USER MOD reduce.3.24.130724 H: found=0, std=0, add=1398, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1392 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 52 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 106 HIS :FLIP no HD1:sc= -2.78! C(o=-3.7!,f=-2.8!) USER MOD Set 2.1: A 46 THR OG1 : rot 59:sc= -2.65! USER MOD Set 2.2: A 101 SER OG : rot -97:sc= 0.948 USER MOD Set 3.1: A 30 ASN : amide:sc= -0.0606 K(o=-0.11,f=-0.78) USER MOD Set 3.2: A 56 TYR OH : rot 180:sc= -0.0534 USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.0847 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.019 K(o=-0.019,f=-0.54) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0.0683 K(o=0.068,f=-4!) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0017 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.0093) USER MOD Single : A 20 MET CE :methyl 165:sc= -6.55! (180deg=-7.8!) USER MOD Single : A 25 THR OG1 : rot -129:sc= -0.313 USER MOD Single : A 26 HIS :FLIP no HD1:sc= -5.62 F(o=-7.2!,f=-5.6) USER MOD Single : A 27 ASN : amide:sc=-0.00012 X(o=-0.00012,f=-0.14) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 49:sc= 0.499 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.00732 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -120:sc= -0.143 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -88:sc= -3.31! USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0304 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.66) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot -79:sc= -2.67! USER MOD Single : A 107 CYS SG : rot -140:sc= -2.46 USER MOD Single : A 125 SER OG : rot -156:sc= -0.113 USER MOD Single : A 127 MET CE :methyl -115:sc= -6.64! (180deg=-12.5!) USER MOD Single : A 128 LYS NZ :NH3+ -127:sc= 0.613 (180deg=-0.248) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 138 GLN : amide:sc= -0.442 K(o=-0.44,f=-2.9!) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 162:sc= -1.56! (180deg=-2.27!) USER MOD Single : A 148 GLN :FLIP amide:sc= -11.9! C(o=-13!,f=-12!) USER MOD Single : A 150 THR OG1 : rot 108:sc= 1.13 USER MOD Single : A 151 TYR OH : rot -37:sc= -4.77! USER MOD Single : A 154 LYS NZ :NH3+ -106:sc= 0.692 (180deg=-0.591) USER MOD Single : A 155 TYR OH : rot -89:sc= -4.54! USER MOD Single : A 158 LYS NZ :NH3+ 147:sc= -0.101 (180deg=-1.28!) USER MOD Single : A 159 GLN : amide:sc= -0.0106 K(o=-0.011,f=-1.1) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.39) USER MOD Single : A 168 THR OG1 : rot 180:sc= 0 USER MOD Single : A 169 HIS : no HD1:sc= -0.0215 X(o=-0.022,f=0) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.999 28.534 -17.142 1.00 0.00 N ATOM 2 CA GLY A 1 -18.761 28.429 -18.416 1.00 0.00 C ATOM 3 C GLY A 1 -20.213 28.055 -18.195 1.00 0.00 C ATOM 4 O GLY A 1 -20.706 28.095 -17.068 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.550 29.470 -17.082 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.647 28.409 -16.338 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.266 27.796 -17.114 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.711 29.381 -18.945 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.291 27.683 -19.057 1.00 0.00 H new ATOM 10 N SER A 2 -20.898 27.689 -19.273 1.00 0.00 N ATOM 11 CA SER A 2 -22.303 27.305 -19.193 1.00 0.00 C ATOM 12 C SER A 2 -22.444 25.822 -18.867 1.00 0.00 C ATOM 13 O SER A 2 -23.106 25.449 -17.899 1.00 0.00 O ATOM 14 CB SER A 2 -23.016 27.620 -20.508 1.00 0.00 C ATOM 15 OG SER A 2 -24.362 27.176 -20.479 1.00 0.00 O ATOM 0 H SER A 2 -20.503 27.650 -20.213 1.00 0.00 H new ATOM 0 HA SER A 2 -22.765 27.880 -18.391 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.988 28.694 -20.692 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.490 27.141 -21.334 1.00 0.00 H new ATOM 0 HG SER A 2 -24.796 27.391 -21.331 1.00 0.00 H new ATOM 21 N HIS A 3 -21.817 24.980 -19.683 1.00 0.00 N ATOM 22 CA HIS A 3 -21.873 23.537 -19.482 1.00 0.00 C ATOM 23 C HIS A 3 -20.808 23.084 -18.489 1.00 0.00 C ATOM 24 O HIS A 3 -19.873 23.825 -18.185 1.00 0.00 O ATOM 25 CB HIS A 3 -21.690 22.808 -20.813 1.00 0.00 C ATOM 26 CG HIS A 3 -22.609 23.290 -21.891 1.00 0.00 C ATOM 27 ND1 HIS A 3 -22.388 24.445 -22.611 1.00 0.00 N ATOM 28 CD2 HIS A 3 -23.762 22.766 -22.374 1.00 0.00 C ATOM 29 CE1 HIS A 3 -23.361 24.614 -23.486 1.00 0.00 C ATOM 30 NE2 HIS A 3 -24.208 23.608 -23.365 1.00 0.00 N ATOM 0 H HIS A 3 -21.265 25.273 -20.489 1.00 0.00 H new ATOM 0 HA HIS A 3 -22.853 23.290 -19.073 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -20.659 22.929 -21.145 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -21.852 21.741 -20.659 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -24.241 21.857 -22.042 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -23.450 25.435 -24.182 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -25.056 23.477 -23.917 1.00 0.00 H new ATOM 38 N MET A 4 -20.955 21.862 -17.988 1.00 0.00 N ATOM 39 CA MET A 4 -20.005 21.309 -17.029 1.00 0.00 C ATOM 40 C MET A 4 -18.930 20.492 -17.739 1.00 0.00 C ATOM 41 O MET A 4 -19.021 20.237 -18.940 1.00 0.00 O ATOM 42 CB MET A 4 -20.732 20.439 -16.002 1.00 0.00 C ATOM 43 CG MET A 4 -20.249 20.649 -14.576 1.00 0.00 C ATOM 44 SD MET A 4 -20.463 22.347 -14.012 1.00 0.00 S ATOM 45 CE MET A 4 -21.353 22.087 -12.480 1.00 0.00 C ATOM 0 H MET A 4 -21.723 21.236 -18.230 1.00 0.00 H new ATOM 0 HA MET A 4 -19.522 22.139 -16.512 1.00 0.00 H new ATOM 0 HB2 MET A 4 -21.800 20.651 -16.050 1.00 0.00 H new ATOM 0 HB3 MET A 4 -20.603 19.390 -16.270 1.00 0.00 H new ATOM 0 HG2 MET A 4 -20.792 19.978 -13.910 1.00 0.00 H new ATOM 0 HG3 MET A 4 -19.195 20.379 -14.510 1.00 0.00 H new ATOM 0 HE1 MET A 4 -21.559 23.049 -12.011 1.00 0.00 H new ATOM 0 HE2 MET A 4 -22.293 21.576 -12.688 1.00 0.00 H new ATOM 0 HE3 MET A 4 -20.749 21.478 -11.807 1.00 0.00 H new ATOM 55 N ALA A 5 -17.912 20.083 -16.988 1.00 0.00 N ATOM 56 CA ALA A 5 -16.820 19.295 -17.545 1.00 0.00 C ATOM 57 C ALA A 5 -16.831 17.873 -16.992 1.00 0.00 C ATOM 58 O ALA A 5 -16.464 17.642 -15.840 1.00 0.00 O ATOM 59 CB ALA A 5 -15.485 19.964 -17.256 1.00 0.00 C ATOM 0 H ALA A 5 -17.821 20.285 -15.992 1.00 0.00 H new ATOM 0 HA ALA A 5 -16.960 19.239 -18.625 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -14.679 19.364 -17.678 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -15.471 20.957 -17.704 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -15.347 20.050 -16.178 1.00 0.00 H new ATOM 65 N ARG A 6 -17.254 16.924 -17.822 1.00 0.00 N ATOM 66 CA ARG A 6 -17.313 15.525 -17.416 1.00 0.00 C ATOM 67 C ARG A 6 -16.801 14.615 -18.528 1.00 0.00 C ATOM 68 O ARG A 6 -17.267 14.685 -19.665 1.00 0.00 O ATOM 69 CB ARG A 6 -18.746 15.140 -17.044 1.00 0.00 C ATOM 70 CG ARG A 6 -19.031 15.225 -15.553 1.00 0.00 C ATOM 71 CD ARG A 6 -20.469 14.846 -15.236 1.00 0.00 C ATOM 72 NE ARG A 6 -20.638 13.401 -15.098 1.00 0.00 N ATOM 73 CZ ARG A 6 -20.898 12.581 -16.116 1.00 0.00 C ATOM 74 NH1 ARG A 6 -21.020 13.054 -17.350 1.00 0.00 N ATOM 75 NH2 ARG A 6 -21.036 11.280 -15.896 1.00 0.00 N ATOM 0 H ARG A 6 -17.561 17.099 -18.779 1.00 0.00 H new ATOM 0 HA ARG A 6 -16.673 15.398 -16.543 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -19.438 15.793 -17.576 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -18.941 14.123 -17.385 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -18.352 14.564 -15.014 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -18.835 16.238 -15.202 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -20.778 15.337 -14.313 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -21.123 15.213 -16.027 1.00 0.00 H new ATOM 0 HE ARG A 6 -20.552 12.995 -14.166 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -20.915 14.053 -17.526 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -21.219 12.418 -18.122 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -20.943 10.910 -14.950 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -21.235 10.650 -16.673 1.00 0.00 H new ATOM 89 N MET A 7 -15.838 13.762 -18.193 1.00 0.00 N ATOM 90 CA MET A 7 -15.263 12.839 -19.163 1.00 0.00 C ATOM 91 C MET A 7 -15.145 11.436 -18.577 1.00 0.00 C ATOM 92 O MET A 7 -15.519 10.451 -19.214 1.00 0.00 O ATOM 93 CB MET A 7 -13.886 13.332 -19.615 1.00 0.00 C ATOM 94 CG MET A 7 -13.933 14.644 -20.381 1.00 0.00 C ATOM 95 SD MET A 7 -12.382 15.010 -21.226 1.00 0.00 S ATOM 96 CE MET A 7 -12.794 16.550 -22.041 1.00 0.00 C ATOM 0 H MET A 7 -15.440 13.691 -17.257 1.00 0.00 H new ATOM 0 HA MET A 7 -15.928 12.798 -20.025 1.00 0.00 H new ATOM 0 HB2 MET A 7 -13.247 13.454 -18.740 1.00 0.00 H new ATOM 0 HB3 MET A 7 -13.424 12.570 -20.243 1.00 0.00 H new ATOM 0 HG2 MET A 7 -14.740 14.605 -21.112 1.00 0.00 H new ATOM 0 HG3 MET A 7 -14.167 15.455 -19.691 1.00 0.00 H new ATOM 0 HE1 MET A 7 -11.932 16.904 -22.606 1.00 0.00 H new ATOM 0 HE2 MET A 7 -13.632 16.390 -22.719 1.00 0.00 H new ATOM 0 HE3 MET A 7 -13.069 17.295 -21.294 1.00 0.00 H new ATOM 106 N ASN A 8 -14.622 11.352 -17.357 1.00 0.00 N ATOM 107 CA ASN A 8 -14.455 10.070 -16.683 1.00 0.00 C ATOM 108 C ASN A 8 -14.025 10.269 -15.234 1.00 0.00 C ATOM 109 O ASN A 8 -13.453 11.301 -14.882 1.00 0.00 O ATOM 110 CB ASN