C ATOM 436 OH TYR A 51 -93.657 0.139 -18.769 1.00 0.00 O ATOM 0 H TYR A 51 -93.231 -2.544 -26.537 1.00 0.00 H new ATOM 0 HA TYR A 51 -91.998 -3.004 -23.893 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.530 -0.659 -24.718 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.224 -1.108 -24.727 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.773 -2.188 -22.144 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.002 0.437 -23.067 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.938 -1.556 -19.778 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.163 1.071 -20.700 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.378 0.793 -18.652 1.00 0.00 H new ATOM 446 N LEU A 52 -93.659 -4.742 -23.334 1.00 0.00 N ATOM 447 CA LEU A 52 -94.654 -5.672 -22.827 1.00 0.00 C ATOM 448 C LEU A 52 -94.672 -5.684 -21.315 1.00 0.00 C ATOM 449 O LEU A 52 -93.804 -6.289 -20.682 1.00 0.00 O ATOM 450 CB LEU A 52 -94.420 -7.085 -23.355 1.00 0.00 C ATOM 451 CG LEU A 52 -93.002 -7.648 -23.204 1.00 0.00 C ATOM 452 CD1 LEU A 52 -93.055 -9.148 -22.954 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.183 -7.360 -24.453 1.00 0.00 C ATOM 0 H LEU A 52 -92.697 -4.973 -23.087 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.624 -5.327 -23.185 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.110 -7.758 -22.845 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.682 -7.101 -24.413 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.526 -7.163 -22.351 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -92.042 -9.535 -22.849 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.616 -9.345 -22.040 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.546 -9.640 -23.794 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.179 -7.766 -24.331 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.660 -7.825 -25.316 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -92.123 -6.283 -24.608 1.00 0.00 H new ATOM 465 N LYS A 53 -95.652 -4.979 -20.751 1.00 0.00 N ATOM 466 CA LYS A 53 -95.878 -4.922 -19.303 1.00 0.00 C ATOM 467 C LYS A 53 -94.794 -4.154 -18.562 1.00 0.00 C ATOM 468 O LYS A 53 -95.086 -3.404 -17.628 1.00 0.00 O ATOM 469 CB LYS A 53 -96.016 -6.323 -18.701 1.00 0.00 C ATOM 470 CG LYS A 53 -97.302 -7.034 -19.091 1.00 0.00 C ATOM 471 CD LYS A 53 -97.470 -8.344 -18.335 1.00 0.00 C ATOM 472 CE LYS A 53 -97.444 -8.130 -16.827 1.00 0.00 C ATOM 473 NZ LYS A 53 -98.520 -7.207 -16.369 1.00 0.00 N ATOM 0 H LYS A 53 -96.319 -4.426 -21.289 1.00 0.00 H new ATOM 0 HA LYS A 53 -96.815 -4.380 -19.174 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -95.167 -6.929 -19.016 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -95.968 -6.248 -17.615 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.153 -6.384 -18.888 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -97.299 -7.230 -20.163 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -98.413 -8.811 -18.620 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -96.674 -9.033 -18.619 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -97.554 -9.091 -16.324 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -96.474 -7.727 -16.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -98.550 -7.197 -15.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -98.326 -6.247 -16.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -99.436 -7.532 -16.738 1.00 0.00 H new ATOM 487 N ASP A 54 -93.561 -4.333 -18.982 1.00 0.00 N ATOM 488 CA ASP A 54 -92.420 -3.790 -18.246 1.00 0.00 C ATOM 489 C ASP A 54 -91.151 -3.899 -19.066 1.00 0.00 C ATOM 490 O ASP A 54 -90.268 -3.044 -18.998 1.00 0.00 O ATOM 491 CB ASP A 54 -92.230 -4.542 -16.919 1.00 0.00 C ATOM 492 CG ASP A 54 -91.735 -5.971 -17.107 1.00 0.00 C ATOM 493 OD1 ASP A 54 -92.402 -6.756 -17.814 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.669 -6.317 -16.551 1.00 0.00 O ATOM 0 H ASP A 54 -93.314 -4.848 -19.827 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.624 -2.739 -18.042 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.520 -3.997 -16.298 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.177 -4.560 -16.380 1.00 0.00 H new ATOM 499 N GLY A 55 -91.074 -4.957 -19.844 1.00 0.00 N ATOM 500 CA GLY A 55 -89.878 -5.230 -20.602 1.00 0.00 C ATOM 501 C GLY A 55 -89.858 -4.541 -21.937 1.00 0.00 C ATOM 502 O GLY A 55 -90.581 -4.938 -22.849 1.00 0.00 O ATOM 0 H GLY A 55 -91.823 -5.638 -19.966 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.009 -4.916 -20.024 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.788 -6.306 -20.753 1.00 0.00 H new ATOM 506 N TRP A 56 -89.052 -3.493 -22.047 1.00 0.00 N ATOM 507 CA TRP A 56 -88.676 -2.969 -23.348 1.00 0.00 C ATOM 508 C TRP A 56 -87.706 -3.950 -23.986 1.00 0.00 C ATOM 509 O TRP A 56 -86.491 -3.749 -23.981 1.00 0.00 O ATOM 510 CB TRP A 56 -88.041 -1.576 -23.244 1.00 0.00 C ATOM 511 CG TRP A 56 -89.035 -0.456 -23.283 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.400 0.361 -22.251 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.790 -0.023 -24.423 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.336 1.272 -22.681 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.591 1.055 -24.010 1.00 0.00 C ATOM 516 CE3 TRP A 56 -89.866 -0.447 -25.751 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.457 1.716 -24.879 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.725 0.208 -26.612 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.509 1.277 -26.175 1.00 0.00 C ATOM 0 H TRP A 56 -88.649 -2.993 -21.254 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.570 -2.858 -23.961 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.473 -1.514 -22.316 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.331 -1.448 -24.061 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.011 0.300 -21.245 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.770 1.993 -22.104 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.264 -1.273 -26.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.064 2.543 -24.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -90.791 -0.113 -27.641 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.170 1.768 -26.874 1.00 0.00 H new ATOM 530 N HIS A 57 -88.256 -5.041 -24.484 1.00 0.00 N ATOM 531 CA HIS A 57 -87.455 -6.149 -24.961 1.00 0.00 C ATOM 532 C HIS A 57 -87.052 -5.936 -26.409 1.00 0.00 C ATOM 533 O HIS A 57 -87.907 -5.759 -27.276 1.00 0.00 O ATOM 534 CB HIS A 57 -88.220 -7.474 -24.820 1.00 0.00 C ATOM 535 CG HIS A 57 -88.337 -7.963 -23.406 1.00 0.00 C ATOM 536 ND1 HIS A 57 -87.251 -8.298 -22.622 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.428 -8.161 -22.631 1.00 0.00 C ATOM 538 CE1 HIS A 57 -87.676 -8.679 -21.428 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.994 -8.605 -21.409 1.00 0.00 N ATOM 0 H HIS A 57 -89.263 -5.183 -24.568 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.554 -6.198 -24.350 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.220 -7.350 -25.235 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -87.719 -8.236 -25.417 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -90.455 -7.999 -22.922 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -87.050 -8.997 -20.607 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -89.591 -8.840 -20.616 1.00 0.00 H new ATOM 548 N MET A 58 -85.755 -5.936 -26.664 1.00 0.00 N ATOM 549 CA MET A 58 -85.260 -5.875 -28.029 1.00 0.00 C ATOM 550 C MET A 58 -85.311 -7.260 -28.639 1.00 0.00 C ATOM 551 O MET A 58 -84.462 -8.098 -28.362 1.00 0.00 O ATOM 552 CB MET A 58 -83.826 -5.350 -28.086 1.00 0.00 C ATOM 553 CG MET A 58 -83.690 -3.871 -27.781 1.00 0.00 C ATOM 554 SD MET A 58 -81.976 -3.312 -27.890 1.00 0.00 S ATOM 555 CE MET A 58 -81.549 -3.845 -29.548 1.00 0.00 C ATOM 0 H MET A 58 -85.029 -5.977 -25.949 1.00 0.00 H new ATOM 0 HA MET A 58 -85.893 -5.187 -28.589 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.217 -5.912 -27.378 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.420 -5.543 -29.079 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.303 -3.299 -28.478 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.074 -3.670 -26.781 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.555 -3.478 -29.804 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.556 -4.934 -29.593 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.276 -3.447 -30.256 1.00 0.00 H new ATOM 565 N VAL A 59 -86.318 -7.511 -29.441 1.00 0.00 N ATOM 566 CA VAL A 59 -86.479 -8.823 -30.032 1.00 0.00 C ATOM 567 C VAL A 59 -85.656 -8.911 -31.304 1.00 0.00 C ATOM 568 O VAL A 59 -85.324 -7.889 -31.903 1.00 0.00 O ATOM 569 CB VAL A 59 -87.957 -9.128 -30.348 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.840 -8.718 -29.182 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.394 -8.437 -31.629 1.00 0.00 C ATOM 0 H VAL A 59 -87.034 -6.832 -29.699 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.132 -9.562 -29.310 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.061 -10.202 -30.499 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.881 -8.939 -29.419 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.545 -9.271 -28.290 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.728 -7.649 -28.999 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.440 -8.669 -31.829 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.276 -7.359 -31.520 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.780 -8.787 -32.459 1.00 0.00 H new ATOM 581 N CYS A 60 -85.320 -10.119 -31.715 1.00 0.00 N ATOM 582 CA CYS A 60 -84.552 -10.292 -32.931 1.00 0.00 C ATOM 583 C CYS A 60 -85.436 -10.655 -34.115 1.00 0.00 C ATOM 584 O CYS A 60 -84.988 -11.319 -35.051 1.00 0.00 O ATOM 585 CB CYS A 60 -83.443 -11.317 -32.740 1.00 0.00 C ATOM 586 SG CYS A 60 -83.795 -12.691 -31.638 1.00 0.00 S ATOM 0 H CYS A 60 -85.563 -10.984 -31.232 1.00 0.00 H new ATOM 0 HA CYS A 60 -84.088 -9.332 -33.157 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.183 -11.723 -33.718 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.561 -10.798 -32.365 1.00 0.00 H new ATOM 591 N SER A 61 -86.690 -10.198 -34.057 1.00 0.00 N ATOM 592 CA SER A 61 -87.630 -10.263 -35.182 1.00 0.00 C ATOM 593 C SER A 61 -88.118 -11.687 -35.481 1.00 0.00 C ATOM 594 O SER A 61 -89.320 -11.920 -35.585 1.00 0.00 O ATOM 595 CB SER A 61 -86.997 -9.636 -36.424 1.00 0.00 C ATOM 596 OG SER A 61 -86.538 -8.324 -36.141 1.00 0.00 O ATOM 0 H SER A 61 -87.086 -9.768 -33.221 1.00 0.00 H new ATOM 0 HA SER A 61 -88.514 -9.695 -34.893 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.166 -10.252 -36.766 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.725 -9.606 -37.234 1.00 0.00 H new ATOM 0 HG SER A 61 -85.565 -8.335 -36.028 1.00 0.00 H new ATOM 602 N GLN A 62 -87.194 -12.636 -35.602 1.00 0.00 N ATOM 603 CA GLN A 62 -87.541 -14.016 -35.944 1.00 0.00 C ATOM 604 C GLN A 62 -88.146 -14.756 -34.757 1.00 0.00 C ATOM 605 O GLN A 62 -88.473 -15.940 -34.843 1.00 0.00 O ATOM 606 CB GLN A 62 -86.310 -14.768 -36.475 1.00 0.00 C ATOM 607 CG GLN A 62 -85.062 -14.712 -35.588 1.00 0.00 C ATOM 608 CD GLN A 62 -85.227 -15.380 -34.230 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.571 -14.729 -33.244 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.983 -16.678 -34.168 1.00 0.00 N ATOM 0 H GLN A 62 -86.196 -12.476 -35.468 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.296 -13.979 -36.730 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.582 -15.813 -36.622 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.055 -14.364 -37.455 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.235 -15.187 -36.115 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.786 -13.669 -35.435 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.700 -17.184 -35.007 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.078 -17.173 -33.281 1.00 0.00 H new ATOM 619 N SER A 63 -88.282 -14.047 -33.651 1.00 0.00 N ATOM 620 CA SER A 63 -88.786 -14.624 -32.426 1.00 0.00 C ATOM 621 C SER A 63 -90.259 -15.000 -32.580 1.00 0.00 C ATOM 622 O SER A 63 -90.923 -14.538 -33.512 1.00 0.00 O ATOM 623 CB SER A 63 -88.597 -13.620 -31.294 1.00 0.00 C ATOM 624 OG SER A 63 -87.239 -13.226 -31.193 1.00 0.00 O ATOM 0 H SER A 63 -88.046 -13.057 -33.580 1.00 0.00 H new ATOM 0 HA SER A 63 -88.235 -15.535 -32.194 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.222 -12.745 -31.470 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.924 -14.061 -30.352 1.00 0.00 H new ATOM 0 HG SER A 63 -86.699 -13.749 -31.822 1.00 0.00 H new ATOM 630 N TRP A 64 -90.749 -15.835 -31.663 1.00 0.00 N ATOM 631 CA TRP A 64 -92.138 -16.307 -31.664 1.00 0.00 C ATOM 632 C TRP A 64 -92.374 -17.354 -32.750 1.00 0.00 C ATOM 633 O TRP A 64 -92.811 -18.467 -32.462 1.00 0.00 O ATOM 634 CB TRP A 64 -93.130 -15.145 -31.806 1.00 0.00 C ATOM 635 CG TRP A 64 -93.190 -14.266 -30.597 1.00 0.00 C ATOM 636 CD1 TRP A 64 -93.911 -14.496 -29.466 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.502 -13.026 -30.390 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.713 -13.481 -28.566 1.00 0.00 N ATOM 639 CE2 TRP A 64 -92.851 -12.567 -29.108 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.619 -12.262 -31.158 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.353 -11.380 -28.580 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.123 -11.084 -30.632 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.490 -10.655 -29.349 1.00 0.00 C ATOM 0 H TRP A 64 -90.192 -16.206 -30.893 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.313 -16.780 -30.698 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.852 -14.543 -32.671 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.124 -15.547 -32.004 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.547 -15.353 -29.301 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.139 -13.417 -27.642 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.329 -12.587 -32.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.640 -11.044 -27.595 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.442 -10.485 -31.219 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.082 -9.733 -28.962 1.00 0.00 H new ATOM 654 N GLY A 65 -92.081 -16.998 -33.991 1.00 0.00 N ATOM 655 CA GLY A 65 -92.243 -17.930 -35.085 1.00 0.00 C ATOM 656 C GLY A 65 -90.984 -18.730 -35.354 1.00 0.00 C ATOM 657 O GLY A 65 -90.648 -19.651 -34.606 1.00 0.00 O ATOM 0 H GLY A 65 -91.733 -16.078 -34.260 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -93.062 -18.612 -34.859 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -92.522 -17.384 -35.986 1.00 0.00 H new ATOM 661 N ARG A 66 -90.286 -18.381 -36.425 1.00 0.00 N ATOM 662 CA ARG A 66 -89.079 -19.096 -36.824 1.00 0.00 C ATOM 663 C ARG A 66 -88.036 -18.113 -37.328 1.00 0.00 C ATOM 664 O ARG A 66 -88.373 -16.995 -37.720 1.00 0.00 O ATOM 665 CB ARG A 66 -89.387 -20.105 -37.933 1.00 0.00 C ATOM 666 CG ARG A 66 -90.420 -21.151 -37.557 1.00 0.00 C ATOM 667 CD ARG A 66 -90.750 -22.041 -38.738 1.00 0.00 C ATOM 668 NE ARG A 66 -91.847 -22.958 -38.443 1.00 0.00 N ATOM 669 CZ ARG A 66 -93.013 -22.946 -39.087 1.00 0.00 C ATOM 670 NH1 ARG A 66 -93.237 -22.054 -40.047 1.00 0.00 N ATOM 671 NH2 ARG A 66 -93.961 -23.814 -38.762 1.00 0.00 N ATOM 0 H ARG A 66 -90.535 -17.604 -37.037 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.698 -19.628 -35.952 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.738 -19.565 -38.812 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -88.463 -20.609 -38.216 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -90.044 -21.758 -36.734 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -91.327 -20.660 -37.203 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -91.016 -21.422 -39.595 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -89.866 -22.613 -39.019 1.00 0.00 H new ATOM 0 HE ARG A 66 -91.713 -23.646 -37.702 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -92.515 -21.376 -40.292 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -94.131 -22.047 -40.538 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -93.798 -24.492 -38.018 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -94.853 -23.803 -39.256 1.00 0.00 H new ATOM 685 N SER A 67 -86.779 -18.534 -37.325 1.00 0.00 N ATOM 686 CA SER A 67 -85.706 -17.726 -37.879 1.00 0.00 C ATOM 687 C SER A 67 -85.898 -17.591 -39.383 1.00 0.00 C ATOM 688 O SER A 67 -85.661 -18.533 -40.143 1.00 0.00 O ATOM 689 CB SER A 67 -84.353 -18.355 -37.550 1.00 0.00 C ATOM 690 OG SER A 67 -84.228 -18.547 -36.151 1.00 0.00 O ATOM 0 H SER A 67 -86.479 -19.431 -36.944 1.00 0.00 H new ATOM 0 HA SER A 67 -85.730 -16.730 -37.436 1.00 0.00 H new ATOM 0 HB2 SER A 67 -84.253 -19.310 -38.066 1.00 0.00 H new ATOM 0 HB3 SER A 67 -83.549 -17.713 -37.909 1.00 0.00 H new ATOM 0 HG SER A 67 -83.380 -18.164 -35.843 1.00 0.00 H new ATOM 696 N SER A 68 -86.368 -16.429 -39.800 1.00 0.00 N ATOM 697 CA SER A 68 -86.732 -16.206 -41.182 1.00 0.00 C ATOM 698 C SER A 68 -85.712 -15.314 -41.879 1.00 0.00 C ATOM 699 O SER A 68 -85.216 -14.349 -41.298 1.00 0.00 O ATOM 700 CB SER A 68 -88.121 -15.565 -41.241 1.00 0.00 C ATOM 701 OG SER A 68 -88.604 -15.503 -42.569 1.00 0.00 O ATOM 0 H SER A 68 -86.506 -15.621 -39.193 1.00 0.00 H new ATOM 0 HA SER A 68 -86.748 -17.165 -41.700 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.815 -16.139 -40.626 1.00 0.00 H new ATOM 0 HB3 SER A 68 -88.078 -14.560 -40.820 1.00 0.00 H new ATOM 0 HG SER A 68 -88.675 -16.410 -42.934 1.00 0.00 H new ATOM 707 N LYS A 69 -85.383 -15.662 -43.112 1.00 0.00 N ATOM 708 CA LYS A 69 -84.564 -14.811 -43.955 1.00 0.00 C ATOM 709 C LYS A 69 -85.419 -14.285 -45.093 1.00 0.00 C ATOM 710 O LYS A 69 -86.114 -15.060 -45.756 1.00 0.00 O ATOM 711 CB LYS A 69 -83.351 -15.570 -44.502 1.00 0.00 C ATOM 712 CG LYS A 69 -82.540 -14.769 -45.514 1.00 0.00 C ATOM 713 CD LYS A 69 -81.301 -15.524 -45.966 1.00 0.00 C ATOM 714 CE LYS A 69 -80.664 -14.881 -47.190 1.00 0.00 C ATOM 715 NZ LYS A 69 -80.219 -13.484 -46.937 1.00 0.00 N ATOM 0 H LYS A 69 -85.674 -16.535 -43.553 1.00 0.00 H new ATOM 0 HA LYS A 69 -84.184 -13.980 -43.361 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -82.704 -15.853 -43.671 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -83.691 -16.494 -44.970 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -83.162 -14.540 -46.379 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -82.245 -13.817 -45.072 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -80.576 -15.554 -45.152 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -81.567 -16.556 -46.194 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -79.809 -15.479 -47.506 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -81.379 -14.887 -48.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -79.733 -13.117 -47.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -81.046 -12.889 -46.