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 79 LYS NZ :NH3+ 158:sc= 0.565 (180deg=0) USER MOD Set 1.2: A 82 GLN : amide:sc= 0.516 K(o=1.1,f=-4.2) USER MOD Set 2.1: A 62 GLN : amide:sc= -4.23! C(o=-4.2!,f=-5.7!) USER MOD Set 2.2: A 63 SER OG : rot -7:sc= 0.0178 USER MOD Set 3.1: A 47 GLN : amide:sc= -0.14 X(o=-0.25,f=-0.44) USER MOD Set 3.2: A 58 MET CE :methyl -166:sc= -0.295 (180deg=-0.578) USER MOD Set 3.3: A 104 SER OG : rot -80:sc= 0.181 USER MOD Set 4.1: A 40 SER OG : rot -38:sc= 0.454 USER MOD Set 4.2: A 42 SER OG : rot 96:sc= 1.32 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 120:sc= 0.00452 USER MOD Single : A 34 GLN : amide:sc= -0.86 K(o=-0.86,f=0) USER MOD Single : A 38 THR OG1 : rot 161:sc= 1.21 USER MOD Single : A 41 ASN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 172:sc= 1.26 (180deg=1.18) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -0.0576 K(o=-0.058,f=-1.1) USER MOD Single : A 61 SER OG : rot 116:sc= 1.23 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -114:sc= 0.717 (180deg=-2.55!) USER MOD Single : A 70 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.014) USER MOD Single : A 75 SER OG : rot -4:sc= 0.314 USER MOD Single : A 76 GLN : amide:sc= -0.0186 X(o=-0.019,f=-0.056) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.762 X(o=-0.76,f=-0.94) USER MOD Single : A 91 SER OG : rot -109:sc= 1.12 USER MOD Single : A 97 LYS NZ :NH3+ -164:sc=-0.00468 (180deg=-0.165) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot -140:sc= -1.62! USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.17) USER MOD Single : A 113 SER OG : rot 180:sc= 0.165 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.042) USER MOD Single : A 118 SER OG : rot 4:sc= 1.1 USER MOD Single : A 119 HIS : no HD1:sc= -0.479 X(o=-0.48,f=0) USER MOD Single : A 120 SER OG : rot -139:sc= -2.29! USER MOD Single : A 122 ASN : amide:sc= -0.275 K(o=-0.28,f=-3.5!) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 95:sc= -2.24! USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.474 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 25 -104.638 -11.051 -25.740 1.00 0.00 N ATOM 2 CA ARG A 25 -103.315 -10.922 -25.082 1.00 0.00 C ATOM 3 C ARG A 25 -102.442 -9.942 -25.855 1.00 0.00 C ATOM 4 O ARG A 25 -102.814 -9.497 -26.944 1.00 0.00 O ATOM 5 CB ARG A 25 -102.600 -12.286 -24.975 1.00 0.00 C ATOM 6 CG ARG A 25 -102.013 -12.795 -26.286 1.00 0.00 C ATOM 7 CD ARG A 25 -103.091 -13.268 -27.249 1.00 0.00 C ATOM 8 NE ARG A 25 -102.578 -13.435 -28.607 1.00 0.00 N ATOM 9 CZ ARG A 25 -103.336 -13.380 -29.702 1.00 0.00 C ATOM 10 NH1 ARG A 25 -104.658 -13.296 -29.605 1.00 0.00 N ATOM 11 NH2 ARG A 25 -102.774 -13.449 -30.900 1.00 0.00 N ATOM 0 HA ARG A 25 -103.480 -10.547 -24.072 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -101.799 -12.206 -24.240 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -103.307 -13.024 -24.597 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -101.431 -12.001 -26.755 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -101.325 -13.615 -26.081 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -103.501 -14.215 -26.897 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -103.910 -12.549 -27.257 1.00 0.00 H new ATOM 0 HE ARG A 25 -101.579 -13.604 -28.724 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -105.102 -13.273 -28.687 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -105.230 -13.254 -30.449 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -101.762 -13.544 -30.984 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -103.353 -13.407 -31.738 1.00 0.00 H new ATOM 25 N LEU A 26 -101.283 -9.619 -25.289 1.00 0.00 N ATOM 26 CA LEU A 26 -100.340 -8.698 -25.913 1.00 0.00 C ATOM 27 C LEU A 26 -99.971 -9.172 -27.314 1.00 0.00 C ATOM 28 O LEU A 26 -99.556 -10.316 -27.508 1.00 0.00 O ATOM 29 CB LEU A 26 -99.067 -8.556 -25.066 1.00 0.00 C ATOM 30 CG LEU A 26 -99.258 -7.983 -23.652 1.00 0.00 C ATOM 31 CD1 LEU A 26 -99.836 -9.026 -22.704 1.00 0.00 C ATOM 32 CD2 LEU A 26 -97.940 -7.452 -23.113 1.00 0.00 C ATOM 0 H LEU A 26 -100.973 -9.986 -24.390 1.00 0.00 H new ATOM 0 HA LEU A 26 -100.826 -7.725 -25.982 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.601 -9.538 -24.979 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.366 -7.917 -25.604 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.970 -7.160 -23.719 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -99.959 -8.589 -21.713 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -100.805 -9.359 -23.076 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -99.159 -9.878 -22.643 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.092 -7.050 -22.111 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.211 -8.261 -23.072 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -97.570 -6.663 -23.768 1.00 0.00 H new ATOM 44 N SER A 27 -100.133 -8.293 -28.286 1.00 0.00 N ATOM 45 CA SER A 27 -99.879 -8.633 -29.671 1.00 0.00 C ATOM 46 C SER A 27 -99.293 -7.440 -30.418 1.00 0.00 C ATOM 47 O SER A 27 -99.636 -6.295 -30.127 1.00 0.00 O ATOM 48 CB SER A 27 -101.182 -9.095 -30.320 1.00 0.00 C ATOM 49 OG SER A 27 -102.255 -8.230 -29.981 1.00 0.00 O ATOM 0 H SER A 27 -100.442 -7.332 -28.138 1.00 0.00 H new ATOM 0 HA SER A 27 -99.150 -9.442 -29.718 1.00 0.00 H new ATOM 0 HB2 SER A 27 -101.062 -9.124 -31.403 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.413 -10.110 -29.997 1.00 0.00 H new ATOM 0 HG SER A 27 -103.078 -8.546 -30.410 1.00 0.00 H new ATOM 55 N TRP A 28 -98.420 -7.707 -31.389 1.00 0.00 N ATOM 56 CA TRP A 28 -97.752 -6.633 -32.127 1.00 0.00 C ATOM 57 C TRP A 28 -98.638 -6.090 -33.251 1.00 0.00 C ATOM 58 O TRP A 28 -98.151 -5.509 -34.220 1.00 0.00 O ATOM 59 CB TRP A 28 -96.391 -7.101 -32.676 1.00 0.00 C ATOM 60 CG TRP A 28 -96.452 -8.181 -33.723 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.479 -9.048 -33.960 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.417 -8.517 -34.663 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.155 -9.893 -34.991 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.896 -9.586 -35.442 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.133 -8.012 -34.927 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.139 -10.161 -36.463 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.384 -8.586 -35.942 1.00 0.00 C ATOM 68 CH2 TRP A 28 -93.891 -9.649 -36.698 1.00 0.00 C ATOM 0 H TRP A 28 -98.160 -8.649 -31.682 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.571 -5.818 -31.426 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -95.873 -6.239 -33.097 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -95.787 -7.460 -31.843 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.411 -9.066 -33.415 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.754 -10.631 -35.362 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -93.736 -7.191 -34.349 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.524 -10.983 -37.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.395 -8.207 -36.153 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.285 -10.075 -37.484 1.00 0.00 H new ATOM 79 N TYR A 29 -99.942 -6.272 -33.105 1.00 0.00 N ATOM 80 CA TYR A 29 -100.900 -5.687 -34.028 1.00 0.00 C ATOM 81 C TYR A 29 -102.005 -4.968 -33.259 1.00 0.00 C ATOM 82 O TYR A 29 -103.051 -4.635 -33.814 1.00 0.00 O ATOM 83 CB TYR A 29 -101.481 -6.744 -34.983 1.00 0.00 C ATOM 84 CG TYR A 29 -102.125 -7.940 -34.308 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.455 -7.907 -33.906 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.406 -9.110 -34.097 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.049 -9.004 -33.314 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.993 -10.210 -33.501 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.313 -10.152 -33.113 1.00 0.00 C ATOM 90 OH TYR A 29 -103.904 -11.247 -32.528 1.00 0.00 O ATOM 0 H TYR A 29 -100.360 -6.821 -32.354 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.376 -4.954 -34.642 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.223 -6.265 -35.622 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -100.683 -7.101 -35.634 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.034 -7.008 -34.059 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.372 -9.161 -34.404 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.085 -8.963 -33.010 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.419 -11.111 -33.340 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.868 -12.007 -33.145 1.00 0.00 H new ATOM 100 N ASP A 30 -101.756 -4.715 -31.978 1.00 0.00 N ATOM 101 CA ASP A 30 -102.685 -3.940 -31.159 1.00 0.00 C ATOM 102 C ASP A 30 -102.376 -2.453 -31.312 1.00 0.00 C ATOM 103 O ASP A 30 -101.228 -2.039 -31.155 1.00 0.00 O ATOM 104 CB ASP A 30 -102.592 -4.351 -29.685 1.00 0.00 C ATOM 105 CG ASP A 30 -103.566 -3.583 -28.803 1.00 0.00 C ATOM 106 OD1 ASP A 30 -103.240 -2.452 -28.384 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.662 -4.112 -28.513 1.00 0.00 O ATOM 0 H ASP A 30 -100.922 -5.034 -31.485 1.00 0.00 H new ATOM 0 HA ASP A 30 -103.701 -4.139 -31.499 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.791 -5.419 -29.596 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -101.575 -4.185 -29.328 1.00 0.00 H new ATOM 112 N PRO A 31 -103.395 -1.634 -31.620 1.00 0.00 N ATOM 113 CA PRO A 31 -103.221 -0.200 -31.911 1.00 0.00 C ATOM 114 C PRO A 31 -102.619 0.609 -30.758 1.00 0.00 C ATOM 115 O PRO A 31 -102.201 1.752 -30.951 1.00 0.00 O ATOM 116 CB PRO A 31 -104.647 0.288 -32.198 1.00 0.00 C ATOM 117 CG PRO A 31 -105.409 -0.941 -32.551 1.00 0.00 C ATOM 118 CD PRO A 31 -104.803 -2.043 -31.734 1.00 0.00 C ATOM 0 HA PRO A 31 -102.517 -0.063 -32.732 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.078 0.783 -31.328 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -104.661 1.010 -33.015 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.469 -0.823 -32.325 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.333 -1.156 -33.617 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.279 -2.130 -30.757 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -104.904 -3.011 -32.224 1.00 0.00 H new ATOM 126 N ASP A 32 -102.580 0.036 -29.564 1.00 0.00 N ATOM 127 CA ASP A 32 -102.048 0.757 -28.413 1.00 0.00 C ATOM 128 C ASP A 32 -100.821 0.061 -27.832 1.00 0.00 C ATOM 129 O ASP A 32 -100.069 0.660 -27.062 1.00 0.00 O ATOM 130 CB ASP A 32 -103.119 0.920 -27.333 1.00 0.00 C ATOM 131 CG ASP A 32 -102.658 1.821 -26.206 1.00 0.00 C ATOM 132 OD1 ASP A 32 -102.406 3.019 -26.464 1.00 0.00 O ATOM 133 OD2 ASP A 32 -102.555 1.343 -25.057 1.00 0.00 O ATOM 0 H ASP A 32 -102.904 -0.911 -29.366 1.00 0.00 H new ATOM 0 HA ASP A 32 -101.743 1.744 -28.761 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.024 1.332 -27.779 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.380 -0.059 -26.931 1.00 0.00 H new ATOM 138 N PHE A 33 -100.611 -1.193 -28.214 1.00 0.00 N ATOM 139 CA PHE A 33 -99.495 -1.977 -27.692 1.00 0.00 C ATOM 140 C PHE A 33 -98.170 -1.277 -27.973 1.00 0.00 C ATOM 141 O PHE A 33 -97.924 -0.823 -29.092 1.00 0.00 O ATOM 142 CB PHE A 33 -99.488 -3.382 -28.305 1.00 0.00 C ATOM 143 CG PHE A 33 -98.352 -4.249 -27.828 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.340 -4.752 -26.538 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.299 -4.563 -28.675 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.298 -5.547 -26.099 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.256 -5.358 -28.240 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.255 -5.852 -26.951 1.00 0.00 C ATOM 0 H PHE A 33 -101.198 -1.690 -28.884 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.620 -2.068 -26.613 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.432 -3.875 -28.071 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.435 -3.294 -29.390 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.154 -4.521 -25.867 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.295 -4.182 -29.685 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -97.300 -5.930 -25.089 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.441 -5.593 -28.909 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.441 -6.475 -26.610 1.00 0.00 H new ATOM 158 N GLN A 34 -97.326 -1.174 -26.953 1.00 0.00 N ATOM 159 CA GLN A 34 -96.048 -0.506 -27.111 1.00 0.00 C ATOM 160 C GLN A 34 -95.069 -1.418 -27.825 1.00 0.00 C ATOM 161 O GLN A 34 -94.638 -2.445 -27.295 1.00 0.00 O ATOM 162 CB GLN A 34 -95.492 -0.080 -25.752 1.00 0.00 C ATOM 163 CG GLN A 34 -96.441 0.818 -24.982 1.00 0.00 C ATOM 164 CD GLN A 34 -95.889 1.263 -23.640 1.00 0.00 C ATOM 165 OE1 GLN A 34 -96.635 1.456 -22.679 1.00 0.00 O ATOM 166 NE2 GLN A 34 -94.582 1.459 -23.569 1.00 0.00 N ATOM 0 H GLN A 34 -97.504 -1.542 -26.018 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.195 0.390 -27.714 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.278 -0.968 -25.158 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.546 0.441 -25.899 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -96.667 1.698 -25.584 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -97.382 0.290 -24.823 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -93.996 1.289 -24.386 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -94.161 1.780 -22.697 1.00 0.00 H new ATOM 175 N ALA A 35 -94.718 -1.011 -29.024 1.00 0.00 N ATOM 176 CA ALA A 35 -93.811 -1.756 -29.876 1.00 0.00 C ATOM 177 C ALA A 35 -93.275 -0.838 -30.957 1.00 0.00 C ATOM 178 O ALA A 35 -94.030 -0.044 -31.523 1.00 0.00 O ATOM 179 CB ALA A 35 -94.520 -2.950 -30.502 1.00 0.00 C ATOM 0 H ALA A 35 -95.056 -0.144 -29.442 1.00 0.00 H new ATOM 0 HA ALA A 35 -92.984 -2.132 -29.274 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.822 -3.495 -31.137 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.886 -3.610 -29.715 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.360 -2.601 -31.102 1.00 0.00 H new ATOM 185 N ARG A 36 -91.980 -0.929 -31.226 1.00 0.00 N ATOM 186 CA ARG A 36 -91.345 -0.071 -32.217 1.00 0.00 C