A 8 -13.424 9.214 -17.421 1.00 0.00 C ATOM 111 CG ASN A 8 -13.807 7.747 -17.453 1.00 0.00 C ATOM 112 OD1 ASN A 8 -14.122 7.153 -16.421 1.00 0.00 O ATOM 113 ND2 ASN A 8 -13.783 7.154 -18.641 1.00 0.00 N ATOM 0 H ASN A 8 -14.307 12.157 -16.816 1.00 0.00 H new ATOM 0 HA ASN A 8 -15.416 9.556 -16.690 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -13.315 9.581 -18.442 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.453 9.323 -16.938 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.032 6.168 -18.724 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -13.516 7.684 -19.470 1.00 0.00 H new ATOM 120 N ARG A 9 -14.304 9.275 -14.397 1.00 0.00 N ATOM 121 CA ARG A 9 -13.945 9.341 -12.985 1.00 0.00 C ATOM 122 C ARG A 9 -13.215 8.072 -12.549 1.00 0.00 C ATOM 123 O ARG A 9 -13.505 6.981 -13.039 1.00 0.00 O ATOM 124 CB ARG A 9 -15.197 9.544 -12.128 1.00 0.00 C ATOM 125 CG ARG A 9 -16.315 8.563 -12.444 1.00 0.00 C ATOM 126 CD ARG A 9 -17.658 9.073 -11.950 1.00 0.00 C ATOM 127 NE ARG A 9 -18.517 7.988 -11.478 1.00 0.00 N ATOM 128 CZ ARG A 9 -19.622 8.176 -10.760 1.00 0.00 C ATOM 129 NH1 ARG A 9 -20.008 9.403 -10.431 1.00 0.00 N ATOM 130 NH2 ARG A 9 -20.344 7.135 -10.371 1.00 0.00 N ATOM 0 H ARG A 9 -14.777 8.414 -14.672 1.00 0.00 H new ATOM 0 HA ARG A 9 -13.276 10.190 -12.845 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -14.927 9.448 -11.076 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -15.565 10.560 -12.271 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -16.361 8.396 -13.520 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -16.098 7.600 -11.981 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -17.499 9.787 -11.142 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -18.161 9.609 -12.755 1.00 0.00 H new ATOM 0 HE ARG A 9 -18.254 7.031 -11.713 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -19.457 10.208 -10.729 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -20.856 9.541 -9.881 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -20.053 6.190 -10.622 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -21.191 7.279 -9.821 1.00 0.00 H new ATOM 144 N PRO A 10 -12.254 8.199 -11.616 1.00 0.00 N ATOM 145 CA PRO A 10 -11.485 7.057 -11.116 1.00 0.00 C ATOM 146 C PRO A 10 -12.305 6.166 -10.190 1.00 0.00 C ATOM 147 O PRO A 10 -12.667 6.572 -9.085 1.00 0.00 O ATOM 148 CB PRO A 10 -10.338 7.715 -10.349 1.00 0.00 C ATOM 149 CG PRO A 10 -10.888 9.024 -9.901 1.00 0.00 C ATOM 150 CD PRO A 10 -11.844 9.465 -10.977 1.00 0.00 C ATOM 0 HA PRO A 10 -11.157 6.400 -11.922 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -10.027 7.105 -9.501 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -9.462 7.849 -10.984 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -11.398 8.925 -8.943 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -10.091 9.755 -9.764 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -12.698 9.999 -10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -11.364 10.137 -11.689 1.00 0.00 H new ATOM 158 N ALA A 11 -12.594 4.952 -10.646 1.00 0.00 N ATOM 159 CA ALA A 11 -13.371 4.005 -9.856 1.00 0.00 C ATOM 160 C ALA A 11 -12.517 3.373 -8.759 1.00 0.00 C ATOM 161 O ALA A 11 -11.334 3.100 -8.963 1.00 0.00 O ATOM 162 CB ALA A 11 -13.960 2.929 -10.754 1.00 0.00 C ATOM 0 H ALA A 11 -12.302 4.601 -11.558 1.00 0.00 H new ATOM 0 HA ALA A 11 -14.185 4.550 -9.378 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.538 2.228 -10.151 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.610 3.391 -11.497 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.155 2.395 -11.259 1.00 0.00 H new ATOM 168 N PRO A 12 -13.107 3.132 -7.574 1.00 0.00 N ATOM 169 CA PRO A 12 -12.391 2.530 -6.445 1.00 0.00 C ATOM 170 C PRO A 12 -12.123 1.043 -6.654 1.00 0.00 C ATOM 171 O PRO A 12 -12.750 0.402 -7.498 1.00 0.00 O ATOM 172 CB PRO A 12 -13.345 2.741 -5.270 1.00 0.00 C ATOM 173 CG PRO A 12 -14.698 2.790 -5.890 1.00 0.00 C ATOM 174 CD PRO A 12 -14.515 3.426 -7.241 1.00 0.00 C ATOM 0 HA PRO A 12 -11.408 2.977 -6.300 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.269 1.929 -4.547 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -13.119 3.665 -4.737 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -15.120 1.789 -5.984 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.387 3.370 -5.276 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -15.198 3.005 -7.979 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.704 4.499 -7.208 1.00 0.00 H new ATOM 182 N VAL A 13 -11.190 0.499 -5.878 1.00 0.00 N ATOM 183 CA VAL A 13 -10.845 -0.913 -5.976 1.00 0.00 C ATOM 184 C VAL A 13 -10.514 -1.484 -4.603 1.00 0.00 C ATOM 185 O VAL A 13 -9.677 -0.943 -3.881 1.00 0.00 O ATOM 186 CB VAL A 13 -9.648 -1.141 -6.918 1.00 0.00 C ATOM 187 CG1 VAL A 13 -9.456 -2.625 -7.189 1.00 0.00 C ATOM 188 CG2 VAL A 13 -9.839 -0.375 -8.219 1.00 0.00 C ATOM 0 H VAL A 13 -10.661 1.015 -5.175 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.715 -1.426 -6.386 1.00 0.00 H new ATOM 0 HB VAL A 13 -8.749 -0.765 -6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.606 -2.766 -7.856 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.270 -3.145 -6.249 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.354 -3.029 -7.656 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.984 -0.548 -8.872 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.748 -0.718 -8.713 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.922 0.691 -8.005 1.00 0.00 H new ATOM 198 N GLU A 14 -11.178 -2.574 -4.241 1.00 0.00 N ATOM 199 CA GLU A 14 -10.953 -3.202 -2.946 1.00 0.00 C ATOM 200 C GLU A 14 -10.251 -4.549 -3.092 1.00 0.00 C ATOM 201 O GLU A 14 -10.683 -5.408 -3.862 1.00 0.00 O ATOM 202 CB GLU A 14 -12.282 -3.390 -2.208 1.00 0.00 C ATOM 203 CG GLU A 14 -13.293 -2.284 -2.470 1.00 0.00 C ATOM 204 CD GLU A 14 -14.259 -2.630 -3.586 1.00 0.00 C ATOM 205 OE1 GLU A 14 -15.185 -3.433 -3.341 1.00 0.00 O ATOM 206 OE2 GLU A 14 -14.091 -2.100 -4.704 1.00 0.00 O ATOM 0 H GLU A 14 -11.874 -3.040 -4.823 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.307 -2.542 -2.368 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.718 -4.345 -2.502 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.087 -3.445 -1.137 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.854 -2.086 -1.557 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.764 -1.366 -2.724 1.00 0.00 H new ATOM 213 N VAL A 15 -9.180 -4.733 -2.327 1.00 0.00 N ATOM 214 CA VAL A 15 -8.425 -5.983 -2.341 1.00 0.00 C ATOM 215 C VAL A 15 -8.714 -6.752 -1.058 1.00 0.00 C ATOM 216 O VAL A 15 -8.459 -6.256 0.039 1.00 0.00 O ATOM 217 CB VAL A 15 -6.896 -5.748 -2.468 1.00 0.00 C ATOM 218 CG1 VAL A 15 -6.325 -6.534 -3.641 1.00 0.00 C ATOM 219 CG2 VAL A 15 -6.578 -4.265 -2.617 1.00 0.00 C ATOM 0 H VAL A 15 -8.813 -4.029 -1.686 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.741 -6.553 -3.215 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.427 -6.105 -1.551 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.252 -6.355 -3.711 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.506 -7.598 -3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.808 -6.213 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.500 -4.131 -2.704 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.065 -3.876 -3.511 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.941 -3.725 -1.742 1.00 0.00 H new ATOM 229 N SER A 16 -9.274 -7.950 -1.191 1.00 0.00 N ATOM 230 CA SER A 16 -9.623 -8.752 -0.025 1.00 0.00 C ATOM 231 C SER A 16 -8.792 -10.024 0.068 1.00 0.00 C ATOM 232 O SER A 16 -8.325 -10.555 -0.938 1.00 0.00 O ATOM 233 CB SER A 16 -11.109 -9.108 -0.058 1.00 0.00 C ATOM 234 OG SER A 16 -11.584 -9.195 -1.391 1.00 0.00 O ATOM 0 H SER A 16 -9.494 -8.384 -2.087 1.00 0.00 H new ATOM 0 HA SER A 16 -9.406 -8.150 0.858 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.270 -10.058 0.451 1.00 0.00 H new ATOM 0 HB3 SER A 16 -11.679 -8.354 0.486 1.00 0.00 H new ATOM 0 HG SER A 16 -12.536 -9.426 -1.384 1.00 0.00 H new ATOM 240 N TYR A 17 -8.624 -10.505 1.294 1.00 0.00 N ATOM 241 CA TYR A 17 -7.865 -11.719 1.550 1.00 0.00 C ATOM 242 C TYR A 17 -8.325 -12.360 2.858 1.00 0.00 C ATOM 243 O TYR A 17 -8.122 -11.805 3.937 1.00 0.00 O ATOM 244 CB TYR A 17 -6.367 -11.409 1.608 1.00 0.00 C ATOM 245 CG TYR A 17 -5.532 -12.543 2.163 1.00 0.00 C ATOM 246 CD1 TYR A 17 -5.578 -13.811 1.598 1.00 0.00 C ATOM 247 CD2 TYR A 17 -4.699 -12.342 3.255 1.00 0.00 C ATOM 248 CE1 TYR A 17 -4.818 -14.846 2.108 1.00 0.00 C ATOM 249 CE2 TYR A 17 -3.936 -13.370 3.769 1.00 0.00 C ATOM 250 CZ TYR A 17 -3.997 -14.620 3.193 1.00 0.00 C ATOM 251 OH TYR A 17 -3.237 -15.647 3.703 1.00 0.00 O ATOM 0 H TYR A 17 -9.008 -10.067 2.132 1.00 0.00 H new ATOM 0 HA TYR A 17 -8.042 -12.420 0.734 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -6.016 -11.168 0.605 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -6.212 -10.521 2.222 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -6.218 -13.991 0.747 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -4.647 -11.364 3.710 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -4.867 -15.827 1.659 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -3.294 -13.196 4.619 1.00 0.00 H new ATOM 0 HH TYR A 17 -2.714 -15.320 4.465 1.00 0.00 H new ATOM 261 N LYS A 18 -8.945 -13.529 2.750 1.00 0.00 N ATOM 262 CA LYS A 18 -9.437 -14.251 3.920 1.00 0.00 C ATOM 263 C LYS A 18 -10.567 -13.486 4.609 1.00 0.00 C ATOM 264 O LYS A 18 -11.744 -13.779 4.391 1.00 0.00 O ATOM 265 CB LYS A 18 -8.296 -14.517 4.907 1.00 0.00 C ATOM 266 CG LYS A 18 -7.215 -15.431 4.353 1.00 0.00 C ATOM 267 CD LYS A 18 -7.679 -16.879 4.302 1.00 0.00 C ATOM 268 CE LYS A 18 -7.373 -17.518 2.957 1.00 0.00 C ATOM 269 NZ LYS A 18 -8.416 -17.203 1.943 1.00 0.00 N ATOM 0 H LYS A 18 -9.120 -13.999 1.862 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.835 -15.206 3.578 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -7.845 -13.567 5.194 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.707 -14.961 5.814 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.937 -15.102 3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.321 -15.356 4.973 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -7.191 -17.446 5.094 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.751 -16.925 4.492 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.404 -17.169 2.601 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -7.298 -18.599 3.