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -79.567 -13.469 -46.127 1.00 0.00 H new ATOM 729 N GLN A 70 -85.360 -12.974 -45.305 1.00 0.00 N ATOM 730 CA GLN A 70 -86.207 -12.290 -46.280 1.00 0.00 C ATOM 731 C GLN A 70 -87.656 -12.255 -45.787 1.00 0.00 C ATOM 732 O GLN A 70 -87.917 -12.431 -44.597 1.00 0.00 O ATOM 733 CB GLN A 70 -86.110 -12.938 -47.669 1.00 0.00 C ATOM 734 CG GLN A 70 -84.726 -12.848 -48.285 1.00 0.00 C ATOM 735 CD GLN A 70 -84.676 -13.392 -49.699 1.00 0.00 C ATOM 736 OE1 GLN A 70 -83.895 -12.922 -50.525 1.00 0.00 O ATOM 737 NE2 GLN A 70 -85.504 -14.386 -49.989 1.00 0.00 N ATOM 0 H GLN A 70 -84.723 -12.354 -44.805 1.00 0.00 H new ATOM 0 HA GLN A 70 -85.848 -11.266 -46.380 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -86.397 -13.987 -47.593 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -86.827 -12.459 -48.335 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -84.402 -11.807 -48.289 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -84.020 -13.399 -47.663 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -86.137 -14.748 -49.275 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -85.508 -14.789 -50.926 1.00 0.00 H new ATOM 746 N TRP A 71 -88.592 -12.027 -46.693 1.00 0.00 N ATOM 747 CA TRP A 71 -89.971 -11.788 -46.309 1.00 0.00 C ATOM 748 C TRP A 71 -90.832 -13.036 -46.471 1.00 0.00 C ATOM 749 O TRP A 71 -91.279 -13.349 -47.575 1.00 0.00 O ATOM 750 CB TRP A 71 -90.555 -10.647 -47.150 1.00 0.00 C ATOM 751 CG TRP A 71 -89.704 -9.412 -47.160 1.00 0.00 C ATOM 752 CD1 TRP A 71 -89.818 -8.328 -46.338 1.00 0.00 C ATOM 753 CD2 TRP A 71 -88.603 -9.137 -48.036 1.00 0.00 C ATOM 754 NE1 TRP A 71 -88.858 -7.396 -46.652 1.00 0.00 N ATOM 755 CE2 TRP A 71 -88.099 -7.871 -47.690 1.00 0.00 C ATOM 756 CE3 TRP A 71 -87.993 -9.842 -49.079 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -87.016 -7.294 -48.350 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -86.919 -9.269 -49.734 1.00 0.00 C ATOM 759 CH2 TRP A 71 -86.439 -8.007 -49.366 1.00 0.00 C ATOM 0 H TRP A 71 -88.421 -12.003 -47.698 1.00 0.00 H new ATOM 0 HA TRP A 71 -89.976 -11.514 -45.254 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.689 -10.994 -48.175 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.544 -10.394 -46.767 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -90.555 -8.219 -45.556 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -88.731 -6.497 -46.188 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -88.355 -10.818 -49.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -86.645 -6.319 -48.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -86.443 -9.804 -50.543 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -85.596 -7.587 -49.895 1.00 0.00 H new ATOM 770 N GLU A 72 -91.039 -13.765 -45.380 1.00 0.00 N ATOM 771 CA GLU A 72 -92.045 -14.820 -45.365 1.00 0.00 C ATOM 772 C GLU A 72 -93.400 -14.213 -45.046 1.00 0.00 C ATOM 773 O GLU A 72 -94.376 -14.444 -45.759 1.00 0.00 O ATOM 774 CB GLU A 72 -91.706 -15.920 -44.357 1.00 0.00 C ATOM 775 CG GLU A 72 -90.545 -16.800 -44.787 1.00 0.00 C ATOM 776 CD GLU A 72 -90.350 -18.003 -43.888 1.00 0.00 C ATOM 777 OE1 GLU A 72 -91.023 -19.035 -44.110 1.00 0.00 O ATOM 778 OE2 GLU A 72 -89.522 -17.929 -42.964 1.00 0.00 O ATOM 0 H GLU A 72 -90.530 -13.647 -44.504 1.00 0.00 H new ATOM 0 HA GLU A 72 -92.067 -15.284 -46.351 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -91.468 -15.461 -43.397 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -92.586 -16.544 -44.202 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -90.713 -17.140 -45.809 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -89.630 -16.207 -44.795 1.00 0.00 H new ATOM 785 N ASP A 73 -93.444 -13.437 -43.968 1.00 0.00 N ATOM 786 CA ASP A 73 -94.619 -12.640 -43.632 1.00 0.00 C ATOM 787 C ASP A 73 -94.192 -11.411 -42.836 1.00 0.00 C ATOM 788 O ASP A 73 -93.925 -11.496 -41.642 1.00 0.00 O ATOM 789 CB ASP A 73 -95.644 -13.447 -42.831 1.00 0.00 C ATOM 790 CG ASP A 73 -96.975 -12.722 -42.728 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.035 -11.653 -42.079 1.00 0.00 O ATOM 792 OD2 ASP A 73 -97.967 -13.212 -43.312 1.00 0.00 O ATOM 0 H ASP A 73 -92.673 -13.343 -43.307 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.094 -12.334 -44.564 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -95.794 -14.417 -43.305 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.255 -13.638 -41.831 1.00 0.00 H new ATOM 797 N PRO A 74 -94.073 -10.264 -43.511 1.00 0.00 N ATOM 798 CA PRO A 74 -93.635 -9.014 -42.903 1.00 0.00 C ATOM 799 C PRO A 74 -94.792 -8.090 -42.502 1.00 0.00 C ATOM 800 O PRO A 74 -94.659 -6.865 -42.551 1.00 0.00 O ATOM 801 CB PRO A 74 -92.859 -8.411 -44.053 1.00 0.00 C ATOM 802 CG PRO A 74 -93.728 -8.716 -45.210 1.00 0.00 C ATOM 803 CD PRO A 74 -94.313 -10.083 -44.949 1.00 0.00 C ATOM 0 HA PRO A 74 -93.085 -9.159 -41.973 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.711 -7.339 -43.926 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.871 -8.859 -44.157 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.515 -7.969 -45.313 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -93.157 -8.708 -46.138 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.375 -10.123 -45.191 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.822 -10.854 -45.542 1.00 0.00 H new ATOM 811 N SER A 75 -95.925 -8.667 -42.114 1.00 0.00 N ATOM 812 CA SER A 75 -97.099 -7.869 -41.785 1.00 0.00 C ATOM 813 C SER A 75 -97.495 -8.028 -40.310 1.00 0.00 C ATOM 814 O SER A 75 -96.631 -8.128 -39.438 1.00 0.00 O ATOM 815 CB SER A 75 -98.259 -8.242 -42.718 1.00 0.00 C ATOM 816 OG SER A 75 -98.554 -9.631 -42.676 1.00 0.00 O ATOM 0 H SER A 75 -96.054 -9.674 -42.021 1.00 0.00 H new ATOM 0 HA SER A 75 -96.854 -6.817 -41.934 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.146 -7.675 -42.437 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.008 -7.956 -43.739 1.00 0.00 H new ATOM 0 HG SER A 75 -97.906 -10.086 -42.098 1.00 0.00 H new ATOM 822 N GLN A 76 -98.809 -8.012 -40.052 1.00 0.00 N ATOM 823 CA GLN A 76 -99.387 -8.158 -38.713 1.00 0.00 C ATOM 824 C GLN A 76 -99.213 -6.909 -37.840 1.00 0.00 C ATOM 825 O GLN A 76 -100.185 -6.410 -37.272 1.00 0.00 O ATOM 826 CB GLN A 76 -98.825 -9.387 -38.005 1.00 0.00 C ATOM 827 CG GLN A 76 -99.239 -10.705 -38.643 1.00 0.00 C ATOM 828 CD GLN A 76 -100.743 -10.930 -38.620 1.00 0.00 C ATOM 829 OE1 GLN A 76 -101.298 -11.573 -39.507 1.00 0.00 O ATOM 830 NE2 GLN A 76 -101.415 -10.407 -37.603 1.00 0.00 N ATOM 0 H GLN A 76 -99.511 -7.895 -40.782 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.459 -8.291 -38.859 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.737 -9.324 -37.996 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -99.153 -9.378 -36.966 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.889 -10.728 -39.675 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -98.746 -11.525 -38.121 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.922 -9.878 -36.884 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -102.425 -10.533 -37.540 1.00 0.00 H new ATOM 839 N ALA A 77 -97.993 -6.396 -37.739 1.00 0.00 N ATOM 840 CA ALA A 77 -97.700 -5.253 -36.869 1.00 0.00 C ATOM 841 C ALA A 77 -98.074 -3.924 -37.531 1.00 0.00 C ATOM 842 O ALA A 77 -97.501 -2.872 -37.216 1.00 0.00 O ATOM 843 CB ALA A 77 -96.230 -5.257 -36.491 1.00 0.00 C ATOM 0 H ALA A 77 -97.185 -6.752 -38.249 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.307 -5.352 -35.969 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -96.018 -4.405 -35.844 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.992 -6.181 -35.964 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.622 -5.188 -37.393 1.00 0.00 H new ATOM 849 N SER A 78 -99.047 -3.975 -38.430 1.00 0.00 N ATOM 850 CA SER A 78 -99.486 -2.802 -39.173 1.00 0.00 C ATOM 851 C SER A 78 -99.959 -1.700 -38.228 1.00 0.00 C ATOM 852 O SER A 78 -99.664 -0.524 -38.431 1.00 0.00 O ATOM 853 CB SER A 78 -100.613 -3.199 -40.120 1.00 0.00 C ATOM 854 OG SER A 78 -100.308 -4.414 -40.785 1.00 0.00 O ATOM 0 H SER A 78 -99.553 -4.829 -38.665 1.00 0.00 H new ATOM 0 HA SER A 78 -98.643 -2.414 -39.746 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.542 -3.309 -39.561 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.774 -2.408 -40.853 1.00 0.00 H new ATOM 0 HG SER A 78 -100.669 -5.167 -40.272 1.00 0.00 H new ATOM 860 N LYS A 79 -100.668 -2.098 -37.178 1.00 0.00 N ATOM 861 CA LYS A 79 -101.222 -1.152 -36.216 1.00 0.00 C ATOM 862 C LYS A 79 -100.102 -0.426 -35.467 1.00 0.00 C ATOM 863 O LYS A 79 -100.264 0.714 -35.034 1.00 0.00 O ATOM 864 CB LYS A 79 -102.123 -1.892 -35.221 1.00 0.00 C ATOM 865 CG LYS A 79 -103.136 -1.004 -34.517 1.00 0.00 C ATOM 866 CD LYS A 79 -104.140 -0.418 -35.501 1.00 0.00 C ATOM 867 CE LYS A 79 -105.287 0.283 -34.791 1.00 0.00 C ATOM 868 NZ LYS A 79 -104.854 1.521 -34.091 1.00 0.00 N ATOM 0 H LYS A 79 -100.874 -3.075 -36.970 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.812 -0.412 -36.756 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.655 -2.683 -35.749 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.497 -2.375 -34.471 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.663 -1.582 -33.758 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.617 -0.197 -34.000 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.634 0.289 -36.158 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -104.536 -1.213 -36.133 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -106.061 0.532 -35.517 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -105.735 -0.400 -34.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.673 1.960 -33.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -104.135 1.283 -33.