USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 821 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 99 TYR OH : rot -143:sc= 0.954 USER MOD Set 1.2: A 127 SER OG : rot 130:sc= 1.01 USER MOD Set 2.1: A 79 LYS NZ :NH3+ 156:sc= 1.25 (180deg=0) USER MOD Set 2.2: A 82 GLN : amide:sc= 1.08 K(o=2.3,f=-8.5!) USER MOD Set 3.1: A 75 SER OG : rot -46:sc= 1.37 USER MOD Set 3.2: A 76 GLN : amide:sc= -0.0178 K(o=1.4,f=0.73) USER MOD Set 4.1: A 62 GLN : amide:sc= -1.32! C(o=-0.25!,f=-5.3!) USER MOD Set 4.2: A 68 SER OG : rot -145:sc= 1.5 USER MOD Set 4.3: A 126 HIS : no HD1:sc= -0.429 K(o=-0.25,f=-1.3) USER MOD Set 5.1: A 47 GLN : amide:sc= 0.647! C(o=1.6!,f=-3.3!) USER MOD Set 5.2: A 61 SER OG : rot 23:sc= 0.914 USER MOD Set 5.3: A 98 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 58 MET CE :methyl 148:sc= -0.284 (180deg=-1.32) USER MOD Set 6.2: A 103 SER OG : rot 180:sc= 0.00417 USER MOD Set 7.1: A 42 SER OG : rot 180:sc= -0.0638 USER MOD Set 7.2: A 45 GLN : amide:sc= 0 K(o=-0.064,f=-1.1) USER MOD Set 8.1: A 38 THR OG1 : rot 180:sc= 0.0188 USER MOD Set 8.2: A 40 SER OG : rot 110:sc= 0 USER MOD Single : A 27 SER OG : rot 149:sc= -0.963 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.29) USER MOD Single : A 41 ASN : amide:sc= -0.0432 K(o=-0.043,f=-1.8!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -2.83! C(o=-2.8!,f=-2.7!) USER MOD Single : A 63 SER OG : rot -11:sc= 0.281 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -161:sc= 0.834 (180deg=-0.168!) USER MOD Single : A 70 GLN : amide:sc= -0.773 K(o=-0.77,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.438 USER MOD Single : A 85 ASN : amide:sc= -0.919 X(o=-0.92,f=-0.92) USER MOD Single : A 91 SER OG : rot -113:sc= 0.95 USER MOD Single : A 97 LYS NZ :NH3+ -158:sc= 1.12 (180deg=0.00684) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 104 SER OG : rot 39:sc= -0.41! USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.085 K(o=-0.085,f=-1.3) USER MOD Single : A 118 SER OG : rot 180:sc=-0.00741 USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot -71:sc= 0.827 USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 MET CE :methyl -163:sc= -0.0891 (180deg=-0.51) USER MOD Single : A 131 THR OG1 : rot 25:sc= 0.712 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 25 -104.341 -7.296 -26.241 1.00 0.00 N ATOM 2 CA ARG A 25 -103.454 -7.320 -25.054 1.00 0.00 C ATOM 3 C ARG A 25 -101.994 -7.235 -25.493 1.00 0.00 C ATOM 4 O ARG A 25 -101.680 -6.491 -26.418 1.00 0.00 O ATOM 5 CB ARG A 25 -103.731 -8.584 -24.219 1.00 0.00 C ATOM 6 CG ARG A 25 -103.346 -9.904 -24.879 1.00 0.00 C ATOM 7 CD ARG A 25 -104.170 -11.058 -24.321 1.00 0.00 C ATOM 8 NE ARG A 25 -104.475 -10.885 -22.899 1.00 0.00 N ATOM 9 CZ ARG A 25 -104.150 -11.755 -21.942 1.00 0.00 C ATOM 10 NH1 ARG A 25 -103.494 -12.870 -22.247 1.00 0.00 N ATOM 11 NH2 ARG A 25 -104.481 -11.507 -20.681 1.00 0.00 N ATOM 0 HA ARG A 25 -103.659 -6.455 -24.423 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -103.193 -8.500 -23.275 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -104.794 -8.614 -23.979 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -103.497 -9.833 -25.956 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -102.286 -10.099 -24.718 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -105.100 -11.142 -24.882 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -103.626 -11.992 -24.463 1.00 0.00 H new ATOM 0 HE ARG A 25 -104.971 -10.039 -22.621 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -103.238 -13.062 -23.215 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -103.247 -13.533 -21.513 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -104.984 -10.652 -20.444 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -104.233 -12.172 -19.948 1.00 0.00 H new ATOM 25 N LEU A 26 -101.103 -7.965 -24.825 1.00 0.00 N ATOM 26 CA LEU A 26 -99.698 -7.990 -25.213 1.00 0.00 C ATOM 27 C LEU A 26 -99.526 -8.691 -26.564 1.00 0.00 C ATOM 28 O LEU A 26 -99.229 -9.883 -26.626 1.00 0.00 O ATOM 29 CB LEU A 26 -98.853 -8.692 -24.143 1.00 0.00 C ATOM 30 CG LEU A 26 -98.928 -8.085 -22.737 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.099 -8.908 -21.761 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.452 -6.639 -22.749 1.00 0.00 C ATOM 0 H LEU A 26 -101.329 -8.544 -24.016 1.00 0.00 H new ATOM 0 HA LEU A 26 -99.354 -6.960 -25.307 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -99.164 -9.735 -24.086 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -97.812 -8.687 -24.466 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.968 -8.100 -22.411 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.162 -8.465 -20.767 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -98.482 -9.928 -21.729 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -97.059 -8.921 -22.088 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.513 -6.227 -21.742 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.419 -6.599 -23.095 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.082 -6.054 -23.419 1.00 0.00 H new ATOM 44 N SER A 27 -99.782 -7.954 -27.634 1.00 0.00 N ATOM 45 CA SER A 27 -99.628 -8.458 -28.988 1.00 0.00 C ATOM 46 C SER A 27 -99.164 -7.331 -29.906 1.00 0.00 C ATOM 47 O SER A 27 -99.547 -6.182 -29.710 1.00 0.00 O ATOM 48 CB SER A 27 -100.956 -9.044 -29.471 1.00 0.00 C ATOM 49 OG SER A 27 -102.026 -8.143 -29.254 1.00 0.00 O ATOM 0 H SER A 27 -100.103 -6.987 -27.587 1.00 0.00 H new ATOM 0 HA SER A 27 -98.876 -9.247 -29.004 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.887 -9.280 -30.533 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.154 -9.980 -28.948 1.00 0.00 H new ATOM 0 HG SER A 27 -102.705 -8.269 -29.949 1.00 0.00 H new ATOM 55 N TRP A 28 -98.355 -7.643 -30.916 1.00 0.00 N ATOM 56 CA TRP A 28 -97.790 -6.592 -31.764 1.00 0.00 C ATOM 57 C TRP A 28 -98.765 -6.137 -32.852 1.00 0.00 C ATOM 58 O TRP A 28 -98.377 -5.468 -33.806 1.00 0.00 O ATOM 59 CB TRP A 28 -96.450 -7.027 -32.377 1.00 0.00 C ATOM 60 CG TRP A 28 -96.516 -8.140 -33.388 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.510 -9.062 -33.567 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.501 -8.452 -34.349 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.175 -9.920 -34.589 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.945 -9.565 -35.084 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.259 -7.889 -34.661 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.185 -10.127 -36.110 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.509 -8.448 -35.678 1.00 0.00 C ATOM 68 CH2 TRP A 28 -93.974 -9.555 -36.392 1.00 0.00 C ATOM 0 H TRP A 28 -98.079 -8.593 -31.165 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.606 -5.734 -31.117 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -95.992 -6.159 -32.851 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -95.787 -7.336 -31.569 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.423 -9.110 -32.991 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.748 -10.694 -34.924 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -93.892 -7.032 -34.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.540 -10.984 -36.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.548 -8.022 -35.925 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.365 -9.968 -37.183 1.00 0.00 H new ATOM 79 N TYR A 29 -100.030 -6.491 -32.693 1.00 0.00 N ATOM 80 CA TYR A 29 -101.076 -6.015 -33.585 1.00 0.00 C ATOM 81 C TYR A 29 -102.117 -5.240 -32.784 1.00 0.00 C ATOM 82 O TYR A 29 -103.166 -4.856 -33.302 1.00 0.00 O ATOM 83 CB TYR A 29 -101.728 -7.183 -34.342 1.00 0.00 C ATOM 84 CG TYR A 29 -102.289 -8.271 -33.453 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.567 -8.167 -32.916 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.542 -9.402 -33.151 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.083 -9.156 -32.102 1.00 0.00 C ATOM 88 CE2 TYR A 29 -102.051 -10.398 -32.340 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.322 -10.270 -31.816 1.00 0.00 C ATOM 90 OH TYR A 29 -103.829 -11.253 -30.996 1.00 0.00 O ATOM 0 H TYR A 29 -100.359 -7.109 -31.951 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.631 -5.351 -34.326 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.531 -6.792 -34.967 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -100.989 -7.623 -35.012 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.167 -7.297 -33.139 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.546 -9.505 -33.557 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.077 -9.058 -31.692 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.458 -11.272 -32.117 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.168 -11.969 -30.896 1.00 0.00 H new ATOM 100 N ASP A 30 -101.802 -5.008 -31.512 1.00 0.00 N ATOM 101 CA ASP A 30 -102.704 -4.314 -30.601 1.00 0.00 C ATOM 102 C ASP A 30 -102.377 -2.822 -30.591 1.00 0.00 C ATOM 103 O ASP A 30 -101.233 -2.436 -30.351 1.00 0.00 O ATOM 104 CB ASP A 30 -102.566 -4.899 -29.189 1.00 0.00 C ATOM 105 CG ASP A 30 -103.622 -4.395 -28.221 1.00 0.00 C ATOM 106 OD1 ASP A 30 -103.526 -3.236 -27.772 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.543 -5.172 -27.883 1.00 0.00 O ATOM 0 H ASP A 30 -100.920 -5.294 -31.087 1.00 0.00 H new ATOM 0 HA ASP A 30 -103.732 -4.447 -30.937 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.626 -5.986 -29.247 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -101.579 -4.654 -28.797 1.00 0.00 H new ATOM 112 N PRO A 31 -103.375 -1.965 -30.855 1.00 0.00 N ATOM 113 CA PRO A 31 -103.177 -0.511 -30.951 1.00 0.00 C ATOM 114 C PRO A 31 -102.808 0.145 -29.621 1.00 0.00 C ATOM 115 O PRO A 31 -102.421 1.317 -29.583 1.00 0.00 O ATOM 116 CB PRO A 31 -104.538 0.015 -31.427 1.00 0.00 C ATOM 117 CG PRO A 31 -105.283 -1.183 -31.907 1.00 0.00 C ATOM 118 CD PRO A 31 -104.773 -2.339 -31.102 1.00 0.00 C ATOM 0 HA PRO A 31 -102.346 -0.280 -31.617 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.072 0.510 -30.616 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -104.418 0.748 -32.225 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.357 -1.055 -31.769 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.116 -1.345 -32.972 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.330 -2.463 -30.173 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -104.851 -3.279 -31.648 1.00 0.00 H new ATOM 126 N ASP A 32 -102.934 -0.605 -28.538 1.00 0.00 N ATOM 127 CA ASP A 32 -102.653 -0.080 -27.209 1.00 0.00 C ATOM 128 C ASP A 32 -101.340 -0.656 -26.678 1.00 0.00 C ATOM 129 O ASP A 32 -100.841 -0.244 -25.633 1.00 0.00 O ATOM 130 CB ASP A 32 -103.819 -0.415 -26.267 1.00 0.00 C ATOM 131 CG ASP A 32 -103.683 0.202 -24.889 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.972 1.411 -24.744 1.00 0.00 O ATOM 133 OD2 ASP A 32 -103.320 -0.526 -23.940 1.00 0.00 O ATOM 0 H ASP A 32 -103.230 -1.581 -28.552 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.547 1.003 -27.263 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.750 -0.073 -26.719 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.893 -1.498 -26.165 1.00 0.00 H new ATOM 138 N PHE A 33 -100.775 -1.597 -27.421 1.00 0.00 N ATOM 139 CA PHE A 33 -99.535 -2.254 -27.022 1.00 0.00 C ATOM 140 C PHE A 33 -98.321 -1.410 -27.414 1.00 0.00 C ATOM 141 O PHE A 33 -98.298 -0.795 -28.479 1.00 0.00 O ATOM 142 CB PHE A 33 -99.453 -3.639 -27.673 1.00 0.00 C ATOM 143 CG PHE A 33 -98.191 -4.399 -27.363 1.00 0.00 C ATOM 144 CD1 PHE A 33 -97.983 -4.946 -26.108 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.216 -4.571 -28.333 1.00 0.00 C ATOM 146 CE1 PHE A 33 -96.827 -5.651 -25.827 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.060 -5.272 -28.058 1.00 0.00 C ATOM 148 CZ PHE A 33 -95.864 -5.812 -26.803 1.00 0.00 C ATOM 0 H PHE A 33 -101.157 -1.925 -28.308 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.532 -2.366 -25.938 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.308 -4.231 -27.347 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.537 -3.525 -28.754 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -98.732 -4.821 -25.340 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.363 -4.151 -29.317 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -96.678 -6.075 -24.845 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.309 -5.398 -28.824 1.00 0.00 H new ATOM 0 HZ PHE A 33 -94.959 -6.359 -26.585 1.00 0.00 H new ATOM 158 N GLN A 34 -97.317 -1.380 -26.546 1.00 0.00 N ATOM 159 CA GLN A 34 -96.098 -0.636 -26.823 1.00 0.00 C ATOM 160 C GLN A 34 -95.158 -1.468 -27.683 1.00 0.00 C ATOM 161 O GLN A 34 -94.642 -2.497 -27.242 1.00 0.00 O ATOM 162 CB GLN A 34 -95.398 -0.243 -25.516 1.00 0.00 C ATOM 163 CG GLN A 34 -95.976 0.988 -24.821 1.00 0.00 C ATOM 164 CD GLN A 34 -97.466 0.892 -24.553 1.00 0.00 C ATOM 165 OE1 GLN A 34 -98.283 1.349 -25.352 1.00 0.00 O ATOM 166 NE2 GLN A 34 -97.829 0.294 -23.429 1.00 0.00 N ATOM 0 H GLN A 34 -97.324 -1.862 -25.647 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.365 0.272 -27.363 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.446 -1.087 -24.828 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.344 -0.062 -25.726 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -95.455 1.139 -23.876 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -95.782 1.867 -25.436 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -97.120 -0.071 -22.794 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -98.818 0.198 -23.199 1.00 0.00 H new ATOM 175 N ALA A 35 -94.925 -1.010 -28.903 1.00 0.00 N ATOM 176 CA ALA A 35 -94.049 -1.705 -29.831 1.00 0.00 C ATOM 177 C ALA A 35 -93.325 -0.705 -30.712 1.00 0.00 C ATOM 178 O ALA A 35 -93.895 0.321 -31.087 1.00 0.00 O ATOM 179 CB ALA A 35 -94.843 -2.685 -30.682 1.00 0.00 C ATOM 0 H ALA A 35 -95.334 -0.153 -29.275 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.311 -2.268 -29.259 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -94.171 -3.196 -31.371 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.327 -3.418 -30.037 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.601 -2.144 -31.249 1.00 0.00 H new ATOM 185 N ARG A 36 -92.071 -0.997 -31.028 1.00 0.00 N ATOM 186 CA ARG A 36 -91.244 -0.076 -31.792 1.00 0.00 C ATOM 187 C ARG A 36 -89.923 -0.721 -32.174 1.00 0.00 C ATOM 188 O ARG A 36 -89.694 -1.903 -31.926 1.00 0.00 O ATOM 189 CB ARG A 36 -90.948 1.191 -30.976 1.00 0.00 C ATOM 190 CG ARG A 36 -90.175 0.896 -29.694 1.00 0.00 C ATOM 191 CD ARG A 36 -89.501 2.131 -29.116 1.00 0.00 C ATOM 192 NE ARG A 36 -90.456 3.164 -28.716 1.00 0.00 N ATOM 193 CZ ARG A 36 -90.355 3.874 -27.593 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.318 3.707 -26.782 1.00 0.00 N ATOM 195 NH2 ARG A 36 -91.278 4.776 -27.298 1.00 0.00 N ATOM 0 H ARG A 36 -91.605 -1.866 -30.766 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.797 0.185 -32.694 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.376 1.888 -31.589 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -91.887 1.684 -30.724 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.856 0.478 -28.952 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.420 0.137 -29.897 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -88.903 1.842 -28.252 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -88.815 2.544 -29.855 1.00 0.00 H new ATOM 0 HE ARG A 36 -91.246 3.352 -29.333 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -88.591 3.031 -27.016 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.248 4.254 -25.924 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -92.065 4.926 -27.930 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -91.203 5.321 -26.439 1.00 0.00 H new ATOM 209 N LEU A 37 -89.074 0.072 -32.800 1.00 0.00 N ATOM 210 CA LEU A 37 -87.745 -0.360 -33.182 1.00 0.00 C ATOM 211 C LEU A 37 -86.725 0.144 -32.174 1.00 0.00 C ATOM 212 O LEU A 37 -87.023 1.021 -31.356 1.00 0.00 O ATOM 213 CB LEU A 37 -87.412 0.174 -34.569 1.00 0.00 C ATOM 214 CG LEU A 37 -88.540 0.014 -35.577 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.279 0.847 -36.809 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.697 -1.443 -35.953 1.00 0.00 C ATOM 0 H LEU A 37 -89.288 1.035 -33.058 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.714 -1.449 -33.200 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.156 1.231 -34.489 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.527 -0.341 -34.943 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.465 0.363 -35.118 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.098 0.717 -37.516 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.205 1.898 -36.529 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.345 0.528 -37.273 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.507 -1.547 -36.675 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.769 -1.807 -36.394 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.928 -2.026 -35.062 1.00 0.00 H new ATOM 228 N THR A 38 -85.533 -0.412 -32.232 1.00 0.00 N ATOM 229 CA THR A 38 -84.469 -0.045 -31.322 1.00 0.00 C ATOM 230 C THR A 38 -83.711 1.188 -31.816 1.00 0.00 C ATOM 231 O THR A 38 -84.124 1.843 -32.778 1.00 0.00 O ATOM 232 CB THR A 38 -83.505 -1.227 -31.136 1.00 0.00 C ATOM 233 OG1 THR A 38 -83.190 -1.803 -32.409 1.00 0.00 O ATOM 234 CG2 THR A 38 -84.133 -2.283 -30.249 1.00 0.00 C ATOM 0 H THR A 38 -85.275 -1.129 -32.910 1.00 0.00 H new ATOM 0 HA THR A 38 -84.918 0.206 -30.361 1.00 0.00 H new ATOM 0 HB THR A 38 -82.593 -0.861 -30.665 1.00 0.00 H new ATOM 0 HG1 THR A 38 -82.574 -2.555 -32.284 1.00 0.00 H new ATOM 0 HG21 THR A 38 -83.439 -3.114 -30.126 1.00 0.00 H new ATOM 0 HG22 THR A 38 -84.359 -1.852 -29.274 1.00 0.00 H new ATOM 0 HG23 THR A 38 -85.053 -2.644 -30.708 1.00 0.00 H new ATOM 242 N ARG A 39 -82.614 1.514 -31.143 1.00 0.00 N ATOM 243 CA ARG A 39 -81.818 2.686 -31.493 1.00 0.00 C ATOM 244 C ARG A 39 -80.958 2.438 -32.736 1.00 0.00 C ATOM 245 O ARG A 39 -79.730 2.448 -32.672 1.00 0.00 O ATOM 246 CB ARG A 39 -80.941 3.112 -30.307 1.00 0.00 C ATOM 247 CG ARG A 39 -80.102 1.987 -29.721 1.00 0.00 C ATOM 248 CD ARG A 39 -79.292 2.458 -28.524 1.00 0.00 C ATOM 249 NE ARG A 39 -78.552 1.360 -27.903 1.00 0.00 N ATOM 250 CZ ARG A 39 -78.003 1.413 -26.688 1.00 0.00 C ATOM 251 NH1 ARG A 39 -78.048 2.534 -25.979 1.00 0.00 N ATOM 252 NH2 ARG A 39 -77.382 0.346 -26.198 1.00 0.00 N ATOM 0 H ARG A 39 -82.254 0.983 -30.350 1.00 0.00 H new ATOM 0 HA ARG A 39 -82.509 3.495 -31.729 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -80.278 3.916 -30.629 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -81.580 3.520 -29.524 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -80.753 1.166 -29.420 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -79.430 1.598 -30.485 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -78.594 3.234 -28.840 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -79.959 2.909 -27.789 1.00 0.00 H new ATOM 0 HE ARG A 39 -78.449 0.496 -28.434 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -78.504 3.362 -26.362 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -77.626 2.568 -25.051 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -77.326 -0.510 -26.750 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -76.961 0.382 -25.270 1.00 0.00 H new ATOM 266 N SER A 40 -81.614 2.216 -33.866 1.00 0.00 N ATOM 267 CA SER A 40 -80.921 2.032 -35.135 1.00 0.00 C ATOM 268 C SER A 40 -80.821 3.357 -35.892 1.00 0.00 C ATOM 269 O SER A 40 -80.535 3.380 -37.091 1.00 0.00 O ATOM 270 CB SER A 40 -81.653 0.989 -35.979 1.00 0.00 C ATOM 271 OG SER A 40 -81.676 -0.270 -35.326 1.00 0.00 O ATOM 0 H SER A 40 -82.630 2.159 -33.931 1.00 0.00 H new ATOM 0 HA SER A 40 -79.910 1.679 -34.934 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.673 1.322 -36.170 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.163 0.891 -36.948 1.00 0.00 H new ATOM 0 HG SER A 40 -82.589 -0.469 -35.032 1.00 0.00 H new ATOM 277 N ASN A 41 -81.064 4.455 -35.171 1.00 0.00 N ATOM 278 CA ASN A 41 -80.974 5.812 -35.726 1.00 0.00 C ATOM 279 C ASN A 41 -82.019 6.040 -36.815 1.00 0.00 C ATOM 280 O ASN A 41 -81.859 6.900 -37.683 1.00 0.00 O ATOM 281 CB ASN A 41 -79.567 6.091 -36.273 1.00 0.00 C ATOM 282 CG ASN A 41 -78.517 6.203 -35.179 1.00 0.00 C ATOM 283 OD1 ASN A 41 -78.620 5.570 -34.127 1.00 0.00 O ATOM 284 ND2 ASN A 41 -77.494 7.010 -35.420 1.00 0.00 N ATOM 0 H ASN A 41 -81.329 4.430 -34.186 1.00 0.00 H new ATOM 0 HA ASN A 41 -81.175 6.509 -34.912 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -79.285 5.293 -36.960 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -79.584 7.016 -36.849 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -76.758 7.123 -34.723 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -77.442 7.518 -36.303 1.00 0.00 H new ATOM 291 N SER A 42 -83.093 5.267 -36.759 1.00 0.00 N ATOM 292 CA SER A 42 -84.198 5.400 -37.695 1.00 0.00 C ATOM 293 C SER A 42 -85.484 4.924 -37.029 1.00 0.00 C ATOM 294 O SER A 42 -85.562 3.793 -36.560 1.00 0.00 O ATOM 295 CB SER A 42 -83.919 4.584 -38.964 1.00 0.00 C ATOM 296 OG SER A 42 -82.687 4.963 -39.559 1.00 0.00 O ATOM 0 H SER A 42 -83.223 4.531 -36.065 1.00 0.00 H new ATOM 0 HA SER A 42 -84.308 6.447 -37.979 1.00 0.00 H new ATOM 0 HB2 SER A 42 -83.896 3.522 -38.719 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.730 4.728 -39.678 1.00 0.00 H new ATOM 0 HG SER A 42 -82.534 4.426 -40.364 1.00 0.00 H new ATOM 302 N LYS A 43 -86.494 5.775 -36.988 1.00 0.00 N ATOM 303 CA LYS A 43 -87.718 5.451 -36.267 1.00 0.00 C ATOM 304 C LYS A 43 -88.609 4.529 -37.086 1.00 0.00 C ATOM 305 O LYS A 43 -89.554 3.939 -36.566 1.00 0.00 O ATOM 306 CB LYS A 43 -88.470 6.726 -35.878 1.00 0.00 C ATOM 307 CG LYS A 43 -87.670 7.632 -34.953 1.00 0.00 C ATOM 308 CD LYS A 43 -87.220 6.894 -33.703 1.00 0.00 C ATOM 309 CE LYS A 43 -86.285 7.741 -32.854 1.00 0.00 C ATOM 310 NZ LYS A 43 -85.778 6.993 -31.675 1.00 0.00 N ATOM 0 H LYS A 43 -86.494 6.689 -37.441 1.00 0.00 H new ATOM 0 HA LYS A 43 -87.440 4.924 -35.354 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -88.730 7.277 -36.782 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -89.406 6.454 -35.390 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -86.799 8.017 -35.483 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -88.277 8.492 -34.670 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -88.092 6.613 -33.113 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -86.716 5.970 -33.988 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -85.444 8.074 -33.462 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -86.810 8.636 -32.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -85.144 7.605 -31.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -86.579 6.697 -31.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -85.255 6.153 -31.995 1.00 0.00 H new ATOM 324 N CYS A 44 -88.301 4.397 -38.368 1.00 0.00 N ATOM 325 CA CYS A 44 -89.033 3.477 -39.222 1.00 0.00 C ATOM 326 C CYS A 44 -88.094 2.396 -39.776 1.00 0.00 C ATOM 327 O CYS A 44 -88.443 1.683 -40.711 1.00 0.00 O ATOM 328 CB CYS A 44 -89.738 4.238 -40.354 1.00 0.00 C ATOM 329 SG CYS A 44 -90.554 5.771 -39.809 1.00 0.00 S ATOM 0 H CYS A 44 -87.555 4.912 -38.836 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.799 2.981 -38.626 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.008 4.480 -41.126 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.481 3.584 -40.811 1.00 0.00 H new ATOM 334 N GLN A 45 -86.906 2.261 -39.169 1.00 0.00 N ATOM 335 CA GLN A 45 -85.965 1.189 -39.522 1.00 0.00 C ATOM 336 C GLN A 45 -85.197 0.731 -38.280 1.00 0.00 C ATOM 337 O GLN A 45 -84.569 1.543 -37.608 1.00 0.00 O ATOM 338 CB GLN A 45 -84.959 1.662 -40.576 1.00 0.00 C ATOM 339 CG GLN A 45 -85.540 1.885 -41.960 1.00 0.00 C ATOM 340 CD GLN A 45 -84.513 2.411 -42.942 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.586 3.128 -42.565 1.00 0.00 O ATOM 342 NE2 GLN A 45 -84.665 2.058 -44.210 1.00 0.00 N ATOM 0 H GLN A 45 -86.574 2.882 -38.431 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.545 0.361 -39.929 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -84.507 2.593 -40.234 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.158 0.926 -40.648 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -85.949 0.947 -42.335 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -86.369 2.590 -41.893 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -85.446 1.462 -44.483 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -84.001 2.382 -44.913 1.00 0.00 H new ATOM 351 N GLY A 46 -85.232 -0.564 -37.982 1.00 0.00 N ATOM 352 CA GLY A 46 -84.518 -1.068 -36.819 1.00 0.00 C ATOM 353 C GLY A 46 -85.018 -2.426 -36.362 1.00 0.00 C ATOM 354 O GLY A 46 -85.999 -2.938 -36.895 1.00 0.00 O ATOM 0 H GLY A 46 -85.737 -1.269 -38.519 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.456 -1.137 -37.053 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.618 -0.355 -36.000 1.00 0.00 H new ATOM 358 N GLN A 47 -84.342 -3.018 -35.382 1.00 0.00 N ATOM 359 CA GLN A 47 -84.781 -4.292 -34.823 1.00 0.00 C ATOM 360 C GLN A 47 -85.873 -4.064 -33.784 1.00 0.00 C ATOM 361 O GLN A 47 -85.999 -2.969 -33.244 1.00 0.00 O ATOM 362 CB GLN A 47 -83.614 -5.071 -34.215 1.00 0.00 C ATOM 363 CG GLN A 47 -82.685 -5.684 -35.253 1.00 0.00 C ATOM 364 CD GLN A 47 -81.806 -6.764 -34.667 1.00 0.00 C ATOM 365 OE1 GLN A 47 -80.699 -6.505 -34.204 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.305 -7.988 -34.667 1.00 0.00 N ATOM 0 H GLN A 47 -83.494 -2.639 -34.961 1.00 0.00 H new ATOM 0 HA GLN A 47 -85.188 -4.892 -35.637 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.038 -4.404 -33.573 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -84.009 -5.864 -33.580 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -83.278 -6.102 -36.066 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -82.059 -4.903 -35.684 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -83.229 -8.162 -35.062 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -81.766 -8.759 -34.272 1.00 0.00 H new ATOM 375 N LEU A 48 -86.650 -5.101 -33.502 1.00 0.00 N ATOM 376 CA LEU A 48 -87.862 -4.953 -32.706 1.00 0.00 C ATOM 377 C LEU A 48 -87.577 -4.828 -31.211 1.00 0.00 C ATOM 378 O LEU A 48 -86.795 -5.589 -30.637 1.00 0.00 O ATOM 379 CB LEU A 48 -88.816 -6.119 -32.975 1.00 0.00 C ATOM 380 CG LEU A 48 -90.199 -5.999 -32.328 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.966 -4.817 -32.906 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.987 -7.285 -32.516 1.00 0.00 C ATOM 0 H LEU A 48 -86.463 -6.054 -33.813 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.334 -4.019 -33.013 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.945 -6.219 -34.053 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.348 -7.038 -32.623 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.062 -5.828 -31.260 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.945 -4.752 -32.432 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.411 -3.897 -32.721 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -91.092 -4.955 -33.980 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.967 -7.183 -32.050 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.110 -7.484 -33.581 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.450 -8.112 -32.052 1.00 0.00 H new ATOM 394 N GLU A 49 -88.228 -3.843 -30.607 1.00 0.00 N ATOM 395 CA GLU A 49 -88.177 -3.614 -29.173 1.00 0.00 C ATOM 396 C GLU A 49 -89.605 -3.434 -28.661 1.00 0.00 C ATOM 397 O GLU A 49 -90.305 -2.505 -29.070 1.00 0.00 O ATOM 398 CB GLU A 49 -87.343 -2.366 -28.871 1.00 0.00 C ATOM 399 CG GLU A 49 -87.069 -2.142 -27.392 1.00 0.00 C ATOM 400 CD GLU A 49 -86.288 -0.867 -27.132 1.00 0.00 C ATOM 401 OE1 GLU A 49 -85.084 -0.821 -27.458 1.00 0.00 O ATOM 402 OE2 GLU A 49 -86.876 0.098 -26.604 1.00 0.00 O ATOM 0 H GLU A 49 -88.813 -3.173 -31.107 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.711 -4.464 -28.675 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.392 -2.442 -29.398 