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= -1.2 K(o=-1.1,f=-0.013) USER MOD Set 1.2: A 113 SER OG : rot -140:sc= 0.0884 USER MOD Set 2.1: A 58 MET CE :methyl 174:sc= -3.51! (180deg=-3.31!) USER MOD Set 2.2: A 104 SER OG : rot 180:sc= -0.798 USER MOD Set 3.1: A 43 LYS NZ :NH3+ 173:sc= 1.2 (180deg=0) USER MOD Set 3.2: A 85 ASN : amide:sc= 0.175 K(o=1.4,f=-9.8!) USER MOD Set 4.1: A 62 GLN : amide:sc= -3.93! C(o=-2.7!,f=-8!) USER MOD Set 4.2: A 63 SER OG : rot -8:sc= 0.159 USER MOD Set 4.3: A 67 SER OG : rot 180:sc= 1.03 USER MOD Single : A 27 SER OG : rot 158:sc= 0.319 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -1.44! C(o=-1.4!,f=-16!) USER MOD Single : A 38 THR OG1 : rot -70:sc= -0.442 USER MOD Single : A 40 SER OG : rot 100:sc= -0.0387 USER MOD Single : A 41 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.0653 X(o=-0.065,f=-0.065) USER MOD Single : A 47 GLN : amide:sc= 0.233 K(o=0.23,f=-1) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 163:sc= -0.0351 (180deg=-0.324) USER MOD Single : A 57 HIS : no HD1:sc= -1.88! C(o=-1.4!,f=-7.8!) USER MOD Single : A 61 SER OG : rot 119:sc= 1.1 USER MOD Single : A 68 SER OG : rot 128:sc= 1.16 USER MOD Single : A 69 LYS NZ :NH3+ 165:sc= -0.0152 (180deg=-0.213) USER MOD Single : A 70 GLN : amide:sc= -1.15! K(o=-1.1!,f=-0.016) USER MOD Single : A 75 SER OG : rot -70:sc= 1.23 USER MOD Single : A 76 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.14) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0399 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.537 K(o=-0.54,f=0) USER MOD Single : A 91 SER OG : rot 124:sc= 0.0772 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 -105:sc= -0.874 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.00274 USER MOD Single : A 102 GLN : amide:sc= -5! K(o=-5!,f=-0.59) 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 K(o=0,f=-0.68) USER MOD Single : A 118 SER OG : rot 180:sc= -0.015 USER MOD Single : A 119 HIS : no HE2:sc= 1.12 K(o=1.1,f=-3.8!) USER MOD Single : A 120 SER OG : rot -170:sc= -0.0273 USER MOD Single : A 126 HIS : no HD1:sc= -0.314 X(o=-0.31,f=-0.13) USER MOD Single : A 127 SER OG : rot 113:sc= 0.565 USER MOD Single : A 131 THR OG1 : rot 18:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.312 -9.561 -25.129 1.00 0.00 N ATOM 26 CA LEU A 26 -100.050 -8.877 -25.417 1.00 0.00 C ATOM 27 C LEU A 26 -99.610 -9.191 -26.840 1.00 0.00 C ATOM 28 O LEU A 26 -98.927 -10.183 -27.081 1.00 0.00 O ATOM 29 CB LEU A 26 -98.952 -9.297 -24.429 1.00 0.00 C ATOM 30 CG LEU A 26 -99.312 -9.182 -22.945 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.175 -9.709 -22.086 1.00 0.00 C ATOM 32 CD2 LEU A 26 -99.630 -7.741 -22.580 1.00 0.00 C ATOM 0 HA LEU A 26 -100.211 -7.804 -25.310 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.678 -10.331 -24.638 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.068 -8.688 -24.617 1.00 0.00 H new ATOM 0 HG LEU A 26 -100.200 -9.785 -22.757 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.444 -9.622 -21.033 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -97.991 -10.756 -22.328 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -97.273 -9.128 -22.280 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -99.883 -7.681 -21.522 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -98.761 -7.114 -22.781 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -100.474 -7.393 -23.175 1.00 0.00 H new ATOM 44 N SER A 27 -100.017 -8.368 -27.790 1.00 0.00 N ATOM 45 CA SER A 27 -99.779 -8.688 -29.184 1.00 0.00 C ATOM 46 C SER A 27 -99.406 -7.461 -30.006 1.00 0.00 C ATOM 47 O SER A 27 -99.915 -6.364 -29.779 1.00 0.00 O ATOM 48 CB SER A 27 -101.024 -9.347 -29.759 1.00 0.00 C ATOM 49 OG SER A 27 -102.140 -8.484 -29.676 1.00 0.00 O ATOM 0 H SER A 27 -100.506 -7.488 -27.626 1.00 0.00 H new ATOM 0 HA SER A 27 -98.930 -9.370 -29.234 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.848 -9.620 -30.800 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.233 -10.270 -29.219 1.00 0.00 H new ATOM 0 HG SER A 27 -102.810 -8.751 -30.339 1.00 0.00 H new ATOM 55 N TRP A 28 -98.534 -7.669 -30.986 1.00 0.00 N ATOM 56 CA TRP A 28 -98.060 -6.584 -31.838 1.00 0.00 C ATOM 57 C TRP A 28 -99.060 -6.260 -32.950 1.00 0.00 C ATOM 58 O TRP A 28 -98.735 -5.555 -33.901 1.00 0.00 O ATOM 59 CB TRP A 28 -96.684 -6.924 -32.431 1.00 0.00 C ATOM 60 CG TRP A 28 -96.671 -8.071 -33.409 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.496 -9.162 -33.436 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.757 -8.238 -34.499 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.157 -9.984 -34.483 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.093 -9.439 -35.150 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.691 -7.482 -34.990 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.398 -9.900 -36.265 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -94.001 -7.939 -36.095 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.357 -9.137 -36.724 1.00 0.00 C ATOM 0 H TRP A 28 -98.140 -8.582 -31.211 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.962 -5.695 -31.214 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.293 -6.038 -32.930 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.002 -7.157 -31.614 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.297 -9.350 -32.736 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.623 -10.859 -34.724 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.411 -6.554 -34.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.670 -10.826 -36.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -93.173 -7.362 -36.480 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.800 -9.467 -37.589 1.00 0.00 H new ATOM 79 N TYR A 29 -100.276 -6.776 -32.829 1.00 0.00 N ATOM 80 CA TYR A 29 -101.337 -6.431 -33.764 1.00 0.00 C ATOM 81 C TYR A 29 -102.442 -5.670 -33.039 1.00 0.00 C ATOM 82 O TYR A 29 -103.540 -5.484 -33.564 1.00 0.00 O ATOM 83 CB TYR A 29 -101.892 -7.677 -34.479 1.00 0.00 C ATOM 84 CG TYR A 29 -102.434 -8.759 -33.565 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.699 -8.651 -33.003 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.685 -9.893 -33.279 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.200 -9.637 -32.178 1.00 0.00 C ATOM 88 CE2 TYR A 29 -102.181 -10.886 -32.454 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.439 -10.752 -31.906 1.00 0.00 C ATOM 90 OH TYR A 29 -103.932 -11.728 -31.073 1.00 0.00 O ATOM 0 H TYR A 29 -100.551 -7.431 -32.097 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.917 -5.785 -34.535 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.687 -7.364 -35.156 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.101 -8.106 -35.094 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.301 -7.780 -33.215 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.700 -10.001 -33.708 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.185 -9.535 -31.747 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.586 -11.762 -32.240 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.272 -12.447 -30.986 1.00 0.00 H new ATOM 100 N ASP A 30 -102.140 -5.233 -31.823 1.00 0.00 N ATOM 101 CA ASP A 30 -103.066 -4.414 -31.053 1.00 0.00 C ATOM 102 C ASP A 30 -102.618 -2.960 -31.075 1.00 0.00 C ATOM 103 O ASP A 30 -101.468 -2.656 -30.765 1.00 0.00 O ATOM 104 CB ASP A 30 -103.165 -4.912 -29.609 1.00 0.00 C ATOM 105 CG ASP A 30 -104.439 -5.687 -29.349 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.604 -6.783 -29.922 1.00 0.00 O ATOM 107 OD2 ASP A 30 -105.289 -5.199 -28.578 1.00 0.00 O ATOM 0 H ASP A 30 -101.259 -5.433 -31.349 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.053 -4.491 -31.509 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.306 -5.546 -29.387 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.117 -4.060 -28.930 1.00 0.00 H new ATOM 112 N PRO A 31 -103.525 -2.045 -31.445 1.00 0.00 N ATOM 113 CA PRO A 31 -103.214 -0.614 -31.570 1.00 0.00 C ATOM 114 C PRO A 31 -102.785 0.013 -30.249 1.00 0.00 C ATOM 115 O PRO A 31 -102.029 0.981 -30.223 1.00 0.00 O ATOM 116 CB PRO A 31 -104.536 0.008 -32.033 1.00 0.00 C ATOM 117 CG PRO A 31 -105.341 -1.126 -32.567 1.00 0.00 C ATOM 118 CD PRO A 31 -104.929 -2.331 -31.777 1.00 0.00 C ATOM 0 HA PRO A 31 -102.381 -0.450 -32.253 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.050 0.500 -31.207 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -104.367 0.765 -32.799 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.408 -0.933 -32.457 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.152 -1.273 -33.630 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.538 -2.454 -30.882 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.028 -3.248 -32.358 1.00 0.00 H new ATOM 126 N ASP A 32 -103.268 -0.557 -29.157 1.00 0.00 N ATOM 127 CA ASP A 32 -103.024 -0.011 -27.830 1.00 0.00 C ATOM 128 C ASP A 32 -101.731 -0.566 -27.229 1.00 0.00 C ATOM 129 O ASP A 32 -101.237 -0.067 -26.217 1.00 0.00 O ATOM 130 CB ASP A 32 -104.222 -0.326 -26.926 1.00 0.00 C ATOM 131 CG ASP A 32 -104.073 0.226 -25.527 1.00 0.00 C ATOM 132 OD1 ASP A 32 -104.002 1.463 -25.374 1.00 0.00 O ATOM 133 OD2 ASP A 32 -104.047 -0.574 -24.569 1.00 0.00 O ATOM 0 H ASP A 32 -103.836 -1.404 -29.163 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.905 1.069 -27.911 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -105.126 0.083 -27.377 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -104.354 -1.407 -26.871 1.00 0.00 H new ATOM 138 N PHE A 33 -101.173 -1.585 -27.867 1.00 0.00 N ATOM 139 CA PHE A 33 -99.961 -2.223 -27.367 1.00 0.00 C ATOM 140 C PHE A 33 -98.732 -1.436 -27.815 1.00 0.00 C ATOM 141 O PHE A 33 -98.665 -0.976 -28.955 1.00 0.00 O ATOM 142 CB PHE A 33 -99.886 -3.668 -27.866 1.00 0.00 C ATOM 143 CG PHE A 33 -98.844 -4.505 -27.177 1.00 0.00 C ATOM 144 CD1 PHE A 33 -99.031 -4.927 -25.870 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.686 -4.882 -27.838 1.00 0.00 C ATOM 146 CE1 PHE A 33 -98.083 -5.709 -25.238 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.740 -5.660 -27.210 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.936 -6.075 -25.908 1.00 0.00 C ATOM 0 H PHE A 33 -101.538 -1.988 -28.730 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.987 -2.233 -26.277 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.860 -4.138 -27.732 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.680 -3.661 -28.936 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.927 -4.641 -25.340 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.524 -4.562 -28.857 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -98.241 -6.033 -24.220 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.842 -5.947 -27.737 1.00 0.00 H new ATOM 0 HZ PHE A 33 -96.193 -6.685 -25.416 1.00 0.00 H new ATOM 158 N GLN A 34 -97.766 -1.267 -26.919 1.00 0.00 N ATOM 159 CA GLN A 34 -96.583 -0.478 -27.231 1.00 0.00 C ATOM 160 C GLN A 34 -95.523 -1.307 -27.925 1.00 0.00 C ATOM 161 O GLN A 34 -95.116 -2.360 -27.438 1.00 0.00 O ATOM 162 CB GLN A 34 -95.985 0.159 -25.983 1.00 0.00 C ATOM 163 CG GLN A 34 -96.892 1.160 -25.293 1.00 0.00 C ATOM 164 CD GLN A 34 -97.336 2.313 -26.181 1.00 0.00 C ATOM 165 OE1 GLN A 34 -97.485 2.174 -27.394 1.00 0.00 O ATOM 166 NE2 GLN A 34 -97.534 3.473 -25.577 1.00 0.00 N ATOM 0 H GLN A 34 -97.779 -1.663 -25.979 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.912 0.311 -27.907 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.729 -0.629 -25.275 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -95.055 0.658 -26.255 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -97.775 0.639 -24.924 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.374 1.564 -24.423 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -97.401 3.552 -24.569 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -97.820 4.288 -26.119 1.00 0.00 H new ATOM 175 N ALA A 35 -95.063 -0.787 -29.042 1.00 0.00 N ATOM 176 CA ALA A 35 -94.069 -1.455 -29.870 1.00 0.00 C ATOM 177 C ALA A 35 -93.423 -0.451 -30.809 1.00 0.00 C ATOM 178 O ALA A 35 -94.058 0.535 -31.184 1.00 0.00 O ATOM 179 CB ALA A 35 -94.703 -2.590 -30.662 1.00 0.00 C ATOM 0 H ALA A 35 -95.366 0.116 -29.408 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.303 -1.881 -29.222 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.943 -3.076 -31.274 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.134 -3.317 -29.974 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.487 -2.191 -31.306 1.00 0.00 H new ATOM 185 N ARG A 36 -92.168 -0.689 -31.177 1.00 0.00 N ATOM 186 CA ARG A 36 -91.430 0.256 -32.007 1.00 0.00 C ATOM 187 C ARG A 36 -90.051 -0.280 -32.358 1.00 0.00 C ATOM 188 O ARG A 36 -89.692 -1.405 -32.004 1.00 0.00 O ATOM 189 CB ARG A 36 -91.242 1.577 -31.255 1.00 0.00 C ATOM 190 CG ARG A 36 -90.379 1.397 -30.015 1.00 0.00 C ATOM 191 CD ARG A 36 -90.060 2.703 -29.321 1.00 0.00 C ATOM 192 NE ARG A 36 -89.123 2.488 -28.223 1.00 0.00 N ATOM 193 CZ ARG A 36 -88.839 3.385 -27.287 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.450 4.565 -27.278 1.00 0.00 N ATOM 195 NH2 ARG A 36 -87.949 3.090 -26.350 1.00 0.00 N ATOM 0 H ARG A 36 -91.643 -1.524 -30.915 1.00 0.00 H new ATOM 0 HA ARG A 36 -92.006 0.408 -32.920 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.781 2.311 -31.916 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.215 1.974 -30.967 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.891 0.736 -29.316 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.448 0.904 -30.296 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.634 