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 47 GLN : amide:sc= -5.38! C(o=-6.3!,f=-8.2!) USER MOD Set 1.2: A 99 TYR OH : rot -39:sc= -0.887 USER MOD Set 2.1: A 43 LYS NZ :NH3+ -137:sc= 0.858 (180deg=0) USER MOD Set 2.2: A 85 ASN : amide:sc= -0.158 K(o=0.7,f=-6!) USER MOD Single : A 27 SER OG : rot 158:sc= -0.525 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 0.208 K(o=0.21,f=-0.34) USER MOD Single : A 38 THR OG1 : rot 155:sc= 0.95 USER MOD Single : A 40 SER OG : rot 165:sc= 1.65 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 42 SER OG : rot 180:sc= 0.216 USER MOD Single : A 45 GLN : amide:sc= -0.914 K(o=-0.91,f=0.017) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 140:sc= -1.54 (180deg=-4.04!) USER MOD Single : A 57 HIS : no HD1:sc= -2.43! X(o=-2.4!,f=-2) USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 106:sc= 1.18 USER MOD Single : A 62 GLN : amide:sc= -1.69 K(o=-1.7,f=-2.8) USER MOD Single : A 63 SER OG : rot 73:sc= 1.13 USER MOD Single : A 67 SER OG : rot 133:sc= 0.0029 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.832 K(o=-0.83,f=0) USER MOD Single : A 75 SER OG : rot -10:sc= 0.0928 USER MOD Single : A 76 GLN : amide:sc= 1.08 K(o=1.1,f=-0.34) USER MOD Single : A 78 SER OG : rot -147:sc= 0.00956 USER MOD Single : A 79 LYS NZ :NH3+ 178:sc= 2.19 (180deg=2) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0809) USER MOD Single : A 98 THR OG1 : rot 6:sc= 0.806 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -64:sc= 0.776 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -1.18 K(o=-1.2,f=-5.9!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -46:sc= 0.0439 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 118 SER OG : rot 1:sc= 0.496 USER MOD Single : A 119 HIS : no HE2:sc= 1.19 K(o=1.2,f=-4!) USER MOD Single : A 120 SER OG : rot 180:sc=-0.00598 USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 127 SER OG : rot 122:sc= 1.44 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.352 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.002 -9.205 -24.316 1.00 0.00 N ATOM 26 CA LEU A 26 -99.668 -8.817 -24.747 1.00 0.00 C ATOM 27 C LEU A 26 -99.433 -9.320 -26.165 1.00 0.00 C ATOM 28 O LEU A 26 -98.993 -10.443 -26.369 1.00 0.00 O ATOM 29 CB LEU A 26 -98.609 -9.405 -23.811 1.00 0.00 C ATOM 30 CG LEU A 26 -98.780 -9.071 -22.329 1.00 0.00 C ATOM 31 CD1 LEU A 26 -97.750 -9.827 -21.505 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.659 -7.571 -22.096 1.00 0.00 C ATOM 0 HA LEU A 26 -99.589 -7.730 -24.721 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.612 -10.489 -23.924 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -97.629 -9.054 -24.134 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.777 -9.380 -22.014 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -97.878 -9.584 -20.450 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -97.884 -10.899 -21.649 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -96.748 -9.541 -21.824 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.784 -7.356 -21.035 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.676 -7.230 -22.422 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.430 -7.051 -22.665 1.00 0.00 H new ATOM 44 N SER A 27 -99.810 -8.515 -27.136 1.00 0.00 N ATOM 45 CA SER A 27 -99.679 -8.878 -28.530 1.00 0.00 C ATOM 46 C SER A 27 -99.383 -7.640 -29.351 1.00 0.00 C ATOM 47 O SER A 27 -99.900 -6.568 -29.049 1.00 0.00 O ATOM 48 CB SER A 27 -100.969 -9.545 -29.004 1.00 0.00 C ATOM 49 OG SER A 27 -102.097 -8.738 -28.710 1.00 0.00 O ATOM 0 H SER A 27 -100.215 -7.592 -26.981 1.00 0.00 H new ATOM 0 HA SER A 27 -98.856 -9.581 -28.654 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.916 -9.725 -30.078 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.078 -10.517 -28.523 1.00 0.00 H new ATOM 0 HG SER A 27 -102.835 -8.978 -29.308 1.00 0.00 H new ATOM 55 N TRP A 28 -98.578 -7.765 -30.397 1.00 0.00 N ATOM 56 CA TRP A 28 -98.228 -6.591 -31.185 1.00 0.00 C ATOM 57 C TRP A 28 -99.398 -6.134 -32.057 1.00 0.00 C ATOM 58 O TRP A 28 -99.335 -5.083 -32.698 1.00 0.00 O ATOM 59 CB TRP A 28 -96.958 -6.816 -32.019 1.00 0.00 C ATOM 60 CG TRP A 28 -97.047 -7.862 -33.097 1.00 0.00 C ATOM 61 CD1 TRP A 28 -98.035 -8.785 -33.306 1.00 0.00 C ATOM 62 CD2 TRP A 28 -96.068 -8.089 -34.116 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.729 -9.562 -34.399 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.523 -9.155 -34.910 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.847 -7.487 -34.429 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.800 -9.630 -36.002 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -94.130 -7.957 -35.511 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.606 -9.019 -36.284 1.00 0.00 C ATOM 0 H TRP A 28 -98.164 -8.642 -30.714 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.009 -5.788 -30.482 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.680 -5.869 -32.483 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.148 -7.089 -31.343 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.924 -8.888 -32.702 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -98.305 -10.318 -34.769 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.470 -6.668 -33.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -96.166 -10.449 -36.604 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -93.186 -7.497 -35.764 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -94.020 -9.366 -37.122 1.00 0.00 H new ATOM 79 N TYR A 29 -100.481 -6.904 -32.054 1.00 0.00 N ATOM 80 CA TYR A 29 -101.685 -6.517 -32.776 1.00 0.00 C ATOM 81 C TYR A 29 -102.697 -5.864 -31.836 1.00 0.00 C ATOM 82 O TYR A 29 -103.695 -5.305 -32.286 1.00 0.00 O ATOM 83 CB TYR A 29 -102.308 -7.706 -33.521 1.00 0.00 C ATOM 84 CG TYR A 29 -102.592 -8.933 -32.677 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.770 -9.047 -31.946 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.693 -9.991 -32.638 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.039 -10.178 -31.197 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.958 -11.128 -31.898 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.130 -11.215 -31.177 1.00 0.00 C ATOM 90 OH TYR A 29 -103.397 -12.348 -30.441 1.00 0.00 O ATOM 0 H TYR A 29 -100.549 -7.795 -31.562 1.00 0.00 H new ATOM 0 HA TYR A 29 -101.395 -5.782 -33.527 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -103.242 -7.377 -33.977 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.640 -7.993 -34.333 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.486 -8.239 -31.964 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.771 -9.924 -33.196 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -104.956 -10.249 -30.631 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.251 -11.944 -31.885 1.00 0.00 H new ATOM 0 HH TYR A 29 -102.656 -12.982 -30.536 1.00 0.00 H new ATOM 100 N ASP A 30 -102.413 -5.904 -30.532 1.00 0.00 N ATOM 101 CA ASP A 30 -103.259 -5.241 -29.537 1.00 0.00 C ATOM 102 C ASP A 30 -103.230 -3.733 -29.767 1.00 0.00 C ATOM 103 O ASP A 30 -102.152 -3.140 -29.864 1.00 0.00 O ATOM 104 CB ASP A 30 -102.784 -5.563 -28.114 1.00 0.00 C ATOM 105 CG ASP A 30 -103.718 -5.025 -27.043 1.00 0.00 C ATOM 106 OD1 ASP A 30 -103.804 -3.789 -26.883 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.377 -5.839 -26.355 1.00 0.00 O ATOM 0 H ASP A 30 -101.605 -6.388 -30.141 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.279 -5.608 -29.647 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.695 -6.644 -28.002 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -101.789 -5.144 -27.965 1.00 0.00 H new ATOM 112 N PRO A 31 -104.406 -3.099 -29.870 1.00 0.00 N ATOM 113 CA PRO A 31 -104.529 -1.688 -30.255 1.00 0.00 C ATOM 114 C PRO A 31 -103.736 -0.735 -29.361 1.00 0.00 C ATOM 115 O PRO A 31 -103.285 0.316 -29.819 1.00 0.00 O ATOM 116 CB PRO A 31 -106.028 -1.407 -30.134 1.00 0.00 C ATOM 117 CG PRO A 31 -106.678 -2.744 -30.236 1.00 0.00 C ATOM 118 CD PRO A 31 -105.719 -3.711 -29.607 1.00 0.00 C ATOM 0 HA PRO A 31 -104.123 -1.522 -31.253 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -106.264 -0.924 -29.186 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -106.370 -0.740 -30.925 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -107.638 -2.753 -29.720 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -106.873 -3.006 -31.276 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.904 -3.825 -28.539 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.797 -4.703 -30.051 1.00 0.00 H new ATOM 126 N ASP A 32 -103.550 -1.092 -28.098 1.00 0.00 N ATOM 127 CA ASP A 32 -102.844 -0.211 -27.171 1.00 0.00 C ATOM 128 C ASP A 32 -101.620 -0.891 -26.569 1.00 0.00 C ATOM 129 O ASP A 32 -101.214 -0.588 -25.448 1.00 0.00 O ATOM 130 CB ASP A 32 -103.779 0.315 -26.071 1.00 0.00 C ATOM 131 CG ASP A 32 -104.612 -0.761 -25.400 1.00 0.00 C ATOM 132 OD1 ASP A 32 -104.126 -1.395 -24.439 1.00 0.00 O ATOM 133 OD2 ASP A 32 -105.779 -0.946 -25.812 1.00 0.00 O ATOM 0 H ASP A 32 -103.872 -1.971 -27.694 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.494 0.645 -27.748 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -103.182 0.823 -25.313 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -104.447 1.060 -26.503 1.00 0.00 H new ATOM 138 N PHE A 33 -101.011 -1.781 -27.342 1.00 0.00 N ATOM 139 CA PHE A 33 -99.756 -2.412 -26.946 1.00 0.00 C ATOM 140 C PHE A 33 -98.574 -1.580 -27.444 1.00 0.00 C ATOM 141 O PHE A 33 -98.632 -0.986 -28.524 1.00 0.00 O ATOM 142 CB PHE A 33 -99.685 -3.836 -27.507 1.00 0.00 C ATOM 143 CG PHE A 33 -98.482 -4.618 -27.060 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.436 -5.182 -25.797 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.400 -4.797 -27.910 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.335 -5.907 -25.388 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.298 -5.522 -27.504 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.265 -6.077 -26.242 1.00 0.00 C ATOM 0 H PHE A 33 -101.366 -2.084 -28.249 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.710 -2.465 -25.858 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.585 -4.376 -27.211 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.687 -3.785 -28.596 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.271 -5.053 -25.124 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.420 -4.365 -28.899 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -97.311 -6.341 -24.399 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.462 -5.655 -28.174 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.403 -6.644 -25.923 1.00 0.00 H new ATOM 158 N GLN A 34 -97.507 -1.534 -26.655 1.00 0.00 N ATOM 159 CA GLN A 34 -96.341 -0.716 -26.981 1.00 0.00 C ATOM 160 C GLN A 34 -95.324 -1.506 -27.802 1.00 0.00 C ATOM 161 O GLN A 34 -94.787 -2.513 -27.336 1.00 0.00 O ATOM 162 CB GLN A 34 -95.670 -0.197 -25.703 1.00 0.00 C ATOM 163 CG GLN A 34 -96.402 0.949 -25.008 1.00 0.00 C ATOM 164 CD GLN A 34 -97.757 0.554 -24.454 1.00 0.00 C ATOM 165 OE1 GLN A 34 -97.864 0.085 -23.322 1.00 0.00 O ATOM 166 NE2 GLN A 34 -98.799 0.777 -25.229 1.00 0.00 N ATOM 0 H GLN A 34 -97.424 -2.055 -25.782 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.690 0.129 -27.574 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.572 -1.025 -25.000 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.661 0.133 -25.949 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -95.782 1.326 -24.195 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.532 1.768 -25.715 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -98.666 1.167 -26.162 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -99.738 0.559 -24.896 1.00 0.00 H new ATOM 175 N ALA A 35 -95.053 -1.037 -29.017 1.00 0.00 N ATOM 176 CA ALA A 35 -94.099 -1.695 -29.905 1.00 0.00 C ATOM 177 C ALA A 35 -93.587 -0.721 -30.962 1.00 0.00 C ATOM 178 O ALA A 35 -94.360 0.091 -31.480 1.00 0.00 O ATOM 179 CB ALA A 35 -94.745 -2.898 -30.576 1.00 0.00 C ATOM 0 H ALA A 35 -95.483 -0.200 -29.410 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.254 -2.035 -29.307 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -94.022 -3.379 -31.235 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.071 -3.608 -29.815 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.606 -2.571 -31.159 1.00 0.00 H new ATOM 185 N ARG A 36 -92.289 -0.804 -31.272 1.00 0.00 N ATOM 186 CA ARG A 36 -91.658 0.096 -32.242 1.00 0.00 C ATOM 187 C ARG A 36 -90.197 -0.284 -32.467 1.00 0.00 C ATOM 188 O ARG A 36 -89.715 -1.271 -31.915 1.00 0.00 O ATOM 189 CB ARG A 36 -91.721 1.543 -31.748 1.00 0.00 C ATOM 190 CG ARG A 36 -91.025 1.747 -30.409 1.00 0.00 C ATOM 191 CD ARG A 36 -91.015 3.207 -29.997 1.00 0.00 C ATOM 192 NE ARG A 36 -92.363 3.773 -29.936 1.00 0.00 N ATOM 193 CZ ARG A 36 -92.656 4.919 -29.327 1.00 0.00 C ATOM 194 NH1 ARG A 36 -91.711 5.591 -28.682 1.00 0.00 N ATOM 195 NH2 ARG A 36 -93.897 5.385 -29.349 1.00 0.00 N ATOM 0 H ARG A 36 -91.653 -1.488 -30.863 1.00 0.00 H new ATOM 0 HA ARG A 36 -92.203 0.003 -33.181 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -91.263 2.195 -32.492 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.764 1.845 -31.658 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -91.529 1.157 -29.644 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -90.001 1.380 -30.472 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -90.537 3.304 -29.022 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.414 3.778 -30.705 1.00 