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -8.171 -17.657 1.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.337 -17.558 2.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -8.470 -16.173 1.809 1.00 0.00 H new ATOM 283 N HIS A 19 -10.212 -12.514 5.448 1.00 0.00 N ATOM 284 CA HIS A 19 -11.211 -11.728 6.167 1.00 0.00 C ATOM 285 C HIS A 19 -10.970 -10.227 6.012 1.00 0.00 C ATOM 286 O HIS A 19 -11.911 -9.457 5.819 1.00 0.00 O ATOM 287 CB HIS A 19 -11.208 -12.102 7.651 1.00 0.00 C ATOM 288 CG HIS A 19 -12.152 -13.214 7.991 1.00 0.00 C ATOM 289 ND1 HIS A 19 -13.213 -13.062 8.856 1.00 0.00 N ATOM 290 CD2 HIS A 19 -12.191 -14.502 7.575 1.00 0.00 C ATOM 291 CE1 HIS A 19 -13.864 -14.206 8.961 1.00 0.00 C ATOM 292 NE2 HIS A 19 -13.265 -15.096 8.192 1.00 0.00 N ATOM 0 H HIS A 19 -9.246 -12.254 5.645 1.00 0.00 H new ATOM 0 HA HIS A 19 -12.184 -11.958 5.733 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -10.198 -12.392 7.942 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -11.469 -11.222 8.239 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -11.506 -14.974 6.887 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -14.737 -14.383 9.572 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -13.553 -16.067 8.075 1.00 0.00 H new ATOM 300 N MET A 20 -9.711 -9.816 6.108 1.00 0.00 N ATOM 301 CA MET A 20 -9.359 -8.399 5.988 1.00 0.00 C ATOM 302 C MET A 20 -9.457 -7.928 4.540 1.00 0.00 C ATOM 303 O MET A 20 -9.253 -8.704 3.607 1.00 0.00 O ATOM 304 CB MET A 20 -7.948 -8.138 6.531 1.00 0.00 C ATOM 305 CG MET A 20 -6.983 -9.297 6.340 1.00 0.00 C ATOM 306 SD MET A 20 -5.279 -8.752 6.133 1.00 0.00 S ATOM 307 CE MET A 20 -5.242 -8.446 4.370 1.00 0.00 C ATOM 0 H MET A 20 -8.918 -10.437 6.268 1.00 0.00 H new ATOM 0 HA MET A 20 -10.074 -7.832 6.584 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.539 -7.255 6.040 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.017 -7.908 7.594 1.00 0.00 H new ATOM 0 HG2 MET A 20 -7.046 -9.963 7.201 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.284 -9.876 5.467 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.358 -7.859 4.121 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.208 -9.396 3.836 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.137 -7.897 4.077 1.00 0.00 H new ATOM 317 N ARG A 21 -9.784 -6.649 4.361 1.00 0.00 N ATOM 318 CA ARG A 21 -9.922 -6.072 3.027 1.00 0.00 C ATOM 319 C ARG A 21 -9.171 -4.746 2.909 1.00 0.00 C ATOM 320 O ARG A 21 -8.797 -4.137 3.911 1.00 0.00 O ATOM 321 CB ARG A 21 -11.400 -5.855 2.695 1.00 0.00 C ATOM 322 CG ARG A 21 -12.280 -7.060 2.993 1.00 0.00 C ATOM 323 CD ARG A 21 -13.580 -6.653 3.666 1.00 0.00 C ATOM 324 NE ARG A 21 -14.734 -7.337 3.088 1.00 0.00 N ATOM 325 CZ ARG A 21 -15.914 -7.444 3.695 1.00 0.00 C ATOM 326 NH1 ARG A 21 -16.099 -6.912 4.898 1.00 0.00 N ATOM 327 NH2 ARG A 21 -16.910 -8.083 3.099 1.00 0.00 N ATOM 0 H ARG A 21 -9.958 -5.994 5.123 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.487 -6.776 2.317 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.768 -4.999 3.261 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.492 -5.602 1.639 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.500 -7.588 2.065 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.740 -7.755 3.635 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.522 -6.877 4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -13.714 -5.575 3.574 1.00 0.00 H new ATOM 0 HE ARG A 21 -14.630 -7.758 2.165 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -15.335 -6.419 5.361 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -17.005 -6.996 5.359 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -16.773 -8.493 2.175 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -17.814 -8.165 3.564 1.00 0.00 H new ATOM 341 N PHE A 22 -8.961 -4.311 1.670 1.00 0.00 N ATOM 342 CA PHE A 22 -8.263 -3.059 1.389 1.00 0.00 C ATOM 343 C PHE A 22 -9.099 -2.185 0.459 1.00 0.00 C ATOM 344 O PHE A 22 -9.928 -2.692 -0.294 1.00 0.00 O ATOM 345 CB PHE A 22 -6.908 -3.347 0.738 1.00 0.00 C ATOM 346 CG PHE A 22 -5.785 -3.529 1.718 1.00 0.00 C ATOM 347 CD1 PHE A 22 -5.174 -2.432 2.303 1.00 0.00 C ATOM 348 CD2 PHE A 22 -5.337 -4.798 2.050 1.00 0.00 C ATOM 349 CE1 PHE A 22 -4.139 -2.597 3.203 1.00 0.00 C ATOM 350 CE2 PHE A 22 -4.303 -4.969 2.949 1.00 0.00 C ATOM 351 CZ PHE A 22 -3.704 -3.867 3.527 1.00 0.00 C ATOM 0 H PHE A 22 -9.268 -4.813 0.836 1.00 0.00 H new ATOM 0 HA PHE A 22 -8.106 -2.531 2.330 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -6.993 -4.246 0.128 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.659 -2.527 0.064 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.511 -1.437 2.053 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.802 -5.663 1.600 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.671 -1.734 3.653 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.963 -5.963 3.200 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.896 -3.998 4.232 1.00 0.00 H new ATOM 361 N LEU A 23 -8.873 -0.875 0.505 1.00 0.00 N ATOM 362 CA LEU A 23 -9.610 0.048 -0.354 1.00 0.00 C ATOM 363 C LEU A 23 -8.666 0.917 -1.163 1.00 0.00 C ATOM 364 O LEU A 23 -7.690 1.452 -0.641 1.00 0.00 O ATOM 365 CB LEU A 23 -10.540 0.950 0.459 1.00 0.00 C ATOM 366 CG LEU A 23 -11.868 0.321 0.861 1.00 0.00 C ATOM 367 CD1 LEU A 23 -12.567 -0.292 -0.348 1.00 0.00 C ATOM 368 CD2 LEU A 23 -11.642 -0.719 1.945 1.00 0.00 C ATOM 0 H LEU A 23 -8.192 -0.431 1.122 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.208 -0.563 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.017 1.264 1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.744 1.851 -0.120 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.518 1.100 1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.513 -0.735 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.757 0.483 -1.090 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.932 -1.063 -0.783 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.596 -1.164 2.227 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.976 -1.496 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.192 -0.244 2.817 1.00 0.00 H new ATOM 380 N ILE A 24 -8.980 1.069 -2.438 1.00 0.00 N ATOM 381 CA ILE A 24 -8.185 1.893 -3.328 1.00 0.00 C ATOM 382 C ILE A 24 -9.045 3.040 -3.856 1.00 0.00 C ATOM 383 O ILE A 24 -9.928 2.830 -4.686 1.00 0.00 O ATOM 384 CB ILE A 24 -7.635 1.064 -4.508 1.00 0.00 C ATOM 385 CG1 ILE A 24 -6.573 0.071 -4.019 1.00 0.00 C ATOM 386 CG2 ILE A 24 -7.065 1.969 -5.586 1.00 0.00 C ATOM 387 CD1 ILE A 24 -5.278 0.722 -3.576 1.00 0.00 C ATOM 0 H ILE A 24 -9.786 0.628 -2.881 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.337 2.291 -2.770 1.00 0.00 H new ATOM 0 HB ILE A 24 -8.461 0.500 -4.942 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -6.982 -0.503 -3.187 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -6.357 -0.637 -4.819 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.684 1.362 -6.407 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.848 2.630 -5.957 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.254 2.566 -5.169 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.579 -0.046 -3.245 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.843 1.272 -4.410 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.479 1.409 -2.754 1.00 0.00 H new ATOM 399 N THR A 25 -8.799 4.246 -3.356 1.00 0.00 N ATOM 400 CA THR A 25 -9.574 5.411 -3.773 1.00 0.00 C ATOM 401 C THR A 25 -8.677 6.593 -4.122 1.00 0.00 C ATOM 402 O THR A 25 -7.504 6.634 -3.754 1.00 0.00 O ATOM 403 CB THR A 25 -10.552 5.814 -2.667 1.00 0.00 C ATOM 404 OG1 THR A 25 -10.036 5.474 -1.393 1.00 0.00 O ATOM 405 CG2 THR A 25 -11.910 5.161 -2.802 1.00 0.00 C ATOM 0 H THR A 25 -8.074 4.443 -2.666 1.00 0.00 H new ATOM 0 HA THR A 25 -10.127 5.134 -4.670 1.00 0.00 H new ATOM 0 HB THR