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.859 -1.493 -29.270 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.015 -2.101 -26.853 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.513 -2.992 -26.996 1.00 0.00 H new ATOM 409 N VAL A 50 -90.052 -4.337 -27.802 1.00 0.00 N ATOM 410 CA VAL A 50 -91.433 -4.317 -27.330 1.00 0.00 C ATOM 411 C VAL A 50 -91.508 -4.417 -25.814 1.00 0.00 C ATOM 412 O VAL A 50 -90.751 -5.157 -25.196 1.00 0.00 O ATOM 413 CB VAL A 50 -92.260 -5.458 -27.955 1.00 0.00 C ATOM 414 CG1 VAL A 50 -92.523 -5.179 -29.424 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.553 -6.796 -27.786 1.00 0.00 C ATOM 0 H VAL A 50 -89.483 -5.091 -27.417 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.853 -3.361 -27.642 1.00 0.00 H new ATOM 0 HB VAL A 50 -93.216 -5.510 -27.434 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.108 -5.994 -29.850 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.076 -4.245 -29.524 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.574 -5.097 -29.954 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.156 -7.585 -28.235 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.581 -6.758 -28.277 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -91.416 -7.003 -26.725 1.00 0.00 H new ATOM 425 N TYR A 51 -92.426 -3.670 -25.218 1.00 0.00 N ATOM 426 CA TYR A 51 -92.570 -3.659 -23.770 1.00 0.00 C ATOM 427 C TYR A 51 -93.639 -4.649 -23.332 1.00 0.00 C ATOM 428 O TYR A 51 -94.817 -4.475 -23.641 1.00 0.00 O ATOM 429 CB TYR A 51 -92.929 -2.256 -23.274 1.00 0.00 C ATOM 430 CG TYR A 51 -92.970 -2.144 -21.766 1.00 0.00 C ATOM 431 CD1 TYR A 51 -91.801 -2.005 -21.036 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.175 -2.191 -21.074 1.00 0.00 C ATOM 433 CE1 TYR A 51 -91.826 -1.915 -19.660 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.207 -2.103 -19.696 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.030 -1.967 -18.994 1.00 0.00 C ATOM 436 OH TYR A 51 -93.054 -1.880 -17.622 1.00 0.00 O ATOM 0 H TYR A 51 -93.081 -3.065 -25.714 1.00 0.00 H new ATOM 0 HA TYR A 51 -91.615 -3.953 -23.334 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.202 -1.544 -23.664 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -93.901 -1.973 -23.678 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -90.854 -1.966 -21.553 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.099 -2.298 -21.622 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -90.905 -1.804 -19.107 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.150 -2.141 -19.172 1.00 0.00 H new ATOM 0 HH TYR A 51 -93.981 -1.932 -17.307 1.00 0.00 H new ATOM 446 N LEU A 52 -93.228 -5.684 -22.613 1.00 0.00 N ATOM 447 CA LEU A 52 -94.162 -6.693 -22.143 1.00 0.00 C ATOM 448 C LEU A 52 -93.638 -7.376 -20.907 1.00 0.00 C ATOM 449 O LEU A 52 -92.424 -7.506 -20.739 1.00 0.00 O ATOM 450 CB LEU A 52 -94.485 -7.710 -23.249 1.00 0.00 C ATOM 451 CG LEU A 52 -93.384 -8.698 -23.725 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.065 -8.002 -24.023 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.184 -9.841 -22.735 1.00 0.00 C ATOM 0 H LEU A 52 -92.257 -5.845 -22.344 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.093 -6.191 -21.878 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.333 -8.305 -22.908 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.820 -7.149 -24.121 1.00 0.00 H new ATOM 0 HG LEU A 52 -93.742 -9.123 -24.663 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.331 -8.738 -24.351 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.214 -7.262 -24.809 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -91.703 -7.506 -23.122 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.406 -10.510 -23.104 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.886 -9.437 -21.768 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -94.117 -10.395 -22.625 1.00 0.00 H new ATOM 465 N LYS A 53 -94.569 -7.775 -20.037 1.00 0.00 N ATOM 466 CA LYS A 53 -94.260 -8.463 -18.782 1.00 0.00 C ATOM 467 C LYS A 53 -93.574 -7.519 -17.795 1.00 0.00 C ATOM 468 O LYS A 53 -93.889 -7.530 -16.604 1.00 0.00 O ATOM 469 CB LYS A 53 -93.398 -9.709 -19.042 1.00 0.00 C ATOM 470 CG LYS A 53 -93.080 -10.537 -17.803 1.00 0.00 C ATOM 471 CD LYS A 53 -94.310 -11.246 -17.253 1.00 0.00 C ATOM 472 CE LYS A 53 -93.951 -12.123 -16.060 1.00 0.00 C ATOM 473 NZ LYS A 53 -95.125 -12.870 -15.534 1.00 0.00 N ATOM 0 H LYS A 53 -95.567 -7.628 -20.186 1.00 0.00 H new ATOM 0 HA LYS A 53 -95.199 -8.789 -18.335 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -93.911 -10.344 -19.764 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.461 -9.396 -19.502 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -92.316 -11.275 -18.048 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -92.662 -9.889 -17.033 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -95.055 -10.509 -16.955 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -94.761 -11.857 -18.035 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -93.175 -12.830 -16.352 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -93.534 -11.501 -15.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -94.831 -13.452 -14.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -95.857 -12.197 -15.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -95.509 -13.484 -16.281 1.00 0.00 H new ATOM 487 N ASP A 54 -92.671 -6.687 -18.314 1.00 0.00 N ATOM 488 CA ASP A 54 -91.882 -5.752 -17.495 1.00 0.00 C ATOM 489 C ASP A 54 -90.740 -5.143 -18.300 1.00 0.00 C ATOM 490 O ASP A 54 -90.258 -4.053 -17.989 1.00 0.00 O ATOM 491 CB ASP A 54 -91.284 -6.436 -16.247 1.00 0.00 C ATOM 492 CG ASP A 54 -90.222 -7.478 -16.571 1.00 0.00 C ATOM 493 OD1 ASP A 54 -89.040 -7.109 -16.733 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.562 -8.677 -16.660 1.00 0.00 O ATOM 0 H ASP A 54 -92.462 -6.638 -19.311 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.573 -4.971 -17.177 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -90.848 -5.675 -15.600 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.087 -6.911 -15.684 1.00 0.00 H new ATOM 499 N GLY A 55 -90.308 -5.855 -19.326 1.00 0.00 N ATOM 500 CA GLY A 55 -89.121 -5.457 -20.055 1.00 0.00 C ATOM 501 C GLY A 55 -89.402 -4.813 -21.387 1.00 0.00 C ATOM 502 O GLY A 55 -90.200 -5.328 -22.175 1.00 0.00 O ATOM 0 H GLY A 55 -90.758 -6.704 -19.669 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -88.548 -4.762 -19.442 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -88.494 -6.335 -20.213 1.00 0.00 H new ATOM 506 N TRP A 56 -88.765 -3.669 -21.627 1.00 0.00 N ATOM 507 CA TRP A 56 -88.590 -3.178 -22.982 1.00 0.00 C ATOM 508 C TRP A 56 -87.639 -4.130 -23.681 1.00 0.00 C ATOM 509 O TRP A 56 -86.427 -3.934 -23.689 1.00 0.00 O ATOM 510 CB TRP A 56 -88.038 -1.746 -23.015 1.00 0.00 C ATOM 511 CG TRP A 56 -89.101 -0.697 -23.147 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.483 0.218 -22.206 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.920 -0.454 -24.297 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.489 1.013 -22.704 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.777 0.617 -23.985 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.015 -1.044 -25.561 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.711 1.112 -24.891 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.943 -0.552 -26.460 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.781 0.517 -26.121 1.00 0.00 C ATOM 0 H TRP A 56 -88.366 -3.072 -20.903 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.556 -3.141 -23.485 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.470 -1.563 -22.103 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.342 -1.653 -23.848 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.058 0.304 -21.217 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.947 1.774 -22.202 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.374 -1.870 -25.831 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.358 1.937 -24.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.023 -1.000 -27.440 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.497 0.879 -26.844 1.00 0.00 H new ATOM 530 N HIS A 57 -88.203 -5.191 -24.210 1.00 0.00 N ATOM 531 CA HIS A 57 -87.433 -6.323 -24.656 1.00 0.00 C ATOM 532 C HIS A 57 -86.921 -6.134 -26.074 1.00 0.00 C ATOM 533 O HIS A 57 -87.708 -6.066 -27.019 1.00 0.00 O ATOM 534 CB HIS A 57 -88.283 -7.592 -24.590 1.00 0.00 C ATOM 535 CG HIS A 57 -88.313 -8.233 -23.239 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.043 -9.367 -22.963 1.00 0.00 N ATOM 537 CD2 HIS A 57 -87.680 -7.905 -22.090 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.857 -9.710 -21.703 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.032 -8.838 -21.149 1.00 0.00 N ATOM 0 H HIS A 57 -89.209 -5.291 -24.342 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.572 -6.415 -23.993 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.303 -7.350 -24.889 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -87.901 -8.311 -25.314 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -87.019 -7.064 -21.941 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.303 -10.560 -21.208 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -87.710 -8.856 -20.181 1.00 0.00 H new ATOM 548 N MET A 58 -85.607 -6.034 -26.217 1.00 0.00 N ATOM 549 CA MET A 58 -84.986 -6.068 -27.535 1.00 0.00 C ATOM 550 C MET A 58 -84.962 -7.507 -28.019 1.00 0.00 C ATOM 551 O MET A 58 -84.210 -8.331 -27.485 1.00 0.00 O ATOM 552 CB MET A 58 -83.555 -5.519 -27.505 1.00 0.00 C ATOM 553 CG MET A 58 -83.426 -4.130 -26.906 1.00 0.00 C ATOM 554 SD MET A 58 -83.457 -4.139 -25.101 1.00 0.00 S ATOM 555 CE MET A 58 -81.990 -5.101 -24.743 1.00 0.00 C ATOM 0 H MET A 58 -84.953 -5.929 -25.442 1.00 0.00 H new ATOM 0 HA MET A 58 -85.568 -5.438 -28.208 1.00 0.00 H new ATOM 0 HB2 MET A 58 -82.928 -6.206 -26.937 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.165 -5.500 -28.523 1.00 0.00 H new ATOM 0 HG2 MET A 58 -82.494 -3.678 -27.246 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.238 -3.503 -27.275 1.00 0.00 H new ATOM 0 HE1 MET A 58 -81.547 -4.755 -23.809 1.00 0.00 H new ATOM 0 HE2 MET A 58 -82.259 -6.153 -24.649 1.00 0.00 H new ATOM 0 HE3 MET A 58 -81.270 -4.981 -25.552 1.00 0.00 H new ATOM 565 N VAL A 59 -85.783 -7.819 -29.010 1.00 0.00 N ATOM 566 CA VAL A 59 -85.913 -9.195 -29.469 1.00 0.00 C ATOM 567 C VAL A 59 -84.902 -9.491 -30.571 1.00 0.00 C ATOM 568 O VAL A 59 -84.192 -8.594 -31.024 1.00 0.00 O ATOM 569 CB VAL A 59 -87.343 -9.494 -29.974 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.373 -9.145 -28.914 1.00 0.00 C ATOM 571 CG2 VAL A 59 -87.639 -8.744 -31.256 1.00 0.00 C ATOM 0 H VAL A 59 -86.365 -7.146 -29.509 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.712 -9.843 -28.616 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.403 -10.562 -30.181 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.372 -9.364 -29.291 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.187 -9.736 -28.017 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.301 -8.085 -28.672 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -88.652 -8.974 -31.587 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -87.550 -7.672 -31.079 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -86.929 -9.045 -32.026 1.00 0.00 H new ATOM 581 N CYS A 60 -84.844 -10.741 -31.016 1.00 0.00 N ATOM 582 CA CYS A 60 -83.925 -11.111 -32.088 1.00 0.00 C ATOM 583 C CYS A 60 -84.583 -10.806 -33.440 1.00 0.00 C ATOM 584 O CYS A 60 -84.082 -11.195 -34.498 1.00 0.00 O ATOM 585 CB CYS A 60 -83.540 -12.599 -31.991 1.00 0.00 C ATOM 586 SG CYS A 60 -84.591 -13.709 -32.963 1.00 0.00 S ATOM 0 H CYS A 60 -85.414 -11.507 -30.657 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.009 -10.528 -31.993 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -82.507 -12.717 -32.319 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -83.579 -12.904 -30.945 1.00 0.00 H new ATOM 591 N SER A 61 -85.716 -10.091 -33.363 1.00 0.00 N ATOM 592 CA SER A 61 -86.525 -9.683 -34.515 1.00 0.00 C ATOM 593 C SER A 61 -87.446 -10.803 -34.999 1.00 0.00 C ATOM 594 O SER A 61 -88.647 -10.590 -35.153 1.00 0.00 O ATOM 595 CB SER A 61 -85.653 -9.154 -35.654 1.00 0.00 C ATOM 596 OG SER A 61 -85.030 -7.933 -35.299 1.00 0.00 O ATOM 0 H SER A 61 -86.102 -9.774 -32.474 1.00 0.00 H new ATOM 0 HA SER A 61 -87.163 -8.867 -34.177 1.00 0.00 H new ATOM 0 HB2 SER A 61 -84.893 -9.893 -35.906 1.00 0.00 H new ATOM 0 HB3 SER A 61 -86.264 -9.008 -36.545 1.00 0.00 H new ATOM 0 HG SER A 61 -84.980 -7.863 -34.323 1.00 0.00 H new ATOM 602 N GLN A 62 -86.909 -11.995 -35.212 1.00 0.00 N ATOM 603 CA GLN A 62 -87.715 -13.091 -35.739 1.00 0.00 C ATOM 604 C GLN A 62 -88.149 -14.050 -34.629 1.00 0.00 C ATOM 605 O GLN A 62 -88.423 -15.228 -34.875 1.00 0.00 O ATOM 606 CB GLN A 62 -86.950 -13.838 -36.831 1.00 0.00 C ATOM 607 CG GLN A 62 -85.801 -14.689 -36.327 1.00 0.00 C ATOM 608 CD GLN A 62 -85.085 -15.390 -37.457 1.00 0.00 C ATOM 609 OE1 GLN A 62 -84.119 -14.872 -38.008 1.00 0.00 O ATOM 610 NE2 GLN A 62 -85.573 -16.560 -37.833 1.00 0.00 N ATOM 0 H GLN A 62 -85.933 -12.229 -35.032 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.618 -12.663 -36.176 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -87.647 -14.477 -37.373 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.561 -13.112 -37.545 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -85.095 -14.061 -35.783 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -86.179 -15.429 -35.621 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -86.378 -16.956 -37.348 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.144 -17.066 -38.608 1.00 0.00 H new ATOM 619 N SER A 63 -88.237 -13.529 -33.412 1.00 0.00 N ATOM 620 CA SER A 63 -88.685 -14.310 -32.266 1.00 0.00 C ATOM 621 C SER A 63 -90.141 -14.773 -32.454 1.00 0.00 C ATOM 622 O SER A 63 -90.811 -14.354 -33.406 1.00 0.00 O ATOM 623 CB SER A 63 -88.540 -13.460 -31.007 1.00 0.00 C ATOM 624 OG SER A 63 -87.212 -12.966 -30.892 1.00 0.00 O ATOM 0 H SER A 63 -88.002 -12.561 -33.192 1.00 0.00 H new ATOM 0 HA SER A 63 -88.071 -15.205 -32.172 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.243 -12.627 -31.040 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.791 -14.054 -30.128 1.00 0.00 H new ATOM 0 HG SER A 63 -86.636 -13.421 -31.541 1.00 0.00 H new ATOM 630 N TRP A 64 -90.622 -15.631 -31.545 1.00 0.00 N ATOM 631 CA TRP A 64 -91.984 -16.175 -31.601 1.00 0.00 C ATOM 632 C TRP A 64 -92.121 -17.192 -32.729 1.00 0.00 C ATOM 633 O TRP A 64 -92.081 -18.399 -32.490 1.00 0.00 O ATOM 634 CB TRP A 64 -93.041 -15.070 -31.748 1.00 0.00 C ATOM 635 CG TRP A 64 -93.164 -14.196 -30.540 1.00 0.00 C ATOM 636 CD1 TRP A 64 -93.928 -14.435 -29.437 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.506 -12.946 -30.311 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.784 -13.413 -28.534 1.00 0.00 N ATOM 639 CE2 TRP A 64 -92.915 -12.487 -29.045 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.608 -12.170 -31.048 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.456 -11.290 -28.505 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.152 -10.985 -30.511 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.574 -10.555 -29.249 1.00 0.00 C ATOM 0 H TRP A 64 -90.078 -15.967 -30.751 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.163 -16.679 -30.651 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.791 -14.452 -32.610 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.008 -15.529 -31.955 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.555 -15.303 -29.295 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.249 -13.353 -27.628 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.276 -12.493 -32.