ATOM 187 C ARG A 36 -89.881 -0.442 -32.375 1.00 0.00 C ATOM 188 O ARG A 36 -89.404 -1.385 -31.754 1.00 0.00 O ATOM 189 CB ARG A 36 -91.462 1.401 -31.805 1.00 0.00 C ATOM 190 CG ARG A 36 -90.772 1.725 -30.487 1.00 0.00 C ATOM 191 CD ARG A 36 -91.162 3.103 -29.981 1.00 0.00 C ATOM 192 NE ARG A 36 -92.594 3.190 -29.695 1.00 0.00 N ATOM 193 CZ ARG A 36 -93.193 4.268 -29.190 1.00 0.00 C ATOM 194 NH1 ARG A 36 -92.492 5.363 -28.923 1.00 0.00 N ATOM 195 NH2 ARG A 36 -94.497 4.247 -28.952 1.00 0.00 N ATOM 0 H ARG A 36 -91.348 -1.589 -30.772 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.854 -0.214 -33.170 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -91.035 2.024 -32.591 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.517 1.664 -31.727 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -91.036 0.974 -29.742 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.691 1.677 -30.619 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -90.596 3.333 -29.078 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.893 3.853 -30.725 1.00 0.00 H new ATOM 0 HE ARG A 36 -93.171 2.373 -29.895 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -91.488 5.383 -29.104 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -92.957 6.185 -28.537 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -95.039 3.407 -29.155 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -94.958 5.071 -28.565 1.00 0.00 H new ATOM 209 N LEU A 37 -89.187 0.297 -33.216 1.00 0.00 N ATOM 210 CA LEU A 37 -87.778 0.057 -33.465 1.00 0.00 C ATOM 211 C LEU A 37 -86.931 1.045 -32.682 1.00 0.00 C ATOM 212 O LEU A 37 -87.306 2.210 -32.530 1.00 0.00 O ATOM 213 CB LEU A 37 -87.516 0.195 -34.952 1.00 0.00 C ATOM 214 CG LEU A 37 -88.535 -0.531 -35.822 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.404 -0.094 -37.259 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.352 -2.034 -35.697 1.00 0.00 C ATOM 0 H LEU A 37 -89.579 1.077 -33.744 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.511 -0.948 -33.140 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.514 1.253 -35.215 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.521 -0.190 -35.174 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.538 -0.276 -35.479 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.138 -0.621 -37.868 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.577 0.980 -37.330 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.401 -0.324 -37.619 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.085 -2.543 -36.323 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.347 -2.306 -36.020 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.492 -2.332 -34.658 1.00 0.00 H new ATOM 228 N THR A 38 -85.801 0.582 -32.176 1.00 0.00 N ATOM 229 CA THR A 38 -84.939 1.418 -31.358 1.00 0.00 C ATOM 230 C THR A 38 -83.480 1.267 -31.770 1.00 0.00 C ATOM 231 O THR A 38 -83.176 0.607 -32.769 1.00 0.00 O ATOM 232 CB THR A 38 -85.084 1.065 -29.868 1.00 0.00 C ATOM 233 OG1 THR A 38 -84.792 -0.325 -29.670 1.00 0.00 O ATOM 234 CG2 THR A 38 -86.489 1.378 -29.369 1.00 0.00 C ATOM 0 H THR A 38 -85.459 -0.368 -32.317 1.00 0.00 H new ATOM 0 HA THR A 38 -85.248 2.452 -31.513 1.00 0.00 H new ATOM 0 HB THR A 38 -84.378 1.669 -29.299 1.00 0.00 H new ATOM 0 HG1 THR A 38 -84.582 -0.484 -28.726 1.00 0.00 H new ATOM 0 HG21 THR A 38 -86.566 1.120 -28.313 1.00 0.00 H new ATOM 0 HG22 THR A 38 -86.693 2.441 -29.498 1.00 0.00 H new ATOM 0 HG23 THR A 38 -87.215 0.798 -29.938 1.00 0.00 H new ATOM 242 N ARG A 39 -82.592 1.912 -31.007 1.00 0.00 N ATOM 243 CA ARG A 39 -81.138 1.843 -31.208 1.00 0.00 C ATOM 244 C ARG A 39 -80.704 2.642 -32.435 1.00 0.00 C ATOM 245 O ARG A 39 -79.732 3.397 -32.385 1.00 0.00 O ATOM 246 CB ARG A 39 -80.646 0.393 -31.319 1.00 0.00 C ATOM 247 CG ARG A 39 -80.908 -0.460 -30.085 1.00 0.00 C ATOM 248 CD ARG A 39 -80.314 0.154 -28.827 1.00 0.00 C ATOM 249 NE ARG A 39 -81.301 0.927 -28.068 1.00 0.00 N ATOM 250 CZ ARG A 39 -81.063 2.115 -27.514 1.00 0.00 C ATOM 251 NH1 ARG A 39 -79.881 2.697 -27.658 1.00 0.00 N ATOM 252 NH2 ARG A 39 -82.011 2.719 -26.808 1.00 0.00 N ATOM 0 H ARG A 39 -82.864 2.504 -30.222 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.679 2.290 -30.326 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -81.127 -0.076 -32.178 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.574 0.401 -31.519 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -81.983 -0.586 -29.954 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -80.487 -1.454 -30.236 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -79.910 -0.637 -28.195 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -79.480 0.801 -29.100 1.00 0.00 H new ATOM 0 HE ARG A 39 -82.233 0.528 -27.956 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -79.147 2.235 -28.195 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -79.705 3.607 -27.231 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -82.921 2.274 -26.690 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -81.829 3.629 -26.384 1.00 0.00 H new ATOM 266 N SER A 40 -81.430 2.476 -33.530 1.00 0.00 N ATOM 267 CA SER A 40 -81.148 3.198 -34.761 1.00 0.00 C ATOM 268 C SER A 40 -81.846 4.557 -34.744 1.00 0.00 C ATOM 269 O SER A 40 -81.798 5.298 -35.727 1.00 0.00 O ATOM 270 CB SER A 40 -81.612 2.369 -35.967 1.00 0.00 C ATOM 271 OG SER A 40 -81.235 2.974 -37.197 1.00 0.00 O ATOM 0 H SER A 40 -82.226 1.841 -33.591 1.00 0.00 H new ATOM 0 HA SER A 40 -80.074 3.364 -34.842 1.00 0.00 H new ATOM 0 HB2 SER A 40 -81.184 1.368 -35.907 1.00 0.00 H new ATOM 0 HB3 SER A 40 -82.695 2.254 -35.935 1.00 0.00 H new ATOM 0 HG SER A 40 -81.329 3.947 -37.126 1.00 0.00 H new ATOM 277 N ASN A 41 -82.483 4.869 -33.606 1.00 0.00 N ATOM 278 CA ASN A 41 -83.227 6.124 -33.407 1.00 0.00 C ATOM 279 C ASN A 41 -84.547 6.100 -34.165 1.00 0.00 C ATOM 280 O ASN A 41 -85.603 6.396 -33.604 1.00 0.00 O ATOM 281 CB ASN A 41 -82.406 7.353 -33.828 1.00 0.00 C ATOM 282 CG ASN A 41 -81.119 7.497 -33.042 1.00 0.00 C ATOM 283 OD1 ASN A 41 -81.090 8.120 -31.982 1.00 0.00 O ATOM 284 ND2 ASN A 41 -80.037 6.943 -33.565 1.00 0.00 N ATOM 0 H ASN A 41 -82.497 4.255 -32.792 1.00 0.00 H new ATOM 0 HA ASN A 41 -83.430 6.204 -32.339 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -82.172 7.281 -34.890 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -83.010 8.251 -33.695 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -79.140 7.025 -33.087 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -80.100 6.434 -34.446 1.00 0.00 H new ATOM 291 N SER A 42 -84.470 5.750 -35.438 1.00 0.00 N ATOM 292 CA SER A 42 -85.634 5.629 -36.292 1.00 0.00 C ATOM 293 C SER A 42 -86.601 4.575 -35.779 1.00 0.00 C ATOM 294 O SER A 42 -86.279 3.393 -35.715 1.00 0.00 O ATOM 295 CB SER A 42 -85.170 5.302 -37.711 1.00 0.00 C ATOM 296 OG SER A 42 -83.959 4.563 -37.681 1.00 0.00 O ATOM 0 H SER A 42 -83.590 5.541 -35.909 1.00 0.00 H new ATOM 0 HA SER A 42 -86.175 6.575 -36.290 1.00 0.00 H new ATOM 0 HB2 SER A 42 -85.940 4.729 -38.228 1.00 0.00 H new ATOM 0 HB3 SER A 42 -85.026 6.224 -38.274 1.00 0.00 H new ATOM 0 HG SER A 42 -84.159 3.605 -37.740 1.00 0.00 H new ATOM 302 N LYS A 43 -87.793 5.014 -35.408 1.00 0.00 N ATOM 303 CA LYS A 43 -88.841 4.096 -34.995 1.00 0.00 C ATOM 304 C LYS A 43 -89.431 3.397 -36.213 1.00 0.00 C ATOM 305 O LYS A 43 -90.269 2.507 -36.087 1.00 0.00 O ATOM 306 CB LYS A 43 -89.936 4.829 -34.212 1.00 0.00 C ATOM 307 CG LYS A 43 -90.509 6.041 -34.934 1.00 0.00 C ATOM 308 CD LYS A 43 -91.647 6.664 -34.143 1.00 0.00 C ATOM 309 CE LYS A 43 -92.065 8.011 -34.714 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.478 7.924 -36.142 1.00 0.00 N ATOM 0 H LYS A 43 -88.058 5.999 -35.385 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.403 3.347 -34.336 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.745 4.130 -33.998 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -89.530 5.149 -33.253 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -89.723 6.780 -35.089 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -90.867 5.745 -35.920 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -92.502 5.988 -34.144 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -91.341 6.789 -33.104 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -92.890 8.411 -34.125 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -91.237 8.714 -34.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -92.880 8.835 -36.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -91.650 7.699 -36.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -93.193 7.177 -36.252 1.00 0.00 H new ATOM 324 N CYS A 44 -88.983 3.811 -37.393 1.00 0.00 N ATOM 325 CA CYS A 44 -89.438 3.207 -38.634 1.00 0.00 C ATOM 326 C CYS A 44 -88.300 2.425 -39.298 1.00 0.00 C ATOM 327 O CYS A 44 -88.463 1.893 -40.391 1.00 0.00 O ATOM 328 CB CYS A 44 -89.976 4.285 -39.578 1.00 0.00 C ATOM 329 SG CYS A 44 -90.918 5.594 -38.737 1.00 0.00 S ATOM 0 H CYS A 44 -88.305 4.563 -37.513 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.245 2.509 -38.409 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.140 4.737 -40.112 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.614 3.814 -40.326 1.00 0.00 H new ATOM 334 N GLN A 45 -87.152 2.345 -38.618 1.00 0.00 N ATOM 335 CA GLN A 45 -86.036 1.511 -39.071 1.00 0.00 C ATOM 336 C GLN A 45 -85.109 1.186 -37.895 1.00 0.00 C ATOM 337 O GLN A 45 -84.593 2.087 -37.243 1.00 0.00 O ATOM 338 CB GLN A 45 -85.259 2.227 -40.182 1.00 0.00 C ATOM 339 CG GLN A 45 -84.025 1.476 -40.649 1.00 0.00 C ATOM 340 CD GLN A 45 -83.400 2.092 -41.886 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.481 3.300 -42.104 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.779 1.262 -42.708 1.00 0.00 N ATOM 0 H GLN A 45 -86.972 2.849 -37.750 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.432 0.577 -39.470 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.922 2.383 -41.033 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.960 3.213 -39.826 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.289 1.458 -39.845 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.292 0.440 -40.859 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -82.735 0.267 -42.490 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -82.345 1.618 -43.560 1.00 0.00 H new ATOM 351 N GLY A 46 -84.878 -0.096 -37.637 1.00 0.00 N ATOM 352 CA GLY A 46 -84.091 -0.476 -36.476 1.00 0.00 C ATOM 353 C GLY A 46 -84.407 -1.876 -35.994 1.00 0.00 C ATOM 354 O GLY A 46 -85.216 -2.575 -36.594 1.00 0.00 O ATOM 0 H GLY A 46 -85.217 -0.873 -38.204 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.031 -0.411 -36.722 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.275 0.233 -35.669 1.00 0.00 H new ATOM 358 N GLN A 47 -83.739 -2.311 -34.938 1.00 0.00 N ATOM 359 CA GLN A 47 -84.050 -3.594 -34.323 1.00 0.00 C ATOM 360 C GLN A 47 -85.373 -3.468 -33.564 1.00 0.00 C ATOM 361 O GLN A 47 -85.639 -2.428 -32.957 1.00 0.00 O ATOM 362 CB GLN A 47 -82.925 -4.015 -33.372 1.00 0.00 C ATOM 363 CG GLN A 47 -83.009 -5.467 -32.929 1.00 0.00 C ATOM 364 CD GLN A 47 -81.993 -5.812 -31.856 1.00 0.00 C ATOM 365 OE1 GLN A 47 -80.904 -5.243 -31.803 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.346 -6.749 -30.992 1.00 0.00 N ATOM 0 H GLN A 47 -82.980 -1.798 -34.489 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.143 -4.359 -35.094 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -81.966 -3.849 -33.862 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -82.947 -3.374 -32.491 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -84.012 -5.670 -32.553 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -82.855 -6.115 -33.792 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -83.259 -7.197 -31.070 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -81.705 -7.024 -30.247 1.00 0.00 H new ATOM 375 N LEU A 48 -86.206 -4.505 -33.615 1.00 0.00 N ATOM 376 CA LEU A 48 -87.515 -4.454 -32.970 1.00 0.00 C ATOM 377 C LEU A 48 -87.377 -4.494 -31.457 1.00 0.00 C ATOM 378 O LEU A 48 -86.636 -5.306 -30.909 1.00 0.00 O ATOM 379 CB LEU A 48 -88.408 -5.611 -33.427 1.00 0.00 C ATOM 380 CG LEU A 48 -89.818 -5.618 -32.822 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.585 -4.373 -33.236 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.576 -6.867 -33.239 1.00 0.00 C ATOM 0 H LEU A 48 -86.000 -5.383 -34.092 1.00 0.00 H new ATOM 0 HA LEU A 48 -87.980 -3.513 -33.264 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.495 -5.576 -34.513 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -87.916 -6.551 -33.176 1.00 0.00 H new ATOM 0 HG LEU A 48 -89.720 -5.620 -31.736 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.582 -4.397 -32.797 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.056 -3.487 -32.886 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.668 -4.341 -34.322 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.573 -6.851 -32.799 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.659 -6.896 -34.325 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.040 -7.751 -32.892 1.00 0.00 H new ATOM 394 N GLU A 49 -88.091 -3.610 -30.794 1.00 0.00 N ATOM 395 CA GLU A 49 -88.126 -3.575 -29.350 1.00 0.00 C ATOM 396 C GLU A 49 -89.581 -3.548 -28.895 1.00 0.00 C ATOM 397 O GLU A 49 -90.347 -2.654 -29.270 1.00 0.00 O ATOM 398 CB GLU A 49 -87.373 -2.339 -28.845 1.00 0.00 C ATOM 399 CG GLU A 49 -87.093 -2.336 -27.352 1.00 0.00 C ATOM 400 CD GLU A 49 -86.382 -1.071 -26.904 1.00 0.00 C ATOM 401 OE1 GLU A 49 -85.158 -0.957 -27.129 1.00 0.00 O ATOM 402 OE2 GLU A 49 -87.039 -0.175 -26.339 1.00 0.00 O ATOM 0 H GLU A 49 -88.664 -2.895 -31.243 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.640 -4.460 -28.939 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.426 -2.263 -29.379 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.952 -1.450 -29.095 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.032 -2.435 -26.808 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.484 -3.203 -27.097 1.00 0.00 H new ATOM 409 N VAL A 50 -89.968 -4.546 -28.124 