A 25 -10.674 6.892 -2.768 1.00 0.00 H new ATOM 0 HG1 THR A 25 -10.710 4.970 -0.891 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.554 5.489 -1.987 1.00 0.00 H new ATOM 0 HG22 THR A 25 -12.357 5.445 -3.755 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.798 4.077 -2.762 1.00 0.00 H new ATOM 413 N HIS A 26 -9.255 7.555 -4.830 1.00 0.00 N ATOM 414 CA HIS A 26 -8.544 8.759 -5.247 1.00 0.00 C ATOM 415 C HIS A 26 -8.488 9.779 -4.118 1.00 0.00 C ATOM 416 O HIS A 26 -9.350 9.797 -3.242 1.00 0.00 O ATOM 417 CB HIS A 26 -9.197 9.374 -6.490 1.00 0.00 C ATOM 418 CG HIS A 26 -10.656 9.673 -6.333 1.00 0.00 C ATOM 419 ND1 HIS A 26 -11.740 8.862 -6.393 1.00 0.00 N flip ATOM 420 CD2 HIS A 26 -11.144 10.942 -6.102 1.00 0.00 C flip ATOM 421 CE1 HIS A 26 -12.849 9.651 -6.199 1.00 0.00 C flip ATOM 422 NE2 HIS A 26 -12.462 10.901 -6.025 1.00 0.00 N flip ATOM 0 H HIS A 26 -10.229 7.524 -5.132 1.00 0.00 H new ATOM 0 HA HIS A 26 -7.523 8.472 -5.499 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.674 10.296 -6.743 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -9.066 8.692 -7.330 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -10.541 11.832 -6.000 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -13.872 9.304 -6.190 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -13.076 11.699 -5.859 1.00 0.00 H new ATOM 430 N ASN A 27 -7.455 10.616 -4.130 1.00 0.00 N ATOM 431 CA ASN A 27 -7.283 11.622 -3.090 1.00 0.00 C ATOM 432 C ASN A 27 -8.454 12.598 -3.113 1.00 0.00 C ATOM 433 O ASN A 27 -9.124 12.751 -4.134 1.00 0.00 O ATOM 434 CB ASN A 27 -5.966 12.375 -3.286 1.00 0.00 C ATOM 435 CG ASN A 27 -4.836 11.787 -2.464 1.00 0.00 C ATOM 436 OD1 ASN A 27 -4.663 10.570 -2.407 1.00 0.00 O ATOM 437 ND2 ASN A 27 -4.059 12.652 -1.822 1.00 0.00 N ATOM 0 H ASN A 27 -6.728 10.617 -4.845 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.255 11.122 -2.122 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.693 12.355 -4.341 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -6.105 13.421 -3.012 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -3.282 12.315 -1.253 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.239 13.653 -1.898 1.00 0.00 H new ATOM 444 N PRO A 28 -8.749 13.237 -1.968 1.00 0.00 N ATOM 445 CA PRO A 28 -9.882 14.155 -1.853 1.00 0.00 C ATOM 446 C PRO A 28 -9.867 15.261 -2.895 1.00 0.00 C ATOM 447 O PRO A 28 -8.831 15.862 -3.172 1.00 0.00 O ATOM 448 CB PRO A 28 -9.733 14.741 -0.448 1.00 0.00 C ATOM 449 CG PRO A 28 -8.952 13.724 0.309 1.00 0.00 C ATOM 450 CD PRO A 28 -8.031 13.081 -0.689 1.00 0.00 C ATOM 0 HA PRO A 28 -10.827 13.637 -2.018 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -9.215 15.700 -0.472 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.705 14.916 0.013 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.388 14.188 1.118 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.612 12.985 0.764 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.058 13.572 -0.712 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -7.853 12.032 -0.454 1.00 0.00 H new ATOM 458 N THR A 29 -11.040 15.520 -3.466 1.00 0.00 N ATOM 459 CA THR A 29 -11.194 16.553 -4.478 1.00 0.00 C ATOM 460 C THR A 29 -11.744 17.825 -3.846 1.00 0.00 C ATOM 461 O THR A 29 -12.519 17.770 -2.892 1.00 0.00 O ATOM 462 CB THR A 29 -12.126 16.075 -5.593 1.00 0.00 C ATOM 463 OG1 THR A 29 -11.908 14.705 -5.875 1.00 0.00 O ATOM 464 CG2 THR A 29 -11.955 16.843 -6.886 1.00 0.00 C ATOM 0 H THR A 29 -11.902 15.023 -3.241 1.00 0.00 H new ATOM 0 HA THR A 29 -10.216 16.765 -4.910 1.00 0.00 H new ATOM 0 HB THR A 29 -13.136 16.245 -5.219 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.514 14.418 -6.589 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.645 16.454 -7.634 1.00 0.00 H new ATOM 0 HG22 THR A 29 -12.165 17.898 -6.713 1.00 0.00 H new ATOM 0 HG23 THR A 29 -10.931 16.731 -7.243 1.00 0.00 H new ATOM 472 N ASN A 30 -11.326 18.965 -4.371 1.00 0.00 N ATOM 473 CA ASN A 30 -11.762 20.250 -3.844 1.00 0.00 C ATOM 474 C ASN A 30 -13.239 20.520 -4.126 1.00 0.00 C ATOM 475 O ASN A 30 -13.801 21.480 -3.596 1.00 0.00 O ATOM 476 CB ASN A 30 -10.911 21.375 -4.435 1.00 0.00 C ATOM 477 CG ASN A 30 -10.857 21.327 -5.949 1.00 0.00 C ATOM 478 OD1 ASN A 30 -10.012 20.646 -6.530 1.00 0.00 O ATOM 479 ND2 ASN A 30 -11.762 22.051 -6.598 1.00 0.00 N ATOM 0 H ASN A 30 -10.685 19.028 -5.162 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.633 20.216 -2.762 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -11.316 22.337 -4.119 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -9.899 21.309 -4.036 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -11.775 22.057 -7.618 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -12.444 22.601 -6.076 1.00 0.00 H new ATOM 486 N ALA A 31 -13.873 19.700 -4.965 1.00 0.00 N ATOM 487 CA ALA A 31 -15.279 19.921 -5.285 1.00 0.00 C ATOM 488 C ALA A 31 -16.225 19.124 -4.386 1.00 0.00 C ATOM 489 O ALA A 31 -17.330 19.584 -4.095 1.00 0.00 O ATOM 490 CB ALA A 31 -15.538 19.582 -6.746 1.00 0.00 C ATOM 0 H ALA A 31 -13.446 18.896 -5.425 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.485 20.976 -5.105 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -16.590 19.749 -6.977 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.921 20.217 -7.382 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.289 18.536 -6.927 1.00 0.00 H new ATOM 496 N THR A 32 -15.802 17.947 -3.926 1.00 0.00 N ATOM 497 CA THR A 32 -16.652 17.149 -3.042 1.00 0.00 C ATOM 498 C THR A 32 -15.856 16.490 -1.921 1.00 0.00 C ATOM 499 O THR A 32 -15.414 15.349 -2.055 1.00 0.00 O ATOM 500 CB THR A 32 -17.388 16.079 -3.850 1.00 0.00 C ATOM 501 OG1 THR A 32 -16.473 15.291 -4.591 1.00 0.00 O ATOM 502 CG2 THR A 32 -18.396 16.650 -4.824 1.00 0.00 C ATOM 0 H THR A 32 -14.896 17.531 -4.144 1.00 0.00 H new ATOM 0 HA THR A 32 -17.371 17.827 -2.583 1.00 0.00 H new ATOM 0 HB THR A 32 -17.920 15.478 -3.113 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.743 15.000 -4.006 1.00 0.00 H new ATOM 0 HG21 THR A 32 -18.881 15.837 -5.364 1.00 0.00 H new ATOM 0 HG22 THR A 32 -19.146 17.222 -4.278 1.00 0.00 H new ATOM 0 HG23 THR A 32 -17.887 17.303 -5.533 1.00 0.00 H new ATOM 510 N LEU A 33 -15.704 17.189 -0.803 1.00 0.00 N ATOM 511 CA LEU A 33 -14.994 16.636 0.345 1.00 0.00 C ATOM 512 C LEU A 33 -15.893 15.705 1.162 1.00 0.00 C ATOM 513 O LEU A 33 -15.523 14.573 1.471 1.00 0.00 O ATOM 514 CB LEU A 33 -14.428 17.752 1.226 1.00 0.00 C ATOM 515 CG LEU A 33 -12.900 17.844 1.228 1.00 0.00 C ATOM 516 CD1 LEU A 33 -12.289 16.605 1.862 1.00 0.00 C ATOM 517 CD2 LEU A 33 -12.376 18.021 -0.190 1.00 0.00 C ATOM 0 H LEU A 33 -16.060 18.135 -0.666 1.00 0.00 H new ATOM 0 HA LEU A 33 -14.161 16.045 -0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -14.837 18.705 0.891 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -14.772 17.600 2.249 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.611 18.713 1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.202 16.690 1.854 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -12.638 16.513 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.588 15.722 1.297 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.288 18.085 -0.171 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -12.679 17.169 -0.799 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -12.785 18.936 -0.618 1.00 0.00 H new ATOM 529 N SER A 34 -17.067 16.218 1.529 1.00 0.00 N ATOM 530 CA SER A 34 -18.033 15.474 2.339 1.00 0.00 C ATOM 531 C SER A 34 -18.420 14.137 1.710 1.00 0.00 C ATOM 532 O SER A 34 -18.455 13.111 2.387 1.00 0.00 O ATOM 533 CB SER A 34 -19.290 16.318 2.556 1.00 0.00 C ATOM 534 OG SER A 34 -19.959 15.941 3.747 1.00 0.00 O ATOM 0 H SER A 34 -17.375 17.157 1.275 1.00 0.00 H new ATOM 0 HA SER A 34 -17.552 15.260 3.293 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.019 17.373 2.606 1.00 0.00 H new ATOM 0 HB3 SER A 34 -19.962 16.201 1.705 1.00 0.00 H new ATOM 0 HG SER A 34 -20.758 16.497 3.863 1.00 0.00 H new ATOM 540 N THR A 35 -18.729 14.147 0.422 1.00 0.00 N ATOM 541 CA THR A 35 -19.130 12.925 -0.266 1.00 0.00 C ATOM 542 C THR A 35 -18.051 11.850 -0.156 1.00 0.00 C ATOM 543 O THR A 35 -18.350 10.653 -0.125 1.00 0.00 O ATOM 544 CB THR A 35 -19.424 13.218 -1.737 1.00 0.00 C ATOM 545 OG1 THR A 35 -20.207 14.390 -1.868 1.00 0.00 O ATOM 546 CG2 THR A 35 -20.158 12.094 -2.436 1.00 0.00 C ATOM 0 H THR A 35 -18.711 14.980 -0.166 1.00 0.00 H new ATOM 0 HA THR A 35 -20.035 12.552 0.214 1.00 0.00 H new ATOM 0 HB THR A 35 -18.449 13.341 -2.208 1.00 0.00 H new ATOM 0 HG1 THR A 35 -20.383 14.562 -2.817 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.335 12.367 -3.476 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.556 11.186 -2.396 1.00 0.00 H new ATOM 0 HG23 THR A 35 -21.112 11.918 -1.939 1.00 0.00 H new ATOM 554 N PHE A 36 -16.796 12.280 -0.108 1.00 0.00 N ATOM 555 CA PHE A 36 -15.680 11.349 -0.021 1.00 0.00 C ATOM 556 C PHE A 36 -15.538 10.749 1.373 1.00 0.00 C ATOM 557 O PHE A 36 -15.388 9.539 1.518 1.00 0.00 O ATOM 558 CB PHE A 36 -14.379 12.045 -0.415 1.00 0.00 C ATOM 559 CG PHE A 36 -13.557 11.286 -1.418 1.00 0.00 C ATOM 