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.451 2.187 -34.781 1.00 0.00 H new ATOM 882 N VAL A 80 -98.960 -1.095 -35.342 1.00 0.00 N ATOM 883 CA VAL A 80 -97.820 -0.549 -34.621 1.00 0.00 C ATOM 884 C VAL A 80 -97.149 0.573 -35.408 1.00 0.00 C ATOM 885 O VAL A 80 -97.083 1.711 -34.948 1.00 0.00 O ATOM 886 CB VAL A 80 -96.779 -1.645 -34.305 1.00 0.00 C ATOM 887 CG1 VAL A 80 -95.547 -1.048 -33.648 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.390 -2.715 -33.415 1.00 0.00 C ATOM 0 H VAL A 80 -98.801 -2.023 -35.735 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.203 -0.143 -33.685 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.473 -2.106 -35.244 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -94.829 -1.840 -33.435 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -95.094 -0.318 -34.319 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -95.833 -0.557 -32.718 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -96.644 -3.480 -33.201 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -97.725 -2.264 -32.481 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -98.240 -3.169 -33.924 1.00 0.00 H new ATOM 898 N CYS A 81 -96.669 0.268 -36.601 1.00 0.00 N ATOM 899 CA CYS A 81 -95.947 1.267 -37.382 1.00 0.00 C ATOM 900 C CYS A 81 -96.884 2.374 -37.857 1.00 0.00 C ATOM 901 O CYS A 81 -96.450 3.497 -38.104 1.00 0.00 O ATOM 902 CB CYS A 81 -95.211 0.618 -38.553 1.00 0.00 C ATOM 903 SG CYS A 81 -93.996 -0.624 -38.018 1.00 0.00 S ATOM 0 H CYS A 81 -96.761 -0.645 -37.047 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.199 1.725 -36.735 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.937 0.148 -39.217 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.704 1.391 -39.131 1.00 0.00 H new ATOM 908 N GLN A 82 -98.175 2.069 -37.949 1.00 0.00 N ATOM 909 CA GLN A 82 -99.163 3.079 -38.310 1.00 0.00 C ATOM 910 C GLN A 82 -99.276 4.123 -37.205 1.00 0.00 C ATOM 911 O GLN A 82 -99.359 5.319 -37.480 1.00 0.00 O ATOM 912 CB GLN A 82 -100.524 2.442 -38.582 1.00 0.00 C ATOM 913 CG GLN A 82 -101.591 3.449 -38.982 1.00 0.00 C ATOM 914 CD GLN A 82 -102.882 2.797 -39.434 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.607 3.350 -40.259 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.177 1.622 -38.900 1.00 0.00 N ATOM 0 H GLN A 82 -98.559 1.139 -37.780 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.831 3.569 -39.226 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.419 1.701 -39.374 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.853 1.910 -37.690 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.799 4.105 -38.137 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.207 4.077 -39.786 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.547 1.199 -38.219 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.034 1.140 -39.170 1.00 0.00 H new ATOM 925 N ARG A 83 -99.256 3.669 -35.953 1.00 0.00 N ATOM 926 CA ARG A 83 -99.292 4.586 -34.817 1.00 0.00 C ATOM 927 C ARG A 83 -97.915 5.221 -34.629 1.00 0.00 C ATOM 928 O ARG A 83 -97.754 6.185 -33.882 1.00 0.00 O ATOM 929 CB ARG A 83 -99.733 3.863 -33.533 1.00 0.00 C ATOM 930 CG ARG A 83 -98.637 3.041 -32.871 1.00 0.00 C ATOM 931 CD ARG A 83 -99.160 2.254 -31.678 1.00 0.00 C ATOM 932 NE ARG A 83 -99.796 3.116 -30.679 1.00 0.00 N ATOM 933 CZ ARG A 83 -100.164 2.709 -29.464 1.00 0.00 C ATOM 934 NH1 ARG A 83 -99.896 1.473 -29.063 1.00 0.00 N ATOM 935 NH2 ARG A 83 -100.779 3.550 -28.641 1.00 0.00 N ATOM 0 H ARG A 83 -99.215 2.681 -35.702 1.00 0.00 H new ATOM 0 HA ARG A 83 -100.024 5.367 -35.023 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.097 4.603 -32.820 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -100.571 3.207 -33.769 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -98.209 2.353 -33.600 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -97.834 3.702 -32.546 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -99.878 1.510 -32.023 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -98.336 1.711 -31.215 1.00 0.00 H new ATOM 0 HE ARG A 83 -99.968 4.090 -30.929 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.406 0.830 -29.685 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -100.179 1.166 -28.133 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -100.970 4.507 -28.938 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -101.061 3.239 -27.711 1.00 0.00 H new ATOM 949 N LEU A 84 -96.928 4.663 -35.320 1.00 0.00 N ATOM 950 CA LEU A 84 -95.569 5.182 -35.296 1.00 0.00 C ATOM 951 C LEU A 84 -95.339 6.093 -36.504 1.00 0.00 C ATOM 952 O LEU A 84 -94.206 6.454 -36.814 1.00 0.00 O ATOM 953 CB LEU A 84 -94.582 4.021 -35.300 1.00 0.00 C ATOM 954 CG LEU A 84 -93.141 4.390 -34.953 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.083 5.198 -33.664 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.327 3.131 -34.807 1.00 0.00 C ATOM 0 H LEU A 84 -97.048 3.840 -35.911 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.417 5.768 -34.390 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.928 3.269 -34.591 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -94.594 3.559 -36.287 1.00 0.00 H new ATOM 0 HG LEU A 84 -92.732 5.003 -35.756 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.047 5.449 -33.438 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.660 6.115 -33.783 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -93.500 4.610 -32.847 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -91.298 3.390 -34.559 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.748 2.516 -34.012 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -92.346 2.575 -35.744 1.00 0.00 H new ATOM 968 N ASN A 85 -96.446 6.448 -37.173 1.00 0.00 N ATOM 969 CA ASN A 85 -96.454 7.297 -38.381 1.00 0.00 C ATOM 970 C ASN A 85 -95.441 6.845 -39.435 1.00 0.00 C ATOM 971 O ASN A 85 -94.995 7.636 -40.266 1.00 0.00 O ATOM 972 CB ASN A 85 -96.281 8.800 -38.059 1.00 0.00 C ATOM 973 CG ASN A 85 -95.003 9.162 -37.319 1.00 0.00 C ATOM 974 OD1 ASN A 85 -93.946 9.359 -37.922 1.00 0.00 O ATOM 975 ND2 ASN A 85 -95.104 9.305 -36.006 1.00 0.00 N ATOM 0 H ASN A 85 -97.379 6.150 -36.887 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.447 7.168 -38.811 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.312 9.361 -38.993 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.132 9.127 -37.462 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.290 9.587 -35.460 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.996 9.133 -35.541 1.00 0.00 H new ATOM 982 N CYS A 86 -95.125 5.558 -39.431 1.00 0.00 N ATOM 983 CA CYS A 86 -94.249 4.982 -40.443 1.00 0.00 C ATOM 984 C CYS A 86 -95.063 4.164 -41.438 1.00 0.00 C ATOM 985 O CYS A 86 -94.522 3.594 -42.384 1.00 0.00 O ATOM 986 CB CYS A 86 -93.158 4.126 -39.792 1.00 0.00 C ATOM 987 SG CYS A 86 -92.010 5.086 -38.767 1.00 0.00 S ATOM 0 H CYS A 86 -95.463 4.891 -38.737 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.759 5.792 -40.983 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.627 3.357 -39.178 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.596 3.612 -40.571 1.00 0.00 H new ATOM 992 N GLY A 87 -96.373 4.114 -41.208 1.00 0.00 N ATOM 993 CA GLY A 87 -97.274 3.474 -42.145 1.00 0.00 C ATOM 994 C GLY A 87 -97.473 1.999 -41.869 1.00 0.00 C ATOM 995 O GLY A 87 -97.918 1.610 -40.792 1.00 0.00 O ATOM 0 H GLY A 87 -96.826 4.509 -40.384 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -98.240 3.977 -42.111 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.885 3.599 -43.156 1.00 0.00 H new ATOM 999 N ASP A 88 -97.127 1.180 -42.843 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.313 -0.260 -42.746 1.00 0.00 C ATOM 1001 C ASP A 88 -96.199 -0.863 -41.898 1.00 0.00 C ATOM 1002 O ASP A 88 -95.233 -0.172 -41.578 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.354 -0.860 -44.155 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.657 -0.548 -44.854 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.820 0.589 -45.345 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.536 -1.429 -44.902 1.00 0.00 O ATOM 0 H ASP A 88 -96.711 1.489 -43.721 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.259 -0.490 -42.257 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.523 -0.469 -44.742 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.222 -1.940 -44.095 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.306 -2.137 -41.487 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.374 -2.699 -40.528 1.00 0.00 C ATOM 1013 C PRO A 89 -94.004 -2.968 -41.074 1.00 0.00 C ATOM 1014 O PRO A 89 -93.808 -3.266 -42.255 1.00 0.00 O ATOM 1015 CB PRO A 89 -96.000 -4.006 -40.107 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.847 -4.407 -41.256 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.321 -3.128 -41.901 1.00 0.00 C ATOM 0 HA PRO A 89 -95.218 -1.985 -39.719 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.240 -4.758 -39.894 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.593 -3.887 -39.201 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.281 -5.012 -41.964 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.691 -5.011 -40.924 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.373 -3.221 -42.986 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.317 -2.850 -41.557 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.070 -2.790 -40.176 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.721 -3.228 -40.316 1.00 0.00 C ATOM 1027 C LEU A 90 -91.627 -4.567 -41.005 1.00 0.00 C ATOM 1028 O LEU A 90 -92.100 -5.589 -40.521 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.007 -3.239 -38.955 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.888 -3.092 -37.691 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.065 -4.043 -37.675 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.065 -3.301 -36.441 1.00 0.00 C ATOM 0 H LEU A 90 -93.245 -2.314 -39.291 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.209 -2.512 -40.959 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.452 -4.173 -38.873 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.275 -2.432 -38.952 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.284 -2.077 -37.716 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.643 -3.891 -36.764 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.698 -3.854 -38.542 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.703 -5.071 -37.707 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.703 -3.194 -35.563 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.631 -4.301 -36.454 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.267 -2.560 -36.403 1.00 0.00 H new ATOM 1044 N SER A 91 -91.057 -4.505 -42.179 1.00 0.00 N ATOM 1045 CA SER A 91 -90.757 -5.684 -42.961 1.00 0.00 C ATOM 1046 C SER A 91 -89.540 -6.399 -42.384 1.00 0.00 C ATOM 1047 O SER A 91 -88.705 -5.783 -41.720 1.00 0.00 O ATOM 1048 CB SER A 91 -90.511 -5.288 -44.413 1.00 0.00 C ATOM 1049 OG SER A 91 -91.640 -4.619 -44.952 1.00 0.00 O ATOM 0 H SER A 91 -90.784 -3.630 -42.627 1.00 0.00 H new ATOM 0 HA SER A 91 -91.605 -6.368 -42.924 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.636 -4.641 -44.475 1.00 0.00 H new ATOM 0 HB3 SER A 91 -90.293 -6.177 -45.005 1.00 0.00 H new ATOM 0 HG SER A 91 -91.403 -3.691 -45.158 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.447 -7.691 -42.645 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.410 -8.521 -42.054 1.00 0.00 C ATOM 1057 C LEU A 92 -87.155 -8.571 -42.918 1.00 0.00 C