1.00 0.00 N ATOM 410 CA VAL A 50 -91.350 -4.680 -27.679 1.00 0.00 C ATOM 411 C VAL A 50 -91.449 -4.655 -26.160 1.00 0.00 C ATOM 412 O VAL A 50 -90.701 -5.344 -25.466 1.00 0.00 O ATOM 413 CB VAL A 50 -91.999 -5.969 -28.229 1.00 0.00 C ATOM 414 CG1 VAL A 50 -92.508 -5.736 -29.642 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.006 -7.125 -28.219 1.00 0.00 C ATOM 0 H VAL A 50 -89.345 -5.281 -27.789 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.895 -3.824 -28.076 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.838 -6.230 -27.584 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -92.964 -6.651 -30.020 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.250 -4.938 -29.634 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.676 -5.452 -30.286 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -91.487 -8.021 -28.611 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.147 -6.872 -28.841 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.672 -7.309 -27.198 1.00 0.00 H new ATOM 425 N TYR A 51 -92.373 -3.856 -25.647 1.00 0.00 N ATOM 426 CA TYR A 51 -92.492 -3.651 -24.213 1.00 0.00 C ATOM 427 C TYR A 51 -93.494 -4.618 -23.607 1.00 0.00 C ATOM 428 O TYR A 51 -94.699 -4.499 -23.830 1.00 0.00 O ATOM 429 CB TYR A 51 -92.913 -2.213 -23.916 1.00 0.00 C ATOM 430 CG TYR A 51 -92.742 -1.818 -22.469 1.00 0.00 C ATOM 431 CD1 TYR A 51 -91.576 -2.130 -21.787 1.00 0.00 C ATOM 432 CD2 TYR A 51 -93.733 -1.123 -21.791 1.00 0.00 C ATOM 433 CE1 TYR A 51 -91.400 -1.761 -20.472 1.00 0.00 C ATOM 434 CE2 TYR A 51 -93.565 -0.752 -20.472 1.00 0.00 C ATOM 435 CZ TYR A 51 -92.396 -1.075 -19.817 1.00 0.00 C ATOM 436 OH TYR A 51 -92.216 -0.703 -18.503 1.00 0.00 O ATOM 0 H TYR A 51 -93.052 -3.338 -26.205 1.00 0.00 H new ATOM 0 HA TYR A 51 -91.517 -3.838 -23.764 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.329 -1.536 -24.540 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -93.958 -2.084 -24.198 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -90.792 -2.672 -22.296 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -94.649 -0.868 -22.303 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -90.484 -2.009 -19.957 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -94.345 -0.212 -19.956 1.00 0.00 H new ATOM 0 HH TYR A 51 -93.011 -0.225 -18.186 1.00 0.00 H new ATOM 446 N LEU A 52 -92.988 -5.578 -22.845 1.00 0.00 N ATOM 447 CA LEU A 52 -93.836 -6.566 -22.198 1.00 0.00 C ATOM 448 C LEU A 52 -93.109 -7.226 -21.052 1.00 0.00 C ATOM 449 O LEU A 52 -91.885 -7.382 -21.096 1.00 0.00 O ATOM 450 CB LEU A 52 -94.289 -7.608 -23.205 1.00 0.00 C ATOM 451 CG LEU A 52 -93.169 -8.384 -23.909 1.00 0.00 C ATOM 452 CD1 LEU A 52 -93.017 -9.775 -23.310 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.431 -8.474 -25.401 1.00 0.00 C ATOM 0 H LEU A 52 -91.991 -5.692 -22.660 1.00 0.00 H new ATOM 0 HA LEU A 52 -94.714 -6.058 -21.799 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.936 -8.322 -22.695 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.896 -7.114 -23.964 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.236 -7.841 -23.757 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -92.217 -10.307 -23.825 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.774 -9.690 -22.251 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.951 -10.325 -23.425 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.624 -9.029 -25.879 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -94.377 -8.988 -25.574 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -93.481 -7.470 -25.823 1.00 0.00 H new ATOM 465 N LYS A 53 -93.869 -7.608 -20.030 1.00 0.00 N ATOM 466 CA LYS A 53 -93.307 -8.136 -18.797 1.00 0.00 C ATOM 467 C LYS A 53 -92.259 -7.166 -18.277 1.00 0.00 C ATOM 468 O LYS A 53 -91.234 -7.570 -17.740 1.00 0.00 O ATOM 469 CB LYS A 53 -92.722 -9.536 -19.015 1.00 0.00 C ATOM 470 CG LYS A 53 -93.752 -10.550 -19.494 1.00 0.00 C ATOM 471 CD LYS A 53 -93.225 -11.975 -19.434 1.00 0.00 C ATOM 472 CE LYS A 53 -92.998 -12.428 -18.000 1.00 0.00 C ATOM 473 NZ LYS A 53 -92.569 -13.848 -17.922 1.00 0.00 N ATOM 0 H LYS A 53 -94.888 -7.560 -20.036 1.00 0.00 H new ATOM 0 HA LYS A 53 -94.095 -8.237 -18.051 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -91.915 -9.476 -19.745 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.282 -9.888 -18.082 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -94.650 -10.470 -18.881 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -94.043 -10.315 -20.518 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -93.933 -12.646 -19.920 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -92.290 -12.041 -19.990 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -92.241 -11.795 -17.536 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -93.917 -12.296 -17.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -92.426 -14.113 -16.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -93.302 -14.456 -18.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -91.678 -13.971 -18.444 1.00 0.00 H new ATOM 487 N ASP A 54 -92.531 -5.882 -18.537 1.00 0.00 N ATOM 488 CA ASP A 54 -91.744 -4.730 -18.045 1.00 0.00 C ATOM 489 C ASP A 54 -90.419 -4.588 -18.790 1.00 0.00 C ATOM 490 O ASP A 54 -89.708 -3.597 -18.628 1.00 0.00 O ATOM 491 CB ASP A 54 -91.530 -4.752 -16.508 1.00 0.00 C ATOM 492 CG ASP A 54 -90.300 -5.518 -16.030 1.00 0.00 C ATOM 493 OD1 ASP A 54 -89.160 -5.046 -16.244 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.469 -6.584 -15.398 1.00 0.00 O ATOM 0 H ASP A 54 -93.326 -5.601 -19.111 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.343 -3.845 -18.260 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.457 -3.724 -16.153 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.413 -5.188 -16.041 1.00 0.00 H new ATOM 499 N GLY A 55 -90.113 -5.555 -19.631 1.00 0.00 N ATOM 500 CA GLY A 55 -88.906 -5.501 -20.418 1.00 0.00 C ATOM 501 C GLY A 55 -89.129 -4.856 -21.763 1.00 0.00 C ATOM 502 O GLY A 55 -89.955 -5.331 -22.548 1.00 0.00 O ATOM 0 H GLY A 55 -90.685 -6.385 -19.784 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -88.144 -4.945 -19.873 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -88.522 -6.511 -20.561 1.00 0.00 H new ATOM 506 N TRP A 56 -88.429 -3.754 -22.020 1.00 0.00 N ATOM 507 CA TRP A 56 -88.329 -3.229 -23.371 1.00 0.00 C ATOM 508 C TRP A 56 -87.448 -4.177 -24.159 1.00 0.00 C ATOM 509 O TRP A 56 -86.243 -3.971 -24.306 1.00 0.00 O ATOM 510 CB TRP A 56 -87.756 -1.808 -23.396 1.00 0.00 C ATOM 511 CG TRP A 56 -88.798 -0.732 -23.525 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.071 0.262 -22.630 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.708 -0.541 -24.621 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.084 1.062 -23.106 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.490 0.587 -24.323 1.00 0.00 C ATOM 516 CE3 TRP A 56 -89.933 -1.213 -25.827 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.479 1.058 -25.184 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.915 -0.745 -26.680 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.677 0.381 -26.357 1.00 0.00 C ATOM 0 H TRP A 56 -87.928 -3.214 -21.314 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.323 -3.162 -23.812 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.186 -1.641 -22.482 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.056 -1.724 -24.227 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -88.565 0.400 -21.686 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.470 1.877 -22.629 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.349 -2.083 -26.087 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.069 1.927 -24.934 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.097 -1.259 -27.613 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.436 0.723 -27.045 1.00 0.00 H new ATOM 530 N HIS A 57 -88.063 -5.248 -24.613 1.00 0.00 N ATOM 531 CA HIS A 57 -87.341 -6.381 -25.139 1.00 0.00 C ATOM 532 C HIS A 57 -86.849 -6.123 -26.554 1.00 0.00 C ATOM 533 O HIS A 57 -87.642 -6.134 -27.497 1.00 0.00 O ATOM 534 CB HIS A 57 -88.239 -7.626 -25.125 1.00 0.00 C ATOM 535 CG HIS A 57 -88.468 -8.194 -23.762 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.690 -8.664 -23.341 1.00 0.00 N ATOM 537 CD2 HIS A 57 -87.618 -8.380 -22.725 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.584 -9.114 -22.107 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.337 -8.954 -21.705 1.00 0.00 N ATOM 0 H HIS A 57 -89.077 -5.355 -24.627 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.471 -6.545 -24.503 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.202 -7.372 -25.568 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -87.790 -8.393 -25.756 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -86.569 -8.124 -22.704 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -90.384 -9.542 -21.522 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -87.969 -9.213 -20.790 1.00 0.00 H new ATOM 548 N MET A 58 -85.553 -5.867 -26.701 1.00 0.00 N ATOM 549 CA MET A 58 -84.952 -5.801 -28.025 1.00 0.00 C ATOM 550 C MET A 58 -84.902 -7.199 -28.610 1.00 0.00 C ATOM 551 O MET A 58 -84.011 -7.981 -28.301 1.00 0.00 O ATOM 552 CB MET A 58 -83.544 -5.205 -27.983 1.00 0.00 C ATOM 553 CG MET A 58 -83.512 -3.713 -27.707 1.00 0.00 C ATOM 554 SD MET A 58 -81.853 -3.014 -27.848 1.00 0.00 S ATOM 555 CE MET A 58 -81.007 -3.868 -26.524 1.00 0.00 C ATOM 0 H MET A 58 -84.907 -5.704 -25.929 1.00 0.00 H new ATOM 0 HA MET A 58 -85.563 -5.148 -28.648 1.00 0.00 H new ATOM 0 HB2 MET A 58 -82.966 -5.718 -27.214 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.050 -5.398 -28.935 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.177 -3.204 -28.405 1.00 0.00 H new ATOM 0 HG3 MET A 58 -83.897 -3.525 -26.705 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.057 -3.374 -26.321 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.625 -3.850 -25.626 1.00 0.00 H new ATOM 0 HE3 MET A 58 -80.823 -4.902 -26.817 1.00 0.00 H new ATOM 565 N VAL A 59 -85.859 -7.505 -29.452 1.00 0.00 N ATOM 566 CA VAL A 59 -86.033 -8.851 -29.949 1.00 0.00 C ATOM 567 C VAL A 59 -85.417 -8.991 -31.336 1.00 0.00 C ATOM 568 O VAL A 59 -85.114 -7.991 -31.988 1.00 0.00 O ATOM 569 CB VAL A 59 -87.531 -9.223 -29.978 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.270 -8.450 -31.055 1.00 0.00 C ATOM 571 CG2 VAL A 59 -87.711 -10.712 -30.157 1.00 0.00 C ATOM 0 H VAL A 59 -86.537 -6.833 -29.811 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.521 -9.539 -29.277 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.963 -8.943 -29.017 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.322 -8.734 -31.050 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.182 -7.381 -30.861 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -87.837 -8.679 -32.029 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -88.774 -10.950 -30.174 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -87.254 -11.023 -31.096 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.235 -11.238 -29.330 1.00 0.00 H new ATOM 581 N CYS A 60 -85.205 -10.223 -31.779 1.00 0.00 N ATOM 582 CA CYS A 60 -84.621 -10.451 -33.084 1.00 0.00 C ATOM 583 C CYS A 60 -85.654 -10.876 -34.129 1.00 0.00 C ATOM 584 O CYS A 60 -85.318 -11.576 -35.085 1.00 0.00 O ATOM 585 CB CYS A 60 -83.468 -11.448 -33.007 1.00 0.00 C ATOM 586 SG CYS A 60 -83.592 -12.769 -31.800 1.00 0.00 S ATOM 0 H CYS A 60 -85.428 -11.070 -31.256 1.00 0.00 H new ATOM 0 HA CYS A 60 -84.221 -9.493 -33.417 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.350 -11.902 -33.991 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.554 -10.890 -32.802 1.00 0.00 H new ATOM 591 N SER A 61 -86.899 -10.428 -33.940 1.00 0.00 N ATOM 592 CA SER A 61 -87.949 -10.501 -34.971 1.00 0.00 C ATOM 593 C SER A 61 -88.461 -11.931 -35.228 1.00 0.00 C ATOM 594 O SER A 61 -89.653 -12.197 -35.096 1.00 0.00 O ATOM 595 CB SER A 61 -87.441 -9.880 -36.276 1.00 0.00 C ATOM 596 OG SER A 61 -86.936 -8.573 -36.051 1.00 0.00 O ATOM 0 H SER A 61 -87.212 -10.003 -33.067 1.00 0.00 H new ATOM 0 HA SER A 61 -88.799 -9.936 -34.590 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.659 -10.508 -36.702 1.00 0.00 H new ATOM 0 HB3 SER A 61 -88.251 -9.841 -37.004 1.00 0.00 H new ATOM 0 HG SER A 61 -85.977 -8.554 -36.251 1.00 0.00 H new ATOM 602 N GLN A 62 -87.557 -12.846 -35.578 1.00 0.00 N ATOM 603 CA GLN A 62 -87.923 -14.210 -35.985 1.00 0.00 C ATOM 604 C GLN A 62 -88.389 -15.069 -34.818 1.00 0.00 C ATOM 605 O GLN A 62 -88.638 -16.267 -34.975 1.00 0.00 O ATOM 606 CB GLN A 62 -86.734 -14.881 -36.679 1.00 0.00 C ATOM 607 CG GLN A 62 -85.413 -14.775 -35.922 1.00 0.00 C ATOM 608 CD GLN A 62 -85.338 -15.642 -34.678 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.700 -15.211 -33.583 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.844 -16.859 -34.836 1.00 0.00 N ATOM 0 H GLN A 62 -86.553 -12.667 -35.589 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.763 -14.123 -36.674 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.967 -15.935 -36.831 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.608 -14.436 -37.666 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.599 -15.051 -36.593 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -85.253 -13.735 -35.637 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.556 -17.176 -35.762 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -84.751 -17.480 -34.032 1.00 0.00 H new ATOM 619 N SER A 63 -88.503 -14.455 -33.662 1.00 0.00 N ATOM 620 CA SER A 63 -88.873 -15.155 -32.453 1.00 0.00 C ATOM 621 C SER A 63 -90.335 -15.609 -32.504 1.00 0.00 C ATOM 622 O SER A 63 -91.023 -15.393 -33.504 1.00 0.00 O ATOM 623 CB SER A 63 -88.633 -14.227 -31.273 1.00 0.00 C ATOM 624 OG SER A 63 -87.301 -13.742 -31.282 1.00 0.00 O ATOM 0 H SER A 63 -88.342 -13.456 -33.534 1.00 0.00 H new ATOM 0 HA SER A 63 -88.265 -16.053 -32.348 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.331 -13.390 -31.314 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.826 -14.758 -30.341 1.00 0.00 H new ATOM 0 HG SER A 63 -86.790 -14.203 -31.980 1.00 0.00 H new ATOM 630 N TRP A 64 -90.795 -16.239 -31.423 1.00 0.00 N ATOM 631 CA TRP A 64 -92.167 -16.735 -31.313 1.00 0.00 C ATOM 632 C TRP A 64 -92.427 -17.897 -32.266 1.00 0.00 C ATOM 633 O TRP A 64 -92.297 -19.060 -31.886 1.00 0.00 O ATOM 634 CB TRP A 64 -93.192 -15.616 -31.553 1.00 0.00 C ATOM 635 CG TRP A 64 -93.236 -14.602 -30.456 1.00 0.00 C ATOM 636 CD1 TRP A 64 -93.976 -14.677 -29.315 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.514 -13.365 -30.388 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.761 -13.567 -28.539 1.00 0.00 N ATOM 639 CE2 TRP A 64 -92.867 -12.746 -29.176 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.602 -12.719 -31.232 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.341 -11.518 -28.786 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.079 -11.500 -30.841 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.448 -10.910 -29.626 1.00 0.00 C ATOM 0 H TRP A 64 -90.225 -16.420 -30.597 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.286 -17.099 -30.293 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.957 -15.114 -32.492 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.181 -16.059 -31.667 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.636 -15.492 -29.059 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.196 -13.382 -27.635 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.312 -13.165 -32.