0.00 H new ATOM 0 HE ARG A 36 -93.121 3.260 -30.386 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.758 5.229 -28.652 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -91.938 6.469 -28.216 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -94.629 4.865 -29.833 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -94.120 6.264 -28.882 1.00 0.00 H new ATOM 209 N LEU A 37 -89.509 0.501 -33.292 1.00 0.00 N ATOM 210 CA LEU A 37 -88.089 0.298 -33.563 1.00 0.00 C ATOM 211 C LEU A 37 -87.246 1.244 -32.718 1.00 0.00 C ATOM 212 O LEU A 37 -87.610 2.409 -32.529 1.00 0.00 O ATOM 213 CB LEU A 37 -87.802 0.549 -35.038 1.00 0.00 C ATOM 214 CG LEU A 37 -88.743 -0.168 -35.997 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.541 0.338 -37.407 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.514 -1.667 -35.927 1.00 0.00 C ATOM 0 H LEU A 37 -89.918 1.292 -33.789 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.832 -0.731 -33.310 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.858 1.621 -35.228 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.779 0.240 -35.254 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.772 0.039 -35.704 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.220 -0.183 -38.081 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.745 1.408 -37.442 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.512 0.155 -37.715 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.191 -2.171 -36.616 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.483 -1.891 -36.202 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.703 -2.017 -34.912 1.00 0.00 H new ATOM 228 N THR A 38 -86.124 0.750 -32.216 1.00 0.00 N ATOM 229 CA THR A 38 -85.241 1.549 -31.377 1.00 0.00 C ATOM 230 C THR A 38 -83.775 1.253 -31.675 1.00 0.00 C ATOM 231 O THR A 38 -83.456 0.478 -32.583 1.00 0.00 O ATOM 232 CB THR A 38 -85.489 1.260 -29.889 1.00 0.00 C ATOM 233 OG1 THR A 38 -85.318 -0.140 -29.649 1.00 0.00 O ATOM 234 CG2 THR A 38 -86.883 1.697 -29.461 1.00 0.00 C ATOM 0 H THR A 38 -85.802 -0.205 -32.376 1.00 0.00 H new ATOM 0 HA THR A 38 -85.458 2.594 -31.599 1.00 0.00 H new ATOM 0 HB THR A 38 -84.770 1.830 -29.300 1.00 0.00 H new ATOM 0 HG1 THR A 38 -85.081 -0.284 -28.709 1.00 0.00 H new ATOM 0 HG21 THR A 38 -87.024 1.478 -28.403 1.00 0.00 H new ATOM 0 HG22 THR A 38 -86.996 2.768 -29.628 1.00 0.00 H new ATOM 0 HG23 THR A 38 -87.629 1.158 -30.046 1.00 0.00 H new ATOM 242 N ARG A 39 -82.892 1.894 -30.900 1.00 0.00 N ATOM 243 CA ARG A 39 -81.452 1.640 -30.946 1.00 0.00 C ATOM 244 C ARG A 39 -80.835 2.004 -32.294 1.00 0.00 C ATOM 245 O ARG A 39 -79.701 1.620 -32.587 1.00 0.00 O ATOM 246 CB ARG A 39 -81.148 0.179 -30.594 1.00 0.00 C ATOM 247 CG ARG A 39 -80.780 -0.031 -29.132 1.00 0.00 C ATOM 248 CD ARG A 39 -81.912 0.346 -28.188 1.00 0.00 C ATOM 249 NE ARG A 39 -81.421 0.565 -26.824 1.00 0.00 N ATOM 250 CZ ARG A 39 -82.195 0.614 -25.738 1.00 0.00 C ATOM 251 NH1 ARG A 39 -83.493 0.346 -25.813 1.00 0.00 N ATOM 252 NH2 ARG A 39 -81.660 0.912 -24.561 1.00 0.00 N ATOM 0 H ARG A 39 -83.160 2.606 -30.221 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.994 2.289 -30.200 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -82.018 -0.432 -30.832 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -80.329 -0.174 -31.221 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -80.512 -1.076 -28.974 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -79.898 0.564 -28.893 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -82.403 1.250 -28.549 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -82.663 -0.444 -28.184 1.00 0.00 H new ATOM 0 HE ARG A 39 -80.417 0.689 -26.696 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -83.912 0.098 -26.710 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -84.072 0.388 -24.974 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -80.661 1.103 -24.489 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -82.248 0.951 -23.729 1.00 0.00 H new ATOM 266 N SER A 40 -81.560 2.758 -33.101 1.00 0.00 N ATOM 267 CA SER A 40 -81.041 3.205 -34.381 1.00 0.00 C ATOM 268 C SER A 40 -81.095 4.728 -34.477 1.00 0.00 C ATOM 269 O SER A 40 -80.122 5.414 -34.155 1.00 0.00 O ATOM 270 CB SER A 40 -81.831 2.555 -35.528 1.00 0.00 C ATOM 271 OG SER A 40 -83.229 2.779 -35.380 1.00 0.00 O ATOM 0 H SER A 40 -82.508 3.073 -32.893 1.00 0.00 H new ATOM 0 HA SER A 40 -79.998 2.899 -34.464 1.00 0.00 H new ATOM 0 HB2 SER A 40 -81.494 2.961 -36.482 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.632 1.484 -35.549 1.00 0.00 H new ATOM 0 HG SER A 40 -83.684 2.573 -36.223 1.00 0.00 H new ATOM 277 N ASN A 41 -82.256 5.232 -34.882 1.00 0.00 N ATOM 278 CA ASN A 41 -82.505 6.663 -35.052 1.00 0.00 C ATOM 279 C ASN A 41 -83.837 6.851 -35.762 1.00 0.00 C ATOM 280 O ASN A 41 -84.477 7.896 -35.655 1.00 0.00 O ATOM 281 CB ASN A 41 -81.395 7.358 -35.867 1.00 0.00 C ATOM 282 CG ASN A 41 -81.425 7.018 -37.350 1.00 0.00 C ATOM 283 OD1 ASN A 41 -82.102 7.681 -38.137 1.00 0.00 O ATOM 284 ND2 ASN A 41 -80.674 6.004 -37.749 1.00 0.00 N ATOM 0 H ASN A 41 -83.064 4.651 -35.105 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.521 7.119 -34.062 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -81.490 8.437 -35.748 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.425 7.077 -35.458 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -80.643 5.750 -38.736 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -80.126 5.477 -37.069 1.00 0.00 H new ATOM 291 N SER A 42 -84.249 5.816 -36.483 1.00 0.00 N ATOM 292 CA SER A 42 -85.470 5.864 -37.263 1.00 0.00 C ATOM 293 C SER A 42 -86.536 4.985 -36.643 1.00 0.00 C ATOM 294 O SER A 42 -86.311 3.809 -36.370 1.00 0.00 O ATOM 295 CB SER A 42 -85.186 5.425 -38.702 1.00 0.00 C ATOM 296 OG SER A 42 -86.364 5.430 -39.490 1.00 0.00 O ATOM 0 H SER A 42 -83.749 4.929 -36.541 1.00 0.00 H new ATOM 0 HA SER A 42 -85.839 6.890 -37.272 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.447 6.091 -39.147 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.753 4.425 -38.699 1.00 0.00 H new ATOM 0 HG SER A 42 -86.148 5.147 -40.403 1.00 0.00 H new ATOM 302 N LYS A 43 -87.701 5.564 -36.413 1.00 0.00 N ATOM 303 CA LYS A 43 -88.838 4.800 -35.936 1.00 0.00 C ATOM 304 C LYS A 43 -89.450 4.020 -37.093 1.00 0.00 C ATOM 305 O LYS A 43 -90.365 3.223 -36.908 1.00 0.00 O ATOM 306 CB LYS A 43 -89.870 5.726 -35.288 1.00 0.00 C ATOM 307 CG LYS A 43 -90.399 6.808 -36.213 1.00 0.00 C ATOM 308 CD LYS A 43 -91.255 7.807 -35.455 1.00 0.00 C ATOM 309 CE LYS A 43 -91.922 8.799 -36.392 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.733 9.799 -35.651 1.00 0.00 N ATOM 0 H LYS A 43 -87.884 6.558 -36.549 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.505 4.092 -35.177 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.707 5.126 -34.932 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -89.421 6.198 -34.414 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -89.565 7.325 -36.687 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -90.986 6.353 -37.011 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -92.017 7.275 -34.885 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -90.637 8.344 -34.736 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -91.161 9.312 -36.980 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -92.560 8.263 -37.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -93.639 9.943 -36.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -92.913 9.454 -34.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -92.216 10.700 -35.606 1.00 0.00 H new ATOM 324 N CYS A 44 -88.921 4.251 -38.293 1.00 0.00 N ATOM 325 CA CYS A 44 -89.372 3.544 -39.480 1.00 0.00 C ATOM 326 C CYS A 44 -88.279 2.592 -39.975 1.00 0.00 C ATOM 327 O CYS A 44 -88.432 1.948 -41.009 1.00 0.00 O ATOM 328 CB CYS A 44 -89.756 4.540 -40.584 1.00 0.00 C ATOM 329 SG CYS A 44 -90.581 6.041 -39.974 1.00 0.00 S ATOM 0 H CYS A 44 -88.176 4.927 -38.465 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.255 2.958 -39.223 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -88.856 4.828 -41.128 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.413 4.041 -41.296 1.00 0.00 H new ATOM 334 N GLN A 45 -87.172 2.510 -39.230 1.00 0.00 N ATOM 335 CA GLN A 45 -86.104 1.553 -39.527 1.00 0.00 C ATOM 336 C GLN A 45 -85.259 1.300 -38.278 1.00 0.00 C ATOM 337 O GLN A 45 -84.669 2.224 -37.720 1.00 0.00 O ATOM 338 CB GLN A 45 -85.223 2.076 -40.668 1.00 0.00 C ATOM 339 CG GLN A 45 -83.995 1.223 -40.944 1.00 0.00 C ATOM 340 CD GLN A 45 -83.194 1.710 -42.138 1.00 0.00 C ATOM 341 OE1 GLN A 45 -82.522 0.926 -42.807 1.00 0.00 O ATOM 342 NE2 GLN A 45 -83.266 3.002 -42.424 1.00 0.00 N ATOM 0 H GLN A 45 -86.993 3.097 -38.415 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.556 0.612 -39.840 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.822 2.137 -41.577 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.902 3.090 -40.429 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.356 1.219 -40.061 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.306 0.193 -41.117 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -83.834 3.621 -41.846 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -82.754 3.377 -43.222 1.00 0.00 H new ATOM 351 N GLY A 46 -85.161 0.040 -37.871 1.00 0.00 N ATOM 352 CA GLY A 46 -84.498 -0.279 -36.622 1.00 0.00 C ATOM 353 C GLY A 46 -84.847 -1.667 -36.131 1.00 0.00 C ATOM 354 O GLY A 46 -85.568 -2.399 -36.805 1.00 0.00 O ATOM 0 H GLY A 46 -85.527 -0.763 -38.382 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.419 -0.203 -36.755 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.779 0.454 -35.866 1.00 0.00 H new ATOM 358 N GLN A 47 -84.304 -2.049 -34.984 1.00 0.00 N ATOM 359 CA GLN A 47 -84.623 -3.342 -34.390 1.00 0.00 C ATOM 360 C GLN A 47 -85.909 -3.252 -33.574 1.00 0.00 C ATOM 361 O GLN A 47 -86.272 -2.176 -33.097 1.00 0.00 O ATOM 362 CB GLN A 47 -83.466 -3.840 -33.519 1.00 0.00 C ATOM 363 CG GLN A 47 -82.224 -4.226 -34.318 1.00 0.00 C ATOM 364 CD GLN A 47 -82.439 -5.438 -35.213 1.00 0.00 C ATOM 365 OE1 GLN A 47 -83.540 -5.696 -35.687 1.00 0.00 O ATOM 366 NE2 GLN A 47 -81.383 -6.203 -35.440 1.00 0.00 N ATOM 0 H GLN A 47 -83.644 -1.486 -34.447 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.775 -4.060 -35.196 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.200 -3.063 -32.803 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.801 -4.703 -32.943 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.917 -3.379 -34.932 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.406 -4.433 -33.628 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -80.481 -5.961 -35.031 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -81.472 -7.035 -36.024 1.00 0.00 H new ATOM 375 N LEU A 48 -86.589 -4.382 -33.419 1.00 0.00 N ATOM 376 CA LEU A 48 -87.889 -4.418 -32.759 1.00 0.00 C ATOM 377 C LEU A 48 -87.734 -4.331 -31.241 1.00 0.00 C ATOM 378 O LEU A 48 -86.952 -5.068 -30.638 1.00 0.00 O ATOM 379 CB LEU A 48 -88.638 -5.708 -33.148 1.00 0.00 C ATOM 380 CG LEU A 48 -90.175 -5.668 -33.064 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.656 -5.627 -31.625 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.729 -4.481 -33.833 1.00 0.00 C ATOM 0 H LEU A 48 -86.259 -5.291 -33.744 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.468 -3.555 -33.088 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.360 -5.968 -34.169 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.283 -6.514 -32.506 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.547 -6.586 -33.519 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.745 -5.599 -31.606 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.306 -6.515 -31.099 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.262 -4.737 -31.135 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.816 -4.475 -33.759 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.331 -3.557 -33.413 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.437 -4.558 -34.880 1.00 0.00 H new ATOM 394 N GLU A 49 -88.479 -3.418 -30.637 1.00 0.00 N ATOM 395 CA GLU A 49 -88.523 -3.294 -29.191 1.00 0.00 C ATOM 396 C GLU A 49 -89.982 -3.252 -28.734 1.00 0.00 C ATOM 397 O GLU A 49 -90.771 -2.429 -29.212 1.00 0.00 O ATOM 398 CB GLU A 49 -87.776 -2.031 -28.753 1.00 0.00 C ATOM 399 CG GLU A 49 -87.501 -1.954 -27.259 1.00 0.00 C ATOM 400 CD GLU A 49 -86.708 -0.717 -26.885 1.00 0.00 C ATOM 401 OE1 GLU A 49 -85.482 -0.703 -27.118 1.00 0.00 O ATOM 402 OE2 GLU A 49 -87.304 0.252 -26.367 1.00 0.00 O ATOM 0 H GLU A 49 -89.066 -2.747 -31.133 1.00 0.00 H new ATOM 0 HA GLU A 49 -88.035 -4.153 -28.731 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.828 -1.979 -29.288 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -88.357 -1.158 -29.049 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.447 -1.955 -26.717 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.953 -2.843 -26.946 1.00 0.00 H new ATOM 409 N VAL A 50 -90.345 -4.161 -27.841 1.00 0.00 N ATOM 410 CA VAL A 50 -91.722 -4.270 -27.364 1.00 0.00 C ATOM 411 C VAL A 50 -91.807 -4.150 -25.852 1.00 0.00 C ATOM 412 O VAL A 50 -91.008 -4.742 -25.134 1.00 0.00 O ATOM 413 CB VAL A 50 -92.366 -5.605 -27.785 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.069 -5.455 -29.117 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.320 -6.711 -27.859 1.00 0.00 C ATOM 0 H VAL A 50 -89.704 -4.838 -27.428 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.265 -3.444 -27.823 1.00 0.00 H new