3.406 -30.037 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.977 3.152 -28.940 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.653 1.584 -28.171 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.142 4.786 -27.994 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.227 5.249 -26.555 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.489 2.180 -26.352 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -87.724 3.773 -25.627 1.00 0.00 H new ATOM 209 N LEU A 37 -89.289 0.546 -33.057 1.00 0.00 N ATOM 210 CA LEU A 37 -87.910 0.245 -33.382 1.00 0.00 C ATOM 211 C LEU A 37 -86.995 1.154 -32.583 1.00 0.00 C ATOM 212 O LEU A 37 -87.258 2.351 -32.458 1.00 0.00 O ATOM 213 CB LEU A 37 -87.670 0.452 -34.872 1.00 0.00 C ATOM 214 CG LEU A 37 -88.676 -0.254 -35.765 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.543 0.232 -37.191 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.471 -1.755 -35.683 1.00 0.00 C ATOM 0 H LEU A 37 -89.613 1.445 -33.414 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.699 -0.795 -33.132 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.695 1.520 -35.088 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.669 0.099 -35.121 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.684 -0.022 -35.422 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.270 -0.282 -37.820 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.726 1.306 -37.228 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.537 0.023 -37.554 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.195 -2.257 -36.325 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.462 -2.003 -36.011 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.609 -2.085 -34.653 1.00 0.00 H new ATOM 228 N THR A 38 -85.937 0.590 -32.037 1.00 0.00 N ATOM 229 CA THR A 38 -84.988 1.364 -31.258 1.00 0.00 C ATOM 230 C THR A 38 -83.567 0.891 -31.567 1.00 0.00 C ATOM 231 O THR A 38 -83.387 -0.054 -32.344 1.00 0.00 O ATOM 232 CB THR A 38 -85.278 1.237 -29.742 1.00 0.00 C ATOM 233 OG1 THR A 38 -86.667 0.964 -29.520 1.00 0.00 O ATOM 234 CG2 THR A 38 -84.923 2.521 -29.007 1.00 0.00 C ATOM 0 H THR A 38 -85.711 -0.401 -32.117 1.00 0.00 H new ATOM 0 HA THR A 38 -85.088 2.415 -31.531 1.00 0.00 H new ATOM 0 HB THR A 38 -84.667 0.418 -29.362 1.00 0.00 H new ATOM 0 HG1 THR A 38 -87.196 1.759 -29.739 1.00 0.00 H new ATOM 0 HG21 THR A 38 -85.137 2.403 -27.945 1.00 0.00 H new ATOM 0 HG22 THR A 38 -83.863 2.736 -29.142 1.00 0.00 H new ATOM 0 HG23 THR A 38 -85.514 3.345 -29.407 1.00 0.00 H new ATOM 242 N ARG A 39 -82.568 1.561 -30.977 1.00 0.00 N ATOM 243 CA ARG A 39 -81.154 1.219 -31.165 1.00 0.00 C ATOM 244 C ARG A 39 -80.705 1.605 -32.566 1.00 0.00 C ATOM 245 O ARG A 39 -79.677 1.143 -33.061 1.00 0.00 O ATOM 246 CB ARG A 39 -80.901 -0.272 -30.913 1.00 0.00 C ATOM 247 CG ARG A 39 -81.497 -0.776 -29.611 1.00 0.00 C ATOM 248 CD ARG A 39 -81.018 0.034 -28.420 1.00 0.00 C ATOM 249 NE ARG A 39 -81.674 -0.377 -27.182 1.00 0.00 N ATOM 250 CZ ARG A 39 -81.105 -0.301 -25.983 1.00 0.00 C ATOM 251 NH1 ARG A 39 -79.871 0.176 -25.857 1.00 0.00 N ATOM 252 NH2 ARG A 39 -81.765 -0.707 -24.908 1.00 0.00 N ATOM 0 H ARG A 39 -82.719 2.356 -30.356 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.570 1.782 -30.437 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -81.316 -0.848 -31.740 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.826 -0.454 -30.906 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -82.585 -0.730 -29.668 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -81.229 -1.823 -29.470 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -79.939 -0.080 -28.314 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -81.211 1.092 -28.599 1.00 0.00 H new ATOM 0 HE ARG A 39 -82.624 -0.744 -27.241 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -79.357 0.485 -26.682 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -79.438 0.233 -24.935 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -82.711 -1.078 -25.000 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -81.327 -0.648 -23.988 1.00 0.00 H new ATOM 266 N SER A 40 -81.497 2.455 -33.193 1.00 0.00 N ATOM 267 CA SER A 40 -81.215 2.964 -34.520 1.00 0.00 C ATOM 268 C SER A 40 -81.831 4.350 -34.654 1.00 0.00 C ATOM 269 O SER A 40 -82.726 4.708 -33.885 1.00 0.00 O ATOM 270 CB SER A 40 -81.775 2.011 -35.581 1.00 0.00 C ATOM 271 OG SER A 40 -81.234 0.707 -35.420 1.00 0.00 O ATOM 0 H SER A 40 -82.363 2.814 -32.790 1.00 0.00 H new ATOM 0 HA SER A 40 -80.138 3.034 -34.671 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.862 1.971 -35.504 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.539 2.388 -36.576 1.00 0.00 H new ATOM 0 HG SER A 40 -81.881 0.140 -34.951 1.00 0.00 H new ATOM 277 N ASN A 41 -81.354 5.127 -35.612 1.00 0.00 N ATOM 278 CA ASN A 41 -81.825 6.498 -35.799 1.00 0.00 C ATOM 279 C ASN A 41 -82.991 6.551 -36.774 1.00 0.00 C ATOM 280 O ASN A 41 -83.173 7.538 -37.492 1.00 0.00 O ATOM 281 CB ASN A 41 -80.687 7.393 -36.294 1.00 0.00 C ATOM 282 CG ASN A 41 -79.758 7.815 -35.174 1.00 0.00 C ATOM 283 OD1 ASN A 41 -79.604 7.112 -34.177 1.00 0.00 O ATOM 284 ND2 ASN A 41 -79.132 8.969 -35.330 1.00 0.00 N ATOM 0 H ASN A 41 -80.638 4.834 -36.277 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.171 6.865 -34.833 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.116 6.863 -37.056 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -81.106 8.280 -36.769 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -78.494 9.305 -34.608 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -79.287 9.523 -36.172 1.00 0.00 H new ATOM 291 N SER A 42 -83.793 5.504 -36.775 1.00 0.00 N ATOM 292 CA SER A 42 -84.922 5.411 -37.674 1.00 0.00 C ATOM 293 C SER A 42 -86.149 4.899 -36.940 1.00 0.00 C ATOM 294 O SER A 42 -86.154 3.790 -36.414 1.00 0.00 O ATOM 295 CB SER A 42 -84.576 4.489 -38.842 1.00 0.00 C ATOM 296 OG SER A 42 -83.368 4.889 -39.470 1.00 0.00 O ATOM 0 H SER A 42 -83.680 4.701 -36.157 1.00 0.00 H new ATOM 0 HA SER A 42 -85.148 6.405 -38.060 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.481 3.464 -38.484 1.00 0.00 H new ATOM 0 HB3 SER A 42 -85.388 4.499 -39.569 1.00 0.00 H new ATOM 0 HG SER A 42 -83.169 4.282 -40.213 1.00 0.00 H new ATOM 302 N LYS A 43 -87.184 5.725 -36.894 1.00 0.00 N ATOM 303 CA LYS A 43 -88.461 5.315 -36.329 1.00 0.00 C ATOM 304 C LYS A 43 -89.032 4.188 -37.171 1.00 0.00 C ATOM 305 O LYS A 43 -89.767 3.333 -36.686 1.00 0.00 O ATOM 306 CB LYS A 43 -89.450 6.483 -36.330 1.00 0.00 C ATOM 307 CG LYS A 43 -88.937 7.747 -35.660 1.00 0.00 C ATOM 308 CD LYS A 43 -89.837 8.932 -35.978 1.00 0.00 C ATOM 309 CE LYS A 43 -89.895 9.187 -37.477 1.00 0.00 C ATOM 310 NZ LYS A 43 -90.903 10.216 -37.839 1.00 0.00 N ATOM 0 H LYS A 43 -87.164 6.684 -37.241 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.303 4.986 -35.302 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -89.716 6.716 -37.361 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -90.365 6.168 -35.829 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.891 7.599 -34.581 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -87.921 7.956 -35.996 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -90.841 8.742 -35.599 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.467 9.821 -35.468 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -88.913 9.506 -37.827 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -90.130 8.256 -37.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -90.823 10.439 -38.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -91.857 9.853 -37.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -90.736 11.077 -37.280 1.00 0.00 H new ATOM 324 N CYS A 44 -88.667 4.199 -38.446 1.00 0.00 N ATOM 325 CA CYS A 44 -89.211 3.260 -39.405 1.00 0.00 C ATOM 326 C CYS A 44 -88.153 2.245 -39.844 1.00 0.00 C ATOM 327 O CYS A 44 -88.326 1.571 -40.851 1.00 0.00 O ATOM 328 CB CYS A 44 -89.752 4.028 -40.614 1.00 0.00 C ATOM 329 SG CYS A 44 -90.279 5.724 -40.215 1.00 0.00 S ATOM 0 H CYS A 44 -87.991 4.855 -38.838 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.023 2.706 -38.934 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -88.982 4.066 -41.385 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.597 3.482 -41.034 1.00 0.00 H new ATOM 334 N GLN A 45 -87.060 2.141 -39.085 1.00 0.00 N ATOM 335 CA GLN A 45 -86.044 1.110 -39.322 1.00 0.00 C ATOM 336 C GLN A 45 -85.211 0.882 -38.056 1.00 0.00 C ATOM 337 O GLN A 45 -84.639 1.820 -37.512 1.00 0.00 O ATOM 338 CB GLN A 45 -85.138 1.505 -40.493 1.00 0.00 C ATOM 339 CG GLN A 45 -83.964 0.564 -40.704 1.00 0.00 C ATOM 340 CD GLN A 45 -83.043 1.023 -41.816 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.214 0.650 -42.976 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.062 1.839 -41.473 1.00 0.00 N ATOM 0 H GLN A 45 -86.855 2.759 -38.300 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.551 0.180 -39.578 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.733 1.539 -41.406 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.758 2.512 -40.323 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.396 0.483 -39.777 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.339 -0.433 -40.936 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.953 2.125 -40.500 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.413 2.183 -42.181 1.00 0.00 H new ATOM 351 N GLY A 46 -85.135 -0.361 -37.593 1.00 0.00 N ATOM 352 CA GLY A 46 -84.422 -0.636 -36.359 1.00 0.00 C ATOM 353 C GLY A 46 -84.739 -2.008 -35.797 1.00 0.00 C ATOM 354 O GLY A 46 -85.492 -2.771 -36.398 1.00 0.00 O ATOM 0 H GLY A 46 -85.550 -1.176 -38.045 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.350 -0.560 -36.538 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.676 0.123 -35.620 1.00 0.00 H new ATOM 358 N GLN A 47 -84.131 -2.345 -34.668 1.00 0.00 N ATOM 359 CA GLN A 47 -84.458 -3.585 -33.977 1.00 0.00 C ATOM 360 C GLN A 47 -85.767 -3.422 -33.217 1.00 0.00 C ATOM 361 O GLN A 47 -86.034 -2.355 -32.659 1.00 0.00 O ATOM 362 CB GLN A 47 -83.330 -3.996 -33.027 1.00 0.00 C ATOM 363 CG GLN A 47 -82.176 -4.694 -33.729 1.00 0.00 C ATOM 364 CD GLN A 47 -82.612 -5.980 -34.404 1.00 0.00 C ATOM 365 OE1 GLN A 47 -83.552 -6.638 -33.962 1.00 0.00 O ATOM 366 NE2 GLN A 47 -81.930 -6.350 -35.475 1.00 0.00 N ATOM 0 H GLN A 47 -83.413 -1.781 -34.213 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.574 -4.376 -34.717 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -82.953 -3.110 -32.517 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.733 -4.658 -32.260 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.745 -4.023 -34.472 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.391 -4.913 -33.005 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -81.156 -5.776 -35.810 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.178 -7.209 -35.966 1.00 0.00 H new ATOM 375 N LEU A 48 -86.579 -4.471 -33.201 1.00 0.00 N ATOM 376 CA LEU A 48 -87.908 -4.388 -32.611 1.00 0.00 C ATOM 377 C LEU A 48 -87.844 -4.389 -31.090 1.00 0.00 C ATOM 378 O LEU A 48 -87.493 -5.388 -30.461 1.00 0.00 O ATOM 379 CB LEU A 48 -88.799 -5.533 -33.103 1.00 0.00 C ATOM 380 CG LEU A 48 -90.242 -5.497 -32.584 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.952 -4.238 -33.050 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.011 -6.728 -33.036 1.00 0.00 C ATOM 0 H LEU A 48 -86.342 -5.385 -33.588 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.346 -3.443 -32.931 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.820 -5.515 -34.193 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.346 -6.479 -32.808 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.204 -5.492 -31.495 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.974 -4.234 -32.670 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.422 -3.362 -32.676 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.970 -4.213 -34.140 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.031 -6.680 -32.656 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.031 -6.765 -34.125 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.523 -7.624 -32.652 1.00 0.00 H new ATOM 394 N GLU A 49 -88.187 -3.254 -30.516 1.00 0.00 N ATOM 395 CA GLU A 49 -88.253 -3.102 -29.080 1.00 0.00 C ATOM 396 C GLU A 49 -89.717 -2.968 -28.677 1.00 0.00 C ATOM 397 O GLU A 49 -90.386 -2.001 -29.049 1.00 0.00 O ATOM 398 CB GLU A 49 -87.441 -1.877 -28.659 1.00 0.00 C ATOM 399 CG GLU A 49 -87.288 -1.704 -27.159 1.00 0.00 C ATOM 400 CD GLU A 49 -86.422 -0.512 -26.805 1.00 0.00 C ATOM 401 OE1 GLU A 49 -86.941 0.626 -26.799 1.00 0.00 O ATOM 402 OE2 GLU A 49 -85.215 -0.703 -26.537 1.00 0.00 O ATOM 0 H GLU A 49 -88.428 -2.410 -31.035 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.828 -3.971 -28.577 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.449 -1.944 -29.107 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.916 -0.985 -29.068 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.272 -1.583 -26.707 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.851 -2.607 -26.734 1.00 0.00 H new ATOM 409 N VAL A 50 -90.229 -3.959 -27.961 1.00 0.00 N ATOM 410 CA VAL A 50 -91.649 -4.004 -27.635 1.00 0.00 C ATOM 411 C VAL A 50 -91.852 -3.939 -26.129 1.00 0.00 C ATOM 412 O VAL A 50 -91.175 -4.639 -25.380 1.00 0.00 O ATOM 413 CB VAL A 50 -92.307 -5.292 -28.170 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.770 -5.052 -28.461 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.585 -5.812 -29.405 1.00 0.00 C ATOM 0 H VAL A 50 -89.685 -4.741 -27.595 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.118 -3.142 -28.110 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.228 -6.058 -27.399 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -94.221 -5.970 -28.838 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -94.278 -4.747 -27.546 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -93.868 -4.266 -29.209 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.074 -6.720 -29.757 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -91.616 -5.056 -30.190 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.547 -6.032 -29.154 1.00 0.00 H new ATOM 425 N TYR A 51 -92.787 -3.115 -25.680 1.00 0.00 N ATOM 426 CA TYR A 51 -92.997 -2.938 -24.251 1.00 0.00 C ATOM 427 C TYR A 51 -94.069 -3.885 -23.741 1.00 0.00 C ATOM 428 O TYR A 51 -95.256 -3.557 -23.726 1.00 0.00 O ATOM 429 CB TYR A 51 -93.377 -1.492 -23.925 1.00 0.00 C ATOM 430 CG TYR A 51 -93.397 -1.180 -22.442 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.244 -1.300 -21.674 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.561 -0.758 -21.811 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.249 -1.009 -20.323 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.574 -0.466 -20.459 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.415 -0.593 -19.720 1.00 0.00 C ATOM 436 OH TYR A 51 -93.420 -0.300 -18.374 1.00 0.00 O ATOM 0 H TYR A 51 -93.405 -2.565 -26.276 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.058 -3.170 -23.749 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.672 -0.822 -24.417 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.361 -1.283 -24.343 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.327 -1.627 -22.142 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.470 -0.656 -22.385 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.343 -1.107 -19.743 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.487 -0.140 -19.983 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.319 -0.020 -18.103 1.00 0.00 H new ATOM 446 N LEU A 52 -93.649 -5.071 -23.341 1.00 0.00 N ATOM 447 CA LEU A 52 -94.566 -6.033 -22.767 1.00 0.00 C ATOM 448 C LEU A 52 -94.431 -6.074 -21.271 1.00 0.00 C ATOM 449 O LEU A 52 -93.662 -6.874 -20.761 1.00 0.00 O ATOM 450 CB LEU A 52 -94.351 -7.443 -23.310 1.00 0.00 C ATOM 451 CG LEU A 52 -92.897 -7.916 -23.441 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.801 -9.406 -23.157 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.364 -7.623 -24.835 1.00 0.00 C ATOM 0 H LEU A 52 -92.682 -5.389 -23.403 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.565 -5.701 -23.048 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.879 -8.142 -22.661 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.819 -7.504 -24.293 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.294 -7.374 -22.713 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.764 -9.729 -23.253 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.151 -9.607 -22.144 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.419 -9.953 -23.869 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.332 -7.965 -24.909 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.973 -8.143 -25.574 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -92.405 -6.550 -25.022 1.00 0.00 H new ATOM 465 N LYS A 53 -95.147 -5.169 -20.601 1.00 0.00 N ATOM 466 CA LYS A 53 -95.320 -5.175 -19.138 1.00 0.00 C ATOM 467 C LYS A 53 -93.999 -5.101 -18.364 1.00 0.00 C ATOM 468 O LYS A 53 -93.738 -4.130 -17.654 1.00 0.00 O ATOM 469 CB LYS A 53 -96.108 -6.418 -18.707 1.00 0.00 C ATOM 470 CG LYS A 53 -97.464 -6.546 -19.387 1.00 0.00 C ATOM 471 CD LYS A 53 -98.220 -7.782 -18.920 1.00 0.00 C ATOM 472 CE LYS A 53 -98.690 -7.649 -17.478 1.00 0.00 C ATOM 473 NZ LYS A 53 -99.674 -6.543 -17.316 1.00 0.00 N ATOM 0 H LYS A 53 -95.632 -4.399 -21.061 1.00 0.00 H new ATOM 0 HA LYS A 53 -95.875 -4.270 -18.891 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -95.516 -7.307 -18.925 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -96.254 -6.389 -17.627 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.059 -5.657 -19.180 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -97.325 -6.592 -20.467 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -99.080 -7.948 -19.568 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -97.577 -8.657 -19.013 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -99.141 -8.587 -17.155 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -97.831 -7.469 -16.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -100.181 -6.659 -16.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -99.174 -5.631 -17.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -100.355 -6.566 -18.102 1.00 0.00 H new ATOM 487 N ASP A 54 -93.170 -6.120 -18.516 1.00 0.00 N ATOM 488 CA ASP A 54 -91.968 -6.270 -17.705 1.00 0.00 C ATOM 489 C ASP A 54 -90.773 -5.613 -18.378 1.00 0.00 C ATOM 490 O ASP A 54 -89.845 -5.155 -17.707 1.00 0.00 O ATOM 491 CB ASP A 54 -91.653 -7.755 -17.459 1.00 0.00 C ATOM 492 CG ASP A 54 -91.024 -8.442 -18.664 1.00 0.00 C ATOM 493 OD1 ASP A 54 -91.758 -8.788 -19.608 1.00 0.00 O ATOM 494 OD2 ASP A 54 -89.784 -8.630 -18.678 1.00 0.00 O ATOM 0 H ASP A 54 -93.308 -6.864 -19.200 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.157 -5.780 -16.750 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -90.979 -7.840 -16.607 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.573 -8.275 -17.191 1.00 0.00 H new ATOM 499 N GLY A 55 -90.790 -5.561 -19.700 1.00 0.00 N ATOM 500 CA GLY A 55 -89.615 -5.103 -20.409 1.00 0.00 C ATOM 501 C GLY A 55 -89.899 -4.510 -21.758 1.00 0.00 C ATOM 502 O GLY A 55 -90.784 -4.979 -22.480 1.00 0.00 O ATOM 0 H GLY A 55 -91.582 -5.823 -20.287 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.104 -4.359 -19.798 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -88.929 -5.941 -20.531 1.00 0.00 H new ATOM 506 N TRP A 56 -89.146 -3.471 -22.093 1.00 0.00 N ATOM 507 CA TRP A 56 -88.988 -3.066 -23.476 1.00 0.00 C ATOM 508 C TRP A 56 -88.145 -4.128 -24.164 1.00 0.00 C ATOM 509 O TRP A 56 -86.982 -3.894 -24.501 1.00 0.00 O ATOM 510 CB TRP A 56 -88.293 -1.700 -23.589 1.00 0.00 C ATOM 511 CG TRP A 56 -89.227 -0.528 -23.619 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.395 0.417 -22.649 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.108 -0.170 -24.687 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.333 1.341 -23.051 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.787 1.000 -24.299 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.390 -0.728 -25.933 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.731 1.619 -25.117 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.325 -0.115 -26.742 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.985 1.047 -26.334 1.00 0.00 C ATOM 0 H TRP A 56 -88.636 -2.895 -21.423 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.968 -2.969 -23.943 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.610 -1.583 -22.747 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.687 -1.689 -24.495 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -88.870 0.437 -21.706 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.640 2.148 -22.508 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.885 -1.625 -26.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.243 2.516 -24.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.551 -0.541 -27.708 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.710 1.503 -26.992 1.00 0.00 H new ATOM 530 N HIS A 57 -88.726 -5.313 -24.313 1.00 0.00 N ATOM 531 CA HIS A 57 -87.995 -6.471 -24.783 1.00 0.00 C ATOM 532 C HIS A 57 -87.485 -6.237 -26.195 1.00 0.00 C ATOM 533 O HIS A 57 -88.272 -6.075 -27.127 1.00 0.00 O ATOM 534 CB HIS A 57 -88.866 -7.737 -24.771 1.00 0.00 C ATOM 535 CG HIS A 57 -89.017 -8.398 -23.432 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.334 -9.731 -23.294 1.00 0.00 N ATOM 537 CD2 HIS A 57 -88.926 -7.906 -22.176 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.432 -10.027 -22.011 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.192 -8.938 -21.309 1.00 0.00 N ATOM 0 H HIS A 57 -89.710 -5.492 -24.112 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.156 -6.619 -24.103 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.857 -7.480 -25.145 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.440 -8.458 -25.468 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -88.688 -6.888 -21.904 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.669 -10.999 -21.605 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -89.202 -8.872 -20.291 1.00 0.00 H new ATOM 548 N MET A 58 -86.177 -6.192 -26.342 1.00 0.00 N ATOM 549 CA MET A 58 -85.565 -6.094 -27.655 1.00 0.00 C ATOM 550 C MET A 58 -85.545 -7.464 -28.309 1.00 0.00 C ATOM 551 O MET A 58 -84.711 -8.301 -27.971 1.00 0.00 O ATOM 552 CB MET A 58 -84.140 -5.555 -27.547 1.00 0.00 C ATOM 553 CG MET A 58 -84.053 -4.121 -27.054 1.00 0.00 C ATOM 554 SD MET A 58 -82.351 -3.594 -26.785 1.00 0.00 S ATOM 555 CE MET A 58 -81.632 -3.963 -28.383 1.00 0.00 C ATOM 0 H MET A 58 -85.514 -6.222 -25.567 1.00 0.00 H new ATOM 0 HA MET A 58 -86.151 -5.405 -28.263 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.572 -6.195 -26.872 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.663 -5.621 -28.525 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.525 -3.460 -27.780 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.613 -4.024 -26.124 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.606 -3.595 -28.414 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.636 -5.041 -28.544 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.215 -3.477 -29.165 1.00 0.00 H new ATOM 565 N VAL A 59 -86.465 -7.701 -29.226 1.00 0.00 N ATOM 566 CA VAL A 59 -86.571 -9.008 -29.847 1.00 0.00 C ATOM 567 C VAL A 59 -85.699 -9.065 -31.092 1.00 0.00 C ATOM 568 O VAL A 59 -85.393 -8.035 -31.691 1.00 0.00 O ATOM 569 CB VAL A 59 -88.030 -9.359 -30.218 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.960 -9.123 -29.038 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.492 -8.574 -31.431 1.00 0.00 C ATOM 0 H VAL A 59 -87.143 -7.013 -29.555 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.227 -9.743 -29.119 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.063 -10.418 -30.473 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.981 -9.377 -29.323 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.651 -9.748 -28.200 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.916 -8.074 -28.744 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.522 -8.842 -31.668 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.435 -7.507 -31.217 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.852 -8.808 -32.281 1.00 0.00 H new ATOM 581 N CYS A 60 -85.297 -10.262 -31.481 1.00 0.00 N ATOM 582 CA CYS A 60 -84.491 -10.419 -32.676 1.00 0.00 C ATOM 583 C CYS A 60 -85.348 -10.672 -33.915 1.00 0.00 C ATOM 584 O CYS A 60 -84.896 -11.303 -34.873 1.00 0.00 O ATOM 585 CB CYS A 60 -83.438 -11.512 -32.493 1.00 0.00 C ATOM 586 SG CYS A 60 -83.831 -12.850 -31.353 1.00 0.00 S ATOM 0 H CYS A 60 -85.513 -11.131 -30.992 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.968 -9.476 -32.838 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.232 -11.950 -33.470 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.516 -11.040 -32.155 1.00 0.00 H new ATOM 591 N SER A 61 -86.580 -10.148 -33.886 1.00 0.00 N ATOM 592 CA SER A 61 -87.498 -10.154 -35.036 1.00 0.00 C ATOM 593 C SER A 61 -88.042 -11.555 -35.359 1.00 0.00 C ATOM 594 O SER A 61 -89.248 -11.732 -35.506 1.00 0.00 O ATOM 595 CB SER A 61 -86.815 -9.547 -36.264 1.00 0.00 C ATOM 596 OG SER A 61 -86.363 -8.229 -35.991 1.00 0.00 O ATOM 0 H SER A 61 -86.973 -9.703 -33.056 1.00 0.00 H new ATOM 0 HA SER A 61 -88.356 -9.542 -34.759 1.00 0.00 H new ATOM 0 HB2 SER A 61 -85.972 -10.171 -36.562 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.512 -9.531 -37.102 1.00 0.00 H new ATOM 0 HG SER A 61 -85.389 -8.191 -36.089 1.00 0.00 H new ATOM 602 N GLN A 62 -87.158 -12.545 -35.450 1.00 0.00 N ATOM 603 CA GLN A 62 -87.549 -13.908 -35.825 1.00 0.00 C ATOM 604 C GLN A 62 -88.187 -14.659 -34.660 1.00 0.00 C ATOM 605 O GLN A 62 -88.489 -15.849 -34.765 1.00 0.00 O ATOM 606 CB GLN A 62 -86.329 -14.683 -36.347 1.00 0.00 C ATOM 607 CG GLN A 62 -85.089 -14.621 -35.451 1.00 0.00 C ATOM 608 CD GLN A 62 -85.279 -15.261 -34.083 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.654 -14.594 -33.118 1.00 0.00 O ATOM 610 NE2 GLN A 62 -85.015 -16.552 -33.988 1.00 0.00 N ATOM 0 H GLN A 62 -86.161 -12.431 -35.269 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.296 -13.830 -36.615 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.611 -15.728 -36.479 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.066 -14.296 -37.332 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.261 -15.115 -35.960 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.803 -13.578 -35.316 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.706 -17.071 -34.810 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.120 -17.029 -33.093 1.00 0.00 H new ATOM 619 N SER A 63 -88.380 -13.959 -33.555 1.00 0.00 N ATOM 620 CA SER A 63 -88.878 -14.566 -32.338 1.00 0.00 C ATOM 621 C SER A 63 -90.317 -15.054 -32.518 1.00 0.00 C ATOM 622 O SER A 63 -91.016 -14.610 -33.432 1.00 0.00 O ATOM 623 CB SER A 63 -88.790 -13.552 -31.200 1.00 0.00 C ATOM 624 OG SER A 63 -87.466 -13.059 -31.068 1.00 0.00 O ATOM 0 H SER A 63 -88.196 -12.959 -33.479 1.00 0.00 H new ATOM 0 HA SER A 63 -88.265 -15.435 -32.096 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.474 -12.725 -31.390 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.105 -14.018 -30.266 1.00 0.00 H new ATOM 0 HG SER A 63 -86.867 -13.569 -31.653 1.00 0.00 H new ATOM 630 N TRP A 64 -90.739 -15.966 -31.636 1.00 0.00 N ATOM 631 CA TRP A 64 -92.077 -16.572 -31.673 1.00 0.00 C ATOM 632 C TRP A 64 -92.196 -17.596 -32.799 1.00 0.00 C ATOM 633 O TRP A 64 -92.511 -18.761 -32.554 1.00 0.00 O ATOM 634 CB TRP A 64 -93.180 -15.513 -31.798 1.00 0.00 C ATOM 635 CG TRP A 64 -93.348 -14.667 -30.572 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.040 -14.998 -29.445 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.824 -13.353 -30.349 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.982 -13.974 -28.537 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.241 -12.955 -29.066 1.00 0.00 C ATOM 640 CE3 TRP A 64 -92.043 -12.477 -31.106 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.902 -11.720 -28.524 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.705 -11.251 -30.564 1.00 0.00 C ATOM 643 CH2 TRP A 64 -92.134 -10.882 -29.284 1.00 0.00 C ATOM 0 H TRP A 64 -90.158 -16.308 -30.870 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.213 -17.089 -30.723 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.956 -14.866 -32.646 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.125 -16.010 -32.017 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.559 -15.932 -29.290 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.420 -13.972 -27.616 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.710 -12.752 -32.