560 CD1 PHE A 36 -13.738 9.923 -1.617 1.00 0.00 C ATOM 561 CD2 PHE A 36 -12.597 11.941 -2.159 1.00 0.00 C ATOM 562 CE1 PHE A 36 -12.973 9.235 -2.536 1.00 0.00 C ATOM 563 CE2 PHE A 36 -11.827 11.260 -3.080 1.00 0.00 C ATOM 564 CZ PHE A 36 -12.015 9.904 -3.268 1.00 0.00 C ATOM 0 H PHE A 36 -16.527 13.264 -0.128 1.00 0.00 H new ATOM 0 HA PHE A 36 -15.887 10.534 -0.714 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -14.614 13.028 -0.823 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.780 12.207 0.481 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -14.487 9.395 -1.045 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.445 13.001 -2.017 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.124 8.176 -2.682 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.078 11.786 -3.653 1.00 0.00 H new ATOM 0 HZ PHE A 36 -11.413 9.369 -3.987 1.00 0.00 H new ATOM 574 N ILE A 37 -15.582 11.589 2.400 1.00 0.00 N ATOM 575 CA ILE A 37 -15.450 11.104 3.767 1.00 0.00 C ATOM 576 C ILE A 37 -16.490 10.035 4.057 1.00 0.00 C ATOM 577 O ILE A 37 -16.214 9.045 4.735 1.00 0.00 O ATOM 578 CB ILE A 37 -15.601 12.239 4.796 1.00 0.00 C ATOM 579 CG1 ILE A 37 -16.803 13.124 4.465 1.00 0.00 C ATOM 580 CG2 ILE A 37 -14.326 13.066 4.875 1.00 0.00 C ATOM 581 CD1 ILE A 37 -17.144 14.112 5.559 1.00 0.00 C ATOM 0 H ILE A 37 -15.707 12.598 2.314 1.00 0.00 H new ATOM 0 HA ILE A 37 -14.449 10.683 3.858 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.777 11.788 5.773 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -16.600 13.670 3.544 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.669 12.490 4.275 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.454 13.863 5.608 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.496 12.427 5.175 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -14.114 13.502 3.899 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -18.006 14.706 5.257 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -17.379 13.572 6.476 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -16.293 14.770 5.733 1.00 0.00 H new ATOM 593 N GLU A 38 -17.686 10.247 3.532 1.00 0.00 N ATOM 594 CA GLU A 38 -18.784 9.309 3.719 1.00 0.00 C ATOM 595 C GLU A 38 -18.500 7.971 3.038 1.00 0.00 C ATOM 596 O GLU A 38 -18.622 6.917 3.661 1.00 0.00 O ATOM 597 CB GLU A 38 -20.084 9.905 3.176 1.00 0.00 C ATOM 598 CG GLU A 38 -20.784 10.833 4.155 1.00 0.00 C ATOM 599 CD GLU A 38 -21.245 10.115 5.409 1.00 0.00 C ATOM 600 OE1 GLU A 38 -21.555 8.909 5.324 1.00 0.00 O ATOM 601 OE2 GLU A 38 -21.294 10.762 6.477 1.00 0.00 O ATOM 0 H GLU A 38 -17.923 11.065 2.970 1.00 0.00 H new ATOM 0 HA GLU A 38 -18.888 9.127 4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.867 10.454 2.260 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -20.762 9.094 2.909 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -20.107 11.641 4.431 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -21.644 11.290 3.665 1.00 0.00 H new ATOM 608 N ASP A 39 -18.138 8.011 1.754 1.00 0.00 N ATOM 609 CA ASP A 39 -17.862 6.784 1.003 1.00 0.00 C ATOM 610 C ASP A 39 -16.589 6.086 1.493 1.00 0.00 C ATOM 611 O ASP A 39 -16.594 4.880 1.772 1.00 0.00 O ATOM 612 CB ASP A 39 -17.735 7.099 -0.487 1.00 0.00 C ATOM 613 CG ASP A 39 -19.080 7.145 -1.186 1.00 0.00 C ATOM 614 OD1 ASP A 39 -19.831 6.152 -1.093 1.00 0.00 O ATOM 615 OD2 ASP A 39 -19.382 8.174 -1.826 1.00 0.00 O ATOM 0 H ASP A 39 -18.030 8.871 1.216 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.699 6.105 1.167 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.231 8.058 -0.611 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -17.107 6.345 -0.962 1.00 0.00 H new ATOM 620 N LEU A 40 -15.501 6.846 1.599 1.00 0.00 N ATOM 621 CA LEU A 40 -14.227 6.295 2.054 1.00 0.00 C ATOM 622 C LEU A 40 -14.388 5.643 3.420 1.00 0.00 C ATOM 623 O LEU A 40 -13.909 4.533 3.650 1.00 0.00 O ATOM 624 CB LEU A 40 -13.156 7.389 2.107 1.00 0.00 C ATOM 625 CG LEU A 40 -12.906 8.116 0.783 1.00 0.00 C ATOM 626 CD1 LEU A 40 -11.938 9.272 0.975 1.00 0.00 C ATOM 627 CD2 LEU A 40 -12.376 7.151 -0.266 1.00 0.00 C ATOM 0 H LEU A 40 -15.476 7.841 1.377 1.00 0.00 H new ATOM 0 HA LEU A 40 -13.907 5.534 1.342 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.446 8.124 2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.219 6.943 2.442 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.857 8.519 0.435 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.776 9.773 0.021 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.355 9.981 1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.988 8.892 1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.205 7.687 -1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.438 6.716 0.080 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.105 6.357 -0.431 1.00 0.00 H new ATOM 639 N LYS A 41 -15.083 6.332 4.315 1.00 0.00 N ATOM 640 CA LYS A 41 -15.330 5.810 5.650 1.00 0.00 C ATOM 641 C LYS A 41 -16.438 4.764 5.604 1.00 0.00 C ATOM 642 O LYS A 41 -16.499 3.868 6.446 1.00 0.00 O ATOM 643 CB LYS A 41 -15.715 6.943 6.605 1.00 0.00 C ATOM 644 CG LYS A 41 -15.399 6.644 8.062 1.00 0.00 C ATOM 645 CD LYS A 41 -16.260 7.472 9.001 1.00 0.00 C ATOM 646 CE LYS A 41 -15.470 7.944 10.210 1.00 0.00 C ATOM 647 NZ LYS A 41 -16.194 9.000 10.971 1.00 0.00 N ATOM 0 H LYS A 41 -15.485 7.253 4.140 1.00 0.00 H new ATOM 0 HA LYS A 41 -14.416 5.343 6.017 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -15.192 7.852 6.307 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.782 7.143 6.507 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -15.559 5.584 8.260 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -14.346 6.849 8.256 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -16.658 8.334 8.466 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -17.113 6.880 9.331 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -15.270 7.097 10.866 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.504 8.330 9.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.621 9.294 11.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -16.363 9.819 10.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -17.105 8.625 11.305 1.00 0.00 H new ATOM 661 N LYS A 42 -17.315 4.891 4.609 1.00 0.00 N ATOM 662 CA LYS A 42 -18.429 3.965 4.440 1.00 0.00 C ATOM 663 C LYS A 42 -17.950 2.518 4.407 1.00 0.00 C ATOM 664 O LYS A 42 -18.533 1.656 5.065 1.00 0.00 O ATOM 665 CB LYS A 42 -19.199 4.287 3.158 1.00 0.00 C ATOM 666 CG LYS A 42 -20.585 4.856 3.410 1.00 0.00 C ATOM 667 CD LYS A 42 -21.286 5.212 2.110 1.00 0.00 C ATOM 668 CE LYS A 42 -22.131 6.468 2.259 1.00 0.00 C ATOM 669 NZ LYS A 42 -23.403 6.377 1.492 1.00 0.00 N ATOM 0 H LYS A 42 -17.273 5.629 3.907 1.00 0.00 H new ATOM 0 HA LYS A 42 -19.091 4.085 5.297 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -18.624 5.000 2.568 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.290 3.380 2.561 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.183 4.129 3.960 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.506 5.744 4.037 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -20.545 5.362 1.325 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -21.919 4.381 1.797 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -22.354 6.632 3.313 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -21.561 7.331 1.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.949 7.253 1.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -23.191 6.246 0.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -23.959 5.569 1.837 1.00 0.00 H new ATOM 683 N TYR A 43 -16.895 2.241 3.640 1.00 0.00 N ATOM 684 CA TYR A 43 -16.386 0.879 3.553 1.00 0.00 C ATOM 685 C TYR A 43 -15.871 0.406 4.907 1.00 0.00 C ATOM 686 O TYR A 43 -16.064 -0.751 5.282 1.00 0.00 O ATOM 687 CB TYR A 43 -15.273 0.777 2.517 1.00 0.00 C ATOM 688 CG TYR A 43 -14.926 -0.649 2.162 1.00 0.00 C ATOM 689 CD1 TYR A 43 -14.224 -1.447 3.053 1.00 0.00 C ATOM 690 CD2 TYR A 43 -15.298 -1.199 0.942 1.00 0.00 C ATOM 691 CE1 TYR A 43 -13.898 -2.753 2.742 1.00 0.00 C ATOM 692 CE2 TYR A 43 -14.978 -2.506 0.621 1.00 0.00 C ATOM 693 CZ TYR A 43 -14.278 -3.278 1.525 1.00 0.00 C ATOM 694 OH TYR A 43 -13.957 -4.579 1.210 1.00 0.00 O ATOM 0 H TYR A 43 -16.388 2.928 3.082 1.00 0.00 H new ATOM 0 HA TYR A 43 -17.212 0.238 3.245 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.575 1.307 1.614 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.383 1.278 2.898 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.927 -1.040 4.008 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.846 -0.597 0.233 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.349 -3.359 3.448 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.274 -2.920 -0.332 1.00 0.00 H new ATOM 0 HH TYR A 43 -14.299 -4.793 0.317 1.00 0.00 H new ATOM 704 N GLY A 44 -15.225 1.305 5.645 1.00 0.00 N ATOM 705 CA GLY A 44 -14.709 0.947 6.951 1.00 0.00 C ATOM 706 C GLY A 44 -13.691 1.934 7.475 1.00 0.00 C ATOM 707 O GLY A 44 -13.411 2.946 6.832 1.00 0.00 O ATOM 0 H GLY A 44 -15.051 2.269 5.362 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.537 0.879 7.656 