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.628 -11.060 -27.851 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.374 -10.994 -31.484 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.020 -9.958 -29.347 1.00 0.00 H new ATOM 654 N GLY A 65 -92.747 -17.574 -33.513 1.00 0.00 N ATOM 655 CA GLY A 65 -93.160 -18.585 -34.465 1.00 0.00 C ATOM 656 C GLY A 65 -92.000 -19.204 -35.216 1.00 0.00 C ATOM 657 O GLY A 65 -92.214 -20.024 -36.110 1.00 0.00 O ATOM 0 H GLY A 65 -92.727 -16.624 -33.883 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -93.705 -19.369 -33.939 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -93.852 -18.141 -35.180 1.00 0.00 H new ATOM 661 N ARG A 66 -90.774 -18.789 -34.872 1.00 0.00 N ATOM 662 CA ARG A 66 -89.560 -19.359 -35.467 1.00 0.00 C ATOM 663 C ARG A 66 -89.526 -19.090 -36.967 1.00 0.00 C ATOM 664 O ARG A 66 -88.896 -19.825 -37.727 1.00 0.00 O ATOM 665 CB ARG A 66 -89.487 -20.871 -35.209 1.00 0.00 C ATOM 666 CG ARG A 66 -89.425 -21.247 -33.737 1.00 0.00 C ATOM 667 CD ARG A 66 -88.171 -20.703 -33.080 1.00 0.00 C ATOM 668 NE ARG A 66 -86.959 -21.185 -33.734 1.00 0.00 N ATOM 669 CZ ARG A 66 -85.774 -20.590 -33.631 1.00 0.00 C ATOM 670 NH1 ARG A 66 -85.636 -19.502 -32.883 1.00 0.00 N ATOM 671 NH2 ARG A 66 -84.724 -21.087 -34.271 1.00 0.00 N ATOM 0 H ARG A 66 -90.597 -18.058 -34.183 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.698 -18.882 -35.000 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -90.358 -21.348 -35.658 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -88.608 -21.273 -35.713 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -90.305 -20.859 -33.223 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -89.450 -22.332 -33.636 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -88.190 -19.614 -33.109 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.157 -20.994 -32.030 1.00 0.00 H new ATOM 0 HE ARG A 66 -87.024 -22.028 -34.304 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -86.440 -19.120 -32.385 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -84.726 -19.048 -32.806 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -84.825 -21.926 -34.842 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -83.815 -20.630 -34.192 1.00 0.00 H new ATOM 685 N SER A 67 -90.186 -18.011 -37.369 1.00 0.00 N ATOM 686 CA SER A 67 -90.381 -17.692 -38.774 1.00 0.00 C ATOM 687 C SER A 67 -89.058 -17.547 -39.523 1.00 0.00 C ATOM 688 O SER A 67 -88.774 -18.316 -40.446 1.00 0.00 O ATOM 689 CB SER A 67 -91.201 -16.407 -38.885 1.00 0.00 C ATOM 690 OG SER A 67 -92.411 -16.522 -38.156 1.00 0.00 O ATOM 0 H SER A 67 -90.600 -17.334 -36.729 1.00 0.00 H new ATOM 0 HA SER A 67 -90.917 -18.519 -39.240 1.00 0.00 H new ATOM 0 HB2 SER A 67 -90.621 -15.565 -38.507 1.00 0.00 H new ATOM 0 HB3 SER A 67 -91.420 -16.198 -39.932 1.00 0.00 H new ATOM 0 HG SER A 67 -92.922 -15.690 -38.237 1.00 0.00 H new ATOM 696 N SER A 68 -88.258 -16.560 -39.122 1.00 0.00 N ATOM 697 CA SER A 68 -86.988 -16.266 -39.787 1.00 0.00 C ATOM 698 C SER A 68 -87.215 -15.950 -41.268 1.00 0.00 C ATOM 699 O SER A 68 -86.316 -16.088 -42.094 1.00 0.00 O ATOM 700 CB SER A 68 -86.024 -17.448 -39.625 1.00 0.00 C ATOM 701 OG SER A 68 -85.876 -17.791 -38.257 1.00 0.00 O ATOM 0 H SER A 68 -88.468 -15.947 -38.335 1.00 0.00 H new ATOM 0 HA SER A 68 -86.543 -15.388 -39.320 1.00 0.00 H new ATOM 0 HB2 SER A 68 -86.398 -18.307 -40.182 1.00 0.00 H new ATOM 0 HB3 SER A 68 -85.053 -17.192 -40.048 1.00 0.00 H new ATOM 0 HG SER A 68 -85.259 -18.548 -38.174 1.00 0.00 H new ATOM 707 N LYS A 69 -88.425 -15.503 -41.584 1.00 0.00 N ATOM 708 CA LYS A 69 -88.809 -15.214 -42.955 1.00 0.00 C ATOM 709 C LYS A 69 -88.545 -13.754 -43.287 1.00 0.00 C ATOM 710 O LYS A 69 -88.838 -12.866 -42.485 1.00 0.00 O ATOM 711 CB LYS A 69 -90.289 -15.542 -43.165 1.00 0.00 C ATOM 712 CG LYS A 69 -90.598 -17.033 -43.129 1.00 0.00 C ATOM 713 CD LYS A 69 -92.095 -17.298 -43.189 1.00 0.00 C ATOM 714 CE LYS A 69 -92.750 -17.108 -41.830 1.00 0.00 C ATOM 715 NZ LYS A 69 -94.233 -17.129 -41.916 1.00 0.00 N ATOM 0 H LYS A 69 -89.162 -15.332 -40.899 1.00 0.00 H new ATOM 0 HA LYS A 69 -88.209 -15.834 -43.621 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -90.876 -15.040 -42.396 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -90.609 -15.137 -44.125 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -90.107 -17.527 -43.967 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -90.187 -17.468 -42.218 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -92.556 -16.626 -43.913 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -92.272 -18.315 -43.540 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -92.415 -17.895 -41.154 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -92.426 -16.160 -41.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -94.608 -16.191 -41.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -94.521 -17.373 -42.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -94.609 -17.838 -41.255 1.00 0.00 H new ATOM 729 N GLN A 70 -87.989 -13.512 -44.461 1.00 0.00 N ATOM 730 CA GLN A 70 -87.665 -12.162 -44.893 1.00 0.00 C ATOM 731 C GLN A 70 -88.542 -11.739 -46.065 1.00 0.00 C ATOM 732 O GLN A 70 -88.479 -12.332 -47.143 1.00 0.00 O ATOM 733 CB GLN A 70 -86.190 -12.074 -45.273 1.00 0.00 C ATOM 734 CG GLN A 70 -85.254 -12.211 -44.084 1.00 0.00 C ATOM 735 CD GLN A 70 -83.808 -12.357 -44.499 1.00 0.00 C ATOM 736 OE1 GLN A 70 -83.307 -13.469 -44.661 1.00 0.00 O ATOM 737 NE2 GLN A 70 -83.131 -11.239 -44.687 1.00 0.00 N ATOM 0 H GLN A 70 -87.751 -14.238 -45.137 1.00 0.00 H new ATOM 0 HA GLN A 70 -87.858 -11.481 -44.065 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -85.962 -12.855 -45.998 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -86.005 -11.119 -45.764 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -85.358 -11.337 -43.442 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -85.548 -13.078 -43.492 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -83.585 -10.337 -44.541 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -82.154 -11.277 -44.978 1.00 0.00 H new ATOM 746 N TRP A 71 -89.358 -10.711 -45.830 1.00 0.00 N ATOM 747 CA TRP A 71 -90.279 -10.167 -46.835 1.00 0.00 C ATOM 748 C TRP A 71 -91.354 -11.163 -47.264 1.00 0.00 C ATOM 749 O TRP A 71 -91.329 -12.335 -46.877 1.00 0.00 O ATOM 750 CB TRP A 71 -89.518 -9.642 -48.058 1.00 0.00 C ATOM 751 CG TRP A 71 -89.154 -8.197 -47.936 1.00 0.00 C ATOM 752 CD1 TRP A 71 -88.058 -7.668 -47.319 1.00 0.00 C ATOM 753 CD2 TRP A 71 -89.904 -7.092 -48.445 1.00 0.00 C ATOM 754 NE1 TRP A 71 -88.080 -6.296 -47.419 1.00 0.00 N ATOM 755 CE2 TRP A 71 -89.206 -5.919 -48.106 1.00 0.00 C ATOM 756 CE3 TRP A 71 -91.101 -6.982 -49.159 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -89.666 -4.652 -48.456 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -91.557 -5.725 -49.503 1.00 0.00 C ATOM 759 CH2 TRP A 71 -90.840 -4.574 -49.152 1.00 0.00 C ATOM 0 H TRP A 71 -89.401 -10.228 -44.933 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.792 -9.335 -46.353 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -88.611 -10.230 -48.196 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -90.129 -9.784 -48.949 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -87.287 -8.241 -46.825 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -87.374 -5.662 -47.044 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -91.659 -7.864 -49.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -89.115 -3.763 -48.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -92.482 -5.628 -50.052 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -91.223 -3.605 -49.437 1.00 0.00 H new ATOM 770 N GLU A 72 -92.310 -10.657 -48.052 1.00 0.00 N ATOM 771 CA GLU A 72 -93.452 -11.430 -48.553 1.00 0.00 C ATOM 772 C GLU A 72 -94.443 -11.764 -47.437 1.00 0.00 C ATOM 773 O GLU A 72 -95.593 -11.320 -47.465 1.00 0.00 O ATOM 774 CB GLU A 72 -92.992 -12.707 -49.268 1.00 0.00 C ATOM 775 CG GLU A 72 -92.105 -12.436 -50.472 1.00 0.00 C ATOM 776 CD GLU A 72 -92.768 -11.525 -51.486 1.00 0.00 C ATOM 777 OE1 GLU A 72 -93.602 -12.013 -52.272 1.00 0.00 O ATOM 778 OE2 GLU A 72 -92.457 -10.314 -51.502 1.00 0.00 O ATOM 0 H GLU A 72 -92.312 -9.686 -48.364 1.00 0.00 H new ATOM 0 HA GLU A 72 -93.968 -10.802 -49.279 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -92.451 -13.336 -48.561 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -93.868 -13.270 -49.590 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -91.171 -11.984 -50.137 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -91.848 -13.381 -50.950 1.00 0.00 H new ATOM 785 N ASP A 73 -93.997 -12.532 -46.456 1.00 0.00 N ATOM 786 CA ASP A 73 -94.851 -12.934 -45.340 1.00 0.00 C ATOM 787 C ASP A 73 -94.904 -11.845 -44.256 1.00 0.00 C ATOM 788 O ASP A 73 -95.993 -11.429 -43.870 1.00 0.00 O ATOM 789 CB ASP A 73 -94.376 -14.272 -44.760 1.00 0.00 C ATOM 790 CG ASP A 73 -95.190 -14.724 -43.562 1.00 0.00 C ATOM 791 OD1 ASP A 73 -96.291 -15.278 -43.756 1.00 0.00 O ATOM 792 OD2 ASP A 73 -94.711 -14.570 -42.422 1.00 0.00 O ATOM 0 H ASP A 73 -93.044 -12.893 -46.406 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.865 -13.065 -45.717 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -94.427 -15.036 -45.536 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -93.329 -14.184 -44.468 1.00 0.00 H new ATOM 797 N PRO A 74 -93.733 -11.384 -43.738 1.00 0.00 N ATOM 798 CA PRO A 74 -93.639 -10.278 -42.772 1.00 0.00 C ATOM 799 C PRO A 74 -94.549 -9.087 -43.068 1.00 0.00 C ATOM 800 O PRO A 74 -94.186 -8.185 -43.824 1.00 0.00 O ATOM 801 CB PRO A 74 -92.197 -9.855 -42.906 1.00 0.00 C ATOM 802 CG PRO A 74 -91.500 -11.136 -43.109 1.00 0.00 C ATOM 803 CD PRO A 74 -92.396 -11.952 -43.993 1.00 0.00 C ATOM 0 HA PRO A 74 -93.952 -10.604 -41.780 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.051 -9.177 -43.747 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.842 -9.338 -42.014 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -90.526 -10.982 -43.574 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -91.323 -11.640 -42.159 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -92.115 -11.863 -45.042 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -92.354 -13.011 -43.740 1.00 0.00 H new ATOM 811 N SER A 75 -95.742 -9.104 -42.496 1.00 0.00 N ATOM 812 CA SER A 75 -96.666 -7.980 -42.614 1.00 0.00 C ATOM 813 C SER A 75 -97.597 -7.915 -41.404 1.00 0.00 C ATOM 814 O SER A 75 -98.508 -7.094 -41.350 1.00 0.00 O ATOM 815 CB SER A 75 -97.494 -8.107 -43.901 1.00 0.00 C ATOM 816 OG SER A 75 -96.659 -8.153 -45.048 1.00 0.00 O ATOM 0 H SER A 75 -96.097 -9.884 -41.943 1.00 0.00 H new ATOM 0 HA SER A 75 -96.081 -7.061 -42.653 1.00 0.00 H new ATOM 0 HB2 SER A 75 -98.104 -9.009 -43.856 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.179 -7.263 -43.980 1.00 0.00 H new ATOM 0 HG SER A 75 -95.726 -8.023 -44.779 1.00 0.00 H new ATOM 822 N GLN A 76 -97.321 -8.746 -40.407 1.00 0.00 N ATOM 823 CA GLN A 76 -98.254 -8.961 -39.302 1.00 0.00 C ATOM 824 C GLN A 76 -98.118 -7.897 -38.207 1.00 0.00 C ATOM 825 O GLN A 76 -98.579 -8.096 -37.084 1.00 0.00 O ATOM 826 CB GLN A 76 -98.034 -10.357 -38.710 1.00 0.00 C ATOM 827 CG GLN A 76 -98.073 -11.472 -39.745 1.00 0.00 C ATOM 828 CD GLN A 76 -99.355 -11.479 -40.554 1.00 0.00 C ATOM 829 OE1 GLN A 76 -99.446 -10.834 -41.597 1.00 0.00 O ATOM 830 NE2 GLN A 76 -100.352 -12.209 -40.082 1.00 0.00 N ATOM 0 H GLN A 76 -96.457 -9.284 -40.339 1.00 0.00 H new ATOM 0 HA GLN A 76 -99.265 -8.880 -39.702 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.070 -10.379 -38.201 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.797 -10.547 -37.955 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -97.224 -11.365 -40.420 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -97.961 -12.432 -39.242 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.236 -12.730 -39.213 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -101.237 -12.251 -40.587 1.00 0.00 H new ATOM 839 N ALA A 77 -97.515 -6.763 -38.547 1.00 0.00 N ATOM 840 CA ALA A 77 -97.310 -5.680 -37.585 1.00 0.00 C ATOM 841 C ALA A 77 -97.684 -4.336 -38.209 1.00 0.00 C ATOM 842 O ALA A 77 -97.219 -3.261 -37.783 1.00 0.00 O ATOM 843 CB ALA A 77 -95.869 -5.671 -37.106 1.00 0.00 C ATOM 0 H ALA A 77 -97.158 -6.567 -39.482 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.957 -5.846 -36.724 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.728 -4.861 -36.391 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.639 -6.622 -36.627 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.204 -5.523 -37.957 1.00 0.00 H new ATOM 849 N SER A 78 -98.555 -4.407 -39.208 1.00 0.00 N ATOM 850 CA SER A 78 -98.993 -3.232 -39.944 1.00 0.00 C ATOM 851 C SER A 78 -99.549 -2.174 -39.000 1.00 0.00 C ATOM 852 O SER A 78 -99.340 -0.979 -39.196 1.00 0.00 O ATOM 853 CB SER A 78 -100.050 -3.642 -40.970 1.00 0.00 C ATOM 854 OG SER A 78 -101.016 -4.498 -40.381 1.00 0.00 O ATOM 0 H SER A 78 -98.976 -5.279 -39.529 1.00 0.00 H new ATOM 0 HA SER A 78 -98.136 -2.799 -40.460 1.00 0.00 H new ATOM 0 HB2 SER A 78 -100.540 -2.754 -41.370 1.00 0.00 H new ATOM 0 HB3 SER A 78 -99.572 -4.148 -41.809 1.00 0.00 H new ATOM 0 HG SER A 78 -101.684 -4.748 -41.053 1.00 0.00 H new ATOM 860 N LYS A 79 -100.217 -2.632 -37.951 1.00 0.00 N ATOM 861 CA LYS A 79 -100.890 -1.740 -37.031 1.00 0.00 C ATOM 862 C LYS A 79 -99.899 -0.916 -36.207 1.00 0.00 C ATOM 863 O LYS A 79 -100.131 0.271 -35.977 1.00 0.00 O ATOM 864 CB LYS A 79 -101.817 -2.534 -36.110 1.00 0.00 C ATOM 865 CG LYS A 79 -102.838 -1.670 -35.382 1.00 0.00 C ATOM 866 CD LYS A 79 -103.705 -0.895 -36.363 1.00 0.00 C ATOM 867 CE LYS A 79 -104.479 -1.827 -37.282 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.150 -1.096 -38.387 1.00 0.00 N ATOM 0 H LYS A 79 -100.305 -3.621 -37.719 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.483 -1.042 -37.622 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.343 -3.286 -36.698 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.215 -3.068 -35.375 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.469 -2.299 -34.754 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.323 -0.974 -34.720 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -104.403 -0.263 -35.813 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -103.078 -0.233 -36.960 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -103.799 -2.569 -37.700 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -105.225 -2.369 -36.