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.234 -11.433 -27.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -91.099 -10.566 -31.138 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.853 -9.917 -28.889 1.00 0.00 H new ATOM 654 N GLY A 65 -91.942 -17.163 -34.026 1.00 0.00 N ATOM 655 CA GLY A 65 -92.021 -18.058 -35.162 1.00 0.00 C ATOM 656 C GLY A 65 -90.731 -18.819 -35.385 1.00 0.00 C ATOM 657 O GLY A 65 -90.372 -19.694 -34.594 1.00 0.00 O ATOM 0 H GLY A 65 -91.682 -16.204 -34.255 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -92.836 -18.766 -35.008 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -92.261 -17.485 -36.057 1.00 0.00 H new ATOM 661 N ARG A 66 -90.039 -18.489 -36.467 1.00 0.00 N ATOM 662 CA ARG A 66 -88.783 -19.145 -36.818 1.00 0.00 C ATOM 663 C ARG A 66 -87.855 -18.162 -37.520 1.00 0.00 C ATOM 664 O ARG A 66 -88.304 -17.139 -38.043 1.00 0.00 O ATOM 665 CB ARG A 66 -89.031 -20.355 -37.733 1.00 0.00 C ATOM 666 CG ARG A 66 -89.674 -21.545 -37.038 1.00 0.00 C ATOM 667 CD ARG A 66 -89.985 -22.656 -38.025 1.00 0.00 C ATOM 668 NE ARG A 66 -90.582 -23.822 -37.377 1.00 0.00 N ATOM 669 CZ ARG A 66 -91.780 -24.315 -37.683 1.00 0.00 C ATOM 670 NH1 ARG A 66 -92.536 -23.719 -38.601 1.00 0.00 N ATOM 671 NH2 ARG A 66 -92.224 -25.405 -37.069 1.00 0.00 N ATOM 0 H ARG A 66 -90.328 -17.764 -37.124 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.317 -19.493 -35.896 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.669 -20.045 -38.561 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -88.081 -20.671 -38.164 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -89.007 -21.921 -36.262 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.592 -21.228 -36.543 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -90.665 -22.280 -38.790 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -89.068 -22.955 -38.533 1.00 0.00 H new ATOM 0 HE ARG A 66 -90.047 -24.287 -36.644 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -92.198 -22.881 -39.074 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -93.453 -24.100 -38.832 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -91.647 -25.864 -36.364 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -93.142 -25.784 -37.303 1.00 0.00 H new ATOM 685 N SER A 67 -86.569 -18.477 -37.532 1.00 0.00 N ATOM 686 CA SER A 67 -85.587 -17.657 -38.219 1.00 0.00 C ATOM 687 C SER A 67 -85.647 -17.926 -39.718 1.00 0.00 C ATOM 688 O SER A 67 -85.169 -18.958 -40.194 1.00 0.00 O ATOM 689 CB SER A 67 -84.189 -17.951 -37.673 1.00 0.00 C ATOM 690 OG SER A 67 -84.169 -17.825 -36.260 1.00 0.00 O ATOM 0 H SER A 67 -86.181 -19.300 -37.071 1.00 0.00 H new ATOM 0 HA SER A 67 -85.811 -16.604 -38.046 1.00 0.00 H new ATOM 0 HB2 SER A 67 -83.886 -18.958 -37.958 1.00 0.00 H new ATOM 0 HB3 SER A 67 -83.468 -17.264 -38.115 1.00 0.00 H new ATOM 0 HG SER A 67 -83.268 -18.018 -35.927 1.00 0.00 H new ATOM 696 N SER A 68 -86.268 -17.014 -40.447 1.00 0.00 N ATOM 697 CA SER A 68 -86.441 -17.171 -41.881 1.00 0.00 C ATOM 698 C SER A 68 -85.617 -16.128 -42.631 1.00 0.00 C ATOM 699 O SER A 68 -84.985 -15.264 -42.016 1.00 0.00 O ATOM 700 CB SER A 68 -87.927 -17.050 -42.243 1.00 0.00 C ATOM 701 OG SER A 68 -88.169 -17.448 -43.584 1.00 0.00 O ATOM 0 H SER A 68 -86.662 -16.153 -40.067 1.00 0.00 H new ATOM 0 HA SER A 68 -86.089 -18.160 -42.176 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.519 -17.667 -41.567 1.00 0.00 H new ATOM 0 HB3 SER A 68 -88.254 -16.020 -42.103 1.00 0.00 H new ATOM 0 HG SER A 68 -88.882 -18.120 -43.602 1.00 0.00 H new ATOM 707 N LYS A 69 -85.620 -16.212 -43.956 1.00 0.00 N ATOM 708 CA LYS A 69 -84.851 -15.294 -44.773 1.00 0.00 C ATOM 709 C LYS A 69 -85.710 -14.125 -45.236 1.00 0.00 C ATOM 710 O LYS A 69 -86.571 -14.281 -46.110 1.00 0.00 O ATOM 711 CB LYS A 69 -84.243 -16.007 -45.983 1.00 0.00 C ATOM 712 CG LYS A 69 -83.332 -15.106 -46.799 1.00 0.00 C ATOM 713 CD LYS A 69 -82.723 -15.832 -47.983 1.00 0.00 C ATOM 714 CE LYS A 69 -81.751 -14.936 -48.735 1.00 0.00 C ATOM 715 NZ LYS A 69 -80.554 -14.596 -47.916 1.00 0.00 N ATOM 0 H LYS A 69 -86.148 -16.908 -44.483 1.00 0.00 H new ATOM 0 HA LYS A 69 -84.040 -14.908 -44.155 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -83.678 -16.875 -45.642 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -85.045 -16.379 -46.621 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -83.898 -14.245 -47.154 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -82.536 -14.723 -46.161 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -82.205 -16.726 -47.637 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -83.514 -16.162 -48.657 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -81.433 -15.435 -49.651 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -82.259 -14.019 -49.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -79.811 -14.207 -48.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -80.814 -13.890 -47.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -80.200 -15.453 -47.446 1.00 0.00 H new ATOM 729 N GLN A 70 -85.467 -12.965 -44.635 1.00 0.00 N ATOM 730 CA GLN A 70 -86.112 -11.717 -45.032 1.00 0.00 C ATOM 731 C GLN A 70 -87.642 -11.811 -44.972 1.00 0.00 C ATOM 732 O GLN A 70 -88.210 -12.259 -43.973 1.00 0.00 O ATOM 733 CB GLN A 70 -85.638 -11.312 -46.431 1.00 0.00 C ATOM 734 CG GLN A 70 -84.142 -11.063 -46.508 1.00 0.00 C ATOM 735 CD GLN A 70 -83.661 -10.766 -47.912 1.00 0.00 C ATOM 736 OE1 GLN A 70 -82.709 -10.012 -48.107 1.00 0.00 O ATOM 737 NE2 GLN A 70 -84.298 -11.373 -48.901 1.00 0.00 N ATOM 0 H GLN A 70 -84.816 -12.863 -43.857 1.00 0.00 H new ATOM 0 HA GLN A 70 -85.821 -10.946 -44.319 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -85.906 -12.096 -47.139 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -86.166 -10.410 -46.739 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -83.885 -10.227 -45.858 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -83.614 -11.937 -46.127 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -85.083 -11.991 -48.698 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -84.003 -11.222 -49.866 1.00 0.00 H new ATOM 746 N TRP A 71 -88.302 -11.393 -46.046 1.00 0.00 N ATOM 747 CA TRP A 71 -89.747 -11.228 -46.041 1.00 0.00 C ATOM 748 C TRP A 71 -90.468 -12.557 -46.219 1.00 0.00 C ATOM 749 O TRP A 71 -90.753 -12.972 -47.341 1.00 0.00 O ATOM 750 CB TRP A 71 -90.180 -10.271 -47.157 1.00 0.00 C ATOM 751 CG TRP A 71 -89.318 -9.049 -47.286 1.00 0.00 C ATOM 752 CD1 TRP A 71 -89.376 -7.913 -46.529 1.00 0.00 C ATOM 753 CD2 TRP A 71 -88.273 -8.838 -48.246 1.00 0.00 C ATOM 754 NE1 TRP A 71 -88.426 -7.016 -46.955 1.00 0.00 N ATOM 755 CE2 TRP A 71 -87.740 -7.559 -48.007 1.00 0.00 C ATOM 756 CE3 TRP A 71 -87.735 -9.609 -49.282 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -86.696 -7.033 -48.764 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -86.700 -9.084 -50.033 1.00 0.00 C ATOM 759 CH2 TRP A 71 -86.191 -7.807 -49.771 1.00 0.00 C ATOM 0 H TRP A 71 -87.856 -11.162 -46.933 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.019 -10.814 -45.070 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.173 -10.809 -48.105 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.208 -9.959 -46.975 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -90.067 -7.745 -45.716 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -88.259 -6.094 -46.552 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -88.121 -10.596 -49.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -86.300 -6.049 -48.563 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -86.277 -9.669 -50.836 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -85.383 -7.425 -50.377 1.00 0.00 H new ATOM 770 N GLU A 72 -90.730 -13.241 -45.118 1.00 0.00 N ATOM 771 CA GLU A 72 -91.618 -14.391 -45.156 1.00 0.00 C ATOM 772 C GLU A 72 -93.028 -13.930 -44.818 1.00 0.00 C ATOM 773 O GLU A 72 -93.983 -14.256 -45.521 1.00 0.00 O ATOM 774 CB GLU A 72 -91.153 -15.493 -44.202 1.00 0.00 C ATOM 775 CG GLU A 72 -91.974 -16.767 -44.311 1.00 0.00 C ATOM 776 CD GLU A 72 -91.333 -17.943 -43.607 1.00 0.00 C ATOM 777 OE1 GLU A 72 -90.450 -18.589 -44.211 1.00 0.00 O ATOM 778 OE2 GLU A 72 -91.705 -18.231 -42.451 1.00 0.00 O ATOM 0 H GLU A 72 -90.346 -13.024 -44.198 1.00 0.00 H new ATOM 0 HA GLU A 72 -91.604 -14.821 -46.158 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -90.108 -15.724 -44.406 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.203 -15.123 -43.178 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -92.964 -16.593 -43.889 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -92.115 -17.013 -45.363 1.00 0.00 H new ATOM 785 N ASP A 73 -93.138 -13.152 -43.745 1.00 0.00 N ATOM 786 CA ASP A 73 -94.388 -12.495 -43.386 1.00 0.00 C ATOM 787 C ASP A 73 -94.083 -11.229 -42.594 1.00 0.00 C ATOM 788 O ASP A 73 -93.900 -11.271 -41.381 1.00 0.00 O ATOM 789 CB ASP A 73 -95.300 -13.415 -42.571 1.00 0.00 C ATOM 790 CG ASP A 73 -96.712 -12.868 -42.468 1.00 0.00 C ATOM 791 OD1 ASP A 73 -96.909 -11.815 -41.826 1.00 0.00 O ATOM 792 OD2 ASP A 73 -97.636 -13.487 -43.045 1.00 0.00 O ATOM 0 H ASP A 73 -92.368 -12.961 -43.104 1.00 0.00 H new ATOM 0 HA ASP A 73 -94.915 -12.242 -44.306 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -95.326 -14.402 -43.033 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -94.886 -13.542 -41.571 1.00 0.00 H new ATOM 797 N PRO A 74 -93.964 -10.092 -43.287 1.00 0.00 N ATOM 798 CA PRO A 74 -93.620 -8.809 -42.678 1.00 0.00 C ATOM 799 C PRO A 74 -94.843 -7.972 -42.287 1.00 0.00 C ATOM 800 O PRO A 74 -94.792 -6.740 -42.313 1.00 0.00 O ATOM 801 CB PRO A 74 -92.881 -8.142 -43.818 1.00 0.00 C ATOM 802 CG PRO A 74 -93.693 -8.531 -44.989 1.00 0.00 C ATOM 803 CD PRO A 74 -94.119 -9.957 -44.744 1.00 0.00 C ATOM 0 HA PRO A 74 -93.065 -8.920 -41.746 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.836 -7.060 -43.696 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.854 -8.497 -43.900 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.559 -7.878 -45.097 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -93.115 -8.449 -45.909 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.147 -10.133 -45.060 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.493 -10.666 -45.286 1.00 0.00 H new ATOM 811 N SER A 75 -95.940 -8.627 -41.933 1.00 0.00 N ATOM 812 CA SER A 75 -97.182 -7.918 -41.659 1.00 0.00 C ATOM 813 C SER A 75 -97.537 -7.953 -40.169 1.00 0.00 C ATOM 814 O SER A 75 -96.654 -7.931 -39.310 1.00 0.00 O ATOM 815 CB SER A 75 -98.310 -8.515 -42.506 1.00 0.00 C ATOM 816 OG SER A 75 -98.563 -9.875 -42.177 1.00 0.00 O ATOM 0 H SER A 75 -95.996 -9.640 -41.829 1.00 0.00 H new ATOM 0 HA SER A 75 -97.048 -6.870 -41.928 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.219 -7.932 -42.361 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.049 -8.440 -43.562 1.00 0.00 H new ATOM 0 HG SER A 75 -97.814 -10.430 -42.480 1.00 0.00 H new ATOM 822 N GLN A 76 -98.845 -7.980 -39.890 1.00 0.00 N ATOM 823 CA GLN A 76 -99.404 -8.020 -38.537 1.00 0.00 C ATOM 824 C GLN A 76 -99.274 -6.689 -37.788 1.00 0.00 C ATOM 825 O GLN A 76 -100.258 -6.183 -37.250 1.00 0.00 O ATOM 826 CB GLN A 76 -98.787 -9.157 -37.729 1.00 0.00 C ATOM 827 CG GLN A 76 -99.157 -10.538 -38.245 1.00 0.00 C ATOM 828 CD GLN A 76 -100.653 -10.805 -38.199 1.00 0.00 C ATOM 829 OE1 GLN A 76 -101.191 -11.525 -39.040 1.00 0.00 O ATOM 830 NE2 GLN A 76 -101.333 -10.236 -37.214 1.00 0.00 N ATOM 0 H GLN A 76 -99.560 -7.974 -40.617 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.472 -8.204 -38.653 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.702 -9.053 -37.740 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -99.106 -9.069 -36.690 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.806 -10.643 -39.271 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -98.640 -11.293 -37.652 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.851 -9.646 -36.536 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -102.338 -10.389 -37.134 1.00 0.00 H new ATOM 839 N ALA A 77 -98.078 -6.119 -37.759 1.00 0.00 N ATOM 840 CA ALA A 77 -97.831 -4.891 -37.001 1.00 0.00 C ATOM 841 C ALA A 77 -98.148 -3.640 -37.820 1.00 0.00 C ATOM 842 O ALA A 77 -97.573 -2.570 -37.589 1.00 0.00 O ATOM 843 CB ALA A 77 -96.386 -4.856 -36.529 1.00 0.00 C ATOM 0 H ALA A 77 -97.261 -6.483 -38.250 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.497 -4.894 -36.138 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -96.209 -3.940 -35.966 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -96.191 -5.718 -35.891 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.721 -4.886 -37.392 1.00 0.00 H new ATOM 849 N SER A 78 -99.084 -3.770 -38.757 1.00 0.00 N ATOM 850 CA SER A 78 -99.445 -2.672 -39.647 1.00 0.00 C ATOM 851 C SER A 78 -99.897 -1.450 -38.854 1.00 0.00 C ATOM 852 O SER A 78 -99.470 -0.326 -39.120 1.00 0.00 O ATOM 853 CB SER A 78 -100.553 -3.125 -40.599 1.00 0.00 C ATOM 854 OG SER A 78 -100.215 -4.358 -41.217 1.00 0.00 O ATOM 0 H SER A 78 -99.608 -4.630 -38.919 1.00 0.00 H new ATOM 0 HA SER A 78 -98.565 -2.390 -40.225 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.489 -3.233 -40.050 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.717 -2.364 -41.362 1.00 0.00 H new ATOM 0 HG SER A 78 -100.938 -4.630 -41.820 1.00 0.00 H new ATOM 860 N LYS A 79 -100.741 -1.688 -37.862 1.00 0.00 N ATOM 861 CA LYS A 79 -101.264 -0.625 -37.021 1.00 0.00 C ATOM 862 C LYS A 79 -100.143 0.059 -36.243 1.00 0.00 C ATOM 863 O LYS A 79 -100.173 1.271 -36.038 1.00 0.00 O ATOM 864 CB LYS A 79 -102.300 -1.200 -36.054 1.00 0.00 C ATOM 865 CG LYS A 79 -102.995 -0.159 -35.193 1.00 0.00 C ATOM 866 CD LYS A 79 -103.860 0.781 -36.020 1.00 0.00 C ATOM 867 CE LYS A 79 -104.884 0.023 -36.849 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.876 0.937 -37.469 1.00 0.00 N ATOM 0 H LYS A 79 -101.081 -2.619 -37.619 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.736 0.122 -37.659 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -103.052 -1.743 -36.626 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.810 -1.925 -35.404 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.614 -0.659 -34.448 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.248 0.420 -34.650 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -104.373 1.479 -35.359 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -103.225 1.374 -36.679 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -104.374 -0.543 -37.629 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -105.400 -0.700 -36.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -106.558 0.383 -38.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -106.381 1.459 -36.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -105.386 1.610 -38.092 1.00 0.00 H new ATOM 882 N VAL A 80 -99.143 -0.721 -35.850 1.00 0.00 N ATOM 883 CA VAL A 80 -98.068 -0.232 -34.994 1.00 0.00 C ATOM 884 C VAL A 80 -97.230 0.836 -35.699 1.00 0.00 C ATOM 885 O VAL A 80 -97.057 1.937 -35.178 1.00 0.00 O ATOM 886 CB VAL A 80 -97.158 -1.389 -34.520 1.00 0.00 C ATOM 887 CG1 VAL A 80 -96.108 -0.893 -33.535 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.993 -2.495 -33.892 1.00 0.00 C ATOM 0 H VAL A 80 -99.054 -1.703 -36.113 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.538 0.222 -34.121 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.640 -1.790 -35.391 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -95.483 -1.728 -33.219 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -95.487 -0.136 -34.015 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -96.601 -0.459 -32.665 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -97.339 -3.303 -33.563 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -98.538 -2.098 -33.036 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -98.701 -2.878 -34.627 1.00 0.00 H new ATOM 898 N CYS A 81 -96.734 0.533 -36.893 1.00 0.00 N ATOM 899 CA CYS A 81 -95.930 1.510 -37.627 1.00 0.00 C ATOM 900 C CYS A 81 -96.807 2.629 -38.178 1.00 0.00 C ATOM 901 O CYS A 81 -96.335 3.741 -38.404 1.00 0.00 O ATOM 902 CB CYS A 81 -95.126 0.843 -38.746 1.00 0.00 C ATOM 903 SG CYS A 81 -93.918 -0.369 -38.133 1.00 0.00 S ATOM 0 H CYS A 81 -96.868 -0.360 -37.367 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.219 1.948 -36.927 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.812 0.347 -39.432 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.604 1.611 -39.317 1.00 0.00 H new ATOM 908 N GLN A 82 -98.092 2.349 -38.352 1.00 0.00 N ATOM 909 CA GLN A 82 -99.029 3.361 -38.820 1.00 0.00 C ATOM 910 C GLN A 82 -99.191 4.453 -37.766 1.00 0.00 C ATOM 911 O GLN A 82 -99.156 5.644 -38.083 1.00 0.00 O ATOM 912 CB GLN A 82 -100.376 2.728 -39.167 1.00 0.00 C ATOM 913 CG GLN A 82 -101.370 3.702 -39.778 1.00 0.00 C ATOM 914 CD GLN A 82 -102.498 2.999 -40.507 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.059 3.530 -41.467 1.00 0.00 O ATOM 916 NE2 GLN A 82 -102.827 1.797 -40.068 1.00 0.00 N ATOM 0 H GLN A 82 -98.508 1.434 -38.177 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.631 3.816 -39.727 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.212 1.905 -39.863 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.809 2.299 -38.263 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.787 4.332 -38.992 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -100.848 4.361 -40.472 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.337 1.394 -39.269 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -103.571 1.272 -40.528 1.00 0.00 H new ATOM 925 N ARG A 83 -99.338 4.044 -36.509 1.00 0.00 N ATOM 926 CA ARG A 83 -99.381 4.996 -35.402 1.00 0.00 C ATOM 927 C ARG A 83 -97.974 5.490 -35.073 1.00 0.00 C ATOM 928 O ARG A 83 -97.799 6.432 -34.299 1.00 0.00 O ATOM 929 CB ARG A 83 -100.037 4.387 -34.157 1.00 0.00 C ATOM 930 CG ARG A 83 -99.407 3.083 -33.705 1.00 0.00 C ATOM 931 CD ARG A 83 -99.997 2.599 -32.391 1.00 0.00 C ATOM 932 NE ARG A 83 -99.591 3.443 -31.274 1.00 0.00 N ATOM 933 CZ ARG A 83 -99.121 2.979 -30.120 1.00 0.00 C ATOM 934 NH1 ARG A 83 -99.067 1.671 -29.892 1.00 0.00 N ATOM 935 NH2 ARG A 83 -98.721 3.826 -29.186 1.00 0.00 N ATOM 0 H ARG A 83 -99.429 3.067 -36.232 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.991 5.843 -35.717 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -99.983 5.107 -33.341 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -101.094 4.217 -34.362 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -99.554 2.323 -34.472 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -98.331 3.218 -33.593 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -101.085 2.588 -32.462 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -99.680 1.573 -32.206 1.00 0.00 H new ATOM 0 HE ARG A 83 -99.673 4.454 -31.385 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.387 1.015 -30.605 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -98.705 1.323 -29.004 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -98.774 4.831 -29.352 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -98.360 3.474 -28.299 1.00 0.00 H new ATOM 949 N LEU A 84 -96.971 4.840 -35.659 1.00 0.00 N ATOM 950 CA LEU A 84 -95.585 5.264 -35.520 1.00 0.00 C ATOM 951 C LEU A 84 -95.207 6.195 -36.673 1.00 0.00 C ATOM 952 O LEU A 84 -94.032 6.477 -36.898 1.00 0.00 O ATOM 953 CB LEU A 84 -94.671 4.048 -35.491 1.00 0.00 C ATOM 954 CG LEU A 84 -93.237 4.322 -35.037 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.219 5.124 -33.743 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.512 3.014 -34.844 1.00 0.00 C ATOM 0 H LEU A 84 -97.097 4.011 -36.239 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.468 5.808 -34.583 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -95.108 3.301 -34.829 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -94.642 3.611 -36.489 1.00 0.00 H new ATOM 0 HG LEU A 84 -92.734 4.909 -35.806 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.187 5.305 -33.442 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.725 6.077 -33.899 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -93.732 4.564 -32.961 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -91.490 3.209 -34.520 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -93.026 2.422 -34.087 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -92.496 2.465 -35.785 1.00 0.00 H new ATOM 968 N ASN A 85 -96.239 6.663 -37.394 1.00 0.00 N ATOM 969 CA ASN A 85 -96.095 7.581 -38.538 1.00 0.00 C ATOM 970 C ASN A 85 -95.025 7.113 -39.526 1.00 0.00 C ATOM 971 O ASN A 85 -94.315 7.921 -40.127 1.00 0.00 O ATOM 972 CB ASN A 85 -95.852 9.045 -38.097 1.00 0.00 C ATOM 973 CG ASN A 85 -94.599 9.273 -37.264 1.00 0.00 C ATOM 974 OD1 ASN A 85 -93.507 9.484 -37.795 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.759 9.274 -35.952 1.00 0.00 N ATOM 0 H ASN A 85 -97.208 6.412 -37.197 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.051 7.560 -39.061 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -95.795 9.671 -38.988 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -96.716 9.383 -37.524 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -93.962 9.454 -35.341 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.679 9.095 -35.550 1.00 0.00 H new ATOM 982 N CYS A 86 -94.957 5.804 -39.734 1.00 0.00 N ATOM 983 CA CYS A 86 -93.998 5.227 -40.666 1.00 0.00 C ATOM 984 C CYS A 86 -94.692 4.378 -41.731 1.00 0.00 C ATOM 985 O CYS A 86 -94.035 3.718 -42.537 1.00 0.00 O ATOM 986 CB CYS A 86 -92.954 4.407 -39.904 1.00 0.00 C ATOM 987 SG CYS A 86 -91.811 5.427 -38.928 1.00 0.00 S ATOM 0 H CYS A 86 -95.556 5.122 -39.269 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.493 6.043 -41.184 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.464 3.709 -39.240 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.381 3.811 -40.614 1.00 0.00 H new ATOM 992 N GLY A 87 -96.021 4.413 -41.738 1.00 0.00 N ATOM 993 CA GLY A 87 -96.784 3.734 -42.770 1.00 0.00 C ATOM 994 C GLY A 87 -97.138 2.305 -42.412 1.00 0.00 C ATOM 995 O GLY A 87 -97.660 2.032 -41.332 1.00 0.00 O ATOM 0 H GLY A 87 -96.586 4.902 -41.044 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.701 4.291 -42.960 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.211 3.738 -43.697 1.00 0.00 H new ATOM 999 N ASP A 88 -96.835 1.396 -43.325 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.132 -0.021 -43.149 1.00 0.00 C ATOM 1001 C ASP A 88 -96.082 -0.645 -42.228 1.00 0.00 C ATOM 1002 O ASP A 88 -95.106 0.021 -41.881 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.177 -0.700 -44.526 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.352 -0.228 -45.363 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -99.510 -0.462 -44.958 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -98.124 0.398 -46.425 1.00 0.00 O ATOM 0 H ASP A 88 -96.377 1.617 -44.209 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.106 -0.159 -42.679 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.249 -0.496 -45.060 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.238 -1.780 -44.394 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.251 -1.904 -41.777 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.366 -2.468 -40.770 1.00 0.00 C ATOM 1013 C PRO A 89 -93.977 -2.759 -41.250 1.00 0.00 C ATOM 1014 O PRO A 89 -93.732 -3.083 -42.414 1.00 0.00 O ATOM 1015 CB PRO A 89 -96.019 -3.767 -40.361 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.868 -4.154 -41.514 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.292 -2.866 -42.182 1.00 0.00 C ATOM 0 HA PRO A 89 -95.243 -1.744 -39.964 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.273 -4.532 -40.146 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.615 -3.641 -39.457 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.316 -4.788 -42.208 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.736 -4.724 -41.183 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.338 -2.973 -43.266 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.281 -2.549 -41.850 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.080 -2.579 -40.315 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.732 -3.035 -40.398 1.00 0.00 C ATOM 1027 C LEU A 90 -91.631 -4.377 -41.082 1.00 0.00 C ATOM 1028 O LEU A 90 -92.202 -5.378 -40.660 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.076 -3.042 -39.009 1.00 0.00 C ATOM 1030 CG LEU A 90 -92.025 -3.045 -37.791 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.136 -4.063 -37.918 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.253 -3.302 -36.520 1.00 0.00 C ATOM 0 H LEU A 90 -93.285 -2.090 -39.444 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.179 -2.333 -41.022 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.433 -3.920 -38.941 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.430 -2.167 -38.934 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.484 -2.057 -37.755 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.772 -4.020 -37.034 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.732 -3.843 -38.804 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.707 -5.061 -38.008 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.938 -3.301 -35.672 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.758 -4.271 -36.585 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.505 -2.520 -36.384 1.00 0.00 H new ATOM 1044 N SER A 91 -90.953 -4.331 -42.196 1.00 0.00 N ATOM 1045 CA SER A 91 -90.657 -5.508 -42.980 1.00 0.00 C ATOM 1046 C SER A 91 -89.467 -6.252 -42.397 1.00 0.00 C ATOM 1047 O SER A 91 -88.610 -5.655 -41.747 1.00 0.00 O ATOM 1048 CB SER A 91 -90.382 -5.102 -44.420 1.00 0.00 C ATOM 1049 OG SER A 91 -91.485 -4.385 -44.945 1.00 0.00 O ATOM 0 H SER A 91 -90.584 -3.467 -42.593 1.00 0.00 H new ATOM 0 HA SER A 91 -91.516 -6.178 -42.957 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.483 -4.487 -44.467 1.00 0.00 H new ATOM 0 HB3 SER A 91 -90.193 -5.988 -45.026 1.00 0.00 H new ATOM 0 HG SER A 91 -91.181 -3.515 -45.278 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.428 -7.550 -42.629 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.380 -8.396 -42.087 1.00 0.00 C ATOM 1057 C LEU A 92 -87.188 -8.488 -43.031 1.00 0.00 C ATOM 1058 O LEU A 92 -87.329 -8.871 -44.191 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.942 -9.787 -41.805 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.709 -9.914 -40.493 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.479 -11.216 -40.453 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.756 -9.836 -39.310 1.00 0.00 C ATOM 0 H LEU A 92 -90.117 -8.046 -43.195 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.027 -7.949 -41.158 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.603 -10.069 -42.625 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.119 -10.501 -41.799 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.416 -9.087 -40.429 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -91.020 -11.290 -39.510 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.187 -11.245 -41.281 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.785 -12.052 -40.539 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.320 -9.928 -38.382 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.029 -10.645 -39.375 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.236 -8.878 -39.325 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.021 -8.123 -42.528 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.800 -8.236 -43.298 1.00 0.00 C ATOM 1076 C GLY A 93 -83.585 -8.141 -42.401 1.00 0.00 C ATOM 1077 O GLY A 93 -83.604 -7.384 -41.434 1.00 0.00 O ATOM 0 H GLY A 93 -85.896 -7.746 -41.589 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.789 -9.186 -43.832 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.765 -7.447 -44.049 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.513 -8.901 -42.678 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.327 -8.924 -41.819 1.00 0.00 C ATOM 1083 C PRO A 94 -80.622 -7.569 -41.769 1.00 0.00 C ATOM 1084 O PRO A 94 -79.942 -7.164 -42.714 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.433 -9.994 -42.450 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.888 -10.083 -43.865 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.364 -9.787 -43.844 1.00 0.00 C ATOM 0 HA PRO A 94 -81.580 -9.142 -40.781 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.381 -9.716 -42.389 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.540 -10.951 -41.939 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.355 -9.368 -44.492 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.694 -11.074 -44.276 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.690 -9.301 -44.763 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.956 -10.696 -43.737 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.811 -6.875 -40.658 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.254 -5.550 -40.459 1.00 0.00 C ATOM 1097 C PHE A 95 -78.829 -5.671 -39.919 1.00 0.00 C ATOM 1098 O PHE A 95 -78.482 -6.673 -39.295 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.150 -4.768 -39.488 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.896 -3.287 -39.454 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -81.003 -2.523 -40.604 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.570 -2.658 -38.265 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.785 -1.159 -40.567 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.350 -1.295 -38.223 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.458 -0.544 -39.375 1.00 0.00 C ATOM 0 H PHE A 95 -81.357 -7.217 -39.867 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.215 -5.011 -41.406 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.192 -4.938 -39.759 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -81.012 -5.170 -38.484 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.259 -2.998 -41.539 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.487 -3.240 -37.359 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -80.870 -0.574 -41.471 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.094 -0.818 -37.289 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.287 0.522 -39.345 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.004 -4.662 -40.164 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.598 -4.714 -39.763 1.00 0.00 C ATOM 1117 C LEU A 96 -76.424 -4.534 -38.252 1.00 0.00 C ATOM 1118 O LEU A 96 -75.344 -4.793 -37.718 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.766 -3.656 -40.504 1.00 0.00 C ATOM 1120 CG LEU A 96 -76.005 -2.199 -40.092 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.829 -1.334 -40.513 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -77.285 -1.661 -40.710 1.00 0.00 C ATOM 0 H LEU A 96 -78.279 -3.800 -40.636 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.237 -5.706 -40.034 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -74.711 -3.885 -40.357 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -75.967 -3.748 -41.571 1.00 0.00 H new ATOM 0 HG LEU A 96 -76.105 -2.168 -39.007 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -75.011 -0.302 -40.215 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -73.920 -1.696 -40.032 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -74.710 -1.383 -41.595 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -77.431 -0.626 -40.402 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -77.213 -1.709 -41.797 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -78.131 -2.262 -40.376 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.480 -4.105 -37.566 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.395 -3.847 -36.130 1.00 0.00 C ATOM 1136 C LYS A 97 -77.187 -5.152 -35.370 1.00 0.00 C ATOM 1137 O LYS A 97 -77.956 -6.100 -35.518 1.00 0.00 O ATOM 1138 CB LYS A 97 -78.655 -3.137 -35.625 1.00 0.00 C ATOM 1139 CG LYS A 97 -78.550 -2.640 -34.190 1.00 0.00 C ATOM 1140 CD LYS A 97 -77.441 -1.607 -34.026 1.00 0.00 C ATOM 1141 CE LYS A 97 -77.690 -0.372 -34.880 1.00 0.00 C ATOM 1142 NZ LYS A 97 -76.601 0.634 -34.742 1.00 0.00 N ATOM 0 H LYS A 97 -78.397 -3.930 -37.976 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.541 -3.194 -35.953 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -78.869 -2.291 -36.277 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -79.501 -3.821 -35.701 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -79.501 -2.203 -33.887 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -78.361 -3.484 -33.526 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.367 -1.316 -32.978 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.485 -2.053 -34.301 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -77.780 -0.667 -35.925 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -78.639 0.081 -34.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -76.812 1.458 -35.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -76.531 0.936 -33.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -75.698 0.212 -35.040 1.00 0.00 H new ATOM 1156 N THR A 98 -76.140 -5.185 -34.560 1.00 0.00 N ATOM 1157 CA THR A 98 -75.742 -6.393 -33.854 1.00 0.00 C ATOM 1158 C THR A 98 -76.722 -6.753 -32.734 1.00 0.00 C ATOM 1159 O THR A 98 -77.222 -5.878 -32.022 1.00 0.00 O ATOM 1160 CB THR A 98 -74.331 -6.221 -33.269 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.453 -5.728 -34.288 1.00 0.00 O ATOM 1162 CG2 THR A 98 -73.791 -7.536 -32.724 1.00 0.00 C ATOM 0 H THR A 98 -75.544 -4.378 -34.374 1.00 0.00 H new ATOM 0 HA THR A 98 -75.747 -7.209 -34.577 1.00 0.00 H new ATOM 0 HB THR A 98 -74.387 -5.511 -32.444 1.00 0.00 H new ATOM 0 HG1 THR A 98 -72.553 -5.616 -33.918 1.00 0.00 H new ATOM 0 HG21 THR A 98 -72.792 -7.379 -32.318 1.00 0.00 H new ATOM 0 HG22 THR A 98 -74.450 -7.901 -31.936 1.00 0.00 H new ATOM 0 HG23 THR A 98 -73.745 -8.271 -33.527 1.00 0.00 H new ATOM 1170 N TYR A 99 -76.985 -8.046 -32.598 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.852 -8.567 -31.550 1.00 0.00 C ATOM 1172 C TYR A 99 -77.010 -8.977 -30.336 1.00 0.00 C ATOM 1173 O TYR A 99 -75.814 -9.239 -30.470 1.00 0.00 O ATOM 1174 CB TYR A 99 -78.646 -9.760 -32.105 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.474 -10.505 -31.083 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -80.755 -10.085 -30.748 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -78.972 -11.637 -30.459 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -81.504 -10.775 -29.815 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.715 -12.327 -29.530 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.979 -11.893 -29.210 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.723 -12.586 -28.286 1.00 0.00 O ATOM 0 H TYR A 99 -76.602 -8.764 -33.213 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.555 -7.799 -31.227 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.306 -9.402 -32.895 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -77.948 -10.459 -32.565 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -81.170 -9.208 -31.223 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -77.979 -11.983 -30.707 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -82.498 -10.438 -29.561 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.307 -13.206 -29.054 1.00 0.00 H new ATOM 0 HH TYR A 99 -81.385 -12.397 -27.386 1.00 0.00 H new ATOM 1191 N THR A 100 -77.632 -9.041 -29.163 1.00 0.00 N ATOM 1192 CA THR A 100 -76.917 -9.345 -27.933 1.00 0.00 C ATOM 1193 C THR A 100 -77.809 -10.135 -26.973 1.00 0.00 C ATOM 1194 O THR A 100 -78.970 -9.796 -26.774 1.00 0.00 O ATOM 1195 CB THR A 100 -76.406 -8.054 -27.247 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.798 -8.361 -25.986 1.00 0.00 O ATOM 1197 CG2 THR A 100 -77.533 -7.050 -27.038 1.00 0.00 C ATOM 0 H THR A 100 -78.633 -8.886 -29.041 1.00 0.00 H new ATOM 0 HA THR A 100 -76.053 -9.956 -28.194 1.00 0.00 H new ATOM 0 HB THR A 100 -75.663 -7.606 -27.908 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.479 -7.535 -25.567 1.00 0.00 H new ATOM 0 HG21 THR A 100 -77.139 -6.156 -26.554 1.00 0.00 H new ATOM 0 HG22 THR A 100 -77.964 -6.781 -28.002 1.00 0.00 H new ATOM 0 HG23 THR A 100 -78.303 -7.494 -26.407 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.277 -11.204 -26.365 1.00 0.00 N ATOM 1206 CA PRO A 101 -78.037 -12.068 -25.462 1.00 0.00 C ATOM 1207 C PRO A 101 -78.228 -11.454 -24.088 1.00 0.00 C ATOM 1208 O PRO A 101 -78.899 -12.016 -23.219 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.186 -13.346 -25.364 1.00 0.00 C ATOM 1210 CG PRO A 101 -76.038 -13.152 -26.308 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.901 -11.670 -26.512 1.00 0.00 C ATOM 0 HA PRO A 101 -79.045 -12.243 -25.837 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.831 -13.501 -24.345 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.770 -14.225 -25.636 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -75.121 -13.573 -25.896 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.224 -13.659 -27.255 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.238 -11.218 -25.774 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.494 -11.431 -27.495 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.654 -10.290 -23.922 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.690 -9.588 -22.650 1.00 0.00 C ATOM 1221 C GLN A 102 -78.937 -8.719 -22.541 1.00 0.00 C ATOM 1222 O GLN A 102 -79.784 -8.941 -21.674 1.00 0.00 O ATOM 1223 CB GLN A 102 -76.427 -8.734 -22.471 1.00 0.00 C ATOM 1224 CG GLN A 102 -76.461 -7.825 -21.245 1.00 0.00 C ATOM 1225 CD GLN A 102 -76.286 -8.556 -19.921 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -75.805 -7.975 -18.950 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -76.657 -9.827 -19.866 1.00 0.00 N ATOM 0 H GLN A 102 -77.148 -9.797 -24.658 1.00 0.00 H new ATOM 0 HA GLN A 102 -77.724 -10.333 -21.855 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.562 -9.393 -22.398 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -76.286 -8.121 -23.361 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -75.675 -7.076 -21.340 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -77.411 -7.290 -21.229 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -77.053 -10.279 -20.690 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -76.547 -10.353 -18.999 1.00 0.00 H new ATOM 1236 N SER A 103 -79.049 -7.742 -23.428 1.00 0.00 N ATOM 1237 CA SER A 103 -80.145 -6.787 -23.370 1.00 0.00 C ATOM 1238 C SER A 103 -81.218 -7.103 -24.409 1.00 0.00 C ATOM 1239 O SER A 103 -82.276 -6.474 -24.431 1.00 0.00 O ATOM 1240 CB SER A 103 -79.602 -5.374 -23.571 1.00 0.00 C ATOM 1241 OG SER A 103 -78.565 -5.102 -22.644 1.00 0.00 O ATOM 0 H SER A 103 -78.395 -7.590 -24.196 1.00 0.00 H new ATOM 0 HA SER A 103 -80.613 -6.858 -22.388 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.226 -5.264 -24.588 1.00 0.00 H new ATOM 0 HB3 SER A 103 -80.406 -4.649 -23.449 1.00 0.00 H new ATOM 0 HG SER A 103 -78.227 -4.193 -22.788 1.00 0.00 H new ATOM 1247 N SER A 104 -80.946 -8.069 -25.275 1.00 0.00 N ATOM 1248 CA SER A 104 -81.930 -8.492 -26.254 1.00 0.00 C ATOM 1249 C SER A 104 -82.360 -9.929 -25.973 1.00 0.00 C ATOM 1250 O SER A 104 -81.651 -10.678 -25.292 1.00 0.00 O ATOM 1251 CB SER A 104 -81.364 -8.356 -27.665 1.00 0.00 C ATOM 1252 OG SER A 104 -80.837 -7.057 -27.875 1.00 0.00 O ATOM 0 H SER A 104 -80.058 -8.570 -25.318 1.00 0.00 H new ATOM 0 HA SER A 104 -82.808 -7.850 -26.179 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.582 -9.100 -27.821 1.00 0.00 H new ATOM 0 HB3 SER A 104 -82.147 -8.558 -28.396 1.00 0.00 H new ATOM 0 HG SER A 104 -80.478 -6.993 -28.785 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.523 -10.305 -26.482 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.100 -11.601 -26.183 1.00 0.00 C ATOM 1260 C ILE A 105 -84.684 -12.273 -27.429 1.00 0.00 C ATOM 1261 O ILE A 105 -84.960 -11.623 -28.437 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.197 -11.491 -25.083 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.161 -10.326 -25.339 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.574 -11.331 -23.705 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.117 -10.543 -26.486 1.00 0.00 C ATOM 0 H ILE A 105 -84.086 -9.727 -27.106 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.286 -12.223 -25.812 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.765 -12.420 -25.122 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.738 -10.143 -24.432 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.578 -9.426 -25.534 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.362 -11.257 -22.956 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.946 -12.195 -23.487 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.966 -10.426 -23.683 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.760 -9.670 -26.594 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.553 -10.694 -27.406 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.730 -11.422 -26.288 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.837 -13.582 -27.345 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.575 -14.353 -28.334 1.00 0.00 C ATOM 1279 C ILE A 106 -86.883 -14.817 -27.690 1.00 0.00 C ATOM 1280 O ILE A 106 -86.852 -15.663 -26.794 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.829 -15.638 -28.750 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.450 -15.328 -29.296 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.638 -16.392 -29.798 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.612 -16.563 -29.548 1.00 0.00 C ATOM 0 H ILE A 106 -84.452 -14.144 -26.586 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.718 -13.716 -29.207 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.710 -16.257 -27.861 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.553 -14.771 -30.228 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.926 -14.680 -28.593 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.105 -17.298 -30.087 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.610 -16.659 -29.384 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.778 -15.759 -30.674 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.638 -16.268 -29.938 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.479 -17.109 -28.614 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.115 -17.202 -30.274 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.020 -14.284 -28.086 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.268 -14.793 -27.530 1.00 0.00 C ATOM 1298 C CYS A 107 -89.709 -16.032 -28.305 1.00 0.00 C ATOM 1299 O CYS A 107 -89.226 -16.278 -29.410 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.382 -13.748 -27.552 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.972 -12.133 -26.839 1.00 0.00 S ATOM 0 H CYS A 107 -88.113 -13.528 -28.764 1.00 0.00 H new ATOM 0 HA CYS A 107 -89.081 -15.049 -26.487 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.692 -13.598 -28.586 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.242 -14.151 -27.017 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.617 -16.811 -27.728 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.116 -18.020 -28.377 1.00 0.00 C ATOM 1308 C TYR A 108 -92.604 -18.199 -28.115 1.00 0.00 C ATOM 1309 O TYR A 108 -93.203 -17.444 -27.347 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.345 -19.262 -27.912 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.041 -19.476 -28.647 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -89.040 -19.877 -29.976 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.819 -19.272 -28.022 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.858 -20.073 -30.662 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.631 -19.464 -28.700 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.655 -19.865 -30.022 1.00 0.00 C ATOM 1317 OH TYR A 108 -85.475 -20.054 -30.710 1.00 0.00 O ATOM 0 H TYR A 108 -91.024 -16.627 -26.811 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.960 -17.904 -29.450 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.141 -19.174 -26.845 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.975 -20.141 -28.044 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.980 -20.038 -30.482 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -87.796 -18.958 -26.989 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -87.876 -20.388 -31.695 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.688 -19.301 -28.199 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.717 -19.865 -30.118 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.194 -19.201 -28.749 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.619 -19.418 -28.626 1.00 0.00 C ATOM 1329 C GLY A 109 -95.339 -19.136 -29.922 1.00 0.00 C ATOM 1330 O GLY A 109 -94.925 -19.592 -30.988 1.00 0.00 O ATOM 0 H GLY A 109 -92.709 -19.869 -29.348 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.806 -20.448 -28.322 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.019 -18.777 -27.840 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.412 -18.381 -29.826 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.180 -17.980 -30.994 1.00 0.00 C ATOM 1336 C GLN A 110 -96.839 -16.548 -31.370 1.00 0.00 C ATOM 1337 O GLN A 110 -96.799 -15.673 -30.506 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.677 -18.093 -30.707 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.113 -19.491 -30.307 1.00 0.00 C ATOM 1340 CD GLN A 110 -100.572 -19.562 -29.912 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -101.225 -20.588 -30.105 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -101.096 -18.478 -29.354 1.00 0.00 N ATOM 0 H GLN A 110 -96.779 -18.027 -28.942 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.927 -18.641 -31.823 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.940 -17.397 -29.910 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.233 -17.787 -31.593 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -98.933 -20.174 -31.137 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.499 -19.833 -29.474 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -100.520 -17.648 -29.212 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -102.075 -18.474 -29.067 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.573 -16.313 -32.651 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.289 -14.969 -33.142 1.00 0.00 C ATOM 1353 C LEU A 111 -97.489 -14.055 -32.908 1.00 0.00 C ATOM 1354 O LEU A 111 -98.435 -14.032 -33.694 1.00 0.00 O ATOM 1355 CB LEU A 111 -95.928 -15.004 -34.632 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.549 -13.653 -35.247 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.283 -13.106 -34.605 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.376 -13.784 -36.753 1.00 0.00 C ATOM 0 H LEU A 111 -96.548 -17.037 -33.369 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.436 -14.574 -32.591 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.096 -15.694 -34.771 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.775 -15.411 -35.184 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.358 -12.948 -35.054 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.032 -12.146 -35.056 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.446 -12.973 -33.536 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.463 -13.807 -34.763 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.107 -12.815 -37.174 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.587 -14.505 -36.967 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.310 -14.126 -37.198 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.448 -13.316 -31.810 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.571 -12.491 -31.427 1.00 0.00 C ATOM 1372 C GLY A 112 -98.925 -12.670 -29.965 1.00 0.00 C ATOM 1373 O GLY A 112 -99.770 -11.960 -29.433 1.00 0.00 O ATOM 0 H GLY A 112 -96.651 -13.274 -31.175 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.336 -11.444 -31.619 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.434 -12.742 -32.044 1.00 0.00 H new ATOM 1377 N SER A 113 -98.289 -13.630 -29.314 1.00 0.00 N ATOM 1378 CA SER A 113 -98.481 -13.830 -27.889 1.00 0.00 C ATOM 1379 C SER A 113 -97.198 -13.477 -27.130 1.00 0.00 C ATOM 1380 O SER A 113 -96.314 -14.313 -26.948 1.00 0.00 O ATOM 1381 CB SER A 113 -98.899 -15.277 -27.606 1.00 0.00 C ATOM 1382 OG SER A 113 -100.050 -15.634 -28.362 1.00 0.00 O ATOM 0 H SER A 113 -97.636 -14.282 -29.750 1.00 0.00 H new ATOM 0 HA SER A 113 -99.278 -13.171 -27.544 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.077 -15.950 -27.849 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.106 -15.398 -26.543 1.00 0.00 H new ATOM 0 HG SER A 113 -100.649 -16.178 -27.809 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.109 -12.227 -26.693 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.905 -11.694 -26.053 1.00 0.00 C ATOM 1390 C PHE A 114 -95.886 -12.008 -24.560 1.00 0.00 C ATOM 1391 O PHE A 114 -95.345 -11.248 -23.763 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.842 -10.173 -26.249 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.564 -9.733 -27.664 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.253 -10.283 -28.738 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.606 -8.768 -27.919 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.991 -9.875 -30.031 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.340 -8.358 -29.210 1.00 0.00 C ATOM 1398 CZ PHE A 114 -95.032 -8.911 -30.267 1.00 0.00 C ATOM 0 H PHE A 114 -97.868 -11.551 -26.771 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.040 -12.168 -26.518 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.789 -9.739 -25.927 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.068 -9.768 -25.598 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -97.003 -11.039 -28.559 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.059 -8.330 -27.097 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.536 -10.310 -30.856 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.589 -7.603 -29.392 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.824 -8.590 -31.277 1.00 0.00 H new ATOM 1408 N SER A 115 -96.458 -13.139 -24.185 1.00 0.00 N ATOM 1409 CA SER A 115 -96.555 -13.505 -22.781 1.00 0.00 C ATOM 1410 C SER A 115 -95.472 -14.509 -22.387 1.00 0.00 C ATOM 1411 O SER A 115 -95.574 -15.165 -21.349 1.00 0.00 O ATOM 1412 CB SER A 115 -97.940 -14.083 -22.490 1.00 0.00 C ATOM 1413 OG SER A 115 -98.959 -13.171 -22.859 1.00 0.00 O ATOM 0 H SER A 115 -96.861 -13.818 -24.830 1.00 0.00 H new ATOM 0 HA SER A 115 -96.405 -12.604 -22.186 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.069 -15.018 -23.035 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.024 -14.318 -21.429 1.00 0.00 H new ATOM 0 HG SER A 115 -99.836 -13.564 -22.665 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.434 -14.625 -23.212 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.334 -15.542 -22.930 1.00 0.00 C ATOM 1421 C ASN A 116 -92.153 -15.280 -23.858 1.00 0.00 C ATOM 1422 O ASN A 116 -92.290 -15.311 -25.081 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.791 -16.999 -23.082 1.00 0.00 C ATOM 1424 CG ASN A 116 -92.746 -17.995 -22.615 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.966 -17.718 -21.702 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -92.726 -19.164 -23.236 1.00 0.00 N ATOM 0 H ASN A 116 -94.332 -14.097 -24.079 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.018 -15.371 -21.901 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.709 -17.148 -22.513 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.029 -17.193 -24.128 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -92.047 -19.875 -22.963 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -93.389 -19.354 -23.987 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.996 -15.013 -23.273 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.772 -14.857 -24.041 1.00 0.00 C ATOM 1435 C CYS A 117 -88.623 -15.567 -23.335 1.00 0.00 C ATOM 1436 O CYS A 117 -88.804 -16.139 -22.259 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.404 -13.380 -24.229 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.681 -12.325 -24.964 1.00 0.00 S ATOM 0 H CYS A 117 -90.879 -14.900 -22.266 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.943 -15.298 -25.023 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.136 -12.967 -23.256 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.513 -13.326 -24.854 1.00 0.00 H new ATOM 1443 N SER A 118 -87.449 -15.540 -23.945 1.00 0.00 N ATOM 1444 CA SER A 118 -86.243 -16.077 -23.337 1.00 0.00 C ATOM 1445 C SER A 118 -85.037 -15.327 -23.886 1.00 0.00 C ATOM 1446 O SER A 118 -85.187 -14.485 -24.765 1.00 0.00 O ATOM 1447 CB SER A 118 -86.120 -17.577 -23.622 1.00 0.00 C ATOM 1448 OG SER A 118 -87.237 -18.284 -23.107 1.00 0.00 O ATOM 0 H SER A 118 -87.306 -15.146 -24.875 1.00 0.00 H new ATOM 0 HA SER A 118 -86.291 -15.946 -22.256 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.044 -17.742 -24.697 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.203 -17.962 -23.175 1.00 0.00 H new ATOM 0 HG SER A 118 -87.138 -19.239 -23.302 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.855 -15.604 -23.365 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.645 -14.969 -23.873 1.00 0.00 C ATOM 1456 C HIS A 119 -82.061 -15.782 -25.019 1.00 0.00 C ATOM 1457 O HIS A 119 -82.447 -16.934 -25.225 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.608 -14.784 -22.758 1.00 0.00 C ATOM 1459 CG HIS A 119 -81.944 -13.667 -21.818 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.212 -12.502 -21.741 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.956 -13.532 -20.927 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -81.760 -11.700 -20.846 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -82.821 -12.299 -20.338 1.00 0.00 N ATOM 0 H HIS A 119 -83.704 -16.258 -22.597 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.912 -13.981 -24.248 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.522 -15.712 -22.193 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.633 -14.592 -23.206 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.378 -12.292 -22.289 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.726 -14.260 -20.719 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -81.400 -10.718 -20.575 1.00 0.00 H new ATOM 1472 N SER A 120 -81.161 -15.164 -25.773 1.00 0.00 N ATOM 1473 CA SER A 120 -80.497 -15.819 -26.890 1.00 0.00 C ATOM 1474 C SER A 120 -79.826 -17.116 -26.434 1.00 0.00 C ATOM 1475 O SER A 120 -78.808 -17.093 -25.735 1.00 0.00 O ATOM 1476 CB SER A 120 -79.470 -14.863 -27.505 1.00 0.00 C ATOM 1477 OG SER A 120 -78.847 -15.424 -28.645 1.00 0.00 O ATOM 0 H SER A 120 -80.872 -14.197 -25.627 1.00 0.00 H new ATOM 0 HA SER A 120 -81.239 -16.076 -27.645 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.962 -13.930 -27.781 1.00 0.00 H new ATOM 0 HB3 SER A 120 -78.712 -14.616 -26.761 1.00 0.00 H new ATOM 0 HG SER A 120 -78.093 -14.860 -28.916 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.432 -18.245 -26.792 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.945 -19.546 -26.352 1.00 0.00 C ATOM 1485 C ARG A 121 -79.572 -20.448 -27.530 1.00 0.00 C ATOM 1486 O ARG A 121 -78.406 -20.547 -27.910 1.00 0.00 O ATOM 1487 CB ARG A 121 -81.010 -20.235 -25.490 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.554 -21.552 -24.877 1.00 0.00 C ATOM 1489 CD ARG A 121 -81.691 -22.251 -24.149 1.00 0.00 C ATOM 1490 NE ARG A 121 -82.308 -21.386 -23.148 1.00 0.00 N ATOM 1491 CZ ARG A 121 -83.420 -21.682 -22.479 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -84.019 -22.856 -22.649 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -83.919 -20.806 -21.618 1.00 0.00 N ATOM 0 H ARG A 121 -81.261 -18.284 -27.385 1.00 0.00 H new ATOM 0 HA ARG A 121 -79.042 -19.378 -25.765 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -81.309 -19.558 -24.690 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -81.895 -20.417 -26.100 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -80.167 -22.204 -25.660 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -79.735 -21.367 -24.182 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -82.445 -22.567 -24.870 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -81.314 -23.153 -23.667 1.00 0.00 H new ATOM 0 HE ARG A 121 -81.856 -20.494 -22.948 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -83.627 -23.540 -23.297 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -84.871 -23.074 -22.132 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -83.451 -19.912 -21.472 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -84.771 -21.026 -21.102 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.527 -16.197 -32.901 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.068 -15.248 -33.883 1.00 0.00 C ATOM 1552 C CYS A 125 -80.026 -14.339 -34.519 1.00 0.00 C ATOM 1553 O CYS A 125 -79.445 -13.457 -33.884 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.238 -14.418 -33.334 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.145 -13.952 -31.585 1.00 0.00 S ATOM 0 HA CYS A 125 -81.448 -15.890 -34.677 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.318 -13.507 -33.927 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.158 -14.981 -33.489 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.821 -14.547 -35.811 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.004 -13.644 -36.606 1.00 0.00 C ATOM 1562 C HIS A 126 -79.647 -12.267 -36.562 1.00 0.00 C ATOM 1563 O HIS A 126 -80.807 -12.145 -36.163 1.00 0.00 O ATOM 1564 CB HIS A 126 -78.898 -14.138 -38.055 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.593 -15.601 -38.161 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -77.324 -16.123 -38.057 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -79.418 -16.661 -38.325 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.382 -17.439 -38.149 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -78.645 -17.792 -38.311 1.00 0.00 N ATOM 0 H HIS A 126 -80.210 -15.334 -36.331 1.00 0.00 H new ATOM 0 HA HIS A 126 -77.994 -13.603 -36.199 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.835 -13.931 -38.572 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.119 -13.573 -38.568 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -80.491 -16.622 -38.445 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -76.539 -18.113 -38.100 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -78.988 -18.748 -38.409 1.00 0.00 H new ATOM 1578 N SER A 127 -78.922 -11.238 -36.969 1.00 0.00 N ATOM 1579 CA SER A 127 -79.426 -9.882 -36.850 1.00 0.00 C ATOM 1580 C SER A 127 -80.552 -9.610 -37.850 1.00 0.00 C ATOM 1581 O SER A 127 -80.361 -8.952 -38.866 1.00 0.00 O ATOM 1582 CB SER A 127 -78.285 -8.876 -37.013 1.00 0.00 C ATOM 1583 OG SER A 127 -77.525 -9.145 -38.179 1.00 0.00 O ATOM 0 H SER A 127 -77.992 -11.315 -37.381 1.00 0.00 H new ATOM 0 HA SER A 127 -79.849 -9.765 -35.852 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.692 -7.866 -37.066 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.637 -8.912 -36.137 1.00 0.00 H new ATOM 0 HG SER A 127 -77.647 -8.418 -38.824 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.719 -10.167 -37.568 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.916 -9.875 -38.332 1.00 0.00 C ATOM 1591 C LEU A 128 -83.533 -8.600 -37.799 1.00 0.00 C ATOM 1592 O LEU A 128 -83.654 -8.423 -36.587 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.925 -11.028 -38.246 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.808 -12.101 -39.336 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.092 -11.500 -40.703 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.435 -12.757 -39.317 1.00 0.00 C ATOM 0 H LEU A 128 -81.860 -10.831 -36.806 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.647 -9.751 -39.381 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -83.815 -11.510 -37.275 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.931 -10.609 -38.282 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.551 -12.872 -39.131 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -84.005 -12.274 -41.466 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.101 -11.088 -40.717 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.374 -10.706 -40.908 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.382 -13.513 -40.100 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.668 -12.002 -39.489 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.270 -13.227 -38.348 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.905 -7.710 -38.694 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.432 -6.438 -38.285 1.00 0.00 C ATOM 1610 C GLY A 129 -85.765 -6.161 -38.921 1.00 0.00 C ATOM 1611 O GLY A 129 -86.116 -6.761 -39.940 1.00 0.00 O ATOM 0 H GLY A 129 -83.850 -7.848 -39.703 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.535 -6.418 -37.200 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.729 -5.649 -38.553 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.504 -5.261 -38.318 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.796 -4.868 -38.823 1.00 0.00 C ATOM 1617 C LEU A 130 -87.753 -3.398 -39.228 1.00 0.00 C ATOM 1618 O LEU A 130 -87.192 -2.569 -38.521 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.857 -5.114 -37.755 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.425 -6.534 -37.715 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -90.187 -6.772 -36.424 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.339 -6.767 -38.910 1.00 0.00 C ATOM 0 H LEU A 130 -86.226 -4.780 -37.462 1.00 0.00 H new ATOM 0 HA LEU A 130 -88.052 -5.461 -39.701 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.428 -4.884 -36.780 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.679 -4.416 -37.914 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.593 -7.237 -37.760 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.582 -7.788 -36.417 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.516 -6.638 -35.575 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -91.011 -6.062 -36.351 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.737 -7.781 -38.871 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -91.162 -6.053 -38.884 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.773 -6.635 -39.832 1.00 0.00 H new ATOM 1634 N THR A 131 -88.322 -3.077 -40.373 1.00 0.00 N ATOM 1635 CA THR A 131 -88.254 -1.719 -40.882 1.00 0.00 C ATOM 1636 C THR A 131 -89.604 -1.262 -41.443 1.00 0.00 C ATOM 1637 O THR A 131 -90.037 -1.718 -42.504 1.00 0.00 O ATOM 1638 CB THR A 131 -87.126 -1.629 -41.918 1.00 0.00 C ATOM 1639 OG1 THR A 131 -87.010 -0.307 -42.443 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.308 -2.624 -43.054 1.00 0.00 C ATOM 0 H THR A 131 -88.833 -3.731 -40.966 1.00 0.00 H new ATOM 0 HA THR A 131 -88.026 -1.035 -40.065 1.00 0.00 H new ATOM 0 HB THR A 131 -86.204 -1.883 -41.394 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.471 0.322 -41.850 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.485 -2.522 -43.762 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.318 -3.637 -42.652 1.00 0.00 H new ATOM 0 HG23 THR A 131 -88.251 -2.426 -43.563 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.280 -0.387 -40.681 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.684 -0.022 -40.928 1.00 0.00 C ATOM 1650 C CYS A 132 -91.945 0.320 -42.380 1.00 0.00 C ATOM 1651 O CYS A 132 -91.553 1.379 -42.876 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.119 1.120 -40.012 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.171 0.646 -38.258 1.00 0.00 S ATOM 0 H CYS A 132 -89.869 0.087 -39.877 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.286 -0.901 -40.696 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.433 1.958 -40.136 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.106 1.468 -40.318 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.594 -0.636 -43.035 1.00 0.00 N ATOM 1659 CA LEU A 133 -93.001 -0.567 -44.423 1.00 0.00 C ATOM 1660 C LEU A 133 -91.819 -0.735 -45.380 1.00 0.00 C ATOM 1661 O LEU A 133 -91.830 -1.598 -46.259 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.761 0.735 -44.720 1.00 0.00 C ATOM 1663 CG LEU A 133 -94.025 1.029 -46.203 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.776 -0.118 -46.862 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.801 2.328 -46.351 1.00 0.00 C ATOM 0 H LEU A 133 -92.859 -1.515 -42.590 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.679 -1.404 -44.592 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.718 0.702 -44.199 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.197 1.567 -44.298 1.00 0.00 H new ATOM 0 HG LEU A 133 -93.064 1.134 -46.706 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.950 0.117 -47.912 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -94.185 -1.031 -46.787 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -95.732 -0.263 -46.360 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.982 2.525 -47.408 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.754 2.244 -45.829 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.224 3.147 -45.922 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.808 0.095 -45.209 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.636 0.066 -46.071 1.00 0.00 C ATOM 1679 C GLU A 134 -88.363 0.298 -45.269 1.00 0.00 C ATOM 1680 O GLU A 134 -87.398 -0.456 -45.394 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.759 1.118 -47.173 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.990 2.526 -46.650 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.995 3.557 -47.757 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -91.048 3.740 -48.399 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -88.939 4.181 -47.998 1.00 0.00 O ATOM 0 H GLU A 134 -90.773 0.804 -44.476 1.00 0.00 H new ATOM 0 HA GLU A 134 -89.579 -0.922 -46.528 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.851 1.108 -47.776 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.582 0.845 -47.833 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.941 2.562 -46.119 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -89.212 2.775 -45.928 1.00 0.00 H new