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.254 -0.042 6.897 1.00 0.00 H new ATOM 711 N ALA A 45 -13.161 1.663 8.666 1.00 0.00 N ATOM 712 CA ALA A 45 -12.201 2.570 9.283 1.00 0.00 C ATOM 713 C ALA A 45 -10.926 1.895 9.797 1.00 0.00 C ATOM 714 O ALA A 45 -10.963 1.078 10.717 1.00 0.00 O ATOM 715 CB ALA A 45 -12.882 3.304 10.410 1.00 0.00 C ATOM 0 H ALA A 45 -13.378 0.832 9.216 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.872 3.253 8.500 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.174 3.986 10.880 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.726 3.871 10.017 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.239 2.586 11.148 1.00 0.00 H new ATOM 721 N THR A 46 -9.798 2.294 9.218 1.00 0.00 N ATOM 722 CA THR A 46 -8.480 1.804 9.613 1.00 0.00 C ATOM 723 C THR A 46 -7.416 2.725 9.027 1.00 0.00 C ATOM 724 O THR A 46 -7.741 3.795 8.514 1.00 0.00 O ATOM 725 CB THR A 46 -8.247 0.346 9.220 1.00 0.00 C ATOM 726 OG1 THR A 46 -9.453 -0.385 9.316 1.00 0.00 O ATOM 727 CG2 THR A 46 -7.230 -0.356 10.096 1.00 0.00 C ATOM 0 H THR A 46 -9.772 2.971 8.456 1.00 0.00 H new ATOM 0 HA THR A 46 -8.418 1.821 10.701 1.00 0.00 H new ATOM 0 HB THR A 46 -7.869 0.376 8.198 1.00 0.00 H new ATOM 0 HG1 THR A 46 -10.126 0.015 8.726 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.112 -1.387 9.762 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.272 0.159 10.026 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.573 -0.346 11.131 1.00 0.00 H new ATOM 735 N THR A 47 -6.152 2.334 9.111 1.00 0.00 N ATOM 736 CA THR A 47 -5.085 3.171 8.591 1.00 0.00 C ATOM 737 C THR A 47 -5.201 3.314 7.074 1.00 0.00 C ATOM 738 O THR A 47 -5.783 2.465 6.389 1.00 0.00 O ATOM 739 CB THR A 47 -3.721 2.582 8.956 1.00 0.00 C ATOM 740 OG1 THR A 47 -2.680 3.287 8.300 1.00 0.00 O ATOM 741 CG2 THR A 47 -3.585 1.120 8.593 1.00 0.00 C ATOM 0 H THR A 47 -5.845 1.455 9.528 1.00 0.00 H new ATOM 0 HA THR A 47 -5.177 4.159 9.042 1.00 0.00 H new ATOM 0 HB THR A 47 -3.643 2.679 10.039 1.00 0.00 H new ATOM 0 HG1 THR A 47 -2.177 2.670 7.728 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.595 0.765 8.879 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.344 0.542 9.120 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.718 0.998 7.518 1.00 0.00 H new ATOM 749 N VAL A 48 -4.670 4.417 6.561 1.00 0.00 N ATOM 750 CA VAL A 48 -4.728 4.706 5.136 1.00 0.00 C ATOM 751 C VAL A 48 -3.357 5.108 4.604 1.00 0.00 C ATOM 752 O VAL A 48 -2.657 5.906 5.219 1.00 0.00 O ATOM 753 CB VAL A 48 -5.736 5.845 4.852 1.00 0.00 C ATOM 754 CG1 VAL A 48 -5.656 6.322 3.405 1.00 0.00 C ATOM 755 CG2 VAL A 48 -7.148 5.399 5.197 1.00 0.00 C ATOM 0 H VAL A 48 -4.193 5.128 7.115 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.054 3.798 4.629 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.471 6.691 5.487 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.379 7.122 3.245 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.652 6.694 3.199 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.880 5.492 2.735 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.846 6.211 4.992 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -7.413 4.531 4.593 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.198 5.135 6.253 1.00 0.00 H new ATOM 765 N VAL A 49 -2.980 4.560 3.453 1.00 0.00 N ATOM 766 CA VAL A 49 -1.697 4.890 2.850 1.00 0.00 C ATOM 767 C VAL A 49 -1.885 5.602 1.514 1.00 0.00 C ATOM 768 O VAL A 49 -2.225 4.983 0.499 1.00 0.00 O ATOM 769 CB VAL A 49 -0.822 3.638 2.648 1.00 0.00 C ATOM 770 CG1 VAL A 49 -1.490 2.653 1.702 1.00 0.00 C ATOM 771 CG2 VAL A 49 0.557 4.027 2.140 1.00 0.00 C ATOM 0 H VAL A 49 -3.540 3.891 2.924 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.187 5.559 3.543 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.705 3.146 3.614 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.851 1.779 1.577 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.450 2.345 2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.648 3.128 0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.161 3.130 2.003 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.460 4.548 1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.040 4.683 2.865 1.00 0.00 H new ATOM 781 N ARG A 50 -1.656 6.907 1.514 1.00 0.00 N ATOM 782 CA ARG A 50 -1.788 7.688 0.298 1.00 0.00 C ATOM 783 C ARG A 50 -0.441 8.258 -0.124 1.00 0.00 C ATOM 784 O ARG A 50 0.082 9.162 0.527 1.00 0.00 O ATOM 785 CB ARG A 50 -2.794 8.822 0.500 1.00 0.00 C ATOM 786 CG ARG A 50 -2.606 9.579 1.805 1.00 0.00 C ATOM 787 CD ARG A 50 -2.869 11.067 1.634 1.00 0.00 C ATOM 788 NE ARG A 50 -3.809 11.575 2.630 1.00 0.00 N ATOM 789 CZ ARG A 50 -5.129 11.419 2.551 1.00 0.00 C ATOM 790 NH1 ARG A 50 -5.668 10.770 1.526 1.00 0.00 N ATOM 791 NH2 ARG A 50 -5.913 11.914 3.499 1.00 0.00 N ATOM 0 H ARG A 50 -1.380 7.442 2.337 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.150 7.030 -0.491 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.711 9.522 -0.331 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.803 8.411 0.471 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.280 9.175 2.561 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.590 9.428 2.170 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -1.929 11.613 1.712 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -3.264 11.253 0.635 1.00 0.00 H new ATOM 0 HE ARG A 50 -3.432 12.079 3.433 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.070 10.388 0.793 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.680 10.654 1.471 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.505 12.414 4.289 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.924 11.795 3.439 1.00 0.00 H new ATOM 805 N VAL A 51 0.110 7.762 -1.227 1.00 0.00 N ATOM 806 CA VAL A 51 1.376 8.288 -1.711 1.00 0.00 C ATOM 807 C VAL A 51 1.112 9.217 -2.876 1.00 0.00 C ATOM 808 O VAL A 51 1.063 8.799 -4.033 1.00 0.00 O ATOM 809 CB VAL A 51 2.340 7.173 -2.161 1.00 0.00 C ATOM 810 CG1 VAL A 51 3.734 7.737 -2.408 1.00 0.00 C ATOM 811 CG2 VAL A 51 2.383 6.052 -1.134 1.00 0.00 C ATOM 0 H VAL A 51 -0.291 7.013 -1.791 1.00 0.00 H new ATOM 0 HA VAL A 51 1.850 8.821 -0.887 1.00 0.00 H new ATOM 0 HB VAL A 51 1.970 6.758 -3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.400 6.935 -2.725 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.686 8.498 -3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.114 8.183 -1.489 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.069 5.275 -1.472 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.725 6.448 -0.178 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.386 5.628 -1.016 1.00 0.00 H new ATOM 821 N CYS A 52 0.941 10.484 -2.550 1.00 0.00 N ATOM 822 CA CYS A 52 0.674 11.506 -3.538 1.00 0.00 C ATOM 823 C CYS A 52 1.053 12.863 -2.985 1.00 0.00 C ATOM 824 O CYS A 52 1.342 12.997 -1.795 1.00 0.00 O ATOM 825 CB CYS A 52 -0.800 11.492 -3.943 1.00 0.00 C ATOM 826 SG CYS A 52 -1.091 11.877 -5.686 1.00 0.00 S ATOM 0 H CYS A 52 0.984 10.832 -1.592 1.00 0.00 H new ATOM 0 HA CYS A 52 1.273 11.301 -4.425 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -1.216 10.508 -3.725 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.341 12.211 -3.328 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.367 11.838 -5.932 1.00 0.00 H new ATOM 832 N GLU A 53 1.026 13.872 -3.833 1.00 0.00 N ATOM 833 CA GLU A 53 1.340 15.213 -3.391 1.00 0.00 C ATOM 834 C GLU A 53 0.243 15.677 -2.432 1.00 0.00 C ATOM 835 O GLU A 53 -0.944 15.527 -2.720 1.00 0.00 O ATOM 836 CB GLU A 53 1.477 16.136 -4.603 1.00 0.00 C ATOM 837 CG GLU A 53 2.607 15.722 -5.544 1.00 0.00 C ATOM 838 CD GLU A 53 2.312 14.439 -6.312 1.00 0.00 C ATOM 839 OE1 GLU A 53 1.484 14.488 -7.246 1.00 0.00 O ATOM 840 OE2 GLU A 53 2.908 13.383 -5.980 1.00 0.00 O ATOM 0 H GLU A 53 0.792 13.789 -4.822 1.00 0.00 H new ATOM 0 HA GLU A 53 2.292 15.236 -2.861 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.537 16.144 -5.155 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.653 17.155 -4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 53 2.793 16.528 -6.254 1.00 0.00 H new ATOM 0 HG3 GLU A 53 3.522 15.589 -4.966 1.00 0.00 H new ATOM 847 N VAL A 54 0.643 16.184 -1.270 1.00 0.00 N ATOM 848 CA VAL A 54 -0.314 16.601 -0.247 1.00 0.00 C ATOM 849 C VAL A 54 -0.951 17.958 -0.531 1.00 0.00 C ATOM 850 O VAL A 54 -0.262 18.972 -0.647 1.00 0.00 O ATOM 851 CB VAL A 54 0.350 16.646 1.143 1.00 0.00 C ATOM 852 CG1 VAL A 54 1.449 17.698 1.182 1.00 0.00 C ATOM 853 CG2 VAL A 54 -0.686 16.906 2.227 1.00 0.00 C ATOM 0 H VAL A 54 1.621 16.316 -1.012 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.105 15.851 -0.266 1.00 0.00 H new ATOM 0 HB VAL A 54 0.805 15.674 1.334 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.904 17.712 2.172 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.208 17.459 0.437 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.023 18.677 0.964 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.195 16.934 3.200 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.176 17.862 2.040 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.430 16.109 2.218 1.00 0.00 H new ATOM 863 N THR A 55 -2.282 