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.784 -10.953 -27.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.458 -10.379 -31.074 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.196 -9.624 -28.854 1.00 0.00 H new ATOM 654 N GLY A 65 -92.261 -16.708 -33.955 1.00 0.00 N ATOM 655 CA GLY A 65 -92.435 -17.604 -35.078 1.00 0.00 C ATOM 656 C GLY A 65 -92.272 -16.915 -36.417 1.00 0.00 C ATOM 657 O GLY A 65 -93.214 -16.860 -37.210 1.00 0.00 O ATOM 0 H GLY A 65 -92.257 -15.716 -34.191 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -91.712 -18.416 -35.003 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -93.426 -18.054 -35.026 1.00 0.00 H new ATOM 661 N ARG A 66 -91.087 -16.371 -36.674 1.00 0.00 N ATOM 662 CA ARG A 66 -90.790 -15.799 -37.980 1.00 0.00 C ATOM 663 C ARG A 66 -89.776 -16.673 -38.712 1.00 0.00 C ATOM 664 O ARG A 66 -88.676 -16.915 -38.211 1.00 0.00 O ATOM 665 CB ARG A 66 -90.253 -14.366 -37.866 1.00 0.00 C ATOM 666 CG ARG A 66 -91.170 -13.386 -37.138 1.00 0.00 C ATOM 667 CD ARG A 66 -92.606 -13.430 -37.652 1.00 0.00 C ATOM 668 NE ARG A 66 -92.690 -13.460 -39.110 1.00 0.00 N ATOM 669 CZ ARG A 66 -93.682 -12.915 -39.819 1.00 0.00 C ATOM 670 NH1 ARG A 66 -94.615 -12.176 -39.234 1.00 0.00 N ATOM 671 NH2 ARG A 66 -93.738 -13.099 -41.125 1.00 0.00 N ATOM 0 H ARG A 66 -90.323 -16.315 -36.001 1.00 0.00 H new ATOM 0 HA ARG A 66 -91.722 -15.762 -38.545 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.294 -14.394 -37.349 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -90.063 -13.985 -38.869 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -91.163 -13.612 -36.072 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.778 -12.375 -37.252 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -93.104 -14.311 -37.247 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -93.146 -12.559 -37.280 1.00 0.00 H new ATOM 0 HE ARG A 66 -91.941 -13.928 -39.621 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -94.582 -12.016 -38.227 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -95.365 -11.767 -39.791 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -93.024 -13.657 -41.592 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -94.496 -12.683 -41.667 1.00 0.00 H new ATOM 685 N SER A 67 -90.163 -17.161 -39.881 1.00 0.00 N ATOM 686 CA SER A 67 -89.294 -18.002 -40.693 1.00 0.00 C ATOM 687 C SER A 67 -88.126 -17.194 -41.252 1.00 0.00 C ATOM 688 O SER A 67 -88.312 -16.064 -41.706 1.00 0.00 O ATOM 689 CB SER A 67 -90.092 -18.607 -41.849 1.00 0.00 C ATOM 690 OG SER A 67 -91.262 -19.260 -41.388 1.00 0.00 O ATOM 0 H SER A 67 -91.080 -16.988 -40.292 1.00 0.00 H new ATOM 0 HA SER A 67 -88.899 -18.798 -40.061 1.00 0.00 H new ATOM 0 HB2 SER A 67 -90.366 -17.822 -42.553 1.00 0.00 H new ATOM 0 HB3 SER A 67 -89.467 -19.317 -42.391 1.00 0.00 H new ATOM 0 HG SER A 67 -91.750 -19.634 -42.151 1.00 0.00 H new ATOM 696 N SER A 68 -86.928 -17.772 -41.216 1.00 0.00 N ATOM 697 CA SER A 68 -85.758 -17.125 -41.790 1.00 0.00 C ATOM 698 C SER A 68 -85.840 -17.192 -43.312 1.00 0.00 C ATOM 699 O SER A 68 -85.556 -18.232 -43.911 1.00 0.00 O ATOM 700 CB SER A 68 -84.471 -17.805 -41.307 1.00 0.00 C ATOM 701 OG SER A 68 -84.526 -18.081 -39.915 1.00 0.00 O ATOM 0 H SER A 68 -86.745 -18.684 -40.796 1.00 0.00 H new ATOM 0 HA SER A 68 -85.737 -16.084 -41.468 1.00 0.00 H new ATOM 0 HB2 SER A 68 -84.318 -18.733 -41.858 1.00 0.00 H new ATOM 0 HB3 SER A 68 -83.616 -17.163 -41.519 1.00 0.00 H new ATOM 0 HG SER A 68 -83.632 -17.980 -39.526 1.00 0.00 H new ATOM 707 N LYS A 69 -86.264 -16.101 -43.927 1.00 0.00 N ATOM 708 CA LYS A 69 -86.477 -16.070 -45.365 1.00 0.00 C ATOM 709 C LYS A 69 -86.565 -14.626 -45.845 1.00 0.00 C ATOM 710 O LYS A 69 -87.020 -13.753 -45.104 1.00 0.00 O ATOM 711 CB LYS A 69 -87.767 -16.833 -45.693 1.00 0.00 C ATOM 712 CG LYS A 69 -88.073 -16.964 -47.175 1.00 0.00 C ATOM 713 CD LYS A 69 -89.359 -17.739 -47.385 1.00 0.00 C ATOM 714 CE LYS A 69 -89.755 -17.796 -48.849 1.00 0.00 C ATOM 715 NZ LYS A 69 -91.053 -18.497 -49.031 1.00 0.00 N ATOM 0 H LYS A 69 -86.468 -15.222 -43.452 1.00 0.00 H new ATOM 0 HA LYS A 69 -85.641 -16.547 -45.877 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -87.701 -17.831 -45.261 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -88.603 -16.330 -45.207 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -88.161 -15.974 -47.623 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -87.250 -17.470 -47.679 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -89.238 -18.752 -47.002 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -90.160 -17.275 -46.810 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -89.827 -16.784 -49.248 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -88.979 -18.309 -49.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -91.145 -18.805 -50.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -91.090 -19.327 -48.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -91.833 -17.850 -48.796 1.00 0.00 H new ATOM 729 N GLN A 70 -86.113 -14.366 -47.065 1.00 0.00 N ATOM 730 CA GLN A 70 -86.198 -13.029 -47.628 1.00 0.00 C ATOM 731 C GLN A 70 -87.580 -12.814 -48.225 1.00 0.00 C ATOM 732 O GLN A 70 -87.855 -13.253 -49.346 1.00 0.00 O ATOM 733 CB GLN A 70 -85.112 -12.805 -48.684 1.00 0.00 C ATOM 734 CG GLN A 70 -83.698 -12.982 -48.148 1.00 0.00 C ATOM 735 CD GLN A 70 -82.626 -12.618 -49.159 1.00 0.00 C ATOM 736 OE1 GLN A 70 -81.530 -12.191 -48.792 1.00 0.00 O ATOM 737 NE2 GLN A 70 -82.927 -12.780 -50.436 1.00 0.00 N ATOM 0 H GLN A 70 -85.687 -15.060 -47.679 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.036 -12.303 -46.831 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -85.269 -13.500 -49.509 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.214 -11.799 -49.091 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -83.574 -12.365 -47.258 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -83.560 -14.018 -47.839 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -83.845 -13.136 -50.702 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -82.241 -12.549 -51.155 1.00 0.00 H new ATOM 746 N TRP A 71 -88.439 -12.157 -47.445 1.00 0.00 N ATOM 747 CA TRP A 71 -89.840 -11.921 -47.801 1.00 0.00 C ATOM 748 C TRP A 71 -90.676 -13.188 -47.631 1.00 0.00 C ATOM 749 O TRP A 71 -90.298 -14.275 -48.076 1.00 0.00 O ATOM 750 CB TRP A 71 -89.992 -11.369 -49.223 1.00 0.00 C ATOM 751 CG TRP A 71 -89.334 -10.035 -49.425 1.00 0.00 C ATOM 752 CD1 TRP A 71 -88.221 -9.774 -50.171 1.00 0.00 C ATOM 753 CD2 TRP A 71 -89.748 -8.781 -48.871 1.00 0.00 C ATOM 754 NE1 TRP A 71 -87.918 -8.435 -50.114 1.00 0.00 N ATOM 755 CE2 TRP A 71 -88.840 -7.806 -49.323 1.00 0.00 C ATOM 756 CE3 TRP A 71 -90.798 -8.387 -48.038 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -88.949 -6.465 -48.969 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -90.907 -7.055 -47.689 1.00 0.00 C ATOM 759 CH2 TRP A 71 -89.986 -6.107 -48.154 1.00 0.00 C ATOM 0 H TRP A 71 -88.179 -11.769 -46.538 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.213 -11.163 -47.112 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -89.568 -12.084 -49.928 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.053 -11.280 -49.458 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -87.660 -10.512 -50.725 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -87.134 -7.984 -50.585 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -91.512 -9.111 -47.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -88.239 -5.733 -49.326 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -91.716 -6.739 -47.047 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -90.098 -5.073 -47.863 1.00 0.00 H new ATOM 770 N GLU A 72 -91.821 -13.021 -46.989 1.00 0.00 N ATOM 771 CA GLU A 72 -92.732 -14.118 -46.681 1.00 0.00 C ATOM 772 C GLU A 72 -94.013 -13.525 -46.110 1.00 0.00 C ATOM 773 O GLU A 72 -95.123 -13.900 -46.487 1.00 0.00 O ATOM 774 CB GLU A 72 -92.103 -15.085 -45.664 1.00 0.00 C ATOM 775 CG GLU A 72 -92.907 -16.363 -45.444 1.00 0.00 C ATOM 776 CD GLU A 72 -92.782 -17.343 -46.595 1.00 0.00 C ATOM 777 OE1 GLU A 72 -93.054 -16.960 -47.754 1.00 0.00 O ATOM 778 OE2 GLU A 72 -92.415 -18.511 -46.353 1.00 0.00 O ATOM 0 H GLU A 72 -92.150 -12.112 -46.663 1.00 0.00 H new ATOM 0 HA GLU A 72 -92.944 -14.682 -47.589 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -91.102 -15.352 -46.003 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.990 -14.570 -44.710 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -92.571 -16.844 -44.525 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -93.957 -16.106 -45.304 1.00 0.00 H new ATOM 785 N ASP A 73 -93.823 -12.577 -45.200 1.00 0.00 N ATOM 786 CA ASP A 73 -94.913 -11.831 -44.587 1.00 0.00 C ATOM 787 C ASP A 73 -94.355 -10.615 -43.859 1.00 0.00 C ATOM 788 O ASP A 73 -93.781 -10.740 -42.781 1.00 0.00 O ATOM 789 CB ASP A 73 -95.709 -12.700 -43.608 1.00 0.00 C ATOM 790 CG ASP A 73 -96.581 -11.867 -42.686 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.533 -11.231 -43.179 1.00 0.00 O ATOM 792 OD2 ASP A 73 -96.294 -11.826 -41.469 1.00 0.00 O ATOM 0 H ASP A 73 -92.900 -12.303 -44.865 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.590 -11.511 -45.379 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -96.334 -13.396 -44.167 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.020 -13.299 -43.012 1.00 0.00 H new ATOM 797 N PRO A 74 -94.474 -9.430 -44.461 1.00 0.00 N ATOM 798 CA PRO A 74 -94.003 -8.184 -43.873 1.00 0.00 C ATOM 799 C PRO A 74 -95.107 -7.412 -43.144 1.00 0.00 C ATOM 800 O PRO A 74 -95.072 -6.185 -43.082 1.00 0.00 O ATOM 801 CB PRO A 74 -93.569 -7.433 -45.113 1.00 0.00 C ATOM 802 CG PRO A 74 -94.646 -7.759 -46.072 1.00 0.00 C ATOM 803 CD PRO A 74 -95.039 -9.192 -45.797 1.00 0.00 C ATOM 0 HA PRO A 74 -93.234 -8.331 -43.114 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -93.495 -6.360 -44.934 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -92.594 -7.765 -45.469 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -95.497 -7.091 -45.943 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -94.301 -7.641 -47.099 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -96.121 -9.325 -45.809 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -94.626 -9.875 -46.539 1.00 0.00 H new ATOM 811 N SER A 75 -96.088 -8.123 -42.600 1.00 0.00 N ATOM 812 CA SER A 75 -97.219 -7.463 -41.965 1.00 0.00 C ATOM 813 C SER A 75 -97.278 -7.778 -40.463 1.00 0.00 C ATOM 814 O SER A 75 -96.252 -7.753 -39.779 1.00 0.00 O ATOM 815 CB SER A 75 -98.525 -7.861 -42.668 1.00 0.00 C ATOM 816 OG SER A 75 -98.886 -9.213 -42.413 1.00 0.00 O ATOM 0 H SER A 75 -96.123 -9.142 -42.586 1.00 0.00 H new ATOM 0 HA SER A 75 -97.088 -6.385 -42.063 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.329 -7.204 -42.335 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.416 -7.713 -43.742 1.00 0.00 H new ATOM 0 HG SER A 75 -98.100 -9.788 -42.524 1.00 0.00 H new ATOM 822 N GLN A 76 -98.491 -8.047 -39.968 1.00 0.00 N ATOM 823 CA GLN A 76 -98.757 -8.369 -38.568 1.00 0.00 C ATOM 824 C GLN A 76 -98.668 -7.136 -37.661 1.00 0.00 C ATOM 825 O GLN A 76 -99.630 -6.801 -36.972 1.00 0.00 O ATOM 826 CB GLN A 76 -97.831 -9.474 -38.070 1.00 0.00 C ATOM 827 CG GLN A 76 -98.001 -10.806 -38.790 1.00 0.00 C ATOM 828 CD GLN A 76 -99.451 -11.217 -38.926 1.00 0.00 C ATOM 829 OE1 GLN A 76 -100.019 -11.841 -38.029 1.00 0.00 O ATOM 830 NE2 GLN A 76 -100.048 -10.897 -40.062 1.00 0.00 N ATOM 0 H GLN A 76 -99.332 -8.046 -40.545 1.00 0.00 H new ATOM 0 HA GLN A 76 -99.783 -8.733 -38.519 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -96.798 -9.144 -38.181 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.005 -9.625 -37.005 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -97.553 -10.738 -39.781 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -97.458 -11.580 -38.247 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -99.538 -10.379 -40.778 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -101.018 -11.168 -40.222 1.00 0.00 H new ATOM 839 N ALA A 77 -97.530 -6.453 -37.678 1.00 0.00 N ATOM 840 CA ALA A 77 -97.324 -5.269 -36.840 1.00 0.00 C ATOM 841 C ALA A 77 -97.738 -3.998 -37.584 1.00 0.00 C ATOM 842 O ALA A 77 -97.217 -2.899 -37.335 1.00 0.00 O ATOM 843 CB ALA A 77 -95.868 -5.192 -36.409 1.00 0.00 C ATOM 0 H ALA A 77 -96.731 -6.696 -38.263 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.950 -5.353 -35.952 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.719 -4.310 -35.786 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.609 -6.085 -35.841 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.231 -5.125 -37.291 1.00 0.00 H new ATOM 849 N SER A 78 -98.704 -4.159 -38.477 1.00 0.00 N ATOM 850 CA SER A 78 -99.156 -3.077 -39.335 1.00 0.00 C ATOM 851 C SER A 78 -99.599 -1.884 -38.503 1.00 0.00 C ATOM 852 O SER A 78 -99.237 -0.745 -38.795 1.00 0.00 O ATOM 853 CB SER A 78 -100.301 -3.565 -40.231 1.00 0.00 C ATOM 854 OG SER A 78 -100.544 -2.664 -41.297 1.00 0.00 O ATOM 0 H SER A 78 -99.194 -5.041 -38.626 1.00 0.00 H new ATOM 0 HA SER A 78 -98.326 -2.759 -39.967 1.00 0.00 H new ATOM 0 HB2 SER A 78 -100.057 -4.548 -40.633 1.00 0.00 H new ATOM 0 HB3 SER A 78 -101.207 -3.680 -39.636 1.00 0.00 H new ATOM 0 HG SER A 78 -101.278 -3.003 -41.851 1.00 0.00 H new ATOM 860 N LYS A 79 -100.339 -2.159 -37.442 1.00 0.00 N ATOM 861 CA LYS A 79 -100.913 -1.108 -36.626 1.00 0.00 C ATOM 862 C LYS A 79 -99.842 -0.312 -35.884 1.00 0.00 C ATOM 863 O LYS A 79 -99.995 0.893 -35.690 1.00 0.00 O ATOM 864 CB LYS A 79 -101.920 -1.701 -35.635 1.00 0.00 C ATOM 865 CG LYS A 79 -102.839 -0.666 -35.003 1.00 0.00 C ATOM 866 CD LYS A 79 -103.586 0.133 -36.065 1.00 0.00 C ATOM 867 CE LYS A 79 -104.416 -0.766 -36.973 1.00 0.00 C ATOM 868 NZ LYS A 79 -104.990 -0.021 -38.126 1.00 0.00 N ATOM 0 H LYS A 79 -100.555 -3.105 -37.127 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.428 -0.416 -37.293 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.526 -2.446 -36.149 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.377 -2.221 -34.846 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.555 -1.163 -34.349 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.254 0.011 -34.380 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -104.237 0.860 -35.581 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -102.871 0.695 -36.666 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -103.794 -1.581 -37.342 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -105.223 -1.217 -36.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.185 -0.683 -38.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -105.875 0.441 -37.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.312 0.700 -38.446 1.00 0.00 H new ATOM 882 N VAL A 80 -98.748 -0.962 -35.488 1.00 0.00 N ATOM 883 CA VAL A 80 -97.753 -0.293 -34.674 1.00 0.00 C ATOM 884 C VAL A 80 -96.923 0.698 -35.494 1.00 0.00 C ATOM 885 O VAL A 80 -96.710 1.828 -35.056 1.00 0.00 O ATOM 886 CB VAL A 80 -96.841 -1.286 -33.918 1.00 0.00 C ATOM 887 CG1 VAL A 80 -97.678 -2.272 -33.118 1.00 0.00 C ATOM 888 CG2 VAL A 80 -95.884 -2.019 -34.848 1.00 0.00 C ATOM 0 H VAL A 80 -98.537 -1.933 -35.716 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.304 0.272 -33.922 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.228 -0.702 -33.231 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -97.021 -2.964 -32.592 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -98.287 -1.729 -32.395 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -98.327 -2.830 -33.793 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -95.266 -2.704 -34.268 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -96.454 -2.582 -35.587 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -95.246 -1.296 -35.356 1.00 0.00 H new ATOM 898 N CYS A 81 -96.483 0.317 -36.695 1.00 0.00 N ATOM 899 CA CYS A 81 -95.726 1.264 -37.520 1.00 0.00 C ATOM 900 C CYS A 81 -96.660 2.321 -38.098 1.00 0.00 C ATOM 901 O CYS A 81 -96.248 3.454 -38.346 1.00 0.00 O ATOM 902 CB CYS A 81 -94.931 0.571 -38.635 1.00 0.00 C ATOM 903 SG CYS A 81 -93.706 -0.625 -38.020 1.00 0.00 S ATOM 0 H CYS A 81 -96.629 -0.604 -37.108 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.996 1.747 -36.871 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.626 0.058 -39.300 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.420 1.328 -39.230 1.00 0.00 H new ATOM 908 N GLN A 82 -97.928 1.957 -38.278 1.00 0.00 N ATOM 909 CA GLN A 82 -98.940 2.914 -38.704 1.00 0.00 C ATOM 910 C GLN A 82 -99.158 3.944 -37.599 1.00 0.00 C ATOM 911 O GLN A 82 -99.358 5.128 -37.860 1.00 0.00 O ATOM 912 CB GLN A 82 -100.253 2.197 -39.028 1.00 0.00 C ATOM 913 CG GLN A 82 -101.265 3.067 -39.756 1.00 0.00 C ATOM 914 CD GLN A 82 -102.569 2.341 -40.027 1.00 0.00 C ATOM 915 OE1 GLN A 82 -102.994 1.483 -39.253 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.205 2.670 -41.140 1.00 0.00 N ATOM 0 H GLN A 82 -98.276 1.009 -38.135 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.597 3.419 -39.607 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.036 1.320 -39.638 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.698 1.837 -38.100 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.466 3.959 -39.162 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -100.837 3.403 -40.701 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.819 3.387 -41.755 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.081 2.207 -41.383 1.00 0.00 H new ATOM 925 N ARG A 83 -99.096 3.473 -36.357 1.00 0.00 N ATOM 926 CA ARG A 83 -99.201 4.336 -35.188 1.00 0.00 C ATOM 927 C ARG A 83 -97.952 5.209 -35.072 1.00 0.00 C ATOM 928 O ARG A 83 -97.977 6.282 -34.471 1.00 0.00 O ATOM 929 CB ARG A 83 -99.362 3.469 -33.934 1.00 0.00 C ATOM 930 CG ARG A 83 -99.836 4.212 -32.696 1.00 0.00 C ATOM 931 CD ARG A 83 -101.267 4.707 -32.848 1.00 0.00 C ATOM 932 NE ARG A 83 -101.884 4.993 -31.554 1.00 0.00 N ATOM 933 CZ ARG A 83 -103.038 5.645 -31.395 1.00 0.00 C ATOM 934 NH1 ARG A 83 -103.682 6.140 -32.446 1.00 0.00 N ATOM 935 NH2 ARG A 83 -103.541 5.806 -30.178 1.00 0.00 N ATOM 0 H ARG A 83 -98.972 2.485 -36.134 1.00 0.00 H new ATOM 0 HA ARG A 83 -100.070 4.986 -35.289 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.069 2.669 -34.152 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.405 2.997 -33.712 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -99.769 3.554 -31.829 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -99.177 5.059 -32.505 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -101.277 5.608 -33.462 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -101.857 3.956 -33.374 1.00 0.00 H new ATOM 0 HE ARG A 83 -101.400 4.673 -30.715 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -103.295 6.023 -33.383 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -104.563 6.637 -32.316 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -103.046 5.432 -29.368 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -104.422 6.304 -30.052 1.00 0.00 H new ATOM 949 N LEU A 84 -96.861 4.739 -35.672 1.00 0.00 N ATOM 950 CA LEU A 84 -95.601 5.471 -35.681 1.00 0.00 C ATOM 951 C LEU A 84 -95.493 6.320 -36.943 1.00 0.00 C ATOM 952 O LEU A 84 -94.417 6.818 -37.268 1.00 0.00 O ATOM 953 CB LEU A 84 -94.416 4.497 -35.615 1.00 0.00 C ATOM 954 CG LEU A 84 -94.325 3.651 -34.343 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.217 2.615 -34.470 1.00 0.00 C ATOM 956 CD2 LEU A 84 -94.087 4.536 -33.129 1.00 0.00 C ATOM 0 H LEU A 84 -96.827 3.845 -36.162 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.576 6.122 -34.807 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.472 3.826 -36.473 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.493 5.068 -35.717 1.00 0.00 H new ATOM 0 HG LEU A 84 -95.273 3.129 -34.209 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -93.167 2.022 -33.557 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.426 1.960 -35.316 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -92.264 3.119 -34.628 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -94.025 3.917 -32.234 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -93.154 5.085 -33.256 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.911 5.242 -33.026 1.00 0.00 H new ATOM 968 N ASN A 85 -96.625 6.461 -37.648 1.00 0.00 N ATOM 969 CA ASN A 85 -96.710 7.191 -38.928 1.00 0.00 C ATOM 970 C ASN A 85 -95.569 6.831 -39.879 1.00 0.00 C ATOM 971 O ASN A 85 -95.141 7.647 -40.696 1.00 0.00 O ATOM 972 CB ASN A 85 -96.808 8.723 -38.732 1.00 0.00 C ATOM 973 CG ASN A 85 -95.731 9.328 -37.850 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.634 9.644 -38.313 1.00 0.00 O ATOM 975 ND2 ASN A 85 -96.060 9.528 -36.583 1.00 0.00 N ATOM 0 H ASN A 85 -97.517 6.069 -37.346 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.640 6.865 -39.394 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.767 9.202 -39.710 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.782 8.957 -38.303 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -95.392 9.961 -35.945 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -96.981 9.249 -36.245 1.00 0.00 H new ATOM 982 N CYS A 86 -95.116 5.585 -39.798 1.00 0.00 N ATOM 983 CA CYS A 86 -94.107 5.067 -40.713 1.00 0.00 C ATOM 984 C CYS A 86 -94.789 4.287 -41.828 1.00 0.00 C ATOM 985 O CYS A 86 -94.135 3.677 -42.670 1.00 0.00 O ATOM 986 CB CYS A 86 -93.098 4.185 -39.962 1.00 0.00 C ATOM 987 SG CYS A 86 -92.123 5.093 -38.727 1.00 0.00 S ATOM 0 H CYS A 86 -95.435 4.911 -39.102 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.556 5.900 -41.151 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.633 3.375 -39.467 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.421 3.726 -40.683 1.00 0.00 H new ATOM 992 N GLY A 87 -96.117 4.328 -41.819 1.00 0.00 N ATOM 993 CA GLY A 87 -96.897 3.675 -42.849 1.00 0.00 C ATOM 994 C GLY A 87 -97.224 2.241 -42.505 1.00 0.00 C ATOM 995 O GLY A 87 -97.771 1.958 -41.441 1.00 0.00 O ATOM 0 H GLY A 87 -96.670 4.807 -41.108 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.823 4.228 -43.005 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.347 3.703 -43.790 1.00 0.00 H new ATOM 999 N ASP A 88 -96.866 1.341 -43.402 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.125 -0.083 -43.225 1.00 0.00 C ATOM 1001 C ASP A 88 -96.088 -0.671 -42.266 1.00 0.00 C ATOM 1002 O ASP A 88 -95.146 0.026 -41.884 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.081 -0.778 -44.592 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.248 -0.396 -45.480 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.210 0.699 -46.086 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.204 -1.195 -45.591 1.00 0.00 O ATOM 0 H ASP A 88 -96.388 1.572 -44.273 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.114 -0.239 -42.794 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.148 -0.523 -45.095 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.079 -1.858 -44.446 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.230 -1.936 -41.828 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.298 -2.509 -40.868 1.00 0.00 C ATOM 1013 C PRO A 89 -93.953 -2.829 -41.447 1.00 0.00 C ATOM 1014 O PRO A 89 -93.794 -3.049 -42.648 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.950 -3.794 -40.415 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.868 -4.174 -41.516 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.286 -2.895 -42.200 1.00 0.00 C ATOM 0 HA PRO A 89 -95.111 -1.791 -40.069 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.207 -4.571 -40.236 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.493 -3.652 -39.481 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.372 -4.843 -42.219 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.737 -4.706 -41.128 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.349 -3.021 -43.281 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.267 -2.562 -41.860 1.00 0.00 H new ATOM 1025 N LEU A 90 -92.994 -2.783 -40.555 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.668 -3.274 -40.768 1.00 0.00 C ATOM 1027 C LEU A 90 -91.647 -4.507 -41.645 1.00 0.00 C ATOM 1028 O LEU A 90 -92.126 -5.577 -41.277 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.959 -3.557 -39.434 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.746 -3.273 -38.134 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.041 -4.057 -38.051 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -90.896 -3.592 -36.919 1.00 0.00 C ATOM 0 H LEU A 90 -93.129 -2.385 -39.626 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.126 -2.488 -41.293 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.663 -4.606 -39.426 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.043 -2.967 -39.408 1.00 0.00 H new ATOM 0 HG LEU A 90 -91.997 -2.212 -38.151 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.552 -3.818 -37.118 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.681 -3.793 -38.893 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.823 -5.124 -38.082 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.465 -3.386 -36.013 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.613 -4.644 -36.939 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -89.998 -2.975 -36.931 1.00 0.00 H new ATOM 1044 N SER A 91 -91.119 -4.301 -42.824 1.00 0.00 N ATOM 1045 CA SER A 91 -90.843 -5.371 -43.750 1.00 0.00 C ATOM 1046 C SER A 91 -89.708 -6.237 -43.212 1.00 0.00 C ATOM 1047 O SER A 91 -88.877 -5.764 -42.429 1.00 0.00 O ATOM 1048 CB SER A 91 -90.490 -4.783 -45.114 1.00 0.00 C ATOM 1049 OG SER A 91 -89.638 -3.655 -44.984 1.00 0.00 O ATOM 0 H SER A 91 -90.866 -3.376 -43.173 1.00 0.00 H new ATOM 0 HA SER A 91 -91.725 -6.001 -43.864 1.00 0.00 H new ATOM 0 HB2 SER A 91 -90.001 -5.542 -45.724 1.00 0.00 H new ATOM 0 HB3 SER A 91 -91.403 -4.494 -45.635 1.00 0.00 H new ATOM 0 HG SER A 91 -90.117 -2.849 -45.270 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.678 -7.495 -43.630 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.715 -8.451 -43.107 1.00 0.00 C ATOM 1057 C LEU A 92 -87.505 -8.613 -44.017 1.00 0.00 C ATOM 1058 O LEU A 92 -87.630 -8.867 -45.217 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.384 -9.805 -42.879 1.00 0.00 C ATOM 1060 CG LEU A 92 -90.067 -9.960 -41.521 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.847 -11.256 -41.466 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -89.038 -9.932 -40.405 1.00 0.00 C ATOM 0 H LEU A 92 -90.312 -7.877 -44.332 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.356 -8.056 -42.157 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -90.124 -9.966 -43.663 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.633 -10.588 -42.984 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.757 -9.127 -41.388 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -91.327 -11.351 -40.492 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.607 -11.256 -42.247 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -90.169 -12.096 -41.619 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.540 -10.044 -39.444 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.331 -10.750 -40.542 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.503 -8.982 -40.427 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.338 -8.458 -43.415 1.00 0.00 N ATOM 1075 CA GLY A 93 -85.077 -8.660 -44.103 1.00 0.00 C ATOM 1076 C GLY A 93 -83.940 -8.636 -43.107 1.00 0.00 C ATOM 1077 O GLY A 93 -83.874 -7.719 -42.294 1.00 0.00 O ATOM 0 H GLY A 93 -86.239 -8.189 -42.436 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -85.089 -9.613 -44.632 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.932 -7.882 -44.852 1.00 0.00 H new ATOM 1081 N PRO A 94 -83.025 -9.622 -43.135 1.00 0.00 N ATOM 1082 CA PRO A 94 -82.012 -9.787 -42.085 1.00 0.00 C ATOM 1083 C PRO A 94 -81.173 -8.523 -41.895 1.00 0.00 C ATOM 1084 O PRO A 94 -80.631 -7.965 -42.851 1.00 0.00 O ATOM 1085 CB PRO A 94 -81.171 -10.978 -42.566 1.00 0.00 C ATOM 1086 CG PRO A 94 -81.442 -11.066 -44.030 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.868 -10.618 -44.205 1.00 0.00 C ATOM 0 HA PRO A 94 -82.453 -9.964 -41.104 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -80.111 -10.820 -42.368 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -81.457 -11.897 -42.054 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.759 -10.430 -44.594 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -81.303 -12.084 -44.394 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -83.039 -10.185 -45.190 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -83.569 -11.445 -44.095 1.00 0.00 H new ATOM 1095 N PHE A 95 -81.101 -8.077 -40.653 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.523 -6.791 -40.313 1.00 0.00 C ATOM 1097 C PHE A 95 -79.322 -6.990 -39.391 1.00 0.00 C ATOM 1098 O PHE A 95 -79.111 -8.089 -38.875 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.606 -5.942 -39.630 1.00 0.00 C ATOM 1100 CG PHE A 95 -81.251 -4.499 -39.410 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -81.133 -3.630 -40.481 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -81.049 -4.010 -38.128 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.819 -2.302 -40.280 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.736 -2.683 -37.923 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.619 -1.827 -38.998 1.00 0.00 C ATOM 0 H PHE A 95 -81.444 -8.601 -39.848 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.174 -6.279 -41.210 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.513 -5.987 -40.233 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -81.841 -6.392 -38.665 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.289 -3.996 -41.485 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -81.138 -4.675 -37.282 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -80.730 -1.634 -41.124 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.582 -2.314 -36.920 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.372 -0.788 -38.838 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.534 -5.938 -39.208 1.00 0.00 N ATOM 1116 CA LEU A 96 -77.381 -5.981 -38.316 1.00 0.00 C ATOM 1117 C LEU A 96 -77.826 -6.208 -36.873 1.00 0.00 C ATOM 1118 O LEU A 96 -78.776 -5.576 -36.404 1.00 0.00 O ATOM 1119 CB LEU A 96 -76.591 -4.673 -38.424 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.330 -4.591 -37.559 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.289 -5.595 -38.027 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -74.762 -3.183 -37.582 1.00 0.00 C ATOM 0 H LEU A 96 -78.673 -5.039 -39.669 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.741 -6.812 -38.613 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -76.306 -4.526 -39.466 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -77.250 -3.848 -38.154 1.00 0.00 H new ATOM 0 HG LEU A 96 -75.602 -4.837 -36.533 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -73.402 -5.519 -37.398 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -74.698 -6.603 -37.957 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -74.019 -5.384 -39.062 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -73.866 -3.142 -36.962 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -74.508 -2.910 -38.606 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -75.504 -2.485 -37.194 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.132 -7.101 -36.174 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.465 -7.409 -34.789 1.00 0.00 C ATOM 1136 C LYS A 97 -77.208 -6.201 -33.892 1.00 0.00 C ATOM 1137 O LYS A 97 -76.066 -5.802 -33.665 1.00 0.00 O ATOM 1138 CB LYS A 97 -76.670 -8.624 -34.287 1.00 0.00 C ATOM 1139 CG LYS A 97 -75.170 -8.528 -34.530 1.00 0.00 C ATOM 1140 CD LYS A 97 -74.397 -9.555 -33.720 1.00 0.00 C ATOM 1141 CE LYS A 97 -74.539 -9.307 -32.227 1.00 0.00 C ATOM 1142 NZ LYS A 97 -73.585 -10.125 -31.434 1.00 0.00 N ATOM 0 H LYS A 97 -76.337 -7.623 -36.544 1.00 0.00 H new ATOM 0 HA LYS A 97 -78.526 -7.655 -34.747 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -76.847 -8.744 -33.218 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -77.050 -9.521 -34.776 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -74.964 -8.673 -35.591 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -74.824 -7.527 -34.272 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -74.757 -10.555 -33.960 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -73.343 -9.521 -33.997 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -74.372 -8.250 -32.017 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -75.558 -9.536 -31.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -73.938 -10.224 -30.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -73.493 -11.067 -31.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -72.656 -9.658 -31.420 1.00 0.00 H new ATOM 1156 N THR A 98 -78.286 -5.610 -33.407 1.00 0.00 N ATOM 1157 CA THR A 98 -78.201 -4.458 -32.525 1.00 0.00 C ATOM 1158 C THR A 98 -78.415 -4.887 -31.072 1.00 0.00 C ATOM 1159 O THR A 98 -78.169 -4.123 -30.133 1.00 0.00 O ATOM 1160 CB THR A 98 -79.253 -3.404 -32.924 1.00 0.00 C ATOM 1161 OG1 THR A 98 -79.251 -3.249 -34.350 1.00 0.00 O ATOM 1162 CG2 THR A 98 -78.964 -2.059 -32.273 1.00 0.00 C ATOM 0 H THR A 98 -79.239 -5.912 -33.611 1.00 0.00 H new ATOM 0 HA THR A 98 -77.208 -4.019 -32.620 1.00 0.00 H new ATOM 0 HB THR A 98 -80.229 -3.748 -32.581 1.00 0.00 H new ATOM 0 HG1 THR A 98 -79.920 -2.581 -34.607 1.00 0.00 H new ATOM 0 HG21 THR A 98 -79.724 -1.338 -32.575 1.00 0.00 H new ATOM 0 HG22 THR A 98 -78.978 -2.169 -31.189 1.00 0.00 H new ATOM 0 HG23 THR A 98 -77.983 -1.705 -32.589 1.00 0.00 H new ATOM 1170 N TYR A 99 -78.865 -6.126 -30.901 1.00 0.00 N ATOM 1171 CA TYR A 99 -79.120 -6.678 -29.576 1.00 0.00 C ATOM 1172 C TYR A 99 -77.891 -7.409 -29.045 1.00 0.00 C ATOM 1173 O TYR A 99 -76.932 -7.635 -29.784 1.00 0.00 O ATOM 1174 CB TYR A 99 -80.329 -7.623 -29.607 1.00 0.00 C ATOM 1175 CG TYR A 99 -80.204 -8.782 -30.582 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -79.602 -9.982 -30.210 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -80.700 -8.675 -31.870 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -79.501 -11.037 -31.102 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -80.604 -9.724 -32.762 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.005 -10.902 -32.377 1.00 0.00 C ATOM 1181 OH TYR A 99 -79.917 -11.946 -33.276 1.00 0.00 O ATOM 0 H TYR A 99 -79.061 -6.769 -31.668 1.00 0.00 H new ATOM 0 HA TYR A 99 -79.343 -5.849 -28.904 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -80.486 -8.024 -28.605 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -81.218 -7.046 -29.862 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -79.208 -10.091 -29.210 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -81.170 -7.754 -32.182 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -79.030 -11.960 -30.800 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -80.999 -9.621 -33.762 1.00 0.00 H new ATOM 0 HH TYR A 99 -79.740 -11.592 -34.172 1.00 0.00 H new ATOM 1191 N THR A 100 -77.927 -7.787 -27.770 1.00 0.00 N ATOM 1192 CA THR A 100 -76.800 -8.467 -27.157 1.00 0.00 C ATOM 1193 C THR A 100 -77.271 -9.462 -26.085 1.00 0.00 C ATOM 1194 O THR A 100 -78.093 -9.135 -25.219 1.00 0.00 O ATOM 1195 CB THR A 100 -75.780 -7.459 -26.568 1.00 0.00 C ATOM 1196 OG1 THR A 100 -74.593 -8.142 -26.143 1.00 0.00 O ATOM 1197 CG2 THR A 100 -76.368 -6.682 -25.396 1.00 0.00 C ATOM 0 H THR A 100 -78.721 -7.633 -27.148 1.00 0.00 H new ATOM 0 HA THR A 100 -76.292 -9.030 -27.940 1.00 0.00 H new ATOM 0 HB THR A 100 -75.531 -6.749 -27.357 1.00 0.00 H new ATOM 0 HG1 THR A 100 -73.957 -7.494 -25.775 1.00 0.00 H new ATOM 0 HG21 THR A 100 -75.623 -5.986 -25.011 1.00 0.00 H new ATOM 0 HG22 THR A 100 -77.244 -6.127 -25.731 1.00 0.00 H new ATOM 0 HG23 THR A 100 -76.658 -7.377 -24.608 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.777 -10.705 -26.178 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.113 -11.798 -25.259 1.00 0.00 C ATOM 1207 C PRO A 101 -76.786 -11.473 -23.811 1.00 0.00 C ATOM 1208 O PRO A 101 -75.640 -11.592 -23.375 1.00 0.00 O ATOM 1209 CB PRO A 101 -76.254 -12.968 -25.738 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.895 -12.633 -27.140 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.855 -11.136 -27.222 1.00 0.00 C ATOM 0 HA PRO A 101 -78.183 -12.004 -25.273 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -75.364 -13.083 -25.119 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -76.803 -13.908 -25.685 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.929 -13.062 -27.407 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.628 -13.040 -27.836 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.849 -10.753 -27.050 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -76.168 -10.781 -28.204 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.813 -11.046 -23.099 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.745 -10.713 -21.686 1.00 0.00 C ATOM 1221 C GLN A 102 -79.043 -10.025 -21.331 1.00 0.00 C ATOM 1222 O GLN A 102 -79.842 -10.519 -20.534 1.00 0.00 O ATOM 1223 CB GLN A 102 -76.582 -9.766 -21.363 1.00 0.00 C ATOM 1224 CG GLN A 102 -76.351 -9.593 -19.870 1.00 0.00 C ATOM 1225 CD GLN A 102 -75.552 -8.348 -19.532 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -74.750 -7.866 -20.333 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -75.758 -7.826 -18.336 1.00 0.00 N ATOM 0 H GLN A 102 -78.743 -10.917 -23.498 1.00 0.00 H new ATOM 0 HA GLN A 102 -77.585 -11.627 -21.115 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.671 -10.148 -21.824 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -76.780 -8.791 -21.809 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -77.314 -9.548 -19.362 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -75.828 -10.469 -19.485 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -76.431 -8.255 -17.701 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -75.244 -6.994 -18.047 1.00 0.00 H new ATOM 1236 N SER A 103 -79.246 -8.888 -21.974 1.00 0.00 N ATOM 1237 CA SER A 103 -80.461 -8.126 -21.823 1.00 0.00 C ATOM 1238 C SER A 103 -81.386 -8.364 -23.011 1.00 0.00 C ATOM 1239 O SER A 103 -82.598 -8.167 -22.907 1.00 0.00 O ATOM 1240 CB SER A 103 -80.125 -6.642 -21.680 1.00 0.00 C ATOM 1241 OG SER A 103 -79.202 -6.231 -22.678 1.00 0.00 O ATOM 0 H SER A 103 -78.570 -8.472 -22.614 1.00 0.00 H new ATOM 0 HA SER A 103 -80.980 -8.453 -20.922 1.00 0.00 H new ATOM 0 HB2 SER A 103 -81.037 -6.050 -21.757 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.705 -6.454 -20.692 1.00 0.00 H new ATOM 0 HG SER A 103 -79.004 -5.278 -22.567 1.00 0.00 H new ATOM 1247 N SER A 104 -80.823 -8.796 -24.145 1.00 0.00 N ATOM 1248 CA SER A 104 -81.646 -9.138 -25.286 1.00 0.00 C ATOM 1249 C SER A 104 -82.342 -10.462 -25.033 1.00 0.00 C ATOM 1250 O SER A 104 -81.852 -11.305 -24.271 1.00 0.00 O ATOM 1251 CB SER A 104 -80.813 -9.222 -26.563 1.00 0.00 C ATOM 1252 OG SER A 104 -81.612 -9.585 -27.673 1.00 0.00 O ATOM 0 H SER A 104 -79.820 -8.912 -24.286 1.00 0.00 H new ATOM 0 HA SER A 104 -82.390 -8.353 -25.421 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.337 -8.260 -26.754 1.00 0.00 H new ATOM 0 HB3 SER A 104 -80.015 -9.952 -26.432 1.00 0.00 H new ATOM 0 HG SER A 104 -82.484 -9.143 -27.606 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.482 -10.644 -25.670 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.277 -11.830 -25.469 1.00 0.00 C ATOM 1260 C ILE A 105 -84.763 -12.388 -26.803 1.00 0.00 C ATOM 1261 O ILE A 105 -84.837 -11.671 -27.802 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.480 -11.542 -24.530 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.303 -10.344 -25.010 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -85.008 -11.298 -23.102 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.275 -10.659 -26.121 1.00 0.00 C ATOM 0 H ILE A 105 -83.877 -9.978 -26.334 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.645 -12.579 -24.992 1.00 0.00 H new ATOM 0 HB ILE A 105 -86.118 -12.426 -24.552 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.857 -9.937 -24.164 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.622 -9.564 -25.350 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.869 -11.099 -22.463 