ATOM 1058 O LEU A 92 -87.225 -8.758 -44.132 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.957 -9.928 -41.815 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.820 -10.072 -40.565 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.575 -11.382 -40.598 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.955 -9.997 -39.316 1.00 0.00 C ATOM 0 H LEU A 92 -90.082 -8.192 -43.267 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.121 -8.075 -41.102 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.545 -10.227 -42.683 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.119 -10.622 -41.744 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.539 -9.253 -40.542 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -91.187 -11.472 -39.700 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.217 -11.410 -41.479 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.867 -12.209 -40.639 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.583 -10.101 -38.431 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.219 -10.800 -39.335 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.442 -9.036 -39.286 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.012 -8.380 -42.273 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.734 -8.450 -42.953 1.00 0.00 C ATOM 1076 C GLY A 93 -83.586 -8.191 -41.997 1.00 0.00 C ATOM 1077 O GLY A 93 -83.667 -7.271 -41.184 1.00 0.00 O ATOM 0 H GLY A 93 -85.948 -8.175 -41.276 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.616 -9.433 -43.409 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.709 -7.719 -43.761 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.502 -8.981 -42.065 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.375 -8.868 -41.130 1.00 0.00 C ATOM 1083 C PRO A 94 -80.772 -7.465 -41.119 1.00 0.00 C ATOM 1084 O PRO A 94 -80.469 -6.892 -42.169 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.364 -9.907 -41.640 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.782 -10.200 -43.040 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.274 -10.032 -43.066 1.00 0.00 C ATOM 0 HA PRO A 94 -81.681 -9.046 -40.099 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.347 -9.517 -41.606 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.381 -10.808 -41.027 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.300 -9.520 -43.742 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.497 -11.212 -43.329 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.630 -9.735 -44.052 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.790 -10.957 -42.806 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.607 -6.922 -39.922 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.184 -5.541 -39.748 1.00 0.00 C ATOM 1097 C PHE A 95 -78.742 -5.497 -39.243 1.00 0.00 C ATOM 1098 O PHE A 95 -78.238 -6.489 -38.722 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.140 -4.849 -38.767 1.00 0.00 C ATOM 1100 CG PHE A 95 -81.027 -3.350 -38.735 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -81.463 -2.588 -39.803 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.506 -2.705 -37.628 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -81.377 -1.211 -39.771 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.413 -1.327 -37.591 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.852 -0.578 -38.664 1.00 0.00 C ATOM 0 H PHE A 95 -80.762 -7.424 -39.048 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.217 -5.014 -40.702 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.164 -5.118 -39.027 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.954 -5.236 -37.765 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.876 -3.076 -40.673 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.168 -3.285 -36.782 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -81.721 -0.629 -40.613 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -79.997 -0.836 -36.723 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.785 0.500 -38.637 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.078 -4.354 -39.396 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.666 -4.230 -39.027 1.00 0.00 C ATOM 1117 C LEU A 96 -76.488 -3.962 -37.531 1.00 0.00 C ATOM 1118 O LEU A 96 -75.379 -3.688 -37.073 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.970 -3.123 -39.838 1.00 0.00 C ATOM 1120 CG LEU A 96 -76.474 -1.692 -39.605 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -75.408 -0.685 -40.013 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -77.750 -1.432 -40.388 1.00 0.00 C ATOM 0 H LEU A 96 -78.492 -3.501 -39.772 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.199 -5.187 -39.262 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -74.904 -3.152 -39.612 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -76.078 -3.356 -40.897 1.00 0.00 H new ATOM 0 HG LEU A 96 -76.689 -1.579 -38.542 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -75.778 0.326 -39.843 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -74.508 -0.847 -39.419 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -75.173 -0.812 -41.070 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -78.087 -0.411 -40.206 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -77.557 -1.566 -41.452 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -78.522 -2.131 -40.068 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.569 -4.049 -36.771 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.493 -3.856 -35.329 1.00 0.00 C ATOM 1136 C LYS A 97 -77.205 -5.185 -34.639 1.00 0.00 C ATOM 1137 O LYS A 97 -77.900 -6.177 -34.867 1.00 0.00 O ATOM 1138 CB LYS A 97 -78.790 -3.234 -34.796 1.00 0.00 C ATOM 1139 CG LYS A 97 -78.780 -2.956 -33.298 1.00 0.00 C ATOM 1140 CD LYS A 97 -77.600 -2.086 -32.881 1.00 0.00 C ATOM 1141 CE LYS A 97 -77.559 -0.772 -33.646 1.00 0.00 C ATOM 1142 NZ LYS A 97 -76.444 0.097 -33.189 1.00 0.00 N ATOM 0 H LYS A 97 -78.504 -4.251 -37.125 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.677 -3.167 -35.110 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -78.976 -2.300 -35.326 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -79.621 -3.902 -35.025 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -79.710 -2.463 -33.016 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -78.742 -3.901 -32.755 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.661 -1.881 -31.812 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.671 -2.631 -33.048 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -77.449 -0.975 -34.711 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -78.505 -0.247 -33.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -76.449 0.983 -33.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -76.563 0.311 -32.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -75.539 -0.394 -33.335 1.00 0.00 H new ATOM 1156 N THR A 98 -76.168 -5.194 -33.813 1.00 0.00 N ATOM 1157 CA THR A 98 -75.728 -6.401 -33.135 1.00 0.00 C ATOM 1158 C THR A 98 -76.755 -6.890 -32.119 1.00 0.00 C ATOM 1159 O THR A 98 -77.261 -6.119 -31.302 1.00 0.00 O ATOM 1160 CB THR A 98 -74.382 -6.162 -32.422 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.428 -5.632 -33.354 1.00 0.00 O ATOM 1162 CG2 THR A 98 -73.845 -7.454 -31.818 1.00 0.00 C ATOM 0 H THR A 98 -75.611 -4.367 -33.596 1.00 0.00 H new ATOM 0 HA THR A 98 -75.609 -7.169 -33.899 1.00 0.00 H new ATOM 0 HB THR A 98 -74.545 -5.448 -31.615 1.00 0.00 H new ATOM 0 HG1 THR A 98 -72.574 -5.480 -32.897 1.00 0.00 H new ATOM 0 HG21 THR A 98 -72.895 -7.256 -31.322 1.00 0.00 H new ATOM 0 HG22 THR A 98 -74.560 -7.841 -31.092 1.00 0.00 H new ATOM 0 HG23 THR A 98 -73.695 -8.190 -32.608 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.060 -8.177 -32.193 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.928 -8.819 -31.225 1.00 0.00 C ATOM 1172 C TYR A 99 -77.111 -9.218 -29.993 1.00 0.00 C ATOM 1173 O TYR A 99 -75.919 -9.508 -30.096 1.00 0.00 O ATOM 1174 CB TYR A 99 -78.607 -10.043 -31.861 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.407 -10.876 -30.887 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -80.709 -10.533 -30.542 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -78.847 -12.000 -30.300 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -81.427 -11.292 -29.636 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.556 -12.758 -29.396 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.843 -12.402 -29.066 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.551 -13.160 -28.161 1.00 0.00 O ATOM 0 H TYR A 99 -76.714 -8.800 -32.922 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.708 -8.125 -30.912 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.266 -9.706 -32.661 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -77.844 -10.672 -32.320 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -81.166 -9.662 -30.988 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -77.838 -12.286 -30.556 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -82.439 -11.016 -29.377 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.103 -13.630 -28.947 1.00 0.00 H new ATOM 0 HH TYR A 99 -81.288 -12.912 -27.250 1.00 0.00 H new ATOM 1191 N THR A 100 -77.751 -9.232 -28.836 1.00 0.00 N ATOM 1192 CA THR A 100 -77.068 -9.517 -27.590 1.00 0.00 C ATOM 1193 C THR A 100 -78.025 -10.244 -26.645 1.00 0.00 C ATOM 1194 O THR A 100 -79.206 -9.914 -26.586 1.00 0.00 O ATOM 1195 CB THR A 100 -76.528 -8.215 -26.938 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.804 -8.510 -25.735 1.00 0.00 O ATOM 1197 CG2 THR A 100 -77.652 -7.235 -26.626 1.00 0.00 C ATOM 0 H THR A 100 -78.749 -9.048 -28.736 1.00 0.00 H new ATOM 0 HA THR A 100 -76.210 -10.158 -27.794 1.00 0.00 H new ATOM 0 HB THR A 100 -75.856 -7.751 -27.660 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.471 -7.677 -25.341 1.00 0.00 H new ATOM 0 HG21 THR A 100 -77.235 -6.336 -26.171 1.00 0.00 H new ATOM 0 HG22 THR A 100 -78.169 -6.969 -27.548 1.00 0.00 H new ATOM 0 HG23 THR A 100 -78.357 -7.698 -25.936 