ATOM 0 HB VAL A 50 -93.103 -5.881 -27.030 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.519 -6.407 -29.400 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.847 -4.696 -29.034 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -92.348 -5.154 -29.877 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -91.798 -7.644 -28.158 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.558 -6.443 -28.591 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.855 -6.838 -26.881 1.00 0.00 H new ATOM 425 N TYR A 51 -92.782 -3.394 -25.374 1.00 0.00 N ATOM 426 CA TYR A 51 -92.975 -3.229 -23.942 1.00 0.00 C ATOM 427 C TYR A 51 -94.135 -4.084 -23.470 1.00 0.00 C ATOM 428 O TYR A 51 -95.293 -3.794 -23.765 1.00 0.00 O ATOM 429 CB TYR A 51 -93.239 -1.763 -23.591 1.00 0.00 C ATOM 430 CG TYR A 51 -93.289 -1.494 -22.106 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.150 -1.624 -21.328 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.468 -1.103 -21.486 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.179 -1.371 -19.974 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.507 -0.850 -20.128 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.357 -0.986 -19.377 1.00 0.00 C ATOM 436 OH TYR A 51 -93.380 -0.733 -18.026 1.00 0.00 O ATOM 0 H TYR A 51 -93.450 -2.886 -25.954 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.062 -3.547 -23.438 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.459 -1.146 -24.037 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.184 -1.456 -24.039 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.223 -1.929 -21.791 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.368 -0.995 -22.074 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.281 -1.475 -19.384 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.431 -0.548 -19.658 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.285 -0.471 -17.758 1.00 0.00 H new ATOM 446 N LEU A 52 -93.822 -5.144 -22.749 1.00 0.00 N ATOM 447 CA LEU A 52 -94.848 -6.036 -22.247 1.00 0.00 C ATOM 448 C LEU A 52 -94.691 -6.284 -20.765 1.00 0.00 C ATOM 449 O LEU A 52 -93.675 -6.819 -20.321 1.00 0.00 O ATOM 450 CB LEU A 52 -94.839 -7.346 -23.022 1.00 0.00 C ATOM 451 CG LEU A 52 -93.463 -7.935 -23.339 1.00 0.00 C ATOM 452 CD1 LEU A 52 -93.222 -9.207 -22.542 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.343 -8.211 -24.829 1.00 0.00 C ATOM 0 H LEU A 52 -92.869 -5.407 -22.499 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.814 -5.553 -22.395 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.405 -8.084 -22.453 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -95.370 -7.192 -23.961 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.703 -7.208 -23.053 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -92.238 -9.607 -22.784 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.271 -8.983 -21.476 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.985 -9.944 -22.793 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.360 -8.630 -25.043 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -94.113 -8.920 -25.131 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -93.470 -7.281 -25.383 1.00 0.00 H new ATOM 465 N LYS A 53 -95.700 -5.847 -20.009 1.00 0.00 N ATOM 466 CA LYS A 53 -95.749 -6.003 -18.553 1.00 0.00 C ATOM 467 C LYS A 53 -94.728 -5.114 -17.855 1.00 0.00 C ATOM 468 O LYS A 53 -95.018 -4.530 -16.810 1.00 0.00 O ATOM 469 CB LYS A 53 -95.541 -7.466 -18.138 1.00 0.00 C ATOM 470 CG LYS A 53 -96.697 -8.385 -18.499 1.00 0.00 C ATOM 471 CD LYS A 53 -97.997 -7.990 -17.801 1.00 0.00 C ATOM 472 CE LYS A 53 -97.988 -8.317 -16.306 1.00 0.00 C ATOM 473 NZ LYS A 53 -97.114 -7.405 -15.518 1.00 0.00 N ATOM 0 H LYS A 53 -96.515 -5.370 -20.394 1.00 0.00 H new ATOM 0 HA LYS A 53 -96.745 -5.691 -18.238 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -94.633 -7.840 -18.610 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -95.381 -7.507 -17.061 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -96.848 -8.367 -19.578 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -96.440 -9.410 -18.230 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -98.166 -6.921 -17.934 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -98.831 -8.506 -18.277 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -99.006 -8.259 -15.921 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -97.652 -9.344 -16.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -97.579 -7.171 -14.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -96.206 -7.874 -15.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -96.946 -6.532 -16.058 1.00 0.00 H new ATOM 487 N ASP A 54 -93.554 -4.995 -18.454 1.00 0.00 N ATOM 488 CA ASP A 54 -92.433 -4.279 -17.834 1.00 0.00 C ATOM 489 C ASP A 54 -91.193 -4.395 -18.700 1.00 0.00 C ATOM 490 O ASP A 54 -90.333 -3.515 -18.699 1.00 0.00 O ATOM 491 CB ASP A 54 -92.115 -4.839 -16.435 1.00 0.00 C ATOM 492 CG ASP A 54 -91.561 -6.256 -16.474 1.00 0.00 C ATOM 493 OD1 ASP A 54 -92.360 -7.218 -16.421 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.326 -6.415 -16.570 1.00 0.00 O ATOM 0 H ASP A 54 -93.345 -5.384 -19.373 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.726 -3.233 -17.738 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.394 -4.186 -15.944 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.021 -4.826 -15.830 1.00 0.00 H new ATOM 499 N GLY A 55 -91.106 -5.490 -19.433 1.00 0.00 N ATOM 500 CA GLY A 55 -89.940 -5.745 -20.240 1.00 0.00 C ATOM 501 C GLY A 55 -89.942 -4.980 -21.535 1.00 0.00 C ATOM 502 O GLY A 55 -90.685 -5.323 -22.453 1.00 0.00 O ATOM 0 H GLY A 55 -91.827 -6.210 -19.482 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.047 -5.484 -19.672 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.880 -6.812 -20.455 1.00 0.00 H new ATOM 506 N TRP A 56 -89.133 -3.929 -21.602 1.00 0.00 N ATOM 507 CA TRP A 56 -88.802 -3.321 -22.877 1.00 0.00 C ATOM 508 C TRP A 56 -87.868 -4.267 -23.604 1.00 0.00 C ATOM 509 O TRP A 56 -86.645 -4.147 -23.532 1.00 0.00 O ATOM 510 CB TRP A 56 -88.149 -1.943 -22.709 1.00 0.00 C ATOM 511 CG TRP A 56 -89.102 -0.796 -22.901 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.384 0.198 -22.009 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.899 -0.529 -24.062 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.307 1.066 -22.547 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.638 0.640 -23.807 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.061 -1.169 -25.293 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.524 1.180 -24.740 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.935 -0.633 -26.217 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.659 0.530 -25.938 1.00 0.00 C ATOM 0 H TRP A 56 -88.699 -3.486 -20.792 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.716 -3.158 -23.448 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.711 -1.877 -21.713 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.332 -1.848 -23.424 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -88.947 0.290 -21.026 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.684 1.893 -22.083 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.510 -2.070 -25.518 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.083 2.079 -24.525 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.062 -1.121 -27.172 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.337 0.923 -26.681 1.00 0.00 H new ATOM 530 N HIS A 57 -88.460 -5.253 -24.242 1.00 0.00 N ATOM 531 CA HIS A 57 -87.712 -6.338 -24.824 1.00 0.00 C ATOM 532 C HIS A 57 -87.164 -5.964 -26.187 1.00 0.00 C ATOM 533 O HIS A 57 -87.905 -5.933 -27.170 1.00 0.00 O ATOM 534 CB HIS A 57 -88.584 -7.597 -24.933 1.00 0.00 C ATOM 535 CG HIS A 57 -88.738 -8.331 -23.638 1.00 0.00 C ATOM 536 ND1 HIS A 57 -87.691 -8.564 -22.773 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.830 -8.881 -23.058 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.132 -9.226 -21.720 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.427 -9.430 -21.867 1.00 0.00 N ATOM 0 H HIS A 57 -89.470 -5.322 -24.370 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.869 -6.547 -24.166 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.570 -7.315 -25.301 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.148 -8.269 -25.672 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -90.833 -8.887 -23.459 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -87.534 -9.547 -20.880 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -90.030 -9.916 -21.204 1.00 0.00 H new ATOM 548 N MET A 58 -85.880 -5.641 -26.229 1.00 0.00 N ATOM 549 CA MET A 58 -85.183 -5.502 -27.493 1.00 0.00 C ATOM 550 C MET A 58 -85.087 -6.882 -28.120 1.00 0.00 C ATOM 551 O MET A 58 -84.247 -7.695 -27.735 1.00 0.00 O ATOM 552 CB MET A 58 -83.787 -4.910 -27.288 1.00 0.00 C ATOM 553 CG MET A 58 -83.010 -4.725 -28.581 1.00 0.00 C ATOM 554 SD MET A 58 -81.324 -4.148 -28.306 1.00 0.00 S ATOM 555 CE MET A 58 -80.744 -4.011 -29.995 1.00 0.00 C ATOM 0 H MET A 58 -85.304 -5.471 -25.404 1.00 0.00 H new ATOM 0 HA MET A 58 -85.729 -4.821 -28.146 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.880 -3.946 -26.788 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.219 -5.560 -26.622 1.00 0.00 H new ATOM 0 HG2 MET A 58 -82.982 -5.671 -29.121 1.00 0.00 H new ATOM 0 HG3 MET A 58 -83.535 -4.011 -29.216 1.00 0.00 H new ATOM 0 HE1 MET A 58 -79.711 -3.663 -29.998 1.00 0.00 H new ATOM 0 HE2 MET A 58 -80.800 -4.986 -30.479 1.00 0.00 H new ATOM 0 HE3 MET A 58 -81.367 -3.300 -30.537 1.00 0.00 H new ATOM 565 N VAL A 59 -85.966 -7.153 -29.056 1.00 0.00 N ATOM 566 CA VAL A 59 -86.169 -8.507 -29.524 1.00 0.00 C ATOM 567 C VAL A 59 -85.755 -8.668 -30.978 1.00 0.00 C ATOM 568 O VAL A 59 -85.863 -7.736 -31.777 1.00 0.00 O ATOM 569 CB VAL A 59 -87.651 -8.917 -29.344 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.572 -8.003 -30.129 1.00 0.00 C ATOM 571 CG2 VAL A 59 -87.872 -10.360 -29.744 1.00 0.00 C ATOM 0 H VAL A 59 -86.554 -6.454 -29.510 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.537 -9.163 -28.925 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.891 -8.816 -28.286 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.606 -8.316 -29.983 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.450 -6.977 -29.780 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.323 -8.058 -31.189 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -88.922 -10.619 -29.607 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -87.599 -10.493 -30.791 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.254 -11.008 -29.123 1.00 0.00 H new ATOM 581 N CYS A 60 -85.255 -9.845 -31.314 1.00 0.00 N ATOM 582 CA CYS A 60 -84.951 -10.162 -32.689 1.00 0.00 C ATOM 583 C CYS A 60 -86.226 -10.435 -33.475 1.00 0.00 C ATOM 584 O CYS A 60 -87.107 -11.173 -33.027 1.00 0.00 O ATOM 585 CB CYS A 60 -83.968 -11.330 -32.785 1.00 0.00 C ATOM 586 SG CYS A 60 -84.014 -12.518 -31.437 1.00 0.00 S ATOM 0 H CYS A 60 -85.053 -10.593 -30.650 1.00 0.00 H new ATOM 0 HA CYS A 60 -84.465 -9.295 -33.137 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -84.158 -11.862 -33.717 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.959 -10.924 -32.850 1.00 0.00 H new ATOM 591 N SER A 61 -86.305 -9.822 -34.650 1.00 0.00 N ATOM 592 CA SER A 61 -87.490 -9.869 -35.504 1.00 0.00 C ATOM 593 C SER A 61 -87.856 -11.300 -35.930 1.00 0.00 C ATOM 594 O SER A 61 -88.916 -11.528 -36.507 1.00 0.00 O ATOM 595 CB SER A 61 -87.222 -9.014 -36.738 1.00 0.00 C ATOM 596 OG SER A 61 -86.673 -7.759 -36.365 1.00 0.00 O ATOM 0 H SER A 61 -85.541 -9.272 -35.043 1.00 0.00 H new ATOM 0 HA SER A 61 -88.338 -9.486 -34.936 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.535 -9.534 -37.405 1.00 0.00 H new ATOM 0 HB3 SER A 61 -88.149 -8.862 -37.290 1.00 0.00 H new ATOM 0 HG SER A 61 -85.716 -7.746 -36.574 1.00 0.00 H new ATOM 602 N GLN A 62 -86.983 -12.262 -35.645 1.00 0.00 N ATOM 603 CA GLN A 62 -87.212 -13.636 -36.076 1.00 0.00 C ATOM 604 C GLN A 62 -87.780 -14.498 -34.953 1.00 0.00 C ATOM 605 O GLN A 62 -88.040 -15.680 -35.154 1.00 0.00 O ATOM 606 CB GLN A 62 -85.914 -14.245 -36.636 1.00 0.00 C ATOM 607 CG GLN A 62 -84.770 -14.393 -35.634 1.00 0.00 C ATOM 608 CD GLN A 62 -84.849 -15.669 -34.809 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.385 -15.681 -33.706 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.331 -16.757 -35.355 1.00 0.00 N ATOM 0 H GLN A 62 -86.119 -12.117 -35.123 1.00 0.00 H new ATOM 0 HA GLN A 62 -87.958 -13.614 -36.870 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.143 -15.228 -37.047 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -85.570 -13.625 -37.464 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -83.822 -14.375 -36.171 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.772 -13.534 -34.962 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -83.893 -16.707 -36.275 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -84.369 -17.646 -34.856 1.00 0.00 H new ATOM 619 N SER A 63 -87.984 -13.903 -33.783 1.00 0.00 N ATOM 620 CA SER A 63 -88.476 -14.638 -32.618 1.00 0.00 C ATOM 621 C SER A 63 -89.883 -15.191 -32.863 1.00 0.00 C ATOM 622 O SER A 63 -90.510 -14.861 -33.875 1.00 0.00 O ATOM 623 CB SER A 63 -88.479 -13.721 -31.399 1.00 0.00 C ATOM 624 OG SER A 63 -87.192 -13.183 -31.166 1.00 0.00 O ATOM 0 H SER A 63 -87.816 -12.911 -33.613 1.00 0.00 H new ATOM 0 HA SER A 63 -87.811 -15.483 -32.439 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.193 -12.912 -31.550 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.809 -14.278 -30.522 1.00 0.00 H new ATOM 0 HG SER A 63 -86.994 -12.504 -31.844 1.00 0.00 H new ATOM 630 N TRP A 64 -90.373 -16.027 -31.928 1.00 0.00 N ATOM 631 CA TRP A 64 -91.687 -16.665 -32.043 1.00 0.00 C ATOM 632 C TRP A 64 -91.677 -17.762 -33.108 1.00 0.00 C ATOM 633 O TRP A 64 -91.773 -18.948 -32.785 1.00 0.00 O ATOM 634 CB TRP A 64 -92.793 -15.635 -32.324 1.00 0.00 C ATOM 635 CG TRP A 64 -93.146 -14.803 -31.125 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.087 -15.099 -30.185 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.564 -13.549 -30.729 1.00 0.00 C ATOM 638 NE1 TRP A 64 -94.119 -14.121 -29.224 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.196 -13.159 -29.534 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.569 -12.722 -31.260 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.866 -11.984 -28.863 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.242 -11.553 -30.593 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.887 -11.195 -29.404 1.00 0.00 C ATOM 0 H TRP A 64 -89.867 -16.275 -31.077 1.00 0.00 H new ATOM 0 HA TRP A 64 -91.908 -17.130 -31.082 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.472 -14.978 -33.132 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -93.685 -16.156 -32.672 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.716 -15.977 -30.195 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.732 -14.112 -28.409 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.064 -12.991 -32.