17.967 -0.605 1.00 0.00 N ATOM 864 CA THR A 55 -3.030 19.197 -0.831 1.00 0.00 C ATOM 865 C THR A 55 -3.986 19.462 0.332 1.00 0.00 C ATOM 866 O THR A 55 -4.037 20.569 0.869 1.00 0.00 O ATOM 867 CB THR A 55 -3.811 19.112 -2.143 1.00 0.00 C ATOM 868 OG1 THR A 55 -3.219 18.171 -3.020 1.00 0.00 O ATOM 869 CG2 THR A 55 -3.896 20.434 -2.876 1.00 0.00 C ATOM 0 H THR A 55 -2.862 17.133 -0.511 1.00 0.00 H new ATOM 0 HA THR A 55 -2.322 20.023 -0.897 1.00 0.00 H new ATOM 0 HB THR A 55 -4.818 18.807 -1.860 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.734 18.130 -3.853 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.463 20.303 -3.798 1.00 0.00 H new ATOM 0 HG22 THR A 55 -4.395 21.169 -2.244 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.891 20.783 -3.114 1.00 0.00 H new ATOM 877 N TYR A 56 -4.732 18.428 0.727 1.00 0.00 N ATOM 878 CA TYR A 56 -5.677 18.536 1.839 1.00 0.00 C ATOM 879 C TYR A 56 -5.482 17.382 2.826 1.00 0.00 C ATOM 880 O TYR A 56 -6.176 16.369 2.750 1.00 0.00 O ATOM 881 CB TYR A 56 -7.119 18.542 1.318 1.00 0.00 C ATOM 882 CG TYR A 56 -7.253 19.008 -0.115 1.00 0.00 C ATOM 883 CD1 TYR A 56 -6.984 20.326 -0.461 1.00 0.00 C ATOM 884 CD2 TYR A 56 -7.644 18.132 -1.121 1.00 0.00 C ATOM 885 CE1 TYR A 56 -7.104 20.761 -1.767 1.00 0.00 C ATOM 886 CE2 TYR A 56 -7.765 18.561 -2.430 1.00 0.00 C ATOM 887 CZ TYR A 56 -7.494 19.874 -2.747 1.00 0.00 C ATOM 888 OH TYR A 56 -7.613 20.303 -4.049 1.00 0.00 O ATOM 0 H TYR A 56 -4.699 17.506 0.292 1.00 0.00 H new ATOM 0 HA TYR A 56 -5.486 19.475 2.358 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.529 17.536 1.402 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -7.723 19.186 1.957 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -6.676 21.023 0.304 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.856 17.102 -0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -6.893 21.790 -2.018 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -8.071 17.869 -3.201 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.896 19.555 -4.615 1.00 0.00 H new ATOM 898 N ASP A 57 -4.526 17.533 3.737 1.00 0.00 N ATOM 899 CA ASP A 57 -4.232 16.493 4.724 1.00 0.00 C ATOM 900 C ASP A 57 -5.224 16.476 5.892 1.00 0.00 C ATOM 901 O ASP A 57 -5.531 15.415 6.435 1.00 0.00 O ATOM 902 CB ASP A 57 -2.812 16.673 5.261 1.00 0.00 C ATOM 903 CG ASP A 57 -2.606 18.028 5.909 1.00 0.00 C ATOM 904 OD1 ASP A 57 -3.083 18.221 7.047 1.00 0.00 O ATOM 905 OD2 ASP A 57 -1.968 18.897 5.278 1.00 0.00 O ATOM 0 H ASP A 57 -3.940 18.364 3.815 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.326 15.536 4.210 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.600 15.890 5.988 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.100 16.552 4.445 1.00 0.00 H new ATOM 910 N LYS A 58 -5.686 17.652 6.304 1.00 0.00 N ATOM 911 CA LYS A 58 -6.602 17.763 7.442 1.00 0.00 C ATOM 912 C LYS A 58 -8.046 17.402 7.093 1.00 0.00 C ATOM 913 O LYS A 58 -8.698 16.658 7.823 1.00 0.00 O ATOM 914 CB LYS A 58 -6.553 19.182 8.013 1.00 0.00 C ATOM 915 CG LYS A 58 -5.433 19.396 9.018 1.00 0.00 C ATOM 916 CD LYS A 58 -5.702 20.600 9.905 1.00 0.00 C ATOM 917 CE LYS A 58 -4.470 20.989 10.704 1.00 0.00 C ATOM 918 NZ LYS A 58 -4.828 21.598 12.015 1.00 0.00 N ATOM 0 H LYS A 58 -5.444 18.543 5.870 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.264 17.040 8.185 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.434 19.890 7.193 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.507 19.405 8.492 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.323 18.505 9.636 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.490 19.536 8.489 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.019 21.442 9.290 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.523 20.375 10.586 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.852 20.107 10.870 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.871 21.694 10.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.960 21.849 12.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.397 22.454 11.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.378 20.916 12.576 1.00 0.00 H new ATOM 932 N THR A 59 -8.548 17.960 5.998 1.00 0.00 N ATOM 933 CA THR A 59 -9.931 17.730 5.569 1.00 0.00 C ATOM 934 C THR A 59 -10.379 16.273 5.739 1.00 0.00 C ATOM 935 O THR A 59 -11.350 15.998 6.442 1.00 0.00 O ATOM 936 CB THR A 59 -10.108 18.154 4.110 1.00 0.00 C ATOM 937 OG1 THR A 59 -8.851 18.301 3.474 1.00 0.00 O ATOM 938 CG2 THR A 59 -10.861 19.459 3.953 1.00 0.00 C ATOM 0 H THR A 59 -8.018 18.579 5.385 1.00 0.00 H new ATOM 0 HA THR A 59 -10.562 18.338 6.217 1.00 0.00 H new ATOM 0 HB THR A 59 -10.693 17.359 3.647 1.00 0.00 H new ATOM 0 HG1 THR A 59 -8.522 19.214 3.608 1.00 0.00 H new ATOM 0 HG21 THR A 59 -10.952 19.702 2.894 1.00 0.00 H new ATOM 0 HG22 THR A 59 -11.855 19.360 4.389 1.00 0.00 H new ATOM 0 HG23 THR A 59 -10.319 20.255 4.463 1.00 0.00 H new ATOM 946 N PRO A 60 -9.699 15.323 5.075 1.00 0.00 N ATOM 947 CA PRO A 60 -10.065 13.899 5.140 1.00 0.00 C ATOM 948 C PRO A 60 -9.898 13.281 6.528 1.00 0.00 C ATOM 949 O PRO A 60 -10.744 12.507 6.973 1.00 0.00 O ATOM 950 CB PRO A 60 -9.105 13.237 4.146 1.00 0.00 C ATOM 951 CG PRO A 60 -7.963 14.185 4.021 1.00 0.00 C ATOM 952 CD PRO A 60 -8.547 15.558 4.188 1.00 0.00 C ATOM 0 HA PRO A 60 -11.121 13.758 4.909 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -8.772 12.264 4.507 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.587 13.071 3.183 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -7.207 13.987 4.781 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.475 14.083 3.051 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.831 16.250 4.631 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.853 15.985 3.233 1.00 0.00 H new ATOM 960 N LEU A 61 -8.800 13.607 7.199 1.00 0.00 N ATOM 961 CA LEU A 61 -8.528 13.058 8.527 1.00 0.00 C ATOM 962 C LEU A 61 -9.455 13.640 9.590 1.00 0.00 C ATOM 963 O LEU A 61 -9.744 12.988 10.593 1.00 0.00 O ATOM 964 CB LEU A 61 -7.073 13.314 8.913 1.00 0.00 C ATOM 965 CG LEU A 61 -6.085 12.257 8.422 1.00 0.00 C ATOM 966 CD1 LEU A 61 -5.686 12.531 6.978 1.00 0.00 C ATOM 967 CD2 LEU A 61 -4.860 12.214 9.322 1.00 0.00 C ATOM 0 H LEU A 61 -8.085 14.245 6.850 1.00 0.00 H new ATOM 0 HA LEU A 61 -8.713 11.985 8.479 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.772 14.284 8.518 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -7.006 13.378 9.999 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.571 11.282 8.462 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.982 11.769 6.644 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -6.573 12.508 6.345 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -5.217 13.513 6.910 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.167 11.456 8.957 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.369 13.187 9.315 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.164 11.968 10.339 1.00 0.00 H new ATOM 979 N GLU A 62 -9.903 14.870 9.378 1.00 0.00 N ATOM 980 CA GLU A 62 -10.781 15.535 10.335 1.00 0.00 C ATOM 981 C GLU A 62 -12.203 14.989 10.274 1.00 0.00 C ATOM 982 O GLU A 62 -12.827 14.746 11.308 1.00 0.00 O ATOM 983 CB GLU A 62 -10.792 17.043 10.080 1.00 0.00 C ATOM 984 CG GLU A 62 -10.983 17.872 11.340 1.00 0.00 C ATOM 985 CD GLU A 62 -9.847 18.848 11.576 1.00 0.00 C ATOM 986 OE1 GLU A 62 -9.846 19.923 10.939 1.00 0.00 O ATOM 987 OE2 GLU A 62 -8.958 18.537 12.396 1.00 0.00 O ATOM 0 H GLU A 62 -9.675 15.427 8.555 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.390 15.336 11.333 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.854 17.330 9.605 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.590 17.278 9.376 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -11.921 18.423 11.269 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -11.069 17.206 12.199 1.00 0.00 H new ATOM 994 N LYS A 63 -12.717 14.812 9.065 1.00 0.00 N ATOM 995 CA LYS A 63 -14.074 14.313 8.881 1.00 0.00 C ATOM 996 C LYS A 63 -14.143 12.793 9.011 1.00 0.00 C ATOM 997 O LYS A 63 -15.179 12.245 9.389 1.00 0.00 O ATOM 998 CB LYS A 63 -14.612 14.744 7.514 1.00 0.00 C ATOM 999 CG LYS A 63 -15.492 15.983 7.571 1.00 0.00 C ATOM 1000 CD LYS A 63 -15.218 16.918 6.404 1.00 0.00 C ATOM 1001 CE LYS A 63 -16.466 17.689 6.004 1.00 0.00 C ATOM 1002 NZ LYS A 63 -16.517 19.034 6.641 1.00 0.00 N ATOM 0 H LYS A 63 -12.216 15.006 8.198 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.692 14.743 9.669 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.772 14.935 6.846 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -15.183 13.922 7.082 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -16.541 15.686 7.562 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -15.319 16.510 8.509 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -14.428 17.618 6.675 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -14.856 16.342 5.552 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.492 17.800 4.920 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -17.351 17.119 6.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.383 19.527 6.