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.533 -11.242 -25.898 1.00 0.00 N ATOM 1206 CA PRO A 101 -78.374 -12.093 -25.048 1.00 0.00 C ATOM 1207 C PRO A 101 -78.788 -11.418 -23.745 1.00 0.00 C ATOM 1208 O PRO A 101 -79.184 -12.080 -22.783 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.474 -13.295 -24.769 1.00 0.00 C ATOM 1210 CG PRO A 101 -76.087 -12.754 -24.826 1.00 0.00 C ATOM 1211 CD PRO A 101 -76.111 -11.612 -25.811 1.00 0.00 C ATOM 0 HA PRO A 101 -79.318 -12.342 -25.533 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -77.688 -13.732 -23.794 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.623 -14.081 -25.510 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -75.764 -12.411 -23.843 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -75.383 -13.524 -25.142 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.502 -10.776 -25.467 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.718 -11.914 -26.782 1.00 0.00 H new ATOM 1219 N GLN A 102 -78.725 -10.103 -23.732 1.00 0.00 N ATOM 1220 CA GLN A 102 -79.055 -9.335 -22.545 1.00 0.00 C ATOM 1221 C GLN A 102 -80.104 -8.281 -22.871 1.00 0.00 C ATOM 1222 O GLN A 102 -81.263 -8.402 -22.476 1.00 0.00 O ATOM 1223 CB GLN A 102 -77.801 -8.674 -21.969 1.00 0.00 C ATOM 1224 CG GLN A 102 -78.013 -8.015 -20.612 1.00 0.00 C ATOM 1225 CD GLN A 102 -78.166 -9.008 -19.467 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -77.801 -8.714 -18.328 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -78.694 -10.189 -19.751 1.00 0.00 N ATOM 0 H GLN A 102 -78.447 -9.539 -24.535 1.00 0.00 H new ATOM 0 HA GLN A 102 -79.463 -10.015 -21.797 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -77.017 -9.425 -21.877 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -77.443 -7.923 -22.673 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -77.169 -7.358 -20.401 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -78.903 -7.387 -20.658 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -78.986 -10.401 -20.705 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -78.808 -10.887 -19.016 1.00 0.00 H new ATOM 1236 N SER A 103 -79.691 -7.253 -23.600 1.00 0.00 N ATOM 1237 CA SER A 103 -80.598 -6.189 -23.999 1.00 0.00 C ATOM 1238 C SER A 103 -81.602 -6.712 -25.017 1.00 0.00 C ATOM 1239 O SER A 103 -82.727 -6.210 -25.122 1.00 0.00 O ATOM 1240 CB SER A 103 -79.800 -5.031 -24.591 1.00 0.00 C ATOM 1241 OG SER A 103 -78.640 -4.776 -23.816 1.00 0.00 O ATOM 0 H SER A 103 -78.732 -7.135 -23.927 1.00 0.00 H new ATOM 0 HA SER A 103 -81.143 -5.835 -23.124 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.514 -5.266 -25.616 1.00 0.00 H new ATOM 0 HB3 SER A 103 -80.422 -4.136 -24.630 1.00 0.00 H new ATOM 0 HG SER A 103 -78.140 -4.032 -24.211 1.00 0.00 H new ATOM 1247 N SER A 104 -81.192 -7.733 -25.760 1.00 0.00 N ATOM 1248 CA SER A 104 -82.043 -8.334 -26.763 1.00 0.00 C ATOM 1249 C SER A 104 -82.417 -9.754 -26.348 1.00 0.00 C ATOM 1250 O SER A 104 -81.756 -10.352 -25.497 1.00 0.00 O ATOM 1251 CB SER A 104 -81.328 -8.330 -28.112 1.00 0.00 C ATOM 1252 OG SER A 104 -80.823 -7.039 -28.412 1.00 0.00 O ATOM 0 H SER A 104 -80.269 -8.159 -25.681 1.00 0.00 H new ATOM 0 HA SER A 104 -82.961 -7.754 -26.856 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.510 -9.051 -28.097 1.00 0.00 H new ATOM 0 HB3 SER A 104 -82.017 -8.646 -28.895 1.00 0.00 H new ATOM 0 HG SER A 104 -80.367 -7.059 -29.279 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.482 -10.282 -26.936 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.975 -11.605 -26.579 1.00 0.00 C ATOM 1260 C ILE A 105 -84.597 -12.325 -27.776 1.00 0.00 C ATOM 1261 O ILE A 105 -84.994 -11.701 -28.762 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.008 -11.540 -25.419 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -85.910 -10.304 -25.523 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.302 -11.551 -24.072 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -86.809 -10.281 -26.738 1.00 0.00 C ATOM 0 H ILE A 105 -84.022 -9.813 -27.664 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.107 -12.173 -26.245 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.640 -12.424 -25.503 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.529 -10.246 -24.628 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.283 -9.413 -25.535 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.042 -11.505 -23.273 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.719 -12.467 -23.974 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.638 -10.689 -24.002 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.410 -9.372 -26.729 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.200 -10.304 -27.642 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.466 -11.151 -26.721 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.656 -13.646 -27.681 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.360 -14.469 -28.657 1.00 0.00 C ATOM 1279 C ILE A 106 -86.652 -14.967 -28.015 1.00 0.00 C ATOM 1280 O ILE A 106 -86.610 -15.890 -27.205 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.559 -15.730 -29.051 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.224 -15.366 -29.667 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.359 -16.581 -30.030 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.296 -16.548 -29.848 1.00 0.00 C ATOM 0 H ILE A 106 -84.219 -14.177 -26.928 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.524 -13.856 -29.543 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.373 -16.301 -28.141 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.396 -14.899 -30.637 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.734 -14.623 -29.038 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -84.782 -17.466 -30.299 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.296 -16.886 -29.565 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.572 -16.000 -30.928 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.360 -16.211 -30.294 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.093 -17.003 -28.879 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -82.766 -17.283 -30.502 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.786 -14.379 -28.324 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.019 -14.850 -27.710 1.00 0.00 C ATOM 1298 C CYS A 107 -89.576 -16.052 -28.475 1.00 0.00 C ATOM 1299 O CYS A 107 -89.113 -16.367 -29.572 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.074 -13.747 -27.625 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.514 -12.181 -26.903 1.00 0.00 S ATOM 0 H CYS A 107 -87.887 -13.599 -28.974 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.776 -15.155 -26.692 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.449 -13.550 -28.629 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -90.914 -14.117 -27.038 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.561 -16.726 -27.889 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.171 -17.896 -28.515 1.00 0.00 C ATOM 1308 C TYR A 108 -92.673 -17.913 -28.279 1.00 0.00 C ATOM 1309 O TYR A 108 -93.217 -17.019 -27.638 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.543 -19.190 -27.989 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.239 -19.547 -28.664 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -89.231 -20.041 -29.962 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.022 -19.385 -28.014 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -88.048 -20.367 -30.594 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.832 -19.710 -28.641 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.852 -20.201 -29.930 1.00 0.00 C ATOM 1317 OH TYR A 108 -85.673 -20.524 -30.562 1.00 0.00 O ATOM 0 H TYR A 108 -90.955 -16.482 -26.980 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.986 -17.832 -29.587 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.373 -19.092 -26.917 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -91.249 -20.009 -28.126 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -90.166 -20.172 -30.486 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.004 -19.000 -27.005 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -88.060 -20.750 -31.604 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.893 -19.580 -28.124 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.920 -20.348 -29.960 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.338 -18.931 -28.803 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.778 -19.016 -28.680 1.00 0.00 C ATOM 1329 C GLY A 109 -95.465 -18.837 -30.012 1.00 0.00 C ATOM 1330 O GLY A 109 -95.111 -19.487 -31.000 1.00 0.00 O ATOM 0 H GLY A 109 -92.905 -19.701 -29.312 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -95.050 -19.983 -28.257 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.129 -18.254 -27.984 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.452 -17.967 -30.034 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.152 -17.629 -31.263 1.00 0.00 C ATOM 1336 C GLN A 110 -96.658 -16.288 -31.778 1.00 0.00 C ATOM 1337 O GLN A 110 -96.444 -15.365 -30.991 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.658 -17.558 -31.026 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.256 -18.834 -30.460 1.00 0.00 C ATOM 1340 CD GLN A 110 -100.744 -18.711 -30.191 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -101.483 -19.691 -30.276 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -101.196 -17.510 -29.857 1.00 0.00 N ATOM 0 H GLN A 110 -96.793 -17.475 -29.208 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.951 -18.406 -32.001 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.869 -16.736 -30.342 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.153 -17.324 -31.969 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -99.083 -19.653 -31.158 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.743 -19.092 -29.533 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -100.552 -16.721 -29.797 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -102.188 -17.375 -29.660 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.477 -16.177 -33.086 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.015 -14.934 -33.687 1.00 0.00 C ATOM 1353 C LEU A 111 -97.049 -13.833 -33.480 1.00 0.00 C ATOM 1354 O LEU A 111 -98.071 -13.785 -34.164 1.00 0.00 O ATOM 1355 CB LEU A 111 -95.739 -15.123 -35.179 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.182 -13.892 -35.899 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -93.821 -13.519 -35.337 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.096 -14.141 -37.395 1.00 0.00 C ATOM 0 H LEU A 111 -96.643 -16.932 -33.751 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.085 -14.643 -33.199 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.034 -15.945 -35.301 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.666 -15.422 -35.669 1.00 0.00 H new ATOM 0 HG LEU A 111 -95.863 -13.057 -35.732 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -93.439 -12.642 -35.860 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -93.915 -13.296 -34.274 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.131 -14.351 -35.473 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -94.698 -13.255 -37.889 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.438 -14.989 -37.585 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.090 -14.358 -37.785 1.00 0.00 H new ATOM 1370 N GLY A 112 -96.785 -12.963 -32.523 1.00 0.00 N ATOM 1371 CA GLY A 112 -97.727 -11.925 -32.197 1.00 0.00 C ATOM 1372 C GLY A 112 -98.105 -11.954 -30.736 1.00 0.00 C ATOM 1373 O GLY A 112 -98.483 -10.933 -30.174 1.00 0.00 O ATOM 0 H GLY A 112 -95.931 -12.959 -31.965 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -97.298 -10.954 -32.443 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -98.623 -12.041 -32.807 1.00 0.00 H new ATOM 1377 N SER A 113 -97.985 -13.119 -30.115 1.00 0.00 N ATOM 1378 CA SER A 113 -98.324 -13.271 -28.709 1.00 0.00 C ATOM 1379 C SER A 113 -97.101 -12.997 -27.833 1.00 0.00 C ATOM 1380 O SER A 113 -96.344 -13.906 -27.487 1.00 0.00 O ATOM 1381 CB SER A 113 -98.870 -14.677 -28.451 1.00 0.00 C ATOM 1382 OG SER A 113 -99.912 -14.990 -29.365 1.00 0.00 O ATOM 0 H SER A 113 -97.655 -13.973 -30.564 1.00 0.00 H new ATOM 0 HA SER A 113 -99.096 -12.546 -28.452 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.066 -15.407 -28.545 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.244 -14.745 -27.429 1.00 0.00 H new ATOM 0 HG SER A 113 -100.768 -15.020 -28.888 1.00 0.00 H new ATOM 1388 N PHE A 114 -96.934 -11.737 -27.468 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.758 -11.262 -26.745 1.00 0.00 C ATOM 1390 C PHE A 114 -95.868 -11.538 -25.248 1.00 0.00 C ATOM 1391 O PHE A 114 -95.545 -10.685 -24.426 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.580 -9.757 -26.982 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.069 -9.402 -28.352 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -95.565 -10.024 -29.487 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.073 -8.454 -28.500 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.080 -9.706 -30.739 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.583 -8.132 -29.749 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.087 -8.760 -30.870 1.00 0.00 C ATOM 0 H PHE A 114 -97.616 -11.005 -27.666 1.00 0.00 H new ATOM 0 HA PHE A 114 -94.890 -11.803 -27.122 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.537 -9.261 -26.824 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -94.890 -9.363 -26.236 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.342 -10.768 -29.390 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.674 -7.959 -27.627 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -95.478 -10.198 -31.614 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -92.806 -7.389 -29.849 1.00 0.00 H new ATOM 0 HZ PHE A 114 -93.704 -8.510 -31.848 1.00 0.00 H new ATOM 1408 N SER A 115 -96.310 -12.734 -24.895 1.00 0.00 N ATOM 1409 CA SER A 115 -96.419 -13.118 -23.495 1.00 0.00 C ATOM 1410 C SER A 115 -95.423 -14.223 -23.160 1.00 0.00 C ATOM 1411 O SER A 115 -95.402 -14.739 -22.042 1.00 0.00 O ATOM 1412 CB SER A 115 -97.841 -13.575 -23.178 1.00 0.00 C ATOM 1413 OG SER A 115 -98.774 -12.547 -23.452 1.00 0.00 O ATOM 0 H SER A 115 -96.599 -13.455 -25.556 1.00 0.00 H new ATOM 0 HA SER A 115 -96.186 -12.247 -22.883 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.083 -14.459 -23.768 1.00 0.00 H new ATOM 0 HB3 SER A 115 -97.909 -13.864 -22.129 1.00 0.00 H new ATOM 0 HG SER A 115 -99.678 -12.862 -23.243 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.598 -14.578 -24.133 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.591 -15.614 -23.946 1.00 0.00 C ATOM 1421 C ASN A 116 -92.301 -15.200 -24.640 1.00 0.00 C ATOM 1422 O ASN A 116 -92.307 -14.884 -25.828 1.00 0.00 O ATOM 1423 CB ASN A 116 -94.085 -16.955 -24.514 1.00 0.00 C ATOM 1424 CG ASN A 116 -93.172 -18.130 -24.178 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.966 -17.977 -23.979 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -93.746 -19.323 -24.126 1.00 0.00 N ATOM 0 H ASN A 116 -94.606 -14.162 -25.064 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.406 -15.738 -22.879 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -95.084 -17.159 -24.128 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.173 -16.872 -25.597 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -93.186 -20.150 -23.916 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -94.748 -19.415 -24.296 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.205 -15.191 -23.897 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.911 -14.842 -24.458 1.00 0.00 C ATOM 1435 C CYS A 117 -88.811 -15.730 -23.882 1.00 0.00 C ATOM 1436 O CYS A 117 -89.022 -16.436 -22.897 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.570 -13.373 -24.197 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.517 -12.160 -25.153 1.00 0.00 S ATOM 0 H CYS A 117 -91.187 -15.422 -22.904 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.972 -15.001 -25.535 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.719 -13.168 -23.137 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.510 -13.223 -24.404 1.00 0.00 H new ATOM 1443 N SER A 118 -87.641 -15.691 -24.508 1.00 0.00 N ATOM 1444 CA SER A 118 -86.482 -16.445 -24.050 1.00 0.00 C ATOM 1445 C SER A 118 -85.213 -15.649 -24.342 1.00 0.00 C ATOM 1446 O SER A 118 -85.282 -14.565 -24.920 1.00 0.00 O ATOM 1447 CB SER A 118 -86.427 -17.807 -24.750 1.00 0.00 C ATOM 1448 OG SER A 118 -87.633 -18.526 -24.559 1.00 0.00 O ATOM 0 H SER A 118 -87.470 -15.136 -25.347 1.00 0.00 H new ATOM 0 HA SER A 118 -86.562 -16.613 -22.976 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.249 -17.665 -25.816 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.589 -18.386 -24.361 1.00 0.00 H new ATOM 0 HG SER A 118 -87.574 -19.391 -25.016 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.065 -16.164 -23.936 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.800 -15.497 -24.220 1.00 0.00 C ATOM 1456 C HIS A 119 -82.046 -16.223 -25.327 1.00 0.00 C ATOM 1457 O HIS A 119 -82.471 -17.286 -25.778 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.939 -15.385 -22.956 1.00 0.00 C ATOM 1459 CG HIS A 119 -82.345 -14.253 -22.060 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.525 -13.180 -21.782 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -83.497 -14.024 -21.385 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -82.155 -12.345 -20.978 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -83.355 -12.831 -20.723 1.00 0.00 N ATOM 0 H HIS A 119 -83.980 -17.035 -23.412 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.022 -14.486 -24.563 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -82.000 -16.320 -22.399 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.896 -15.254 -23.245 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.579 -13.052 -22.142 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -84.367 -14.663 -21.371 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -81.755 -11.419 -20.593 1.00 0.00 H new ATOM 1472 N SER A 120 -80.940 -15.636 -25.767 1.00 0.00 N ATOM 1473 CA SER A 120 -80.152 -16.187 -26.861 1.00 0.00 C ATOM 1474 C SER A 120 -79.465 -17.488 -26.441 1.00 0.00 C ATOM 1475 O SER A 120 -78.398 -17.469 -25.827 1.00 0.00 O ATOM 1476 CB SER A 120 -79.118 -15.156 -27.322 1.00 0.00 C ATOM 1477 OG SER A 120 -78.385 -15.621 -28.441 1.00 0.00 O ATOM 0 H SER A 120 -80.566 -14.770 -25.378 1.00 0.00 H new ATOM 0 HA SER A 120 -80.820 -16.418 -27.691 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.621 -14.223 -27.577 1.00 0.00 H new ATOM 0 HB3 SER A 120 -78.433 -14.935 -26.503 1.00 0.00 H new ATOM 0 HG SER A 120 -77.633 -15.017 -28.613 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.099 -18.612 -26.743 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.555 -19.914 -26.382 1.00 0.00 C ATOM 1485 C ARG A 121 -79.304 -20.785 -27.611 1.00 0.00 C ATOM 1486 O ARG A 121 -78.160 -21.034 -27.986 1.00 0.00 O ATOM 1487 CB ARG A 121 -80.508 -20.646 -25.433 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.076 -22.078 -25.132 1.00 0.00 C ATOM 1489 CD ARG A 121 -81.206 -22.896 -24.531 1.00 0.00 C ATOM 1490 NE ARG A 121 -81.524 -22.500 -23.162 1.00 0.00 N ATOM 1491 CZ ARG A 121 -82.426 -23.125 -22.406 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -83.158 -24.107 -22.921 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -82.614 -22.743 -21.150 1.00 0.00 N ATOM 0 H ARG A 121 -80.991 -18.649 -27.237 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.601 -19.737 -25.885 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -80.577 -20.090 -24.498 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -81.506 -20.659 -25.870 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -79.732 -22.554 -26.050 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -79.231 -22.065 -24.444 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -82.096 -22.789 -25.151 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -80.932 -23.951 -24.545 1.00 0.00 H new ATOM 0 HE ARG A 121 -81.029 -21.702 -22.763 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -83.029 -24.382 -23.895 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -83.849 -24.586 -22.343 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -82.069 -21.972 -20.764 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -83.304 -23.220 -20.570 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.529 -15.813 -32.917 1.00 0.00 N ATOM 1551 CA CYS A 125 -80.994 -15.064 -34.079 1.00 0.00 C ATOM 1552 C CYS A 125 -79.900 -14.253 -34.756 1.00 0.00 C ATOM 1553 O CYS A 125 -79.151 -13.513 -34.114 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.148 -14.170 -33.651 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.072 -13.710 -31.900 1.00 0.00 S ATOM 0 HA CYS A 125 -81.325 -15.783 -34.828 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.145 -13.266 -34.259 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.090 -14.683 -33.846 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.844 -14.393 -36.075 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.791 -13.800 -36.891 1.00 0.00 C ATOM 1562 C HIS A 126 -79.086 -12.328 -37.166 1.00 0.00 C ATOM 1563 O HIS A 126 -79.167 -11.904 -38.318 1.00 0.00 O ATOM 1564 CB HIS A 126 -78.664 -14.567 -38.215 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.634 -16.057 -38.037 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -77.501 -16.754 -37.690 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -79.626 -16.976 -38.123 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.795 -18.036 -37.569 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -79.080 -18.198 -37.826 1.00 0.00 N ATOM 0 H HIS A 126 -80.531 -14.923 -36.611 1.00 0.00 H new ATOM 0 HA HIS A 126 -77.850 -13.866 -36.345 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.500 -14.302 -38.862 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -77.754 -14.250 -38.725 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -80.657 -16.782 -38.379 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -77.101 -18.820 -37.304 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -79.583 -19.085 -37.807 1.00 0.00 H new ATOM 1578 N SER A 127 -79.261 -11.568 -36.087 1.00 0.00 N ATOM 1579 CA SER A 127 -79.528 -10.127 -36.145 1.00 0.00 C ATOM 1580 C SER A 127 -80.641 -9.772 -37.137 1.00 0.00 C ATOM 1581 O SER A 127 -80.590 -8.729 -37.792 1.00 0.00 O ATOM 1582 CB SER A 127 -78.239 -9.350 -36.466 1.00 0.00 C ATOM 1583 OG SER A 127 -77.594 -9.844 -37.632 1.00 0.00 O ATOM 0 H SER A 127 -79.222 -11.936 -35.137 1.00 0.00 H new ATOM 0 HA SER A 127 -79.883 -9.830 -35.158 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.477 -8.295 -36.603 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.556 -9.416 -35.619 1.00 0.00 H new ATOM 0 HG SER A 127 -78.231 -10.370 -38.160 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.656 -10.630 -37.234 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.817 -10.341 -38.069 1.00 0.00 C ATOM 1591 C LEU A 128 -83.485 -9.069 -37.575 1.00 0.00 C ATOM 1592 O LEU A 128 -83.620 -8.867 -36.370 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.831 -11.497 -38.068 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.395 -12.786 -38.774 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -82.797 -12.484 -40.139 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.418 -13.576 -37.921 1.00 0.00 C ATOM 0 H LEU A 128 -81.696 -11.525 -36.747 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.471 -10.212 -39.094 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.072 -11.739 -37.033 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.751 -11.145 -38.536 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.284 -13.400 -38.921 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -82.496 -13.415 -40.618 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -83.539 -11.981 -40.758 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -81.926 -11.839 -40.020 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.127 -14.485 -38.448 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.533 -12.970 -37.726 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.892 -13.841 -36.976 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.885 -8.211 -38.493 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.402 -6.923 -38.107 1.00 0.00 C ATOM 1610 C GLY A 129 -85.726 -6.617 -38.760 1.00 0.00 C ATOM 1611 O GLY A 129 -86.202 -7.375 -39.609 1.00 0.00 O ATOM 0 H GLY A 129 -83.861 -8.383 -39.498 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.518 -6.891 -37.024 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.681 -6.150 -38.374 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.305 -5.502 -38.368 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.581 -5.061 -38.888 1.00 0.00 C ATOM 1617 C LEU A 130 -87.443 -3.628 -39.408 1.00 0.00 C ATOM 1618 O LEU A 130 -86.503 -2.921 -39.042 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.633 -5.137 -37.782 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.232 -6.525 -37.536 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.896 -6.590 -36.168 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.242 -6.864 -38.627 1.00 0.00 C ATOM 0 H LEU A 130 -85.901 -4.872 -37.675 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.895 -5.704 -39.710 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.185 -4.784 -36.853 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.442 -4.449 -38.027 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.425 -7.257 -37.562 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.315 -7.584 -36.014 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.156 -6.384 -35.394 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.693 -5.848 -36.115 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.661 -7.853 -38.441 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -91.043 -6.125 -38.624 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.746 -6.857 -39.597 1.00 0.00 H new ATOM 1634 N THR A 131 -88.345 -3.204 -40.276 1.00 0.00 N ATOM 1635 CA THR A 131 -88.290 -1.851 -40.807 1.00 0.00 C ATOM 1636 C THR A 131 -89.661 -1.401 -41.324 1.00 0.00 C ATOM 1637 O THR A 131 -90.139 -1.872 -42.358 1.00 0.00 O ATOM 1638 CB THR A 131 -87.195 -1.776 -41.886 1.00 0.00 C ATOM 1639 OG1 THR A 131 -86.999 -0.434 -42.335 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.480 -2.680 -43.076 1.00 0.00 C ATOM 0 H THR A 131 -89.118 -3.770 -40.626 1.00 0.00 H new ATOM 0 HA THR A 131 -88.029 -1.155 -40.010 1.00 0.00 H new ATOM 0 HB THR A 131 -86.281 -2.132 -41.411 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.493 -0.293 -43.169 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.675 -2.586 -43.805 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.546 -3.715 -42.739 1.00 0.00 H new ATOM 0 HG23 THR A 131 -88.423 -2.388 -43.537 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.311 -0.519 -40.550 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.730 -0.182 -40.742 1.00 0.00 C ATOM 1650 C CYS A 132 -92.047 0.187 -42.176 1.00 0.00 C ATOM 1651 O CYS A 132 -91.640 1.239 -42.676 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.163 0.931 -39.792 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.249 0.398 -38.060 1.00 0.00 S ATOM 0 H CYS A 132 -89.870 -0.021 -39.777 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.300 -1.081 -40.508 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.464 1.763 -39.875 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.140 1.303 -40.100 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.766 -0.728 -42.812 1.00 0.00 N ATOM 1659 CA LEU A 133 -93.230 -0.608 -44.177 1.00 0.00 C ATOM 1660 C LEU A 133 -92.091 -0.787 -45.179 1.00 0.00 C ATOM 1661 O LEU A 133 -92.065 -1.752 -45.940 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.952 0.729 -44.405 1.00 0.00 C ATOM 1663 CG LEU A 133 -94.225 1.106 -45.866 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -95.137 0.085 -46.530 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.834 2.497 -45.941 1.00 0.00 C ATOM 0 H LEU A 133 -93.049 -1.603 -42.371 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.946 -1.413 -44.344 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.904 0.700 -43.874 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.358 1.522 -43.951 1.00 0.00 H new ATOM 0 HG LEU A 133 -93.277 1.108 -46.405 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -95.315 0.375 -47.565 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -94.664 -0.897 -46.505 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -96.086 0.044 -45.996 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -95.024 2.755 -46.983 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.772 2.514 -45.386 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.143 3.220 -45.508 1.00 0.00 H new ATOM 1677 N GLU A 134 -91.157 0.144 -45.171 1.00 0.00 N ATOM 1678 CA GLU A 134 -90.028 0.101 -46.085 1.00 0.00 C ATOM 1679 C GLU A 134 -88.722 0.036 -45.307 1.00 0.00 C ATOM 1680 O GLU A 134 -88.670 0.453 -44.147 1.00 0.00 O ATOM 1681 CB GLU A 134 -90.029 1.325 -46.998 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.918 2.643 -46.249 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.750 3.823 -47.179 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -88.670 3.948 -47.796 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -90.691 4.634 -47.297 1.00 0.00 O ATOM 0 H GLU A 134 -91.157 0.944 -44.539 1.00 0.00 H new ATOM 0 HA GLU A 134 -90.120 -0.794 -46.701 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -89.199 1.245 -47.700 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.946 1.328 -47.587 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.811 2.788 -45.640 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -89.070 2.599 -45.566 1.00 0.00 H new