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.366 -11.705 -27.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.477 -10.907 -30.997 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.607 -10.279 -28.904 1.00 0.00 H new ATOM 654 N GLY A 65 -91.534 -17.370 -34.365 1.00 0.00 N ATOM 655 CA GLY A 65 -91.509 -18.333 -35.446 1.00 0.00 C ATOM 656 C GLY A 65 -90.134 -18.943 -35.641 1.00 0.00 C ATOM 657 O GLY A 65 -90.012 -20.057 -36.156 1.00 0.00 O ATOM 0 H GLY A 65 -91.434 -16.398 -34.657 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -92.230 -19.125 -35.241 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -91.823 -17.847 -36.370 1.00 0.00 H new ATOM 661 N ARG A 66 -89.107 -18.210 -35.210 1.00 0.00 N ATOM 662 CA ARG A 66 -87.711 -18.622 -35.368 1.00 0.00 C ATOM 663 C ARG A 66 -87.342 -18.706 -36.846 1.00 0.00 C ATOM 664 O ARG A 66 -87.290 -19.787 -37.433 1.00 0.00 O ATOM 665 CB ARG A 66 -87.435 -19.945 -34.648 1.00 0.00 C ATOM 666 CG ARG A 66 -87.527 -19.833 -33.134 1.00 0.00 C ATOM 667 CD ARG A 66 -87.485 -21.195 -32.461 1.00 0.00 C ATOM 668 NE ARG A 66 -86.221 -21.899 -32.689 1.00 0.00 N ATOM 669 CZ ARG A 66 -86.148 -23.149 -33.140 1.00 0.00 C ATOM 670 NH1 ARG A 66 -87.254 -23.775 -33.530 1.00 0.00 N ATOM 671 NH2 ARG A 66 -84.972 -23.766 -33.224 1.00 0.00 N ATOM 0 H ARG A 66 -89.220 -17.312 -34.740 1.00 0.00 H new ATOM 0 HA ARG A 66 -87.080 -17.864 -34.904 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -88.146 -20.695 -34.994 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -86.441 -20.299 -34.920 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -86.705 -19.220 -32.765 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -88.451 -19.323 -32.863 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -87.639 -21.071 -31.389 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.308 -21.805 -32.833 1.00 0.00 H new ATOM 0 HE ARG A 66 -85.351 -21.405 -32.492 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -88.154 -23.297 -33.483 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -87.203 -24.733 -33.876 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -84.120 -23.281 -32.942 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -84.922 -24.724 -33.570 1.00 0.00 H new ATOM 685 N SER A 67 -87.113 -17.543 -37.439 1.00 0.00 N ATOM 686 CA SER A 67 -86.809 -17.442 -38.861 1.00 0.00 C ATOM 687 C SER A 67 -85.302 -17.511 -39.097 1.00 0.00 C ATOM 688 O SER A 67 -84.507 -17.300 -38.178 1.00 0.00 O ATOM 689 CB SER A 67 -87.378 -16.132 -39.422 1.00 0.00 C ATOM 690 OG SER A 67 -87.165 -16.021 -40.820 1.00 0.00 O ATOM 0 H SER A 67 -87.132 -16.647 -36.952 1.00 0.00 H new ATOM 0 HA SER A 67 -87.272 -18.282 -39.379 1.00 0.00 H new ATOM 0 HB2 SER A 67 -88.446 -16.080 -39.212 1.00 0.00 H new ATOM 0 HB3 SER A 67 -86.912 -15.287 -38.915 1.00 0.00 H new ATOM 0 HG SER A 67 -87.999 -15.749 -41.257 1.00 0.00 H new ATOM 696 N SER A 68 -84.915 -17.811 -40.327 1.00 0.00 N ATOM 697 CA SER A 68 -83.510 -17.921 -40.681 1.00 0.00 C ATOM 698 C SER A 68 -83.160 -16.947 -41.805 1.00 0.00 C ATOM 699 O SER A 68 -82.076 -16.367 -41.819 1.00 0.00 O ATOM 700 CB SER A 68 -83.190 -19.358 -41.094 1.00 0.00 C ATOM 701 OG SER A 68 -83.548 -20.265 -40.063 1.00 0.00 O ATOM 0 H SER A 68 -85.558 -17.983 -41.100 1.00 0.00 H new ATOM 0 HA SER A 68 -82.907 -17.662 -39.811 1.00 0.00 H new ATOM 0 HB2 SER A 68 -83.728 -19.608 -42.009 1.00 0.00 H new ATOM 0 HB3 SER A 68 -82.127 -19.451 -41.314 1.00 0.00 H new ATOM 0 HG SER A 68 -83.338 -21.180 -40.345 1.00 0.00 H new ATOM 707 N LYS A 69 -84.087 -16.757 -42.734 1.00 0.00 N ATOM 708 CA LYS A 69 -83.866 -15.861 -43.858 1.00 0.00 C ATOM 709 C LYS A 69 -84.649 -14.567 -43.659 1.00 0.00 C ATOM 710 O LYS A 69 -84.073 -13.482 -43.597 1.00 0.00 O ATOM 711 CB LYS A 69 -84.297 -16.541 -45.161 1.00 0.00 C ATOM 712 CG LYS A 69 -83.983 -15.734 -46.414 1.00 0.00 C ATOM 713 CD LYS A 69 -84.584 -16.378 -47.654 1.00 0.00 C ATOM 714 CE LYS A 69 -86.102 -16.294 -47.639 1.00 0.00 C ATOM 715 NZ LYS A 69 -86.714 -17.026 -48.779 1.00 0.00 N ATOM 0 H LYS A 69 -85.000 -17.212 -42.730 1.00 0.00 H new ATOM 0 HA LYS A 69 -82.804 -15.623 -43.917 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -83.805 -17.511 -45.233 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -85.370 -16.730 -45.122 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -84.371 -14.722 -46.303 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -82.903 -15.650 -46.533 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -84.199 -15.884 -48.546 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -84.276 -17.422 -47.710 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -86.478 -16.704 -46.702 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -86.407 -15.248 -47.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -87.749 -16.942 -48.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -86.376 -16.619 -49.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -86.445 -18.030 -48.732 1.00 0.00 H new ATOM 729 N GLN A 70 -85.965 -14.714 -43.547 1.00 0.00 N ATOM 730 CA GLN A 70 -86.895 -13.595 -43.402 1.00 0.00 C ATOM 731 C GLN A 70 -88.321 -14.126 -43.483 1.00 0.00 C ATOM 732 O GLN A 70 -88.532 -15.338 -43.491 1.00 0.00 O ATOM 733 CB GLN A 70 -86.683 -12.540 -44.498 1.00 0.00 C ATOM 734 CG GLN A 70 -86.803 -13.090 -45.909 1.00 0.00 C ATOM 735 CD GLN A 70 -86.698 -12.015 -46.971 1.00 0.00 C ATOM 736 OE1 GLN A 70 -87.253 -12.149 -48.059 1.00 0.00 O ATOM 737 NE2 GLN A 70 -85.984 -10.944 -46.670 1.00 0.00 N ATOM 0 H GLN A 70 -86.424 -15.625 -43.554 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.715 -13.120 -42.438 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -87.412 -11.741 -44.366 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.696 -12.094 -44.374 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -86.022 -13.832 -46.072 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -87.758 -13.605 -46.013 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -85.538 -10.869 -45.756 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -85.879 -10.193 -47.352 1.00 0.00 H new ATOM 746 N TRP A 71 -89.283 -13.221 -43.538 1.00 0.00 N ATOM 747 CA TRP A 71 -90.669 -13.587 -43.787 1.00 0.00 C ATOM 748 C TRP A 71 -91.200 -12.751 -44.936 1.00 0.00 C ATOM 749 O TRP A 71 -90.835 -11.582 -45.070 1.00 0.00 O ATOM 750 CB TRP A 71 -91.547 -13.361 -42.550 1.00 0.00 C ATOM 751 CG TRP A 71 -91.184 -14.206 -41.365 1.00 0.00 C ATOM 752 CD1 TRP A 71 -90.581 -13.781 -40.215 1.00 0.00 C ATOM 753 CD2 TRP A 71 -91.407 -15.611 -41.208 1.00 0.00 C ATOM 754 NE1 TRP A 71 -90.424 -14.835 -39.349 1.00 0.00 N ATOM 755 CE2 TRP A 71 -90.919 -15.971 -39.936 1.00 0.00 C ATOM 756 CE3 TRP A 71 -91.973 -16.602 -42.018 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -90.980 -17.279 -39.460 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -92.033 -17.898 -41.543 1.00 0.00 C ATOM 759 CH2 TRP A 71 -91.539 -18.227 -40.274 1.00 0.00 C ATOM 0 H TRP A 71 -89.129 -12.220 -43.413 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.703 -14.648 -44.033 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -91.486 -12.311 -42.264 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -92.585 -13.559 -42.816 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -90.273 -12.765 -40.016 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -90.007 -14.782 -38.420 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -92.356 -16.358 -42.998 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -90.599 -17.536 -38.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -92.468 -18.670 -42.160 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -91.600 -19.249 -39.931 1.00 0.00 H new ATOM 770 N GLU A 72 -92.053 -13.332 -45.768 1.00 0.00 N ATOM 771 CA GLU A 72 -92.643 -12.584 -46.866 1.00 0.00 C ATOM 772 C GLU A 72 -94.014 -12.053 -46.454 1.00 0.00 C ATOM 773 O GLU A 72 -94.792 -11.563 -47.277 1.00 0.00 O ATOM 774 CB GLU A 72 -92.742 -13.434 -48.135 1.00 0.00 C ATOM 775 CG GLU A 72 -92.879 -12.595 -49.396 1.00 0.00 C ATOM 776 CD GLU A 72 -93.062 -13.426 -50.642 1.00 0.00 C ATOM 777 OE1 GLU A 72 -94.210 -13.826 -50.927 1.00 0.00 O ATOM 778 OE2 GLU A 72 -92.072 -13.667 -51.356 1.00 0.00 O ATOM 0 H GLU A 72 -92.348 -14.306 -45.705 1.00 0.00 H new ATOM 0 HA GLU A 72 -91.992 -11.740 -47.095 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -91.855 -14.062 -48.216 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -93.599 -14.102 -48.054 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -93.729 -11.922 -49.287 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -91.992 -11.972 -49.509 1.00 0.00 H new ATOM 785 N ASP A 73 -94.314 -12.176 -45.169 1.00 0.00 N ATOM 786 CA ASP A 73 -95.461 -11.498 -44.583 1.00 0.00 C ATOM 787 C ASP A 73 -94.967 -10.459 -43.586 1.00 0.00 C ATOM 788 O ASP A 73 -94.857 -10.728 -42.392 1.00 0.00 O ATOM 789 CB ASP A 73 -96.425 -12.479 -43.901 1.00 0.00 C ATOM 790 CG ASP A 73 -97.703 -11.797 -43.443 1.00 0.00 C ATOM 791 OD1 ASP A 73 -98.430 -11.259 -44.308 1.00 0.00 O ATOM 792 OD2 ASP A 73 -97.986 -11.787 -42.229 1.00 0.00 O ATOM 0 H ASP A 73 -93.777 -12.741 -44.511 1.00 0.00 H new ATOM 0 HA ASP A 73 -96.018 -11.012 -45.384 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -96.672 -13.284 -44.593 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.931 -12.936 -43.044 1.00 0.00 H new ATOM 797 N PRO A 74 -94.613 -9.264 -44.082 1.00 0.00 N ATOM 798 CA PRO A 74 -94.068 -8.185 -43.265 1.00 0.00 C ATOM 799 C PRO A 74 -95.159 -7.297 -42.682 1.00 0.00 C ATOM 800 O PRO A 74 -94.908 -6.160 -42.291 1.00 0.00 O ATOM 801 CB PRO A 74 -93.242 -7.423 -44.282 1.00 0.00 C ATOM 802 CG PRO A 74 -94.096 -7.475 -45.484 1.00 0.00 C ATOM 803 CD PRO A 74 -94.703 -8.854 -45.498 1.00 0.00 C ATOM 0 HA PRO A 74 -93.511 -8.539 -42.398 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -93.050 -6.398 -43.964 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -92.272 -7.891 -44.451 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.869 -6.708 -45.447 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -93.512 -7.296 -46.387 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.734 -8.839 -45.850 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -94.153 -9.532 -46.151 1.00 0.00 H new ATOM 811 N SER A 75 -96.373 -7.826 -42.638 1.00 0.00 N ATOM 812 CA SER A 75 -97.508 -7.080 -42.142 1.00 0.00 C ATOM 813 C SER A 75 -97.654 -7.309 -40.637 1.00 0.00 C ATOM 814 O SER A 75 -96.651 -7.342 -39.918 1.00 0.00 O ATOM 815 CB SER A 75 -98.775 -7.504 -42.895 1.00 0.00 C ATOM 816 OG SER A 75 -99.794 -6.521 -42.784 1.00 0.00 O ATOM 0 H SER A 75 -96.592 -8.774 -42.943 1.00 0.00 H new ATOM 0 HA SER A 75 -97.353 -6.014 -42.312 1.00 0.00 H new ATOM 0 HB2 SER A 75 -98.538 -7.668 -43.946 1.00 0.00 H new ATOM 0 HB3 SER A 75 -99.137 -8.452 -42.498 1.00 0.00 H new ATOM 0 HG SER A 75 -99.530 -5.849 -42.121 1.00 0.00 H new ATOM 822 N GLN A 76 -98.901 -7.451 -40.176 1.00 0.00 N ATOM 823 CA GLN A 76 -99.231 -7.711 -38.776 1.00 0.00 C ATOM 824 C GLN A 76 -99.035 -6.463 -37.904 1.00 0.00 C ATOM 825 O GLN A 76 -99.972 -5.993 -37.257 1.00 0.00 O ATOM 826 CB GLN A 76 -98.396 -8.868 -38.232 1.00 0.00 C ATOM 827 CG GLN A 76 -98.444 -10.144 -39.070 1.00 0.00 C ATOM 828 CD GLN A 76 -99.836 -10.724 -39.224 1.00 0.00 C ATOM 829 OE1 GLN A 76 -100.688 -10.592 -38.342 1.00 0.00 O ATOM 830 NE2 GLN A 76 -100.072 -11.384 -40.348 1.00 0.00 N ATOM 0 H GLN A 76 -99.722 -7.387 -40.778 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.285 -7.984 -38.737 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.359 -8.542 -38.151 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.737 -9.100 -37.223 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.037 -9.933 -40.059 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -97.797 -10.893 -38.612 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -99.339 -11.470 -41.052 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -100.986 -11.806 -40.509 1.00 0.00 H new ATOM 839 N ALA A 77 -97.824 -5.920 -37.906 1.00 0.00 N ATOM 840 CA ALA A 77 -97.479 -4.778 -37.064 1.00 0.00 C ATOM 841 C ALA A 77 -97.803 -3.448 -37.746 1.00 0.00 C ATOM 842 O ALA A 77 -97.228 -2.401 -37.415 1.00 0.00 O ATOM 843 CB ALA A 77 -96.008 -4.835 -36.692 1.00 0.00 C ATOM 0 H ALA A 77 -97.056 -6.255 -38.487 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.085 -4.836 -36.160 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.758 -3.980 -36.064 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.806 -5.757 -36.147 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.402 -4.809 -37.598 1.00 0.00 H new ATOM 849 N SER A 78 -98.746 -3.487 -38.681 1.00 0.00 N ATOM 850 CA SER A 78 -99.196 -2.288 -39.376 1.00 0.00 C ATOM 851 C SER A 78 -99.595 -1.222 -38.365 1.00 0.00 C ATOM 852 O SER A 78 -99.321 -0.038 -38.540 1.00 0.00 O ATOM 853 CB SER A 78 -100.384 -2.633 -40.273 1.00 0.00 C ATOM 854 OG SER A 78 -100.154 -3.852 -40.961 1.00 0.00 O ATOM 0 H SER A 78 -99.216 -4.343 -38.976 1.00 0.00 H new ATOM 0 HA SER A 78 -98.384 -1.901 -39.992 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.289 -2.714 -39.671 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.550 -1.830 -40.991 1.00 0.00 H new ATOM 0 HG SER A 78 -100.574 -3.813 -41.845 1.00 0.00 H new ATOM 860 N LYS A 79 -100.205 -1.684 -37.285 1.00 0.00 N ATOM 861 CA LYS A 79 -100.677 -0.821 -36.216 1.00 0.00 C ATOM 862 C LYS A 79 -99.531 -0.007 -35.602 1.00 0.00 C ATOM 863 O LYS A 79 -99.712 1.163 -35.261 1.00 0.00 O ATOM 864 CB LYS A 79 -101.366 -1.695 -35.158 1.00 0.00 C ATOM 865 CG LYS A 79 -102.034 -0.947 -34.007 1.00 0.00 C ATOM 866 CD LYS A 79 -101.059 -0.621 -32.881 1.00 0.00 C ATOM 867 CE LYS A 79 -100.202 -1.822 -32.509 1.00 0.00 C ATOM 868 NZ LYS A 79 -101.019 -3.030 -32.215 1.00 0.00 N ATOM 0 H LYS A 79 -100.387 -2.675 -37.125 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.388 -0.100 -36.619 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.120 -2.306 -35.654 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -100.626 -2.378 -34.741 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -102.472 -0.023 -34.384 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.852 -1.549 -33.612 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -100.415 0.204 -33.185 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -101.614 -0.286 -32.005 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -99.514 -2.041 -33.326 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -99.595 -1.576 -31.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -100.391 -3.830 -32.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -101.634 -2.843 -31.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -101.605 -3.263 -33.042 1.00 0.00 H new ATOM 882 N VAL A 80 -98.352 -0.612 -35.459 1.00 0.00 N ATOM 883 CA VAL A 80 -97.253 0.064 -34.800 1.00 0.00 C ATOM 884 C VAL A 80 -96.641 1.140 -35.701 1.00 0.00 C ATOM 885 O VAL A 80 -96.477 2.283 -35.272 1.00 0.00 O ATOM 886 CB VAL A 80 -96.170 -0.925 -34.287 1.00 0.00 C ATOM 887 CG1 VAL A 80 -96.808 -2.070 -33.515 1.00 0.00 C ATOM 888 CG2 VAL A 80 -95.282 -1.464 -35.396 1.00 0.00 C ATOM 0 H VAL A 80 -98.142 -1.555 -35.788 1.00 0.00 H new ATOM 0 HA VAL A 80 -97.670 0.557 -33.922 1.00 0.00 H new ATOM 0 HB VAL A 80 -95.526 -0.355 -33.618 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -96.031 -2.750 -33.165 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -97.354 -1.672 -32.660 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -97.496 -2.609 -34.166 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -94.547 -2.149 -34.973 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -95.893 -1.994 -36.126 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -94.768 -0.637 -35.885 1.00 0.00 H new ATOM 898 N CYS A 81 -96.353 0.808 -36.959 1.00 0.00 N ATOM 899 CA CYS A 81 -95.725 1.788 -37.845 1.00 0.00 C ATOM 900 C CYS A 81 -96.733 2.847 -38.280 1.00 0.00 C ATOM 901 O CYS A 81 -96.358 3.975 -38.588 1.00 0.00 O ATOM 902 CB CYS A 81 -95.058 1.121 -39.056 1.00 0.00 C ATOM 903 SG CYS A 81 -93.800 -0.105 -38.591 1.00 0.00 S ATOM 0 H CYS A 81 -96.537 -0.103 -37.379 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.935 2.283 -37.280 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.822 0.636 -39.663 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.597 1.888 -39.678 1.00 0.00 H new ATOM 908 N GLN A 82 -98.016 2.491 -38.271 1.00 0.00 N ATOM 909 CA GLN A 82 -99.080 3.457 -38.528 1.00 0.00 C ATOM 910 C GLN A 82 -99.037 4.573 -37.489 1.00 0.00 C ATOM 911 O GLN A 82 -99.113 5.755 -37.824 1.00 0.00 O ATOM 912 CB GLN A 82 -100.448 2.770 -38.498 1.00 0.00 C ATOM 913 CG GLN A 82 -101.618 3.727 -38.636 1.00 0.00 C ATOM 914 CD GLN A 82 -102.959 3.024 -38.563 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.097 1.984 -37.917 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.959 3.597 -39.212 1.00 0.00 N ATOM 0 H GLN A 82 -98.343 1.542 -38.089 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.926 3.885 -39.519 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.494 2.037 -39.303 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.548 2.221 -37.561 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.563 4.478 -37.848 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.540 4.255 -39.586 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -103.801 4.458 -39.735 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.889 3.178 -39.189 1.00 0.00 H new ATOM 925 N ARG A 83 -98.890 4.188 -36.228 1.00 0.00 N ATOM 926 CA ARG A 83 -98.799 5.156 -35.140 1.00 0.00 C ATOM 927 C ARG A 83 -97.456 5.873 -35.171 1.00 0.00 C ATOM 928 O ARG A 83 -97.288 6.929 -34.565 1.00 0.00 O ATOM 929 CB ARG A 83 -98.984 4.471 -33.789 1.00 0.00 C ATOM 930 CG ARG A 83 -100.330 3.785 -33.628 1.00 0.00 C ATOM 931 CD ARG A 83 -100.484 3.195 -32.237 1.00 0.00 C ATOM 932 NE ARG A 83 -99.388 2.288 -31.900 1.00 0.00 N ATOM 933 CZ ARG A 83 -99.182 1.798 -30.680 1.00 0.00 C ATOM 934 NH1 ARG A 83 -99.990 2.135 -29.680 1.00 0.00 N ATOM 935 NH2 ARG A 83 -98.158 0.981 -30.451 1.00 0.00 N ATOM 0 H ARG A 83 -98.831 3.214 -35.932 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.595 5.888 -35.276 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -98.193 3.734 -33.655 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.867 5.212 -32.998 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -101.130 4.502 -33.812 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -100.430 2.996 -34.373 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -100.525 4.001 -31.504 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -101.431 2.658 -32.174 1.00 0.00 H new ATOM 0 HE ARG A 83 -98.744 2.015 -32.643 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -100.770 2.771 -29.847 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -99.830 1.758 -28.746 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -97.527 0.728 -31.212 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -98.003 0.607 -29.515 1.00 0.00 H new ATOM 949 N LEU A 84 -96.500 5.283 -35.874 1.00 0.00 N ATOM 950 CA LEU A 84 -95.194 5.901 -36.053 1.00 0.00 C ATOM 951 C LEU A 84 -95.168 6.701 -37.350 1.00 0.00 C ATOM 952 O LEU A 84 -94.116 7.176 -37.766 1.00 0.00 O ATOM 953 CB LEU A 84 -94.099 4.832 -36.073 1.00 0.00 C ATOM 954 CG LEU A 84 -93.949 4.029 -34.780 1.00 0.00 C ATOM 955 CD1 LEU A 84 -92.955 2.898 -34.969 1.00 0.00 C ATOM 956 CD2 LEU A 84 -93.516 4.933 -33.637 1.00 0.00 C ATOM 0 H LEU A 84 -96.604 4.377 -36.330 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.008 6.576 -35.217 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.304 4.140 -36.890 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.147 5.314 -36.295 1.00 0.00 H new ATOM 0 HG LEU A 84 -94.918 3.598 -34.529 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.861 2.337 -34.039 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.305 2.234 -35.759 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -91.984 3.309 -35.245 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -93.415 4.344 -32.726 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.558 5.393 -33.880 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.264 5.711 -33.485 1.00 0.00 H new ATOM 968 N ASN A 85 -96.345 6.835 -37.973 1.00 0.00 N ATOM 969 CA ASN A 85 -96.524 7.524 -39.264 1.00 0.00 C ATOM 970 C ASN A 85 -95.494 7.079 -40.306 1.00 0.00 C ATOM 971 O ASN A 85 -95.134 7.841 -41.204 1.00 0.00 O ATOM 972 CB ASN A 85 -96.526 9.065 -39.112 1.00 0.00 C ATOM 973 CG ASN A 85 -95.227 9.658 -38.591 1.00 0.00 C ATOM 974 OD1 ASN A 85 -95.054 9.840 -37.385 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.310 9.975 -39.492 1.00 0.00 N ATOM 0 H ASN A 85 -97.215 6.463 -37.592 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.508 7.230 -39.628 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.749 9.511 -40.081 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.334 9.348 -38.437 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -93.424 10.385 -39.196 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -94.489 9.809 -40.482 1.00 0.00 H new ATOM 982 N CYS A 86 -95.074 5.823 -40.218 1.00 0.00 N ATOM 983 CA CYS A 86 -94.097 5.265 -41.146 1.00 0.00 C ATOM 984 C CYS A 86 -94.791 4.436 -42.228 1.00 0.00 C ATOM 985 O CYS A 86 -94.139 3.753 -43.018 1.00 0.00 O ATOM 986 CB CYS A 86 -93.082 4.409 -40.382 1.00 0.00 C ATOM 987 SG CYS A 86 -92.221 5.303 -39.054 1.00 0.00 S ATOM 0 H CYS A 86 -95.398 5.167 -39.507 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.571 6.085 -41.634 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.596 3.548 -39.954 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.344 4.023 -41.085 1.00 0.00 H new ATOM 992 N GLY A 87 -96.119 4.506 -42.247 1.00 0.00 N ATOM 993 CA GLY A 87 -96.894 3.812 -43.260 1.00 0.00 C ATOM 994 C GLY A 87 -97.254 2.398 -42.851 1.00 0.00 C ATOM 995 O GLY A 87 -97.763 2.174 -41.751 1.00 0.00 O ATOM 0 H GLY A 87 -96.675 5.034 -41.574 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.807 4.372 -43.460 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.327 3.784 -44.190 1.00 0.00 H new ATOM 999 N ASP A 88 -96.972 1.448 -43.732 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.217 0.035 -43.455 1.00 0.00 C ATOM 1001 C ASP A 88 -96.118 -0.495 -42.543 1.00 0.00 C ATOM 1002 O ASP A 88 -95.156 0.223 -42.265 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.272 -0.764 -44.763 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.671 -0.851 -45.339 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -99.443 -1.739 -44.915 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.003 -0.048 -46.235 1.00 0.00 O ATOM 0 H ASP A 88 -96.570 1.630 -44.652 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.179 -0.076 -42.955 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.611 -0.300 -45.495 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.894 -1.771 -44.585 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.231 -1.730 -42.030 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.263 -2.237 -41.077 1.00 0.00 C ATOM 1013 C PRO A 89 -93.936 -2.623 -41.677 1.00 0.00 C ATOM 1014 O PRO A 89 -93.818 -2.992 -42.845 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.914 -3.467 -40.491 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.845 -3.938 -41.544 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.299 -2.714 -42.295 1.00 0.00 C ATOM 0 HA PRO A 89 -95.027 -1.456 -40.354 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.174 -4.229 -40.247 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.445 -3.232 -39.569 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.349 -4.642 -42.213 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.695 -4.460 -41.105 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.405 -2.914 -43.361 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.267 -2.361 -41.939 1.00 0.00 H new ATOM 1025 N LEU A 90 -92.952 -2.457 -40.833 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.614 -2.936 -41.007 1.00 0.00 C ATOM 1027 C LEU A 90 -91.518 -4.235 -41.791 1.00 0.00 C ATOM 1028 O LEU A 90 -92.015 -5.284 -41.386 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.954 -3.077 -39.634 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.902 -3.059 -38.414 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.997 -4.102 -38.518 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.126 -3.260 -37.132 1.00 0.00 C ATOM 0 H LEU A 90 -93.075 -1.953 -39.955 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.085 -2.200 -41.612 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.394 -4.012 -39.618 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.231 -2.270 -39.517 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.378 -2.079 -38.402 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.636 -4.048 -37.636 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.594 -3.915 -39.411 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.550 -5.094 -38.582 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.812 -3.244 -36.285 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.612 -4.221 -37.165 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.394 -2.460 -37.021 1.00 0.00 H new ATOM 1044 N SER A 91 -90.889 -4.107 -42.937 1.00 0.00 N ATOM 1045 CA SER A 91 -90.500 -5.240 -43.760 1.00 0.00 C ATOM 1046 C SER A 91 -89.451 -6.072 -43.018 1.00 0.00 C ATOM 1047 O SER A 91 -88.656 -5.531 -42.244 1.00 0.00 O ATOM 1048 CB SER A 91 -89.952 -4.735 -45.102 1.00 0.00 C ATOM 1049 OG SER A 91 -89.604 -5.802 -45.970 1.00 0.00 O ATOM 0 H SER A 91 -90.628 -3.204 -43.333 1.00 0.00 H new ATOM 0 HA SER A 91 -91.366 -5.872 -43.958 1.00 0.00 H new ATOM 0 HB2 SER A 91 -90.699 -4.104 -45.584 1.00 0.00 H new ATOM 0 HB3 SER A 91 -89.076 -4.112 -44.924 1.00 0.00 H new ATOM 0 HG SER A 91 -89.261 -5.439 -46.813 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.453 -7.377 -43.260 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.611 -8.304 -42.513 1.00 0.00 C ATOM 1057 C LEU A 92 -87.402 -8.756 -43.323 1.00 0.00 C ATOM 1058 O LEU A 92 -87.530 -9.175 -44.471 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.437 -9.519 -42.089 1.00 0.00 C ATOM 1060 CG LEU A 92 -90.225 -9.344 -40.795 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -91.457 -10.226 -40.795 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -89.344 -9.668 -39.599 1.00 0.00 C ATOM 0 H LEU A 92 -90.033 -7.820 -43.973 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.239 -7.781 -41.632 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -90.134 -9.763 -42.891 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.768 -10.373 -41.977 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.548 -8.305 -40.724 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -92.005 -10.086 -39.863 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -92.097 -9.958 -41.636 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -91.157 -11.270 -40.886 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.916 -9.540 -38.680 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.998 -10.699 -39.670 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.485 -8.997 -39.588 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.231 -8.677 -42.708 1.00 0.00 N ATOM 1075 CA GLY A 93 -85.015 -9.142 -43.350 1.00 0.00 C ATOM 1076 C GLY A 93 -83.780 -8.618 -42.643 1.00 0.00 C ATOM 1077 O GLY A 93 -83.829 -7.539 -42.058 1.00 0.00 O ATOM 0 H GLY A 93 -86.099 -8.297 -41.771 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.998 -10.232 -43.355 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -85.005 -8.819 -44.391 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.657 -9.355 -42.687 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.439 -9.007 -41.935 1.00 0.00 C ATOM 1083 C PRO A 94 -80.926 -7.606 -42.264 1.00 0.00 C ATOM 1084 O PRO A 94 -80.814 -7.233 -43.433 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.422 -10.078 -42.360 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.976 -10.675 -43.609 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.468 -10.571 -43.492 1.00 0.00 C ATOM 0 HA PRO A 94 -81.622 -8.990 -40.861 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.440 -9.639 -42.536 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.299 -10.834 -41.584 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.616 -10.142 -44.489 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.665 -11.714 -43.716 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.944 -10.485 -44.469 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.896 -11.447 -43.005 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.617 -6.835 -41.227 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.212 -5.447 -41.401 1.00 0.00 C ATOM 1097 C PHE A 95 -78.805 -5.207 -40.849 1.00 0.00 C ATOM 1098 O PHE A 95 -77.826 -5.240 -41.593 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.229 -4.507 -40.734 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.858 -3.050 -40.806 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.480 -2.474 -42.009 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.875 -2.261 -39.665 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.128 -1.141 -42.073 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.522 -0.928 -39.723 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.148 -0.367 -40.929 1.00 0.00 C ATOM 0 H PHE A 95 -80.640 -7.149 -40.257 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.188 -5.231 -42.469 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.201 -4.647 -41.206 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -81.339 -4.792 -39.688 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -80.461 -3.075 -42.906 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -81.168 -2.695 -38.720 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -79.837 -0.703 -43.017 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.538 -0.325 -38.827 1.00 0.00 H new ATOM 0 HZ PHE A 95 -79.871 0.676 -40.977 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.705 -4.985 -39.542 1.00 0.00 N ATOM 1116 CA LEU A 96 -77.418 -4.695 -38.912 1.00 0.00 C ATOM 1117 C LEU A 96 -76.691 -5.987 -38.550 1.00 0.00 C ATOM 1118 O LEU A 96 -76.946 -7.027 -39.153 1.00 0.00 O ATOM 1119 CB LEU A 96 -77.617 -3.785 -37.686 1.00 0.00 C ATOM 1120 CG LEU A 96 -78.730 -4.182 -36.706 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -78.259 -5.258 -35.737 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -79.212 -2.957 -35.945 1.00 0.00 C ATOM 0 H LEU A 96 -79.496 -5.000 -38.899 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.789 -4.159 -39.623 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -76.677 -3.745 -37.135 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -77.821 -2.775 -38.041 1.00 0.00 H new ATOM 0 HG LEU A 96 -79.558 -4.595 -37.282 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -79.071 -5.516 -35.057 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -77.958 -6.144 -36.296 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -77.410 -4.885 -35.164 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -80.002 -3.247 -35.252 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -78.381 -2.524 -35.388 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -79.600 -2.221 -36.649 1.00 0.00 H new ATOM 1134 N LYS A 97 -75.772 -5.923 -37.592 1.00 0.00 N ATOM 1135 CA LYS A 97 -75.003 -7.097 -37.201 1.00 0.00 C ATOM 1136 C LYS A 97 -75.243 -7.494 -35.745 1.00 0.00 C ATOM 1137 O LYS A 97 -75.073 -6.686 -34.835 1.00 0.00 O ATOM 1138 CB LYS A 97 -73.509 -6.852 -37.425 1.00 0.00 C ATOM 1139 CG LYS A 97 -73.108 -6.808 -38.891 1.00 0.00 C ATOM 1140 CD LYS A 97 -73.315 -8.154 -39.569 1.00 0.00 C ATOM 1141 CE LYS A 97 -72.471 -9.244 -38.922 1.00 0.00 C ATOM 1142 NZ LYS A 97 -71.016 -8.998 -39.088 1.00 0.00 N ATOM 0 H LYS A 97 -75.543 -5.074 -37.075 1.00 0.00 H new ATOM 0 HA LYS A 97 -75.343 -7.921 -37.829 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -73.230 -5.910 -36.953 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -72.942 -7.638 -36.926 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -73.694 -6.047 -39.406 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -72.061 -6.515 -38.974 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -74.368 -8.430 -39.517 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -73.058 -8.073 -40.625 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -72.709 -9.303 -37.860 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -72.727 -10.208 -39.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -70.484 -9.833 -38.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -70.807 -8.815 -40.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -70.736 -8.173 -38.520 1.00 0.00 H new ATOM 1156 N THR A 98 -75.653 -8.752 -35.562 1.00 0.00 N ATOM 1157 CA THR A 98 -75.727 -9.424 -34.255 1.00 0.00 C ATOM 1158 C THR A 98 -76.669 -8.750 -33.249 1.00 0.00 C ATOM 1159 O THR A 98 -77.353 -7.774 -33.559 1.00 0.00 O ATOM 1160 CB THR A 98 -74.326 -9.583 -33.613 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.733 -8.303 -33.351 1.00 0.00 O ATOM 1162 CG2 THR A 98 -73.408 -10.392 -34.515 1.00 0.00 C ATOM 0 H THR A 98 -75.950 -9.348 -36.334 1.00 0.00 H new ATOM 0 HA THR A 98 -76.148 -10.404 -34.480 1.00 0.00 H new ATOM 0 HB THR A 98 -74.455 -10.112 -32.669 1.00 0.00 H new ATOM 0 HG1 THR A 98 -74.380 -7.595 -33.552 1.00 0.00 H new ATOM 0 HG21 THR A 98 -72.430 -10.491 -34.044 1.00 0.00 H new ATOM 0 HG22 THR A 98 -73.835 -11.382 -34.675 1.00 0.00 H new ATOM 0 HG23 THR A 98 -73.300 -9.884 -35.473 1.00 0.00 H new ATOM 1170 N TYR A 99 -76.715 -9.333 -32.051 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.477 -8.804 -30.925 1.00 0.00 C ATOM 1172 C TYR A 99 -76.637 -8.927 -29.659 1.00 0.00 C ATOM 1173 O TYR A 99 -75.452 -9.249 -29.728 1.00 0.00 O ATOM 1174 CB TYR A 99 -78.784 -9.584 -30.722 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.862 -9.321 -31.751 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -79.905 -10.034 -32.938 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -80.848 -8.369 -31.522 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -80.896 -9.805 -33.868 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -81.845 -8.138 -32.449 1.00 0.00 C ATOM 1180 CZ TYR A 99 -81.862 -8.858 -33.622 1.00 0.00 C ATOM 1181 OH TYR A 99 -82.856 -8.640 -34.548 1.00 0.00 O ATOM 0 H TYR A 99 -76.217 -10.197 -31.835 1.00 0.00 H new ATOM 0 HA TYR A 99 -77.720 -7.762 -31.134 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -78.556 -10.650 -30.724 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -79.181 -9.345 -29.735 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -79.151 -10.781 -33.138 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.834 -7.800 -30.604 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -80.914 -10.369 -34.789 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -82.607 -7.397 -32.255 1.00 0.00 H new ATOM 0 HH TYR A 99 -82.478 -8.689 -35.451 1.00 0.00 H new ATOM 1191 N THR A 100 -77.259 -8.696 -28.512 1.00 0.00 N ATOM 1192 CA THR A 100 -76.601 -8.875 -27.227 1.00 0.00 C ATOM 1193 C THR A 100 -77.491 -9.729 -26.324 1.00 0.00 C ATOM 1194 O THR A 100 -78.560 -9.294 -25.926 1.00 0.00 O ATOM 1195 CB THR A 100 -76.311 -7.518 -26.547 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.519 -6.690 -27.413 1.00 0.00 O ATOM 1197 CG2 THR A 100 -75.579 -7.714 -25.224 1.00 0.00 C ATOM 0 H THR A 100 -78.227 -8.381 -28.446 1.00 0.00 H new ATOM 0 HA THR A 100 -75.646 -9.374 -27.393 1.00 0.00 H new ATOM 0 HB THR A 100 -77.266 -7.031 -26.349 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.342 -5.832 -26.974 1.00 0.00 H new ATOM 0 HG21 THR A 100 -75.387 -6.743 -24.767 1.00 0.00 H new ATOM 0 HG22 THR A 100 -76.193 -8.316 -24.554 1.00 0.00 H new ATOM 0 HG23 THR A 100 -74.632 -8.223 -25.404 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.047 -10.946 -25.974 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.883 -11.964 -25.309 1.00 0.00 C ATOM 1207 C PRO A 101 -78.278 -11.615 -23.875 1.00 0.00 C ATOM 1208 O PRO A 101 -78.763 -12.468 -23.124 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.008 -13.227 -25.325 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.867 -12.918 -26.236 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.685 -11.430 -26.188 1.00 0.00 C ATOM 0 HA PRO A 101 -78.836 -12.069 -25.828 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.654 -13.470 -24.323 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.572 -14.089 -25.682 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.961 -13.432 -25.914 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.078 -13.252 -27.252 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.017 -11.130 -25.381 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.259 -11.044 -27.114 1.00 0.00 H new ATOM 1219 N GLN A 102 -78.098 -10.365 -23.513 1.00 0.00 N ATOM 1220 CA GLN A 102 -78.479 -9.882 -22.197 1.00 0.00 C ATOM 1221 C GLN A 102 -79.721 -9.007 -22.306 1.00 0.00 C ATOM 1222 O GLN A 102 -80.783 -9.355 -21.789 1.00 0.00 O ATOM 1223 CB GLN A 102 -77.333 -9.102 -21.549 1.00 0.00 C ATOM 1224 CG GLN A 102 -77.641 -8.640 -20.134 1.00 0.00 C ATOM 1225 CD GLN A 102 -76.467 -7.947 -19.480 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -76.317 -6.728 -19.577 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -75.621 -8.719 -18.816 1.00 0.00 N ATOM 0 H GLN A 102 -77.685 -9.654 -24.117 1.00 0.00 H new ATOM 0 HA GLN A 102 -78.703 -10.741 -21.564 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -76.441 -9.728 -21.533 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -77.101 -8.233 -22.165 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -78.493 -7.961 -20.155 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -77.933 -9.500 -19.531 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -75.784 -9.724 -18.761 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -74.807 -8.308 -18.359 1.00 0.00 H new ATOM 1236 N SER A 103 -79.587 -7.879 -22.996 1.00 0.00 N ATOM 1237 CA SER A 103 -80.699 -6.961 -23.184 1.00 0.00 C ATOM 1238 C SER A 103 -81.541 -7.362 -24.395 1.00 0.00 C ATOM 1239 O SER A 103 -82.754 -7.137 -24.421 1.00 0.00 O ATOM 1240 CB SER A 103 -80.175 -5.534 -23.343 1.00 0.00 C ATOM 1241 OG SER A 103 -79.384 -5.164 -22.225 1.00 0.00 O ATOM 0 H SER A 103 -78.716 -7.580 -23.434 1.00 0.00 H new ATOM 0 HA SER A 103 -81.339 -7.007 -22.303 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.583 -5.458 -24.255 1.00 0.00 H new ATOM 0 HB3 SER A 103 -81.012 -4.843 -23.448 1.00 0.00 H new ATOM 0 HG SER A 103 -79.056 -4.248 -22.345 1.00 0.00 H new ATOM 1247 N SER A 104 -80.899 -7.970 -25.390 1.00 0.00 N ATOM 1248 CA SER A 104 -81.607 -8.444 -26.566 1.00 0.00 C ATOM 1249 C SER A 104 -82.070 -9.874 -26.329 1.00 0.00 C ATOM 1250 O SER A 104 -81.283 -10.734 -25.921 1.00 0.00 O ATOM 1251 CB SER A 104 -80.713 -8.378 -27.806 1.00 0.00 C ATOM 1252 OG SER A 104 -80.057 -7.122 -27.904 1.00 0.00 O ATOM 0 H SER A 104 -79.894 -8.143 -25.401 1.00 0.00 H new ATOM 0 HA SER A 104 -82.471 -7.802 -26.741 1.00 0.00 H new ATOM 0 HB2 SER A 104 -79.971 -9.176 -27.765 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.314 -8.547 -28.699 1.00 0.00 H new ATOM 0 HG SER A 104 -80.723 -6.413 -28.023 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.340 -10.130 -26.573 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.914 -11.422 -26.256 1.00 0.00 C ATOM 1260 C ILE A 105 -84.557 -12.076 -27.476 1.00 0.00 C ATOM 1261 O ILE A 105 -84.817 -11.421 -28.489 1.00 0.00 O ATOM 1262 CB ILE A 105 -84.947 -11.314 -25.101 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.002 -10.234 -25.372 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.249 -11.026 -23.779 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.105 -10.668 -26.307 1.00 0.00 C ATOM 0 H ILE A 105 -83.991 -9.464 -26.988 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.091 -12.057 -25.929 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.456 -12.276 -25.040 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.444 -9.928 -24.424 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.509 -9.357 -25.792 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -84.991 -10.954 -22.984 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.551 -11.832 -23.553 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.704 -10.085 -23.853 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.808 -9.847 -26.446 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.677 -10.946 -27.270 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.627 -11.525 -25.881 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.796 -13.370 -27.359 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.529 -14.131 -28.356 1.00 0.00 C ATOM 1279 C ILE A 106 -86.816 -14.629 -27.717 1.00 0.00 C ATOM 1280 O ILE A 106 -86.767 -15.398 -26.755 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.747 -15.380 -28.826 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.455 -14.987 -29.520 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.606 -16.224 -29.764 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.539 -16.158 -29.797 1.00 0.00 C ATOM 0 H ILE A 106 -84.485 -13.927 -26.563 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.704 -13.479 -29.212 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.497 -15.970 -27.944 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.693 -14.492 -30.461 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.927 -14.261 -28.903 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.041 -17.099 -30.086 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.507 -16.545 -29.242 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.884 -15.631 -30.635 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.636 -15.804 -30.294 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.271 -16.640 -28.857 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.049 -16.875 -30.440 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.960 -14.209 -28.205 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.198 -14.757 -27.682 1.00 0.00 C ATOM 1298 C CYS A 107 -89.597 -15.973 -28.504 1.00 0.00 C ATOM 1299 O CYS A 107 -89.034 -16.220 -29.571 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.328 -13.737 -27.693 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.922 -12.100 -27.035 1.00 0.00 S ATOM 0 H CYS A 107 -88.064 -13.511 -28.941 1.00 0.00 H new ATOM 0 HA CYS A 107 -89.025 -15.041 -26.644 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.675 -13.619 -28.720 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.162 -14.141 -27.119 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.559 -16.734 -28.015 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.001 -17.935 -28.704 1.00 0.00 C ATOM 1308 C TYR A 108 -92.517 -18.029 -28.651 1.00 0.00 C ATOM 1309 O TYR A 108 -93.175 -17.186 -28.043 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.397 -19.184 -28.060 1.00 0.00 C ATOM 1311 CG TYR A 108 -88.883 -19.231 -28.022 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.154 -19.726 -29.095 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.186 -18.804 -26.898 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -86.772 -19.789 -29.051 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.807 -18.868 -26.846 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.105 -19.361 -27.922 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.729 -19.433 -27.867 1.00 0.00 O ATOM 0 H TYR A 108 -91.051 -16.542 -27.142 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.668 -17.877 -29.740 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.771 -19.262 -27.039 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.757 -20.060 -28.600 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -88.674 -20.067 -29.978 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.732 -18.416 -26.051 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.219 -20.171 -29.896 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -86.282 -18.532 -25.964 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.418 -19.091 -27.003 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.064 -19.058 -29.276 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.497 -19.247 -29.271 1.00 0.00 C ATOM 1329 C GLY A 109 -95.113 -18.873 -30.600 1.00 0.00 C ATOM 1330 O GLY A 109 -94.423 -18.836 -31.619 1.00 0.00 O ATOM 0 H GLY A 109 -92.539 -19.767 -29.788 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.726 -20.288 -29.043 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -94.941 -18.642 -28.480 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.405 -18.599 -30.591 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.107 -18.193 -31.797 1.00 0.00 C ATOM 1336 C GLN A 110 -96.862 -16.716 -32.077 1.00 0.00 C ATOM 1337 O GLN A 110 -97.140 -15.865 -31.226 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.608 -18.461 -31.647 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.434 -18.094 -32.874 1.00 0.00 C ATOM 1340 CD GLN A 110 -99.151 -18.980 -34.078 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -98.040 -19.481 -34.261 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -100.158 -19.174 -34.912 1.00 0.00 N ATOM 0 H GLN A 110 -96.992 -18.650 -29.759 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.728 -18.775 -32.637 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.757 -19.518 -31.426 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -98.982 -17.900 -30.790 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -100.493 -18.161 -32.624 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -99.234 -17.056 -33.141 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -101.064 -18.743 -34.727 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -100.029 -19.755 -35.740 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.327 -16.426 -33.261 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.058 -15.054 -33.680 1.00 0.00 C ATOM 1353 C LEU A 111 -97.307 -14.192 -33.529 1.00 0.00 C ATOM 1354 O LEU A 111 -98.287 -14.361 -34.257 1.00 0.00 O ATOM 1355 CB LEU A 111 -95.564 -15.029 -35.130 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.170 -13.651 -35.666 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.007 -13.078 -34.869 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -94.808 -13.740 -37.141 1.00 0.00 C ATOM 0 H LEU A 111 -96.070 -17.131 -33.952 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.278 -14.644 -33.038 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -94.703 -15.692 -35.214 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.346 -15.439 -35.769 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.024 -12.983 -35.556 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -93.742 -12.098 -35.266 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.296 -12.980 -33.823 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.149 -13.745 -34.947 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -94.530 -12.752 -37.508 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -93.969 -14.424 -37.269 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -95.665 -14.108 -37.704 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.262 -13.279 -32.574 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.418 -12.478 -32.250 1.00 0.00 C ATOM 1372 C GLY A 112 -98.634 -12.415 -30.755 1.00 0.00 C ATOM 1373 O GLY A 112 -98.896 -11.349 -30.205 1.00 0.00 O ATOM 0 H GLY A 112 -96.435 -13.078 -32.012 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.288 -11.470 -32.645 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.302 -12.898 -32.731 1.00 0.00 H new ATOM 1377 N SER A 113 -98.490 -13.556 -30.095 1.00 0.00 N ATOM 1378 CA SER A 113 -98.659 -13.633 -28.653 1.00 0.00 C ATOM 1379 C SER A 113 -97.334 -13.367 -27.941 1.00 0.00 C ATOM 1380 O SER A 113 -96.495 -14.255 -27.792 1.00 0.00 O ATOM 1381 CB SER A 113 -99.221 -14.998 -28.253 1.00 0.00 C ATOM 1382 OG SER A 113 -100.541 -15.171 -28.745 1.00 0.00 O ATOM 0 H SER A 113 -98.255 -14.444 -30.539 1.00 0.00 H new ATOM 0 HA SER A 113 -99.370 -12.865 -28.348 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.578 -15.788 -28.642 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.219 -15.092 -27.167 1.00 0.00 H new ATOM 0 HG SER A 113 -100.877 -16.052 -28.477 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.168 -12.134 -27.502 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.947 -11.681 -26.845 1.00 0.00 C ATOM 1390 C PHE A 114 -96.019 -11.946 -25.345 1.00 0.00 C ATOM 1391 O PHE A 114 -95.578 -11.134 -24.534 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.754 -10.180 -27.104 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.333 -9.844 -28.509 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -95.937 -10.445 -29.603 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.312 -8.935 -28.734 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.534 -10.145 -30.886 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.903 -8.634 -30.018 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.515 -9.239 -31.095 1.00 0.00 C ATOM 0 H PHE A 114 -97.880 -11.409 -27.590 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.099 -12.232 -27.252 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.687 -9.662 -26.883 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.005 -9.797 -26.411 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.734 -11.157 -29.447 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.830 -8.456 -27.895 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.016 -10.619 -31.728 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.104 -7.925 -30.178 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.197 -9.004 -32.100 1.00 0.00 H new ATOM 1408 N SER A 115 -96.559 -13.101 -24.984 1.00 0.00 N ATOM 1409 CA SER A 115 -96.774 -13.435 -23.586 1.00 0.00 C ATOM 1410 C SER A 115 -95.605 -14.261 -23.033 1.00 0.00 C ATOM 1411 O SER A 115 -95.546 -14.547 -21.839 1.00 0.00 O ATOM 1412 CB SER A 115 -98.091 -14.209 -23.431 1.00 0.00 C ATOM 1413 OG SER A 115 -98.545 -14.200 -22.084 1.00 0.00 O ATOM 0 H SER A 115 -96.856 -13.822 -25.641 1.00 0.00 H new ATOM 0 HA SER A 115 -96.833 -12.508 -23.015 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.851 -13.768 -24.075 1.00 0.00 H new ATOM 0 HB3 SER A 115 -97.951 -15.238 -23.762 1.00 0.00 H new ATOM 0 HG SER A 115 -97.796 -14.402 -21.485 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.673 -14.642 -23.901 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.555 -15.492 -23.491 1.00 0.00 C ATOM 1421 C ASN A 116 -92.298 -15.186 -24.294 1.00 0.00 C ATOM 1422 O ASN A 116 -92.317 -15.199 -25.527 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.927 -16.972 -23.651 1.00 0.00 C ATOM 1424 CG ASN A 116 -92.751 -17.914 -23.423 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -92.056 -18.298 -24.363 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -92.518 -18.292 -22.173 1.00 0.00 N ATOM 0 H ASN A 116 -94.667 -14.379 -24.887 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.347 -15.282 -22.442 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.723 -17.218 -22.948 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.325 -17.134 -24.653 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -91.742 -18.921 -21.967 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -93.115 -17.954 -21.418 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.208 -14.914 -23.589 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.919 -14.689 -24.228 1.00 0.00 C ATOM 1435 C CYS A 117 -88.808 -15.388 -23.450 1.00 0.00 C ATOM 1436 O CYS A 117 -89.059 -15.983 -22.399 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.594 -13.197 -24.323 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.788 -12.177 -25.221 1.00 0.00 S ATOM 0 H CYS A 117 -91.191 -14.844 -22.572 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.982 -15.101 -25.235 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.498 -12.802 -23.312 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.621 -13.088 -24.802 1.00 0.00 H new ATOM 1443 N SER A 118 -87.587 -15.314 -23.972 1.00 0.00 N ATOM 1444 CA SER A 118 -86.412 -15.875 -23.312 1.00 0.00 C ATOM 1445 C SER A 118 -85.157 -15.163 -23.818 