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -84.482 -12.180 -22.737 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -84.335 -10.441 -23.083 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.815 -9.754 -26.399 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.729 -11.036 -26.986 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.983 -11.415 -25.781 1.00 0.00 H new ATOM 1277 N ILE A 106 -85.076 -13.668 -26.808 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.678 -14.315 -27.958 1.00 0.00 C ATOM 1279 C ILE A 106 -86.924 -15.049 -27.491 1.00 0.00 C ATOM 1280 O ILE A 106 -86.828 -16.069 -26.813 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.716 -15.317 -28.634 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.458 -14.601 -29.116 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.406 -16.009 -29.802 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.412 -15.527 -29.698 1.00 0.00 C ATOM 0 H ILE A 106 -84.920 -14.290 -26.015 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.921 -13.551 -28.697 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.430 -16.071 -27.901 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.737 -13.864 -29.869 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -83.021 -14.053 -28.281 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -84.715 -16.712 -30.268 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.282 -16.547 -29.440 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.715 -15.264 -30.535 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.548 -14.945 -30.018 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.103 -16.248 -28.941 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -82.830 -16.056 -30.554 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.089 -14.516 -27.810 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.327 -15.116 -27.342 1.00 0.00 C ATOM 1298 C CYS A 107 -89.742 -16.226 -28.292 1.00 0.00 C ATOM 1299 O CYS A 107 -89.212 -16.328 -29.399 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.445 -14.077 -27.238 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.891 -12.394 -26.866 1.00 0.00 S ATOM 0 H CYS A 107 -88.205 -13.680 -28.383 1.00 0.00 H new ATOM 0 HA CYS A 107 -89.155 -15.525 -26.346 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.996 -14.063 -28.178 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.144 -14.393 -26.464 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.676 -17.055 -27.864 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.173 -18.149 -28.685 1.00 0.00 C ATOM 1308 C TYR A 108 -92.657 -18.343 -28.421 1.00 0.00 C ATOM 1309 O TYR A 108 -93.231 -17.667 -27.567 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.425 -19.448 -28.377 1.00 0.00 C ATOM 1311 CG TYR A 108 -88.964 -19.441 -28.756 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.566 -19.636 -30.072 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.981 -19.252 -27.793 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.229 -19.641 -30.418 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.643 -19.254 -28.130 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.272 -19.449 -29.442 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.937 -19.453 -29.782 1.00 0.00 O ATOM 0 H TYR A 108 -91.111 -16.992 -26.943 1.00 0.00 H new ATOM 0 HA TYR A 108 -91.010 -17.898 -29.733 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.508 -19.655 -27.310 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.918 -20.268 -28.900 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.314 -19.786 -30.837 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.269 -19.101 -26.763 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.934 -19.794 -31.446 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.891 -19.104 -27.369 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.395 -19.303 -28.980 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.271 -19.261 -29.145 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.675 -19.540 -28.944 1.00 0.00 C ATOM 1329 C GLY A 109 -95.490 -19.242 -30.177 1.00 0.00 C ATOM 1330 O GLY A 109 -95.053 -19.509 -31.295 1.00 0.00 O ATOM 0 H GLY A 109 -92.822 -19.820 -29.870 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.801 -20.587 -28.670 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.048 -18.945 -28.110 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.669 -18.688 -29.974 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.554 -18.357 -31.075 1.00 0.00 C ATOM 1336 C GLN A 110 -97.289 -16.933 -31.552 1.00 0.00 C ATOM 1337 O GLN A 110 -97.388 -15.981 -30.772 1.00 0.00 O ATOM 1338 CB GLN A 110 -99.013 -18.509 -30.639 1.00 0.00 C ATOM 1339 CG GLN A 110 -100.010 -18.390 -31.776 1.00 0.00 C ATOM 1340 CD GLN A 110 -101.444 -18.504 -31.299 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -102.083 -17.505 -30.974 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -101.952 -19.725 -31.231 1.00 0.00 N ATOM 0 H GLN A 110 -97.038 -18.456 -29.052 1.00 0.00 H new ATOM 0 HA GLN A 110 -97.362 -19.042 -31.901 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -99.139 -19.479 -30.158 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.239 -17.750 -29.890 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -99.872 -17.433 -32.279 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -99.812 -19.168 -32.513 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -101.389 -20.528 -31.510 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -102.907 -19.862 -30.899 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.933 -16.801 -32.826 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.663 -15.501 -33.432 1.00 0.00 C ATOM 1353 C LEU A 111 -97.816 -14.529 -33.195 1.00 0.00 C ATOM 1354 O LEU A 111 -98.959 -14.797 -33.563 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.417 -15.656 -34.936 1.00 0.00 C ATOM 1356 CG LEU A 111 -96.170 -14.351 -35.690 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.935 -13.648 -35.149 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -96.031 -14.622 -37.179 1.00 0.00 C ATOM 0 H LEU A 111 -96.824 -17.588 -33.465 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.769 -15.094 -32.960 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.558 -16.310 -35.082 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -97.278 -16.156 -35.380 1.00 0.00 H new ATOM 0 HG LEU A 111 -97.026 -13.693 -35.540 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.775 -12.720 -35.698 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -95.078 -13.424 -34.092 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -94.066 -14.295 -35.269 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.855 -13.684 -37.705 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -95.192 -15.296 -37.349 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.946 -15.081 -37.552 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.505 -13.398 -32.577 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.524 -12.426 -32.261 1.00 0.00 C ATOM 1372 C GLY A 112 -98.733 -12.309 -30.772 1.00 0.00 C ATOM 1373 O GLY A 112 -99.028 -11.229 -30.262 1.00 0.00 O ATOM 0 H GLY A 112 -96.561 -13.139 -32.289 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.241 -11.455 -32.667 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.461 -12.711 -32.740 1.00 0.00 H new ATOM 1377 N SER A 113 -98.548 -13.414 -30.063 1.00 0.00 N ATOM 1378 CA SER A 113 -98.753 -13.437 -28.626 1.00 0.00 C ATOM 1379 C SER A 113 -97.479 -13.020 -27.894 1.00 0.00 C ATOM 1380 O SER A 113 -96.612 -13.841 -27.600 1.00 0.00 O ATOM 1381 CB SER A 113 -99.210 -14.826 -28.178 1.00 0.00 C ATOM 1382 OG SER A 113 -100.393 -15.214 -28.861 1.00 0.00 O ATOM 0 H SER A 113 -98.256 -14.306 -30.462 1.00 0.00 H new ATOM 0 HA SER A 113 -99.535 -12.721 -28.374 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.420 -15.552 -28.369 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.389 -14.825 -27.103 1.00 0.00 H new ATOM 0 HG SER A 113 -100.667 -16.106 -28.561 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.383 -11.732 -27.606 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.216 -11.159 -26.939 1.00 0.00 C ATOM 1390 C PHE A 114 -96.378 -11.233 -25.427 1.00 0.00 C ATOM 1391 O PHE A 114 -95.955 -10.345 -24.696 1.00 0.00 O ATOM 1392 CB PHE A 114 -96.035 -9.702 -27.377 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.403 -9.551 -28.733 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -95.745 -10.396 -29.776 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.453 -8.570 -28.954 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.145 -10.268 -31.011 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.854 -8.435 -30.189 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.198 -9.286 -31.217 1.00 0.00 C ATOM 0 H PHE A 114 -98.110 -11.051 -27.826 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.332 -11.732 -27.221 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -97.008 -9.210 -27.383 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.421 -9.184 -26.640 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.489 -11.163 -29.620 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.177 -7.903 -28.151 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -95.416 -10.935 -31.816 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.116 -7.663 -30.350 1.00 0.00 H new ATOM 0 HZ PHE A 114 -93.727 -9.184 -32.183 1.00 0.00 H new ATOM 1408 N SER A 115 -96.979 -12.313 -24.965 1.00 0.00 N ATOM 1409 CA SER A 115 -97.286 -12.469 -23.557 1.00 0.00 C ATOM 1410 C SER A 115 -96.135 -13.152 -22.807 1.00 0.00 C ATOM 1411 O SER A 115 -96.042 -13.069 -21.581 1.00 0.00 O ATOM 1412 CB SER A 115 -98.570 -13.282 -23.414 1.00 0.00 C ATOM 1413 OG SER A 115 -99.585 -12.755 -24.259 1.00 0.00 O ATOM 0 H SER A 115 -97.265 -13.099 -25.548 1.00 0.00 H new ATOM 0 HA SER A 115 -97.423 -11.482 -23.116 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.379 -14.324 -23.670 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.906 -13.265 -22.377 1.00 0.00 H new ATOM 0 HG SER A 115 -100.402 -13.286 -24.159 1.00 0.00 H new ATOM 1419 N ASN A 116 -95.248 -13.813 -23.547 1.00 0.00 N ATOM 1420 CA ASN A 116 -94.168 -14.588 -22.936 1.00 0.00 C ATOM 1421 C ASN A 116 -92.916 -14.566 -23.816 1.00 0.00 C ATOM 1422 O ASN A 116 -93.014 -14.539 -25.043 1.00 0.00 O ATOM 1423 CB ASN A 116 -94.629 -16.037 -22.707 1.00 0.00 C ATOM 1424 CG ASN A 116 -93.575 -16.902 -22.032 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -92.767 -16.419 -21.237 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -93.580 -18.190 -22.342 1.00 0.00 N ATOM 0 H ASN A 116 -95.254 -13.828 -24.567 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.918 -14.135 -21.977 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -95.531 -16.032 -22.096 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.896 -16.482 -23.665 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -92.899 -18.819 -21.918 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -94.265 -18.552 -23.005 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.747 -14.573 -23.182 1.00 0.00 N ATOM 1434 CA CYS A 117 -90.476 -14.573 -23.903 1.00 0.00 C ATOM 1435 C CYS A 117 -89.444 -15.456 -23.202 1.00 0.00 C ATOM 1436 O CYS A 117 -89.758 -16.176 -22.251 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.913 -13.154 -24.012 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.812 -12.028 -25.110 1.00 0.00 S ATOM 0 H CYS A 117 -91.653 -14.579 -22.166 1.00 0.00 H new ATOM 0 HA CYS A 117 -90.672 -14.968 -24.900 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.889 -12.716 -23.014 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.881 -13.219 -24.356 1.00 0.00 H new ATOM 1443 N SER A 118 -88.213 -15.396 -23.698 1.00 0.00 N ATOM 1444 CA SER A 118 -87.080 -16.090 -23.105 1.00 0.00 C ATOM 1445 C SER A 118 -85.821 -15.282 -23.399 1.00 0.00 C ATOM 1446 O SER A 118 -85.854 -14.400 -24.248 1.00 0.00 O ATOM 1447 CB SER A 118 -86.966 -17.508 -23.673 1.00 0.00 C ATOM 1448 OG SER A 118 -88.159 -18.238 -23.443 1.00 0.00 O ATOM 0 H SER A 118 -87.973 -14.859 -24.531 1.00 0.00 H new ATOM 0 HA SER A 118 -87.215 -16.180 -22.027 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.763 -17.461 -24.743 1.00 0.00 H new ATOM 0 HB3 SER A 118 -86.124 -18.023 -23.211 1.00 0.00 H new ATOM 0 HG SER A 118 -88.067 -19.140 -23.814 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.722 -15.557 -22.710 1.00 0.00 N ATOM 1455 CA HIS A 119 -83.511 -14.758 -22.887 1.00 0.00 C ATOM 1456 C HIS A 119 -82.686 -15.249 -24.066 1.00 0.00 C ATOM 1457 O HIS A 119 -82.712 -16.431 -24.402 1.00 0.00 O ATOM 1458 CB HIS A 119 -82.662 -14.748 -21.612 1.00 0.00 C ATOM 1459 CG HIS A 119 -83.225 -13.883 -20.528 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -82.769 -12.607 -20.268 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -84.218 -14.113 -19.636 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -83.458 -12.090 -19.268 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -84.343 -12.982 -18.870 1.00 0.00 N ATOM 0 H HIS A 119 -84.641 -16.315 -22.032 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.828 -13.737 -23.098 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -82.567 -15.768 -21.240 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -81.657 -14.403 -21.856 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -84.802 -15.017 -19.545 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -83.320 -11.105 -18.848 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -85.014 -12.852 -18.113 1.00 0.00 H new ATOM 1472 N SER A 120 -81.965 -14.329 -24.697 1.00 0.00 N ATOM 1473 CA SER A 120 -81.131 -14.667 -25.838 1.00 0.00 C ATOM 1474 C SER A 120 -79.891 -15.425 -25.372 1.00 0.00 C ATOM 1475 O SER A 120 -78.913 -14.823 -24.928 1.00 0.00 O ATOM 1476 CB SER A 120 -80.726 -13.402 -26.611 1.00 0.00 C ATOM 1477 OG SER A 120 -80.159 -13.729 -27.869 1.00 0.00 O ATOM 0 H SER A 120 -81.943 -13.343 -24.435 1.00 