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.340 -1.751 -39.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -106.047 -0.697 -38.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.533 -0.327 -38.720 1.00 0.00 H new ATOM 882 N VAL A 80 -98.785 -1.517 -35.784 1.00 0.00 N ATOM 883 CA VAL A 80 -97.865 -0.814 -34.914 1.00 0.00 C ATOM 884 C VAL A 80 -97.089 0.257 -35.670 1.00 0.00 C ATOM 885 O VAL A 80 -96.943 1.369 -35.171 1.00 0.00 O ATOM 886 CB VAL A 80 -96.894 -1.753 -34.164 1.00 0.00 C ATOM 887 CG1 VAL A 80 -97.647 -2.612 -33.164 1.00 0.00 C ATOM 888 CG2 VAL A 80 -96.085 -2.618 -35.117 1.00 0.00 C ATOM 0 H VAL A 80 -98.509 -2.468 -36.028 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.486 -0.332 -34.159 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.187 -1.124 -33.623 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -96.946 -3.266 -32.646 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -98.149 -1.971 -32.439 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -98.388 -3.216 -33.688 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -95.416 -3.262 -34.545 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -96.760 -3.233 -35.712 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -95.498 -1.980 -35.778 1.00 0.00 H new ATOM 898 N CYS A 81 -96.617 -0.040 -36.882 1.00 0.00 N ATOM 899 CA CYS A 81 -95.900 0.989 -37.645 1.00 0.00 C ATOM 900 C CYS A 81 -96.869 2.037 -38.177 1.00 0.00 C ATOM 901 O CYS A 81 -96.497 3.197 -38.368 1.00 0.00 O ATOM 902 CB CYS A 81 -95.063 0.398 -38.781 1.00 0.00 C ATOM 903 SG CYS A 81 -93.789 -0.759 -38.207 1.00 0.00 S ATOM 0 H CYS A 81 -96.711 -0.945 -37.344 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.205 1.470 -36.956 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.723 -0.116 -39.480 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.586 1.209 -39.331 1.00 0.00 H new ATOM 908 N GLN A 82 -98.118 1.637 -38.389 1.00 0.00 N ATOM 909 CA GLN A 82 -99.163 2.580 -38.768 1.00 0.00 C ATOM 910 C GLN A 82 -99.404 3.550 -37.619 1.00 0.00 C ATOM 911 O GLN A 82 -99.575 4.753 -37.823 1.00 0.00 O ATOM 912 CB GLN A 82 -100.455 1.838 -39.108 1.00 0.00 C ATOM 913 CG GLN A 82 -101.542 2.732 -39.675 1.00 0.00 C ATOM 914 CD GLN A 82 -102.838 1.987 -39.920 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.174 1.041 -39.204 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.569 2.401 -40.940 1.00 0.00 N ATOM 0 H GLN A 82 -98.430 0.670 -38.305 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.843 3.133 -39.651 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.232 1.051 -39.828 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.831 1.350 -38.208 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.726 3.557 -38.986 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.196 3.170 -40.611 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -103.254 3.188 -41.507 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.448 1.933 -41.160 1.00 0.00 H new ATOM 925 N ARG A 83 -99.386 3.011 -36.403 1.00 0.00 N ATOM 926 CA ARG A 83 -99.518 3.813 -35.197 1.00 0.00 C ATOM 927 C ARG A 83 -98.266 4.665 -34.985 1.00 0.00 C ATOM 928 O ARG A 83 -98.306 5.685 -34.299 1.00 0.00 O ATOM 929 CB ARG A 83 -99.761 2.900 -33.987 1.00 0.00 C ATOM 930 CG ARG A 83 -99.943 3.632 -32.661 1.00 0.00 C ATOM 931 CD ARG A 83 -101.186 4.511 -32.645 1.00 0.00 C ATOM 932 NE ARG A 83 -101.026 5.717 -33.460 1.00 0.00 N ATOM 933 CZ ARG A 83 -102.010 6.576 -33.714 1.00 0.00 C ATOM 934 NH1 ARG A 83 -103.219 6.377 -33.206 1.00 0.00 N ATOM 935 NH2 ARG A 83 -101.785 7.638 -34.476 1.00 0.00 N ATOM 0 H ARG A 83 -99.280 2.011 -36.229 1.00 0.00 H new ATOM 0 HA ARG A 83 -100.371 4.482 -35.308 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.648 2.296 -34.177 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.921 2.212 -33.894 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -100.007 2.903 -31.853 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -99.065 4.247 -32.466 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -102.038 3.938 -33.012 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -101.413 4.797 -31.618 1.00 0.00 H new ATOM 0 HE ARG A 83 -100.106 5.910 -33.856 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -103.397 5.563 -32.618 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -103.970 7.038 -33.403 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -100.857 7.797 -34.868 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -102.540 8.296 -34.670 1.00 0.00 H new ATOM 949 N LEU A 84 -97.162 4.246 -35.596 1.00 0.00 N ATOM 950 CA LEU A 84 -95.904 4.983 -35.517 1.00 0.00 C ATOM 951 C LEU A 84 -95.789 5.964 -36.679 1.00 0.00 C ATOM 952 O LEU A 84 -94.731 6.555 -36.889 1.00 0.00 O ATOM 953 CB LEU A 84 -94.713 4.020 -35.559 1.00 0.00 C ATOM 954 CG LEU A 84 -94.581 3.060 -34.377 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.554 1.986 -34.689 1.00 0.00 C ATOM 956 CD2 LEU A 84 -94.186 3.810 -33.114 1.00 0.00 C ATOM 0 H LEU A 84 -97.113 3.394 -36.155 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.894 5.531 -34.575 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.781 3.431 -36.473 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.798 4.609 -35.626 1.00 0.00 H new ATOM 0 HG LEU A 84 -95.549 2.589 -34.208 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -93.468 1.307 -33.840 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.869 1.427 -35.570 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -92.587 2.452 -34.881 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -94.098 3.107 -32.286 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -93.229 4.308 -33.271 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.948 4.554 -32.879 1.00 0.00 H new ATOM 968 N ASN A 85 -96.891 6.109 -37.428 1.00 0.00 N ATOM 969 CA ASN A 85 -96.962 6.946 -38.640 1.00 0.00 C ATOM 970 C ASN A 85 -95.776 6.695 -39.577 1.00 0.00 C ATOM 971 O ASN A 85 -95.352 7.579 -40.322 1.00 0.00 O ATOM 972 CB ASN A 85 -97.112 8.449 -38.309 1.00 0.00 C ATOM 973 CG ASN A 85 -95.933 9.072 -37.581 1.00 0.00 C ATOM 974 OD1 ASN A 85 -95.890 9.099 -36.351 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.972 9.588 -38.333 1.00 0.00 N ATOM 0 H ASN A 85 -97.771 5.643 -37.208 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.866 6.646 -39.169 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -97.274 8.995 -39.238 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -98.006 8.583 -37.700 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.162 10.026 -37.895 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.042 9.547 -39.350 1.00 0.00 H new ATOM 982 N CYS A 86 -95.284 5.463 -39.570 1.00 0.00 N ATOM 983 CA CYS A 86 -94.169 5.070 -40.423 1.00 0.00 C ATOM 984 C CYS A 86 -94.680 4.510 -41.750 1.00 0.00 C ATOM 985 O CYS A 86 -93.924 4.374 -42.711 1.00 0.00 O ATOM 986 CB CYS A 86 -93.300 4.035 -39.702 1.00 0.00 C ATOM 987 SG CYS A 86 -92.591 4.634 -38.139 1.00 0.00 S ATOM 0 H CYS A 86 -95.643 4.713 -38.978 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.563 5.950 -40.637 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.900 3.147 -39.502 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.490 3.730 -40.364 1.00 0.00 H new ATOM 992 N GLY A 87 -95.968 4.187 -41.787 1.00 0.00 N ATOM 993 CA GLY A 87 -96.581 3.693 -43.002 1.00 0.00 C ATOM 994 C GLY A 87 -96.977 2.240 -42.885 1.00 0.00 C ATOM 995 O GLY A 87 -97.763 1.873 -42.012 1.00 0.00 O ATOM 0 H GLY A 87 -96.601 4.260 -40.990 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.462 4.292 -43.233 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -95.887 3.814 -43.834 1.00 0.00 H new ATOM 999 N ASP A 88 -96.431 1.419 -43.764 1.00 0.00 N ATOM 1000 CA ASP A 88 -96.653 -0.021 -43.728 1.00 0.00 C ATOM 1001 C ASP A 88 -95.758 -0.632 -42.648 1.00 0.00 C ATOM 1002 O ASP A 88 -94.918 0.077 -42.085 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.341 -0.618 -45.105 1.00 0.00 C ATOM 1004 CG ASP A 88 -97.263 -0.105 -46.195 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -97.136 1.077 -46.585 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -98.111 -0.881 -46.676 1.00 0.00 O ATOM 0 H ASP A 88 -95.822 1.727 -44.522 1.00 0.00 H new ATOM 0 HA ASP A 88 -97.693 -0.241 -43.488 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -95.309 -0.386 -45.370 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.420 -1.704 -45.051 1.00 0.00 H new ATOM 1011 N PRO A 89 -95.905 -1.927 -42.303 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.099 -2.517 -41.247 1.00 0.00 C ATOM 1013 C PRO A 89 -93.677 -2.760 -41.646 1.00 0.00 C ATOM 1014 O PRO A 89 -93.358 -2.965 -42.816 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.746 -3.851 -40.961 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.446 -4.212 -42.220 1.00 0.00 C ATOM 1017 CD PRO A 89 -96.842 -2.912 -42.883 1.00 0.00 C ATOM 0 HA PRO A 89 -95.064 -1.838 -40.395 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.003 -4.602 -40.693 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.444 -3.781 -40.127 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -95.796 -4.796 -42.871 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.324 -4.824 -42.013 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -96.744 -2.969 -43.967 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -97.879 -2.653 -42.670 1.00 0.00 H new ATOM 1025 N LEU A 90 -92.840 -2.682 -40.644 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.482 -3.124 -40.706 1.00 0.00 C ATOM 1027 C LEU A 90 -91.342 -4.392 -41.513 1.00 0.00 C ATOM 1028 O LEU A 90 -91.846 -5.457 -41.156 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.896 -3.298 -39.296 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.897 -3.321 -38.129 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.990 -4.341 -38.350 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.186 -3.604 -36.820 1.00 0.00 C ATOM 0 H LEU A 90 -93.099 -2.296 -39.736 1.00 0.00 H new ATOM 0 HA LEU A 90 -90.910 -2.350 -41.218 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.329 -4.229 -39.276 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.187 -2.489 -39.120 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.359 -2.335 -38.080 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.677 -4.327 -37.504 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.534 -4.099 -39.263 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.548 -5.333 -38.442 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.912 -3.616 -36.007 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.690 -4.573 -36.878 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.445 -2.827 -36.633 1.00 0.00 H new ATOM 1044 N SER A 91 -90.715 -4.224 -42.643 1.00 0.00 N ATOM 1045 CA SER A 91 -90.298 -5.336 -43.456 1.00 0.00 C ATOM 1046 C SER A 91 -89.228 -6.114 -42.709 1.00 0.00 C ATOM 1047 O SER A 91 -88.241 -5.538 -42.236 1.00 0.00 O ATOM 1048 CB SER A 91 -89.792 -4.828 -44.805 1.00 0.00 C ATOM 1049 OG SER A 91 -89.038 -3.634 -44.653 1.00 0.00 O ATOM 0 H SER A 91 -90.477 -3.310 -43.029 1.00 0.00 H new ATOM 0 HA SER A 91 -91.137 -6.003 -43.651 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.176 -5.593 -45.277 1.00 0.00 H new ATOM 0 HB3 SER A 91 -90.637 -4.646 -45.468 1.00 0.00 H new ATOM 0 HG SER A 91 -89.547 -2.878 -45.012 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.447 -7.411 -42.572 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.581 -8.252 -41.767 1.00 0.00 C ATOM 1057 C LEU A 92 -87.403 -8.728 -42.600 1.00 0.00 C ATOM 1058 O LEU A 92 -87.579 -9.355 -43.646 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.381 -9.440 -41.220 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.018 -9.915 -39.809 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.115 -10.816 -39.261 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -87.694 -10.653 -39.810 1.00 0.00 C ATOM 0 H LEU A 92 -90.223 -7.906 -43.012 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.194 -7.678 -40.925 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -90.438 -9.173 -41.229 