1.00 0.00 C ATOM 1446 O SER A 118 -85.250 -14.257 -24.642 1.00 0.00 O ATOM 1447 CB SER A 118 -86.317 -17.385 -23.571 1.00 0.00 C ATOM 1448 OG SER A 118 -87.442 -18.065 -23.036 1.00 0.00 O ATOM 0 H SER A 118 -87.384 -14.863 -24.864 1.00 0.00 H new ATOM 0 HA SER A 118 -86.500 -15.724 -22.236 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.252 -17.570 -24.643 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.404 -17.778 -23.124 1.00 0.00 H new ATOM 0 HG SER A 118 -88.053 -17.416 -22.629 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.991 -15.557 -23.325 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.741 -14.944 -23.765 1.00 0.00 C ATOM 1456 C HIS A 119 -82.291 -15.538 -25.093 1.00 0.00 C ATOM 1457 O HIS A 119 -82.743 -16.615 -25.486 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.635 -15.133 -22.723 1.00 0.00 C ATOM 1459 CG HIS A 119 -81.708 -14.182 -21.570 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -80.804 -13.160 -21.386 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.561 -14.119 -20.523 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -81.097 -12.509 -20.278 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -82.161 -13.070 -19.732 1.00 0.00 N ATOM 0 H HIS A 119 -83.882 -16.292 -22.626 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.926 -13.877 -23.890 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.682 -16.153 -22.341 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.668 -15.020 -23.212 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.028 -12.941 -22.010 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.401 -14.773 -20.342 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -80.558 -11.660 -19.883 1.00 0.00 H new ATOM 1472 N SER A 120 -81.406 -14.827 -25.781 1.00 0.00 N ATOM 1473 CA SER A 120 -80.818 -15.323 -27.014 1.00 0.00 C ATOM 1474 C SER A 120 -79.822 -16.437 -26.687 1.00 0.00 C ATOM 1475 O SER A 120 -78.626 -16.189 -26.534 1.00 0.00 O ATOM 1476 CB SER A 120 -80.129 -14.171 -27.770 1.00 0.00 C ATOM 1477 OG SER A 120 -79.776 -14.546 -29.090 1.00 0.00 O ATOM 0 H SER A 120 -81.080 -13.901 -25.502 1.00 0.00 H new ATOM 0 HA SER A 120 -81.599 -15.729 -27.657 1.00 0.00 H new ATOM 0 HB2 SER A 120 -80.794 -13.308 -27.803 1.00 0.00 H new ATOM 0 HB3 SER A 120 -79.235 -13.864 -27.228 1.00 0.00 H new ATOM 0 HG SER A 120 -79.343 -13.791 -29.540 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.331 -17.657 -26.524 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.495 -18.773 -26.094 1.00 0.00 C ATOM 1485 C ARG A 121 -79.464 -19.901 -27.123 1.00 0.00 C ATOM 1486 O ARG A 121 -78.437 -20.124 -27.755 1.00 0.00 O ATOM 1487 CB ARG A 121 -79.970 -19.319 -24.745 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.020 -18.269 -23.650 1.00 0.00 C ATOM 1489 CD ARG A 121 -80.296 -18.887 -22.292 1.00 0.00 C ATOM 1490 NE ARG A 121 -79.193 -19.739 -21.851 1.00 0.00 N ATOM 1491 CZ ARG A 121 -79.164 -20.383 -20.688 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -80.180 -20.276 -19.841 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -78.113 -21.131 -20.378 1.00 0.00 N ATOM 0 H ARG A 121 -81.310 -17.895 -26.682 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.482 -18.385 -25.991 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -80.962 -19.753 -24.867 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -79.306 -20.125 -24.434 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -79.073 -17.730 -23.619 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -80.795 -17.538 -23.882 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -80.461 -18.097 -21.559 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -81.213 -19.474 -22.339 1.00 0.00 H new ATOM 0 HE ARG A 121 -78.394 -19.846 -22.476 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -80.986 -19.699 -20.081 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -80.155 -20.771 -18.950 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -77.333 -21.210 -21.030 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -78.085 -21.627 -19.487 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.418 -15.460 -32.458 1.00 0.00 N ATOM 1551 CA CYS A 125 -80.986 -14.861 -33.646 1.00 0.00 C ATOM 1552 C CYS A 125 -79.978 -14.006 -34.385 1.00 0.00 C ATOM 1553 O CYS A 125 -79.271 -13.193 -33.786 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.214 -14.028 -33.281 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.144 -13.275 -31.627 1.00 0.00 S ATOM 0 HA CYS A 125 -81.283 -15.671 -34.312 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.336 -13.238 -34.022 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.099 -14.661 -33.342 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.899 -14.218 -35.692 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.163 -13.317 -36.553 1.00 0.00 C ATOM 1562 C HIS A 126 -79.891 -11.988 -36.557 1.00 0.00 C ATOM 1563 O HIS A 126 -81.057 -11.921 -36.157 1.00 0.00 O ATOM 1564 CB HIS A 126 -79.047 -13.872 -37.979 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.178 -15.091 -38.090 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -76.983 -15.105 -38.779 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -78.343 -16.345 -37.608 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -76.457 -16.316 -38.721 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -77.262 -17.087 -38.014 1.00 0.00 N ATOM 0 H HIS A 126 -80.336 -15.004 -36.173 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.147 -13.198 -36.178 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -80.044 -14.115 -38.346 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.649 -13.094 -38.630 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -79.173 -16.697 -37.013 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -75.526 -16.623 -39.175 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -77.106 -18.073 -37.804 1.00 0.00 H new ATOM 1578 N SER A 127 -79.228 -10.942 -37.000 1.00 0.00 N ATOM 1579 CA SER A 127 -79.786 -9.607 -36.913 1.00 0.00 C ATOM 1580 C SER A 127 -80.876 -9.363 -37.959 1.00 0.00 C ATOM 1581 O SER A 127 -80.718 -8.541 -38.867 1.00 0.00 O ATOM 1582 CB SER A 127 -78.661 -8.592 -37.030 1.00 0.00 C ATOM 1583 OG SER A 127 -77.602 -9.120 -37.816 1.00 0.00 O ATOM 0 H SER A 127 -78.302 -10.988 -37.424 1.00 0.00 H new ATOM 0 HA SER A 127 -80.273 -9.496 -35.944 1.00 0.00 H new ATOM 0 HB2 SER A 127 -79.036 -7.674 -37.482 1.00 0.00 H new ATOM 0 HB3 SER A 127 -78.292 -8.332 -36.038 1.00 0.00 H new ATOM 0 HG SER A 127 -77.435 -8.529 -38.579 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.973 -10.100 -37.823 1.00 0.00 N ATOM 1590 CA LEU A 128 -83.161 -9.883 -38.630 1.00 0.00 C ATOM 1591 C LEU A 128 -83.743 -8.525 -38.296 1.00 0.00 C ATOM 1592 O LEU A 128 -84.084 -8.254 -37.145 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.210 -10.977 -38.376 1.00 0.00 C ATOM 1594 CG LEU A 128 -84.023 -12.291 -39.151 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.034 -12.033 -40.649 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.739 -12.998 -38.742 1.00 0.00 C ATOM 0 H LEU A 128 -82.061 -10.862 -37.151 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.883 -9.922 -39.683 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.215 -11.206 -37.310 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -85.192 -10.573 -38.620 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.858 -12.946 -38.903 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.900 -12.975 -41.181 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.987 -11.587 -40.934 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.223 -11.352 -40.907 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.637 -13.924 -39.309 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.886 -12.351 -38.947 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.773 -13.227 -37.677 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.858 -7.679 -39.295 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.263 -6.322 -39.061 1.00 0.00 C ATOM 1610 C GLY A 129 -85.702 -6.098 -39.431 1.00 0.00 C ATOM 1611 O GLY A 129 -86.377 -7.004 -39.931 1.00 0.00 O ATOM 0 H GLY A 129 -83.676 -7.911 -40.272 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.115 -6.075 -38.010 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.630 -5.649 -39.639 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.151 -4.884 -39.209 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.511 -4.492 -39.467 1.00 0.00 C ATOM 1617 C LEU A 130 -87.509 -3.025 -39.854 1.00 0.00 C ATOM 1618 O LEU A 130 -86.854 -2.201 -39.217 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.383 -4.740 -38.235 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.019 -6.134 -38.157 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.646 -6.370 -36.792 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.065 -6.302 -39.252 1.00 0.00 C ATOM 0 H LEU A 130 -85.570 -4.132 -38.838 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.930 -5.085 -40.280 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -87.777 -4.584 -37.343 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.177 -3.994 -38.215 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.232 -6.874 -38.304 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.090 -7.365 -36.763 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -88.879 -6.292 -36.021 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.419 -5.623 -36.612 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.507 -7.296 -39.183 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.844 -5.549 -39.130 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.593 -6.181 -40.227 1.00 0.00 H new ATOM 1634 N THR A 131 -88.191 -2.705 -40.922 1.00 0.00 N ATOM 1635 CA THR A 131 -88.164 -1.363 -41.457 1.00 0.00 C ATOM 1636 C THR A 131 -89.533 -0.997 -42.023 1.00 0.00 C ATOM 1637 O THR A 131 -89.940 -1.519 -43.056 1.00 0.00 O ATOM 1638 CB THR A 131 -87.074 -1.293 -42.531 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.791 -1.477 -41.915 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.103 0.024 -43.288 1.00 0.00 C ATOM 0 H THR A 131 -88.776 -3.357 -41.444 1.00 0.00 H new ATOM 0 HA THR A 131 -87.935 -0.643 -40.671 1.00 0.00 H new ATOM 0 HB THR A 131 -87.261 -2.086 -43.255 1.00 0.00 H new ATOM 0 HG1 THR A 131 -85.091 -1.435 -42.599 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.313 0.029 -44.039 1.00 0.00 H new ATOM 0 HG22 THR A 131 -88.070 0.141 -43.777 1.00 0.00 H new ATOM 0 HG23 THR A 131 -86.947 0.848 -42.591 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.250 -0.129 -41.306 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.669 0.126 -41.563 1.00 0.00 C ATOM 1650 C CYS A 132 -91.964 0.378 -43.032 1.00 0.00 C ATOM 1651 O CYS A 132 -91.498 1.353 -43.631 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.175 1.272 -40.693 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.078 0.902 -38.917 1.00 0.00 S ATOM 0 H CYS A 132 -89.865 0.415 -40.534 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.210 -0.781 -41.293 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.592 2.168 -40.905 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.209 1.494 -40.957 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.711 -0.570 -43.587 1.00 0.00 N ATOM 1659 CA LEU A 133 -93.226 -0.536 -44.940 1.00 0.00 C ATOM 1660 C LEU A 133 -92.166 -0.898 -45.981 1.00 0.00 C ATOM 1661 O LEU A 133 -92.308 -1.881 -46.711 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.861 0.827 -45.255 1.00 0.00 C ATOM 1663 CG LEU A 133 -94.173 1.094 -46.735 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -95.167 0.075 -47.276 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.699 2.513 -46.918 1.00 0.00 C ATOM 0 H LEU A 133 -92.982 -1.414 -43.082 1.00 0.00 H new ATOM 0 HA LEU A 133 -94.001 -1.300 -44.999 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.787 0.915 -44.687 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.192 1.610 -44.898 1.00 0.00 H new ATOM 0 HG LEU A 133 -93.248 0.992 -47.303 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -95.370 0.287 -48.326 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -94.748 -0.927 -47.183 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -96.095 0.135 -46.707 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.916 2.688 -47.972 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.610 2.641 -46.334 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.948 3.226 -46.579 1.00 0.00 H new ATOM 1677 N GLU A 134 -91.110 -0.108 -46.042 1.00 0.00 N ATOM 1678 CA GLU A 134 -90.099 -0.262 -47.084 1.00 0.00 C ATOM 1679 C GLU A 134 -89.124 -1.397 -46.764 1.00 0.00 C ATOM 1680 O GLU A 134 -88.866 -1.706 -45.601 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.341 1.054 -47.275 1.00 0.00 C ATOM 1682 CG GLU A 134 -88.619 1.531 -46.028 1.00 0.00 C ATOM 1683 CD GLU A 134 -88.005 2.900 -46.197 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -86.909 3.004 -46.782 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -88.618 3.887 -45.737 1.00 0.00 O ATOM 0 H GLU A 134 -90.926 0.649 -45.384 1.00 0.00 H new ATOM 0 HA GLU A 134 -90.610 -0.522 -48.011 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.615 0.931 -48.079 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.043 1.824 -47.594 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -89.320 1.552 -45.193 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -87.838 0.816 -45.770 1.00 0.00 H new