0.00 H new ATOM 0 HA SER A 120 -81.705 -15.306 -26.509 1.00 0.00 H new ATOM 0 HB2 SER A 120 -81.600 -12.767 -26.757 1.00 0.00 H new ATOM 0 HB3 SER A 120 -80.009 -12.828 -26.024 1.00 0.00 H new ATOM 0 HG SER A 120 -79.272 -14.123 -27.735 1.00 0.00 H new ATOM 1483 N ARG A 121 -79.956 -16.750 -25.444 1.00 0.00 N ATOM 1484 CA ARG A 121 -78.829 -17.592 -25.066 1.00 0.00 C ATOM 1485 C ARG A 121 -77.874 -17.751 -26.237 1.00 0.00 C ATOM 1486 O ARG A 121 -76.799 -18.335 -26.110 1.00 0.00 O ATOM 1487 CB ARG A 121 -79.308 -18.964 -24.583 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.100 -18.910 -23.285 1.00 0.00 C ATOM 1489 CD ARG A 121 -79.311 -18.211 -22.188 1.00 0.00 C ATOM 1490 NE ARG A 121 -78.010 -18.841 -21.960 1.00 0.00 N ATOM 1491 CZ ARG A 121 -76.943 -18.206 -21.480 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -77.016 -16.919 -21.151 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -75.800 -18.864 -21.325 1.00 0.00 N ATOM 0 H ARG A 121 -80.778 -17.264 -25.761 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.303 -17.106 -24.244 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -79.927 -19.417 -25.358 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -78.444 -19.613 -24.445 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -81.040 -18.385 -23.451 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -80.352 -19.922 -22.967 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -79.165 -17.165 -22.457 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -79.887 -18.224 -21.263 1.00 0.00 H new ATOM 0 HE ARG A 121 -77.914 -19.832 -22.184 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -77.894 -16.412 -21.266 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -76.194 -16.439 -20.784 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -75.742 -19.852 -21.573 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -74.980 -18.382 -20.958 1.00 0.00 H new ATOM 1507 N ASN A 122 -78.284 -17.225 -27.378 1.00 0.00 N ATOM 1508 CA ASN A 122 -77.448 -17.220 -28.566 1.00 0.00 C ATOM 1509 C ASN A 122 -76.998 -15.800 -28.860 1.00 0.00 C ATOM 1510 O ASN A 122 -77.689 -14.845 -28.501 1.00 0.00 O ATOM 1511 CB ASN A 122 -78.203 -17.793 -29.767 1.00 0.00 C ATOM 1512 CG ASN A 122 -78.400 -19.293 -29.669 1.00 0.00 C ATOM 1513 OD1 ASN A 122 -77.555 -20.068 -30.111 1.00 0.00 O ATOM 1514 ND2 ASN A 122 -79.522 -19.715 -29.105 1.00 0.00 N ATOM 0 H ASN A 122 -79.199 -16.792 -27.507 1.00 0.00 H new ATOM 0 HA ASN A 122 -76.576 -17.849 -28.385 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -79.175 -17.307 -29.846 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -77.655 -17.561 -30.680 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -79.708 -20.715 -29.026 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -80.199 -19.040 -28.750 1.00 0.00 H new ATOM 1521 N ASP A 123 -75.848 -15.665 -29.504 1.00 0.00 N ATOM 1522 CA ASP A 123 -75.305 -14.352 -29.823 1.00 0.00 C ATOM 1523 C ASP A 123 -76.157 -13.674 -30.889 1.00 0.00 C ATOM 1524 O ASP A 123 -76.336 -12.453 -30.885 1.00 0.00 O ATOM 1525 CB ASP A 123 -73.855 -14.471 -30.295 1.00 0.00 C ATOM 1526 CG ASP A 123 -73.239 -13.123 -30.606 1.00 0.00 C ATOM 1527 OD1 ASP A 123 -72.779 -12.441 -29.667 1.00 0.00 O ATOM 1528 OD2 ASP A 123 -73.213 -12.737 -31.794 1.00 0.00 O ATOM 0 H ASP A 123 -75.273 -16.448 -29.816 1.00 0.00 H new ATOM 0 HA ASP A 123 -75.323 -13.741 -28.921 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -73.265 -14.969 -29.526 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -73.815 -15.100 -31.184 1.00 0.00 H new ATOM 1533 N MET A 124 -76.685 -14.481 -31.797 1.00 0.00 N ATOM 1534 CA MET A 124 -77.593 -13.996 -32.822 1.00 0.00 C ATOM 1535 C MET A 124 -78.535 -15.114 -33.254 1.00 0.00 C ATOM 1536 O MET A 124 -78.098 -16.221 -33.568 1.00 0.00 O ATOM 1537 CB MET A 124 -76.810 -13.454 -34.029 1.00 0.00 C ATOM 1538 CG MET A 124 -75.919 -14.485 -34.705 1.00 0.00 C ATOM 1539 SD MET A 124 -74.925 -13.791 -36.043 1.00 0.00 S ATOM 1540 CE MET A 124 -76.200 -13.201 -37.155 1.00 0.00 C ATOM 0 H MET A 124 -76.497 -15.483 -31.843 1.00 0.00 H new ATOM 0 HA MET A 124 -78.183 -13.179 -32.407 1.00 0.00 H new ATOM 0 HB2 MET A 124 -77.517 -13.064 -34.762 1.00 0.00 H new ATOM 0 HB3 MET A 124 -76.194 -12.616 -33.702 1.00 0.00 H new ATOM 0 HG2 MET A 124 -75.257 -14.929 -33.961 1.00 0.00 H new ATOM 0 HG3 MET A 124 -76.539 -15.289 -35.100 1.00 0.00 H new ATOM 0 HE1 MET A 124 -75.770 -13.027 -38.141 1.00 0.00 H new ATOM 0 HE2 MET A 124 -76.991 -13.947 -37.230 1.00 0.00 H new ATOM 0 HE3 MET A 124 -76.616 -12.270 -36.771 1.00 0.00 H new ATOM 1550 N CYS A 125 -79.831 -14.836 -33.253 1.00 0.00 N ATOM 1551 CA CYS A 125 -80.801 -15.827 -33.691 1.00 0.00 C ATOM 1552 C CYS A 125 -80.772 -15.887 -35.216 1.00 0.00 C ATOM 1553 O CYS A 125 -81.011 -16.930 -35.814 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.211 -15.497 -33.167 1.00 0.00 C ATOM 1555 SG CYS A 125 -83.234 -14.466 -34.259 1.00 0.00 S ATOM 0 H CYS A 125 -80.230 -13.945 -32.958 1.00 0.00 H new ATOM 0 HA CYS A 125 -80.539 -16.803 -33.283 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.738 -16.433 -32.982 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -82.113 -14.991 -32.207 1.00 0.00 H new ATOM 1560 N HIS A 126 -80.432 -14.731 -35.799 1.00 0.00 N ATOM 1561 CA HIS A 126 -80.252 -14.500 -37.243 1.00 0.00 C ATOM 1562 C HIS A 126 -80.433 -13.020 -37.488 1.00 0.00 C ATOM 1563 O HIS A 126 -79.858 -12.450 -38.415 1.00 0.00 O ATOM 1564 CB HIS A 126 -81.243 -15.249 -38.145 1.00 0.00 C ATOM 1565 CG HIS A 126 -80.765 -16.583 -38.627 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -81.603 -17.660 -38.815 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -79.529 -17.005 -38.976 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -80.902 -18.686 -39.259 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -79.640 -18.315 -39.368 1.00 0.00 N ATOM 0 H HIS A 126 -80.266 -13.887 -35.251 1.00 0.00 H new ATOM 0 HA HIS A 126 -79.261 -14.874 -37.500 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -82.176 -15.388 -37.599 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -81.469 -14.625 -39.010 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -78.622 -16.419 -38.951 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -81.295 -19.664 -39.494 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -78.873 -18.905 -39.691 1.00 0.00 H new ATOM 1578 N SER A 127 -81.255 -12.420 -36.628 1.00 0.00 N ATOM 1579 CA SER A 127 -81.567 -11.000 -36.684 1.00 0.00 C ATOM 1580 C SER A 127 -82.332 -10.670 -37.960 1.00 0.00 C ATOM 1581 O SER A 127 -82.064 -9.654 -38.598 1.00 0.00 O ATOM 1582 CB SER A 127 -80.292 -10.151 -36.590 1.00 0.00 C ATOM 1583 OG SER A 127 -79.380 -10.690 -35.639 1.00 0.00 O ATOM 0 H SER A 127 -81.725 -12.913 -35.869 1.00 0.00 H new ATOM 0 HA SER A 127 -82.198 -10.761 -35.828 1.00 0.00 H new ATOM 0 HB2 SER A 127 -79.813 -10.101 -37.568 1.00 0.00 H new ATOM 0 HB3 SER A 127 -80.552 -9.130 -36.309 1.00 0.00 H new ATOM 0 HG SER A 127 -78.491 -10.766 -36.045 1.00 0.00 H new ATOM 1589 N LEU A 128 -83.280 -11.536 -38.332 1.00 0.00 N ATOM 1590 CA LEU A 128 -84.177 -11.248 -39.447 1.00 0.00 C ATOM 1591 C LEU A 128 -84.888 -9.936 -39.165 1.00 0.00 C ATOM 1592 O LEU A 128 -85.834 -9.887 -38.386 1.00 0.00 O ATOM 1593 CB LEU A 128 -85.192 -12.375 -39.637 1.00 0.00 C ATOM 1594 CG LEU A 128 -86.144 -12.208 -40.822 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -85.390 -12.286 -42.140 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -87.241 -13.259 -40.771 1.00 0.00 C ATOM 0 H LEU A 128 -83.443 -12.435 -37.879 1.00 0.00 H new ATOM 0 HA LEU A 128 -83.599 -11.169 -40.368 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.650 -13.313 -39.758 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -85.785 -12.465 -38.727 1.00 0.00 H new ATOM 0 HG LEU A 128 -86.603 -11.222 -40.754 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -86.089 -12.164 -42.967 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.642 -11.495 -42.178 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -84.898 -13.255 -42.221 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -87.911 -13.127 -41.621 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -86.795 -14.253 -40.811 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -87.805 -13.152 -39.844 1.00 0.00 H new ATOM 1608 N GLY A 129 -84.430 -8.885 -39.814 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.712 -7.554 -39.355 1.00 0.00 C ATOM 1610 C GLY A 129 -86.034 -7.030 -39.822 1.00 0.00 C ATOM 1611 O GLY A 129 -86.757 -7.689 -40.568 1.00 0.00 O ATOM 0 H GLY A 129 -83.862 -8.934 -40.660 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.689 -7.541 -38.265 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.923 -6.885 -39.698 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.317 -5.815 -39.410 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.595 -5.207 -39.629 1.00 0.00 C ATOM 1617 C LEU A 130 -87.388 -3.744 -39.977 1.00 0.00 C ATOM 1618 O LEU A 130 -86.408 -3.122 -39.561 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.466 -5.364 -38.383 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.149 -6.727 -38.236 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.767 -6.874 -36.856 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.209 -6.902 -39.318 1.00 0.00 C ATOM 0 H LEU A 130 -85.655 -5.222 -38.910 1.00 0.00 H new ATOM 0 HA LEU A 130 -88.109 -5.696 -40.457 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -87.849 -5.187 -37.502 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.233 -4.590 -38.395 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.396 -7.506 -38.354 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.247 -7.849 -36.774 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -88.989 -6.787 -36.098 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.510 -6.091 -36.705 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.688 -7.874 -39.204 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.958 -6.115 -39.225 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.740 -6.842 -40.300 1.00 0.00 H new ATOM 1634 N THR A 131 -88.273 -3.221 -40.784 1.00 0.00 N ATOM 1635 CA THR A 131 -88.185 -1.850 -41.236 1.00 0.00 C ATOM 1636 C THR A 131 -89.571 -1.341 -41.612 1.00 0.00 C ATOM 1637 O THR A 131 -90.107 -1.735 -42.644 1.00 0.00 O ATOM 1638 CB THR A 131 -87.233 -1.807 -42.434 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.878 -1.795 -41.969 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.491 -0.619 -43.348 1.00 0.00 C ATOM 0 H THR A 131 -89.078 -3.731 -41.149 1.00 0.00 H new ATOM 0 HA THR A 131 -87.801 -1.205 -40.446 1.00 0.00 H new ATOM 0 HB THR A 131 -87.414 -2.702 -43.029 1.00 0.00 H new ATOM 0 HG1 THR A 131 -85.834 -2.203 -41.079 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.787 -0.640 -44.180 1.00 0.00 H new ATOM 0 HG22 THR A 131 -88.509 -0.671 -43.733 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.362 0.307 -42.787 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.162 -0.511 -40.739 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.573 -0.112 -40.870 1.00 0.00 C ATOM 1650 C CYS A 132 -91.893 0.329 -42.284 1.00 0.00 C ATOM 1651 O CYS A 132 -91.553 1.434 -42.707 1.00 0.00 O ATOM 1652 CB CYS A 132 -91.940 0.976 -39.864 1.00 0.00 C ATOM 1653 SG CYS A 132 -91.955 0.395 -38.141 1.00 0.00 S ATOM 0 H CYS A 132 -89.685 -0.103 -39.935 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.180 -0.990 -40.648 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.231 1.799 -39.956 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -92.924 1.374 -40.114 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.536 -0.588 -42.992 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.872 -0.458 -44.390 1.00 0.00 C ATOM 1660 C LEU A 133 -91.621 -0.493 -45.269 1.00 0.00 C ATOM 1661 O LEU A 133 -91.299 -1.521 -45.874 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.694 0.811 -44.663 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.946 1.129 -46.140 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.675 -0.013 -46.828 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.731 2.421 -46.276 1.00 0.00 C ATOM 0 H LEU A 133 -92.846 -1.472 -42.588 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.492 -1.316 -44.650 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.657 0.714 -44.161 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.182 1.659 -44.209 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.980 1.254 -46.630 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.841 0.240 -47.875 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -94.073 -0.920 -46.764 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -95.635 -0.179 -46.339 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.902 2.633 -47.331 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.689 2.320 -45.766 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.166 3.239 -45.828 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.910 0.623 -45.314 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.753 0.765 -46.186 1.00 0.00 C ATOM 1679 C GLU A 134 -88.824 1.870 -45.686 1.00 0.00 C ATOM 1680 O GLU A 134 -89.049 2.457 -44.622 1.00 0.00 O ATOM 1681 CB GLU A 134 -90.203 1.067 -47.620 1.00 0.00 C ATOM 1682 CG GLU A 134 -91.045 2.328 -47.749 1.00 0.00 C ATOM 1683 CD GLU A 134 -91.532 2.561 -49.164 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -90.736 3.038 -50.000 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -92.711 2.263 -49.453 1.00 0.00 O ATOM 0 H GLU A 134 -91.116 1.449 -44.753 1.00 0.00 H new ATOM 0 HA GLU A 134 -89.204 -0.176 -46.176 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -89.322 1.164 -48.254 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.775 0.219 -47.997 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -91.903 2.257 -47.080 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -90.458 3.187 -47.425 1.00 0.00 H new TER 1692 GLU A 134