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -89.258 -10.279 -41.905 1.00 0.00 H new ATOM 0 HG LEU A 92 -88.922 -9.038 -39.169 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -89.846 -11.148 -38.258 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.054 -10.263 -39.221 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -90.232 -11.683 -39.911 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -87.459 -10.980 -38.797 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -87.762 -11.522 -40.465 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -86.908 -9.989 -40.169 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.214 -8.399 -42.138 1.00 0.00 N ATOM 1075 CA GLY A 93 -85.004 -8.769 -42.833 1.00 0.00 C ATOM 1076 C GLY A 93 -83.854 -8.895 -41.866 1.00 0.00 C ATOM 1077 O GLY A 93 -84.048 -9.360 -40.753 1.00 0.00 O ATOM 0 H GLY A 93 -86.062 -7.872 -41.278 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -85.153 -9.714 -43.355 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.769 -8.020 -43.590 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.636 -8.515 -42.260 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.492 -8.473 -41.367 1.00 0.00 C ATOM 1083 C PRO A 94 -81.192 -7.056 -40.866 1.00 0.00 C ATOM 1084 O PRO A 94 -81.489 -6.068 -41.544 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.385 -8.969 -42.288 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.745 -8.412 -43.636 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.241 -8.150 -43.626 1.00 0.00 C ATOM 0 HA PRO A 94 -81.629 -9.055 -40.456 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.407 -8.616 -41.960 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.341 -10.058 -42.306 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.194 -7.492 -43.832 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.482 -9.115 -44.426 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.469 -7.107 -43.846 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.761 -8.753 -44.370 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.622 -6.951 -39.677 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.189 -5.664 -39.163 1.00 0.00 C ATOM 1097 C PHE A 95 -78.674 -5.546 -39.331 1.00 0.00 C ATOM 1098 O PHE A 95 -77.968 -6.554 -39.363 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.628 -5.489 -37.700 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.307 -4.141 -37.112 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.855 -2.987 -37.651 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -79.467 -4.027 -36.017 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.568 -1.747 -37.111 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -79.176 -2.791 -35.473 1.00 0.00 C ATOM 1105 CZ PHE A 95 -79.728 -1.649 -36.020 1.00 0.00 C ATOM 0 H PHE A 95 -80.449 -7.739 -39.052 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.660 -4.859 -39.727 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.703 -5.654 -37.634 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.149 -6.259 -37.095 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.514 -3.058 -38.503 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -79.034 -4.916 -35.583 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -81.000 -0.856 -37.542 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -78.517 -2.718 -34.620 1.00 0.00 H new ATOM 0 HZ PHE A 95 -79.503 -0.682 -35.595 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.184 -4.317 -39.461 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.786 -4.079 -39.829 1.00 0.00 C ATOM 1117 C LEU A 96 -75.842 -4.187 -38.632 1.00 0.00 C ATOM 1118 O LEU A 96 -74.638 -3.975 -38.765 1.00 0.00 O ATOM 1119 CB LEU A 96 -76.621 -2.706 -40.496 1.00 0.00 C ATOM 1120 CG LEU A 96 -77.277 -2.548 -41.875 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -78.786 -2.422 -41.754 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -76.701 -1.343 -42.601 1.00 0.00 C ATOM 0 H LEU A 96 -78.732 -3.468 -39.318 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.515 -4.861 -40.539 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -77.033 -1.948 -39.830 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -75.556 -2.498 -40.596 1.00 0.00 H new ATOM 0 HG LEU A 96 -77.060 -3.445 -42.456 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -79.223 -2.311 -42.747 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -79.189 -3.316 -41.278 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -79.031 -1.548 -41.150 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -77.176 -1.245 -43.577 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -76.886 -0.443 -42.015 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -75.627 -1.476 -42.732 1.00 0.00 H new ATOM 1134 N LYS A 97 -76.390 -4.516 -37.471 1.00 0.00 N ATOM 1135 CA LYS A 97 -75.591 -4.725 -36.272 1.00 0.00 C ATOM 1136 C LYS A 97 -76.092 -5.953 -35.527 1.00 0.00 C ATOM 1137 O LYS A 97 -77.223 -6.389 -35.733 1.00 0.00 O ATOM 1138 CB LYS A 97 -75.622 -3.494 -35.361 1.00 0.00 C ATOM 1139 CG LYS A 97 -74.635 -2.409 -35.770 1.00 0.00 C ATOM 1140 CD LYS A 97 -74.690 -1.216 -34.830 1.00 0.00 C ATOM 1141 CE LYS A 97 -75.902 -0.342 -35.106 1.00 0.00 C ATOM 1142 NZ LYS A 97 -75.768 0.404 -36.386 1.00 0.00 N ATOM 0 H LYS A 97 -77.392 -4.645 -37.334 1.00 0.00 H new ATOM 0 HA LYS A 97 -74.556 -4.886 -36.573 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -76.629 -3.077 -35.362 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -75.406 -3.803 -34.338 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -73.625 -2.820 -35.778 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -74.854 -2.082 -36.786 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -74.721 -1.566 -33.798 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -73.781 -0.624 -34.939 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -76.797 -0.963 -35.140 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -76.035 0.364 -34.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -76.463 1.177 -36.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -74.809 0.799 -36.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -75.938 -0.241 -37.183 1.00 0.00 H new ATOM 1156 N THR A 98 -75.252 -6.505 -34.671 1.00 0.00 N ATOM 1157 CA THR A 98 -75.579 -7.734 -33.969 1.00 0.00 C ATOM 1158 C THR A 98 -76.250 -7.457 -32.624 1.00 0.00 C ATOM 1159 O THR A 98 -75.841 -6.556 -31.889 1.00 0.00 O ATOM 1160 CB THR A 98 -74.314 -8.580 -33.745 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.623 -8.752 -34.991 1.00 0.00 O ATOM 1162 CG2 THR A 98 -74.665 -9.941 -33.166 1.00 0.00 C ATOM 0 H THR A 98 -74.335 -6.121 -34.444 1.00 0.00 H new ATOM 0 HA THR A 98 -76.281 -8.285 -34.595 1.00 0.00 H new ATOM 0 HB THR A 98 -73.673 -8.058 -33.035 1.00 0.00 H new ATOM 0 HG1 THR A 98 -72.817 -9.290 -34.846 1.00 0.00 H new ATOM 0 HG21 THR A 98 -73.753 -10.519 -33.017 1.00 0.00 H new ATOM 0 HG22 THR A 98 -75.172 -9.810 -32.210 1.00 0.00 H new ATOM 0 HG23 THR A 98 -75.322 -10.471 -33.855 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.288 -8.232 -32.324 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.977 -8.151 -31.039 1.00 0.00 C ATOM 1172 C TYR A 99 -77.058 -8.645 -29.920 1.00 0.00 C ATOM 1173 O TYR A 99 -76.045 -9.303 -30.180 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.291 -8.957 -31.068 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.122 -10.465 -31.041 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -78.460 -11.135 -32.062 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -79.638 -11.219 -29.992 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -78.311 -12.503 -32.039 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.491 -12.593 -29.963 1.00 0.00 C ATOM 1180 CZ TYR A 99 -78.826 -13.228 -30.988 1.00 0.00 C ATOM 1181 OH TYR A 99 -78.673 -14.594 -30.965 1.00 0.00 O ATOM 0 H TYR A 99 -77.674 -8.930 -32.960 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.232 -7.109 -30.845 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.900 -8.660 -30.214 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -79.846 -8.685 -31.966 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -78.055 -10.572 -32.890 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.161 -10.723 -29.188 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -77.792 -13.006 -32.842 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.895 -13.165 -29.141 1.00 0.00 H new ATOM 0 HH TYR A 99 -79.092 -14.957 -30.157 1.00 0.00 H new ATOM 1191 N THR A 100 -77.414 -8.349 -28.682 1.00 0.00 N ATOM 1192 CA THR A 100 -76.535 -8.615 -27.557 1.00 0.00 C ATOM 1193 C THR A 100 -77.266 -9.411 -26.484 1.00 0.00 C ATOM 1194 O THR A 100 -78.427 -9.146 -26.203 1.00 0.00 O ATOM 1195 CB THR A 100 -76.017 -7.292 -26.948 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.534 -6.434 -27.989 1.00 0.00 O ATOM 1197 CG2 THR A 100 -74.905 -7.542 -25.940 1.00 0.00 C ATOM 0 H THR A 100 -78.306 -7.924 -28.430 1.00 0.00 H new ATOM 0 HA THR A 100 -75.689 -9.197 -27.922 1.00 0.00 H new ATOM 0 HB THR A 100 -76.848 -6.814 -26.429 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.209 -5.596 -27.598 1.00 0.00 H new ATOM 0 HG21 THR A 100 -74.564 -6.591 -25.531 1.00 0.00 H new ATOM 0 HG22 THR A 100 -75.281 -8.170 -25.132 1.00 0.00 H new ATOM 0 HG23 THR A 100 -74.073 -8.044 -26.433 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.613 -10.420 -25.905 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.165 -11.169 -24.777 1.00 0.00 C ATOM 1207 C PRO A 101 -77.601 -10.254 -23.633 1.00 0.00 C ATOM 1208 O PRO A 101 -76.966 -9.228 -23.366 1.00 0.00 O ATOM 1209 CB PRO A 101 -76.007 -12.066 -24.339 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.172 -12.226 -25.561 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.298 -10.934 -26.319 1.00 0.00 C ATOM 0 HA PRO A 101 -78.062 -11.722 -25.055 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -75.439 -11.612 -23.527 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -76.367 -13.029 -23.976 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.133 -12.426 -25.300 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -75.517 -13.067 -26.163 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.497 -10.240 -26.064 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.251 -11.094 -27.396 1.00 0.00 H new ATOM 1219 N GLN A 102 -78.722 -10.617 -23.005 1.00 0.00 N ATOM 1220 CA GLN A 102 -79.251 -9.926 -21.823 1.00 0.00 C ATOM 1221 C GLN A 102 -80.023 -8.660 -22.207 1.00 0.00 C ATOM 1222 O GLN A 102 -81.144 -8.456 -21.747 1.00 0.00 O ATOM 1223 CB GLN A 102 -78.129 -9.602 -20.826 1.00 0.00 C ATOM 1224 CG GLN A 102 -78.617 -9.044 -19.500 1.00 0.00 C ATOM 1225 CD GLN A 102 -77.478 -8.784 -18.536 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -77.077 -9.668 -17.780 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -76.953 -7.572 -18.551 1.00 0.00 N ATOM 0 H GLN A 102 -79.295 -11.406 -23.304 1.00 0.00 H new ATOM 0 HA GLN A 102 -79.953 -10.604 -21.337 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -77.554 -10.508 -20.636 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -77.449 -8.882 -21.282 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -79.161 -8.116 -19.676 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -79.320 -9.745 -19.049 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -77.315 -6.867 -19.194 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -76.186 -7.341 -17.920 1.00 0.00 H new ATOM 1236 N SER A 103 -79.432 -7.824 -23.051 1.00 0.00 N ATOM 1237 CA SER A 103 -80.086 -6.597 -23.487 1.00 0.00 C ATOM 1238 C SER A 103 -81.077 -6.894 -24.609 1.00 0.00 C ATOM 1239 O SER A 103 -82.189 -6.362 -24.638 1.00 0.00 O ATOM 1240 CB SER A 103 -79.037 -5.582 -23.940 1.00 0.00 C ATOM 1241 OG SER A 103 -78.116 -6.171 -24.844 1.00 0.00 O ATOM 0 H SER A 103 -78.504 -7.972 -23.446 1.00 0.00 H new ATOM 0 HA SER A 103 -80.641 -6.172 -22.651 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.529 -4.734 -24.417 1.00 0.00 H new ATOM 0 HB3 SER A 103 -78.503 -5.194 -23.073 1.00 0.00 H new ATOM 0 HG SER A 103 -77.213 -5.845 -24.649 1.00 0.00 H new ATOM 1247 N SER A 104 -80.659 -7.739 -25.536 1.00 0.00 N ATOM 1248 CA SER A 104 -81.540 -8.231 -26.576 1.00 0.00 C ATOM 1249 C SER A 104 -81.993 -9.639 -26.214 1.00 0.00 C ATOM 1250 O SER A 104 -81.371 -10.294 -25.379 1.00 0.00 O ATOM 1251 CB SER A 104 -80.816 -8.242 -27.922 1.00 0.00 C ATOM 1252 OG SER A 104 -80.231 -6.980 -28.192 1.00 0.00 O ATOM 0 H SER A 104 -79.706 -8.100 -25.587 1.00 0.00 H new ATOM 0 HA SER A 104 -82.407 -7.576 -26.659 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.044 -9.012 -27.918 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.518 -8.499 -28.715 1.00 0.00 H new ATOM 0 HG SER A 104 -80.917 -6.367 -28.530 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.067 -10.105 -26.831 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.624 -11.409 -26.511 1.00 0.00 C ATOM 1260 C ILE A 105 -84.238 -12.079 -27.736 1.00 0.00 C ATOM 1261 O ILE A 105 -84.419 -11.452 -28.782 1.00 0.00 O ATOM 1262 CB ILE A 105 -84.703 -11.305 -25.396 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -85.654 -10.125 -25.649 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.059 -11.176 -24.023 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -86.661 -10.359 -26.756 1.00 0.00 C ATOM 0 H ILE A 105 -83.571 -9.598 -27.558 1.00 0.00 H new ATOM 0 HA ILE A 105 -82.794 -12.019 -26.155 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.286 -12.225 -25.420 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.191 -9.903 -24.727 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.062 -9.243 -25.893 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -84.836 -11.105 -23.262 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.439 -12.051 -23.828 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.440 -10.279 -23.994 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.291 -9.477 -26.867 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.135 -10.549 -27.692 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.282 -11.220 -26.507 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.554 -13.352 -27.579 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.364 -14.093 -28.534 1.00 0.00 C ATOM 1279 C ILE A 106 -86.639 -14.494 -27.787 1.00 0.00 C ATOM 1280 O ILE A 106 -86.539 -15.060 -26.702 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.669 -15.397 -28.991 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.413 -15.087 -29.783 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.615 -16.254 -29.826 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.649 -16.317 -30.211 1.00 0.00 C ATOM 0 H ILE A 106 -84.254 -13.907 -26.778 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.544 -13.475 -29.414 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.390 -15.957 -28.098 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.684 -14.512 -30.668 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.760 -14.455 -29.180 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.103 -17.165 -30.135 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.491 -16.514 -29.232 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.928 -15.696 -30.709 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.764 -16.018 -30.772 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.346 -16.882 -29.330 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.285 -16.940 -30.841 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.821 -14.209 -28.291 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.018 -14.633 -27.567 1.00 0.00 C ATOM 1298 C CYS A 107 -89.590 -15.917 -28.165 1.00 0.00 C ATOM 1299 O CYS A 107 -89.147 -16.369 -29.222 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.093 -13.546 -27.533 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.515 -11.887 -27.085 1.00 0.00 S ATOM 0 H CYS A 107 -87.986 -13.706 -29.163 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.710 -14.824 -26.539 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.564 -13.495 -28.515 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -90.865 -13.846 -26.825 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.572 -16.504 -27.490 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.153 -17.769 -27.928 1.00 0.00 C ATOM 1308 C TYR A 108 -92.658 -17.793 -27.699 1.00 0.00 C ATOM 1309 O TYR A 108 -93.197 -16.977 -26.952 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.502 -18.947 -27.199 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.234 -19.448 -27.853 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -87.993 -18.919 -27.517 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -89.279 -20.456 -28.806 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -86.835 -19.378 -28.117 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -88.126 -20.919 -29.409 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.909 -20.377 -29.061 1.00 0.00 C ATOM 1317 OH TYR A 108 -85.761 -20.838 -29.658 1.00 0.00 O ATOM 0 H TYR A 108 -90.983 -16.124 -26.637 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.963 -17.863 -28.997 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.277 -18.648 -26.175 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -91.218 -19.767 -27.142 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -87.932 -18.137 -26.775 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -90.231 -20.885 -29.081 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -85.879 -18.955 -27.847 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -88.179 -21.703 -30.150 1.00 0.00 H new ATOM 0 HH TYR A 108 -85.987 -21.544 -30.300 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.320 -18.736 -28.351 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.757 -18.866 -28.233 1.00 0.00 C ATOM 1329 C GLY A 109 -95.414 -18.918 -29.590 1.00 0.00 C ATOM 1330 O GLY A 109 -94.872 -19.508 -30.523 1.00 0.00 O ATOM 0 H GLY A 109 -92.882 -19.421 -28.967 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.998 -19.770 -27.675 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.155 -18.025 -27.665 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.580 -18.318 -29.709 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.247 -18.216 -30.992 1.00 0.00 C ATOM 1336 C GLN A 110 -96.997 -16.846 -31.601 1.00 0.00 C ATOM 1337 O GLN A 110 -96.972 -15.841 -30.891 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.749 -18.472 -30.840 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.088 -19.907 -30.466 1.00 0.00 C ATOM 1340 CD GLN A 110 -98.671 -20.906 -31.531 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -99.437 -21.214 -32.441 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -97.448 -21.407 -31.434 1.00 0.00 N ATOM 0 H GLN A 110 -97.087 -17.893 -28.933 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.839 -18.975 -31.660 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -99.148 -17.803 -30.077 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.248 -18.222 -31.776 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -98.597 -20.159 -29.526 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -100.162 -19.990 -30.297 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -96.842 -21.126 -30.663 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -97.113 -22.073 -32.130 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.782 -16.814 -32.909 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.550 -15.560 -33.614 1.00 0.00 C ATOM 1353 C LEU A 111 -97.789 -14.679 -33.491 1.00 0.00 C ATOM 1354 O LEU A 111 -98.841 -14.990 -34.049 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.206 -15.834 -35.089 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.554 -14.675 -35.865 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -96.565 -13.584 -36.193 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -94.385 -14.096 -35.079 1.00 0.00 C ATOM 0 H LEU A 111 -96.763 -17.642 -33.504 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.703 -15.038 -33.168 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.536 -16.693 -35.130 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -97.122 -16.119 -35.606 1.00 0.00 H new ATOM 0 HG LEU A 111 -95.180 -15.077 -36.807 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -96.070 -12.782 -36.741 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -97.365 -14.001 -36.805 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -96.984 -13.187 -35.269 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -93.937 -13.278 -35.643 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.741 -13.722 -34.119 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -93.639 -14.873 -34.911 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.660 -13.598 -32.738 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.798 -12.741 -32.472 1.00 0.00 C ATOM 1372 C GLY A 112 -99.162 -12.732 -31.001 1.00 0.00 C ATOM 1373 O GLY A 112 -99.985 -11.932 -30.561 1.00 0.00 O ATOM 0 H GLY A 112 -96.787 -13.298 -32.305 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.572 -11.725 -32.797 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.653 -13.080 -33.056 1.00 0.00 H new ATOM 1377 N SER A 113 -98.557 -13.631 -30.239 1.00 0.00 N ATOM 1378 CA SER A 113 -98.771 -13.681 -28.802 1.00 0.00 C ATOM 1379 C SER A 113 -97.498 -13.285 -28.061 1.00 0.00 C ATOM 1380 O SER A 113 -96.667 -14.123 -27.718 1.00 0.00 O ATOM 1381 CB SER A 113 -99.229 -15.076 -28.378 1.00 0.00 C ATOM 1382 OG SER A 113 -100.437 -15.427 -29.029 1.00 0.00 O ATOM 0 H SER A 113 -97.912 -14.337 -30.594 1.00 0.00 H new ATOM 0 HA SER A 113 -99.555 -12.970 -28.543 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.456 -15.806 -28.617 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.371 -15.105 -27.298 1.00 0.00 H new ATOM 0 HG SER A 113 -100.713 -16.324 -28.746 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.363 -11.995 -27.815 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.171 -11.440 -27.195 1.00 0.00 C ATOM 1390 C PHE A 114 -96.290 -11.505 -25.680 1.00 0.00 C ATOM 1391 O PHE A 114 -96.305 -10.484 -24.995 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.974 -9.996 -27.665 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.385 -9.890 -29.042 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -95.867 -10.664 -30.085 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.333 -9.023 -29.286 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.309 -10.578 -31.344 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.773 -8.931 -30.544 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.260 -9.710 -31.572 1.00 0.00 C ATOM 0 H PHE A 114 -98.076 -11.301 -28.039 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.301 -12.026 -27.492 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.935 -9.483 -27.649 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.324 -9.478 -26.960 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.689 -11.343 -29.911 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.947 -8.412 -28.483 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -95.692 -11.188 -32.149 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -92.954 -8.250 -30.723 1.00 0.00 H new ATOM 0 HZ PHE A 114 -93.821 -9.641 -32.556 1.00 0.00 H new ATOM 1408 N SER A 115 -96.401 -12.719 -25.168 1.00 0.00 N ATOM 1409 CA SER A 115 -96.582 -12.924 -23.740 1.00 0.00 C ATOM 1410 C SER A 115 -95.321 -13.489 -23.079 1.00 0.00 C ATOM 1411 O SER A 115 -95.122 -13.320 -21.877 1.00 0.00 O ATOM 1412 CB SER A 115 -97.764 -13.865 -23.493 1.00 0.00 C ATOM 1413 OG SER A 115 -98.018 -14.011 -22.105 1.00 0.00 O ATOM 0 H SER A 115 -96.369 -13.577 -25.719 1.00 0.00 H new ATOM 0 HA SER A 115 -96.785 -11.952 -23.291 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.653 -13.476 -23.990 1.00 0.00 H new ATOM 0 HB3 SER A 115 -97.555 -14.840 -23.932 1.00 0.00 H new ATOM 0 HG SER A 115 -98.778 -14.615 -21.973 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.477 -14.161 -23.855 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.302 -14.839 -23.302 1.00 0.00 C ATOM 1421 C ASN A 116 -92.071 -14.620 -24.172 1.00 0.00 C ATOM 1422 O ASN A 116 -92.148 -14.677 -25.400 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.557 -16.348 -23.173 1.00 0.00 C ATOM 1424 CG ASN A 116 -93.991 -16.785 -21.781 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -93.725 -17.915 -21.369 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -94.649 -15.903 -21.044 1.00 0.00 N ATOM 0 H ASN A 116 -94.581 -14.253 -24.866 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.120 -14.410 -22.316 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.325 -16.639 -23.890 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -92.648 -16.884 -23.444 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -94.953 -16.151 -20.102 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -94.852 -14.976 -21.418 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.941 -14.364 -23.531 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.667 -14.280 -24.227 1.00 0.00 C ATOM 1435 C CYS A 117 -88.623 -15.142 -23.517 1.00 0.00 C ATOM 1436 O CYS A 117 -88.897 -15.704 -22.455 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.174 -12.834 -24.299 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.239 -11.685 -25.214 1.00 0.00 S ATOM 0 H CYS A 117 -90.881 -14.210 -22.524 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.813 -14.647 -25.243 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.055 -12.459 -23.282 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.186 -12.829 -24.759 1.00 0.00 H new ATOM 1443 N SER A 118 -87.432 -15.249 -24.099 1.00 0.00 N ATOM 1444 CA SER A 118 -86.350 -16.005 -23.486 1.00 0.00 C ATOM 1445 C SER A 118 -85.015 -15.279 -23.644 1.00 0.00 C ATOM 1446 O SER A 118 -84.840 -14.445 -24.542 1.00 0.00 O ATOM 1447 CB SER A 118 -86.273 -17.416 -24.081 1.00 0.00 C ATOM 1448 OG SER A 118 -86.194 -17.381 -25.494 1.00 0.00 O ATOM 0 H SER A 118 -87.194 -14.821 -24.994 1.00 0.00 H new ATOM 0 HA SER A 118 -86.561 -16.092 -22.420 1.00 0.00 H new ATOM 0 HB2 SER A 118 -85.402 -17.934 -23.680 1.00 0.00 H new ATOM 0 HB3 SER A 118 -87.151 -17.988 -23.779 1.00 0.00 H new ATOM 0 HG SER A 118 -86.149 -16.450 -25.796 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.086 -15.600 -22.758 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.773 -14.977 -22.735 1.00 0.00 C ATOM 1456 C HIS A 119 -81.960 -15.382 -23.964 1.00 0.00 C ATOM 1457 O HIS A 119 -82.004 -16.532 -24.398 1.00 0.00 O ATOM 1458 CB HIS A 119 -82.051 -15.383 -21.445 1.00 0.00 C ATOM 1459 CG HIS A 119 -80.730 -14.714 -21.227 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -80.609 -13.453 -20.693 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -79.468 -15.148 -21.452 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -79.333 -13.140 -20.596 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -78.615 -14.150 -21.050 1.00 0.00 N ATOM 0 H HIS A 119 -84.222 -16.303 -22.032 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.886 -13.893 -22.759 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -82.699 -15.161 -20.597 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -81.898 -16.462 -21.455 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -79.184 -16.102 -21.870 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -78.940 -12.211 -20.209 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -77.597 -14.184 -21.095 1.00 0.00 H new ATOM 1472 N SER A 120 -81.224 -14.422 -24.511 1.00 0.00 N ATOM 1473 CA SER A 120 -80.417 -14.629 -25.709 1.00 0.00 C ATOM 1474 C SER A 120 -79.189 -15.510 -25.438 1.00 0.00 C ATOM 1475 O SER A 120 -78.051 -15.035 -25.431 1.00 0.00 O ATOM 1476 CB SER A 120 -79.999 -13.260 -26.250 1.00 0.00 C ATOM 1477 OG SER A 120 -79.816 -12.349 -25.177 1.00 0.00 O ATOM 0 H SER A 120 -81.169 -13.475 -24.136 1.00 0.00 H new ATOM 0 HA SER A 120 -81.015 -15.161 -26.449 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.075 -13.352 -26.821 1.00 0.00 H new ATOM 0 HB3 SER A 120 -80.760 -12.882 -26.933 1.00 0.00 H new ATOM 0 HG SER A 120 -80.188 -11.476 -25.422 1.00 0.00 H new ATOM 1483 N ARG A 121 -79.431 -16.787 -25.169 1.00 0.00 N ATOM 1484 CA ARG A 121 -78.349 -17.750 -24.994 1.00 0.00 C ATOM 1485 C ARG A 121 -78.460 -18.874 -26.021 1.00 0.00 C ATOM 1486 O ARG A 121 -77.467 -19.511 -26.369 1.00 0.00 O ATOM 1487 CB ARG A 121 -78.348 -18.321 -23.570 1.00 0.00 C ATOM 1488 CG ARG A 121 -79.633 -19.037 -23.191 1.00 0.00 C ATOM 1489 CD ARG A 121 -79.606 -19.506 -21.746 1.00 0.00 C ATOM 1490 NE ARG A 121 -78.625 -20.570 -21.514 1.00 0.00 N ATOM 1491 CZ ARG A 121 -78.167 -20.895 -20.304 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -78.474 -20.145 -19.252 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -77.367 -21.946 -20.151 1.00 0.00 N ATOM 0 H ARG A 121 -80.366 -17.181 -25.067 1.00 0.00 H new ATOM 0 HA ARG A 121 -77.404 -17.229 -25.151 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -77.514 -19.015 -23.468 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -78.175 -17.509 -22.864 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -80.481 -18.369 -23.342 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -79.781 -19.893 -23.849 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -79.378 -18.660 -21.098 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -80.597 -19.864 -21.466 1.00 0.00 H new ATOM 0 HE ARG A 121 -78.274 -21.089 -22.319 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -79.061 -19.319 -19.368 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -78.123 -20.395 -18.328 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -77.101 -22.507 -20.960 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -77.019 -22.191 -19.224 1.00 0.00 H new ATOM 1507 N ASN A 122 -79.671 -19.104 -26.507 1.00 0.00 N ATOM 1508 CA ASN A 122 -79.917 -20.150 -27.492 1.00 0.00 C ATOM 1509 C ASN A 122 -80.399 -19.540 -28.793 1.00 0.00 C ATOM 1510 O ASN A 122 -81.053 -18.500 -28.773 1.00 0.00 O ATOM 1511 CB ASN A 122 -80.966 -21.151 -26.992 1.00 0.00 C ATOM 1512 CG ASN A 122 -80.421 -22.138 -25.978 1.00 0.00 C ATOM 1513 OD1 ASN A 122 -79.503 -21.836 -25.222 1.00 0.00 O ATOM 1514 ND2 ASN A 122 -80.991 -23.332 -25.955 1.00 0.00 N ATOM 0 H ASN A 122 -80.502 -18.579 -26.235 1.00 0.00 H new ATOM 0 HA ASN A 122 -78.977 -20.677 -27.654 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -81.796 -20.604 -26.545 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -81.368 -21.701 -27.843 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -80.669 -24.038 -25.293 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -81.752 -23.546 -26.599 1.00 0.00 H new ATOM 1521 N ASP A 123 -80.062 -20.193 -29.906 1.00 0.00 N ATOM 1522 CA ASP A 123 -80.518 -19.801 -31.244 1.00 0.00 C ATOM 1523 C ASP A 123 -79.830 -18.533 -31.740 1.00 0.00 C ATOM 1524 O ASP A 123 -79.665 -17.556 -31.008 1.00 0.00 O ATOM 1525 CB ASP A 123 -82.041 -19.637 -31.294 1.00 0.00 C ATOM 1526 CG ASP A 123 -82.552 -19.388 -32.700 1.00 0.00 C ATOM 1527 OD1 ASP A 123 -82.264 -20.208 -33.594 1.00 0.00 O ATOM 1528 OD2 ASP A 123 -83.271 -18.387 -32.912 1.00 0.00 O ATOM 0 H ASP A 123 -79.460 -21.016 -29.906 1.00 0.00 H new ATOM 0 HA ASP A 123 -80.237 -20.613 -31.915 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -82.513 -20.534 -30.893 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -82.335 -18.807 -30.652 1.00 0.00 H new ATOM 1533 N MET A 124 -79.410 -18.569 -32.991 1.00 0.00 N ATOM 1534 CA MET A 124 -78.752 -17.435 -33.611 1.00 0.00 C ATOM 1535 C MET A 124 -79.700 -16.735 -34.583 1.00 0.00 C ATOM 1536 O MET A 124 -79.786 -17.087 -35.761 1.00 0.00 O ATOM 1537 CB MET A 124 -77.456 -17.872 -34.322 1.00 0.00 C ATOM 1538 CG MET A 124 -77.642 -18.942 -35.399 1.00 0.00 C ATOM 1539 SD MET A 124 -78.125 -20.553 -34.737 1.00 0.00 S ATOM 1540 CE MET A 124 -78.456 -21.452 -36.250 1.00 0.00 C ATOM 0 H MET A 124 -79.514 -19.379 -33.602 1.00 0.00 H new ATOM 0 HA MET A 124 -78.479 -16.726 -32.829 1.00 0.00 H new ATOM 0 HB2 MET A 124 -76.995 -16.995 -34.777 1.00 0.00 H new ATOM 0 HB3 MET A 124 -76.757 -18.247 -33.574 1.00 0.00 H new ATOM 0 HG2 MET A 124 -78.400 -18.606 -36.107 1.00 0.00 H new ATOM 0 HG3 MET A 124 -76.712 -19.051 -35.957 1.00 0.00 H new ATOM 0 HE1 MET A 124 -78.767 -22.469 -36.009 1.00 0.00 H new ATOM 0 HE2 MET A 124 -79.250 -20.952 -36.804 1.00 0.00 H new ATOM 0 HE3 MET A 124 -77.553 -21.484 -36.859 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.424 -15.743 -34.085 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.397 -15.039 -34.909 1.00 0.00 C ATOM 1552 C CYS A 125 -80.742 -14.009 -35.826 1.00 0.00 C ATOM 1553 O CYS A 125 -81.438 -13.286 -36.535 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.490 -14.388 -34.051 1.00 0.00 C ATOM 1555 SG CYS A 125 -81.994 -13.880 -32.377 1.00 0.00 S ATOM 0 H CYS A 125 -80.358 -15.409 -33.123 1.00 0.00 H new ATOM 0 HA CYS A 125 -81.865 -15.788 -35.547 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.864 -13.511 -34.579 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.321 -15.088 -33.965 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.406 -13.944 -35.805 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.636 -13.091 -36.725 1.00 0.00 C ATOM 1562 C HIS A 126 -79.029 -11.626 -36.607 1.00 0.00 C ATOM 1563 O HIS A 126 -78.714 -10.822 -37.484 1.00 0.00 O ATOM 1564 CB HIS A 126 -78.812 -13.557 -38.176 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.221 -14.907 -38.447 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -78.981 -16.035 -38.682 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -76.930 -15.306 -38.522 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -78.182 -17.065 -38.886 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -76.934 -16.651 -38.792 1.00 0.00 N ATOM 0 H HIS A 126 -78.828 -14.477 -35.155 1.00 0.00 H new ATOM 0 HA HIS A 126 -77.588 -13.184 -36.440 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.875 -13.580 -38.415 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.351 -12.827 -38.842 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -76.058 -14.681 -38.393 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -78.497 -18.077 -39.095 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -76.106 -17.236 -38.902 1.00 0.00 H new ATOM 1578 N SER A 127 -79.687 -11.287 -35.503 1.00 0.00 N ATOM 1579 CA SER A 127 -80.202 -9.944 -35.279 1.00 0.00 C ATOM 1580 C SER A 127 -81.106 -9.520 -36.432 1.00 0.00 C ATOM 1581 O SER A 127 -80.951 -8.428 -36.979 1.00 0.00 O ATOM 1582 CB SER A 127 -79.049 -8.952 -35.131 1.00 0.00 C ATOM 1583 OG SER A 127 -77.884 -9.601 -34.644 1.00 0.00 O ATOM 0 H SER A 127 -79.877 -11.936 -34.740 1.00 0.00 H new ATOM 0 HA SER A 127 -80.786 -9.949 -34.359 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.836 -8.488 -36.094 1.00 0.00 H new ATOM 0 HB3 SER A 127 -79.337 -8.152 -34.449 1.00 0.00 H new ATOM 0 HG SER A 127 -77.314 -9.859 -35.398 1.00 0.00 H new ATOM 1589 N LEU A 128 -82.032 -10.399 -36.818 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.987 -10.070 -37.864 1.00 0.00 C ATOM 1591 C LEU A 128 -83.714 -8.780 -37.518 1.00 0.00 C ATOM 1592 O LEU A 128 -84.220 -8.608 -36.406 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.981 -11.213 -38.099 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.376 -12.483 -38.713 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.466 -13.479 -39.067 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.547 -12.148 -39.944 1.00 0.00 C ATOM 0 H LEU A 128 -82.137 -11.334 -36.424 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.437 -9.925 -38.794 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.444 -11.473 -37.147 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.776 -10.854 -38.753 1.00 0.00 H new ATOM 0 HG LEU A 128 -82.720 -12.936 -37.970 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -84.016 -14.372 -39.501 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.017 -13.751 -38.167 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -85.149 -13.030 -39.788 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.129 -13.064 -40.361 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -83.180 -11.666 -40.689 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -81.737 -11.474 -39.665 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.758 -7.886 -38.483 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.208 -6.550 -38.238 1.00 0.00 C ATOM 1610 C GLY A 129 -85.586 -6.314 -38.796 1.00 0.00 C ATOM 1611 O GLY A 129 -86.182 -7.202 -39.409 1.00 0.00 O ATOM 0 H GLY A 129 -83.484 -8.071 -39.448 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.213 -6.359 -37.165 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.509 -5.843 -38.685 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.068 -5.105 -38.619 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.397 -4.733 -39.023 1.00 0.00 C ATOM 1617 C LEU A 130 -87.394 -3.254 -39.339 1.00 0.00 C ATOM 1618 O LEU A 130 -86.789 -2.459 -38.632 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.404 -5.059 -37.917 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.009 -6.466 -37.975 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.734 -6.794 -36.682 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -89.968 -6.585 -39.151 1.00 0.00 C ATOM 0 H LEU A 130 -85.540 -4.347 -38.186 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.696 -5.296 -39.907 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -87.913 -4.932 -36.952 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.214 -4.331 -37.960 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.195 -7.178 -38.108 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.155 -7.797 -36.746 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.032 -6.747 -35.849 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.536 -6.073 -36.521 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.388 -7.590 -39.177 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.772 -5.858 -39.040 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.431 -6.392 -40.080 1.00 0.00 H new ATOM 1634 N THR A 131 -88.010 -2.888 -40.425 1.00 0.00 N ATOM 1635 CA THR A 131 -87.998 -1.507 -40.849 1.00 0.00 C ATOM 1636 C THR A 131 -89.358 -1.111 -41.403 1.00 0.00 C ATOM 1637 O THR A 131 -89.725 -1.527 -42.500 1.00 0.00 O ATOM 1638 CB THR A 131 -86.887 -1.334 -41.886 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.615 -1.450 -41.235 1.00 0.00 O ATOM 1640 CG2 THR A 131 -86.978 -0.006 -42.621 1.00 0.00 C ATOM 0 H THR A 131 -88.527 -3.520 -41.036 1.00 0.00 H new ATOM 0 HA THR A 131 -87.799 -0.849 -40.003 1.00 0.00 H new ATOM 0 HB THR A 131 -87.004 -2.118 -42.634 1.00 0.00 H new ATOM 0 HG1 THR A 131 -84.899 -1.342 -41.895 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.166 0.065 -43.345 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.934 0.058 -43.140 1.00 0.00 H new ATOM 0 HG23 THR A 131 -86.899 0.812 -41.905 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.114 -0.347 -40.598 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.518 -0.028 -40.886 1.00 0.00 C ATOM 1650 C CYS A 132 -91.698 0.423 -42.319 1.00 0.00 C ATOM 1651 O CYS A 132 -91.359 1.547 -42.698 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.053 1.006 -39.904 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.124 0.394 -38.194 1.00 0.00 S ATOM 0 H CYS A 132 -89.768 0.065 -39.731 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.101 -0.940 -40.759 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.421 1.894 -39.940 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.052 1.312 -40.216 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.223 -0.512 -43.092 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.355 -0.419 -44.523 1.00 0.00 C ATOM 1660 C LEU A 133 -90.978 -0.489 -45.186 1.00 0.00 C ATOM 1661 O LEU A 133 -90.579 -1.534 -45.705 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.121 0.846 -44.944 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.121 1.153 -46.447 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -93.730 0.010 -47.248 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -93.863 2.449 -46.716 1.00 0.00 C ATOM 0 H LEU A 133 -92.582 -1.390 -42.717 1.00 0.00 H new ATOM 0 HA LEU A 133 -92.944 -1.270 -44.865 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.155 0.751 -44.611 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -92.694 1.699 -44.417 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.086 1.266 -46.769 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -93.714 0.260 -48.309 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.153 -0.899 -47.081 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -94.760 -0.150 -46.928 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -93.856 2.657 -47.786 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -94.893 2.357 -46.370 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.374 3.265 -46.185 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.249 0.616 -45.124 1.00 0.00 N ATOM 1678 CA GLU A 134 -88.900 0.701 -45.676 1.00 0.00 C ATOM 1679 C GLU A 134 -88.209 1.964 -45.178 1.00 0.00 C ATOM 1680 O GLU A 134 -88.741 2.675 -44.321 1.00 0.00 O ATOM 1681 CB GLU A 134 -88.918 0.693 -47.207 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.737 1.814 -47.822 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.350 2.083 -49.259 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -89.629 1.235 -50.131 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -88.760 3.149 -49.523 1.00 0.00 O ATOM 0 H GLU A 134 -90.574 1.480 -44.690 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.348 -0.176 -45.338 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -87.893 0.763 -47.572 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -89.314 -0.263 -47.550 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.795 1.557 -47.775 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -89.604 2.723 -47.235 1.00 0.00 H new TER 1692 GLU A 134