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -16.518 18.928 7.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -15.686 19.588 6.350 1.00 0.00 H new ATOM 1016 N ASP A 64 -13.049 12.112 8.687 1.00 0.00 N ATOM 1017 CA ASP A 64 -13.019 10.654 8.764 1.00 0.00 C ATOM 1018 C ASP A 64 -12.301 10.157 10.021 1.00 0.00 C ATOM 1019 O ASP A 64 -12.375 8.974 10.354 1.00 0.00 O ATOM 1020 CB ASP A 64 -12.349 10.074 7.519 1.00 0.00 C ATOM 1021 CG ASP A 64 -13.013 10.538 6.238 1.00 0.00 C ATOM 1022 OD1 ASP A 64 -14.203 10.215 6.037 1.00 0.00 O ATOM 1023 OD2 ASP A 64 -12.345 11.224 5.436 1.00 0.00 O ATOM 0 H ASP A 64 -12.179 12.540 8.371 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.052 10.311 8.818 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.298 10.364 7.506 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.379 8.985 7.567 1.00 0.00 H new ATOM 1028 N GLY A 65 -11.615 11.060 10.719 1.00 0.00 N ATOM 1029 CA GLY A 65 -10.903 10.686 11.934 1.00 0.00 C ATOM 1030 C GLY A 65 -10.144 9.374 11.808 1.00 0.00 C ATOM 1031 O GLY A 65 -10.006 8.634 12.783 1.00 0.00 O ATOM 0 H GLY A 65 -11.539 12.045 10.466 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.202 11.479 12.195 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.616 10.608 12.755 1.00 0.00 H new ATOM 1035 N ILE A 66 -9.651 9.086 10.607 1.00 0.00 N ATOM 1036 CA ILE A 66 -8.902 7.856 10.358 1.00 0.00 C ATOM 1037 C ILE A 66 -7.406 8.123 10.296 1.00 0.00 C ATOM 1038 O ILE A 66 -6.973 9.191 9.862 1.00 0.00 O ATOM 1039 CB ILE A 66 -9.328 7.167 9.048 1.00 0.00 C ATOM 1040 CG1 ILE A 66 -9.527 8.198 7.938 1.00 0.00 C ATOM 1041 CG2 ILE A 66 -10.595 6.356 9.263 1.00 0.00 C ATOM 1042 CD1 ILE A 66 -9.103 7.706 6.571 1.00 0.00 C ATOM 0 H ILE A 66 -9.756 9.687 9.790 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.128 7.195 11.195 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.533 6.487 8.741 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.579 8.483 7.902 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.961 9.097 8.183 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.883 5.876 8.328 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -10.415 5.594 10.022 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -11.397 7.015 9.594 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.273 8.490 5.833 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -8.044 7.448 6.589 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -9.686 6.825 6.304 1.00 0.00 H new ATOM 1054 N THR A 67 -6.618 7.143 10.721 1.00 0.00 N ATOM 1055 CA THR A 67 -5.168 7.272 10.700 1.00 0.00 C ATOM 1056 C THR A 67 -4.654 7.053 9.284 1.00 0.00 C ATOM 1057 O THR A 67 -5.102 6.144 8.587 1.00 0.00 O ATOM 1058 CB THR A 67 -4.526 6.264 11.655 1.00 0.00 C ATOM 1059 OG1 THR A 67 -5.441 5.877 12.664 1.00 0.00 O ATOM 1060 CG2 THR A 67 -3.285 6.795 12.341 1.00 0.00 C ATOM 0 H THR A 67 -6.959 6.252 11.083 1.00 0.00 H new ATOM 0 HA THR A 67 -4.899 8.276 11.028 1.00 0.00 H new ATOM 0 HB THR A 67 -4.242 5.416 11.032 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.013 5.231 13.264 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.880 6.030 13.004 1.00 0.00 H new ATOM 0 HG22 THR A 67 -2.539 7.057 11.591 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.541 7.680 12.923 1.00 0.00 H new ATOM 1068 N VAL A 68 -3.738 7.905 8.845 1.00 0.00 N ATOM 1069 CA VAL A 68 -3.205 7.799 7.495 1.00 0.00 C ATOM 1070 C VAL A 68 -1.731 8.185 7.433 1.00 0.00 C ATOM 1071 O VAL A 68 -1.254 9.005 8.219 1.00 0.00 O ATOM 1072 CB VAL A 68 -4.005 8.695 6.523 1.00 0.00 C ATOM 1073 CG1 VAL A 68 -3.897 10.155 6.932 1.00 0.00 C ATOM 1074 CG2 VAL A 68 -3.545 8.505 5.085 1.00 0.00 C ATOM 0 H VAL A 68 -3.352 8.670 9.398 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.300 6.755 7.198 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.051 8.395 6.578 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.467 10.771 6.236 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.296 10.281 7.939 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.851 10.461 6.915 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.129 9.150 4.428 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.489 8.764 5.003 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.687 7.465 4.792 1.00 0.00 H new ATOM 1084 N VAL A 69 -1.027 7.606 6.469 1.00 0.00 N ATOM 1085 CA VAL A 69 0.381 7.896 6.261 1.00 0.00 C ATOM 1086 C VAL A 69 0.514 8.821 5.064 1.00 0.00 C ATOM 1087 O VAL A 69 -0.092 8.582 4.017 1.00 0.00 O ATOM 1088 CB VAL A 69 1.208 6.613 6.005 1.00 0.00 C ATOM 1089 CG1 VAL A 69 2.674 6.839 6.336 1.00 0.00 C ATOM 1090 CG2 VAL A 69 0.655 5.441 6.802 1.00 0.00 C ATOM 0 H VAL A 69 -1.415 6.927 5.814 1.00 0.00 H new ATOM 0 HA VAL A 69 0.769 8.364 7.166 1.00 0.00 H new ATOM 0 HB VAL A 69 1.130 6.371 4.945 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.235 5.923 6.148 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.069 7.641 5.712 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.772 7.115 7.386 1.00 0.00 H new ATOM 0 HG21 VAL A 69 1.254 4.552 6.604 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.692 5.675 7.866 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.378 5.256 6.507 1.00 0.00 H new ATOM 1100 N ASP A 70 1.288 9.884 5.217 1.00 0.00 N ATOM 1101 CA ASP A 70 1.462 10.840 4.137 1.00 0.00 C ATOM 1102 C ASP A 70 2.781 10.599 3.428 1.00 0.00 C ATOM 1103 O ASP A 70 3.854 10.893 3.956 1.00 0.00 O ATOM 1104 CB ASP A 70 1.407 12.271 4.674 1.00 0.00 C ATOM 1105 CG ASP A 70 -0.013 12.745 4.915 1.00 0.00 C ATOM 1106 OD1 ASP A 70 -0.736 12.982 3.923 1.00 0.00 O ATOM 1107 OD2 ASP A 70 -0.402 12.879 6.093 1.00 0.00 O ATOM 0 H ASP A 70 1.801 10.105 6.071 1.00 0.00 H new ATOM 0 HA ASP A 70 0.649 10.705 3.423 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.969 12.328 5.606 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.895 12.941 3.966 1.00 0.00 H new ATOM 1112 N TRP A 71 2.686 10.050 2.227 1.00 0.00 N ATOM 1113 CA TRP A 71 3.860 9.746 1.429 1.00 0.00 C ATOM 1114 C TRP A 71 3.914 10.630 0.186 1.00 0.00 C ATOM 1115 O TRP A 71 3.166 10.419 -0.767 1.00 0.00 O ATOM 1116 CB TRP A 71 3.804 8.285 0.998 1.00 0.00 C ATOM 1117 CG TRP A 71 4.477 7.329 1.930 1.00 0.00 C ATOM 1118 CD1 TRP A 71 4.277 7.179 3.276 1.00 0.00 C ATOM 1119 CD2 TRP A 71 5.459 6.366 1.562 1.00 0.00 C ATOM 1120 NE1 TRP A 71 5.084 6.178 3.761 1.00 0.00 N ATOM 1121 CE2 TRP A 71 5.819 5.666 2.725 1.00 0.00 C ATOM 1122 CE3 TRP A 71 6.070 6.033 0.352 1.00 0.00 C ATOM 1123 CZ2 TRP A 71 6.761 4.650 2.712 1.00 0.00 C ATOM 1124 CZ3 TRP A 71 7.007 5.024 0.341 1.00 0.00 C ATOM 1125 CH2 TRP A 71 7.345 4.342 1.513 1.00 0.00 C ATOM 0 H TRP A 71 1.801 9.805 1.783 1.00 0.00 H new ATOM 0 HA TRP A 71 4.750 9.933 2.030 1.00 0.00 H new ATOM 0 HB2 TRP A 71 2.759 7.992 0.892 1.00 0.00 H new ATOM 0 HB3 TRP A 71 4.262 8.194 0.013 1.00 0.00 H new ATOM 0 HD1 TRP A 71 3.587 7.761 3.869 1.00 0.00 H new ATOM 0 HE1 TRP A 71 5.128 5.868 4.732 1.00 0.00 H new ATOM 0 HE3 TRP A 71 5.813 6.556 -0.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 7.025 4.120 3.615 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 7.488 4.756 -0.588 1.00 0.00 H new ATOM 0 HH2 TRP A 71 8.083 3.555 1.472 1.00 0.00 H new ATOM 1136 N PRO A 72 4.789 11.643 0.174 1.00 0.00 N ATOM 1137 CA PRO A 72 4.926 12.556 -0.941 1.00 0.00 C ATOM 1138 C PRO A 72 6.164 12.272 -1.786 1.00 0.00 C ATOM 1139 O PRO A 72 7.174 11.785 -1.278 1.00 0.00 O ATOM 1140 CB PRO A 72 5.069 13.872 -0.198 1.00 0.00 C ATOM 1141 CG PRO A 72 5.855 13.524 1.037 1.00 0.00 C ATOM 1142 CD PRO A 72 5.702 12.028 1.253 1.00 0.00 C ATOM 0 HA PRO A 72 4.105 12.505 -1.656 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.589 14.615 -0.803 1.00 0.00 H new ATOM 0 HB3 PRO A 72 4.096 14.292 0.056 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.905 13.791 0.914 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.484 14.078 1.899 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.657 11.508 1.181 1.00 0.00 H new ATOM 0 HD3 PRO A 72 5.288 11.800 2.235 1.00 0.00 H new ATOM 1150 N PHE A 73 6.081 12.580 -3.076 1.00 0.00 N ATOM 1151 CA PHE A 73 7.199 12.360 -3.986 1.00 0.00 C ATOM 1152 C PHE A 73 7.555 13.643 -4.731 1.00 0.00 C ATOM 1153 O PHE A 73 6.948 13.969 -5.752 1.00 0.00 O ATOM 1154 CB PHE A 73 6.864 11.249 -4.982 1.00 0.00 C ATOM 1155 CG PHE A 73 7.848 10.115 -4.970 1.00 0.00 C ATOM 1156 CD1 PHE A 73 7.667 9.031 -4.124 1.00 0.00 C ATOM 1157 CD2 PHE A 73 8.955 10.132 -5.803 1.00 0.00 C ATOM 1158 CE1 PHE A 73 8.572 7.987 -4.111 1.00 0.00 C ATOM 1159 CE2 PHE A 73 9.863 9.091 -5.794 1.00 0.00 C ATOM 1160 CZ PHE A 73 9.671 8.017 -4.947 1.00 0.00 C ATOM 0 H PHE A 73 5.252 12.982 -3.514 1.00 0.00 H new ATOM 0 HA PHE A 73 8.062 12.056 -3.394 1.00 0.00 H new ATOM 0 HB2 PHE A 73 5.871 10.860 -4.759 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.822 11.672 -5.986 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.809 9.003 -3.468 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.110 10.969 -6.467 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.420 7.148 -3.448 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.722 9.117 -6.448 1.00 0.00 H new ATOM 0 HZ PHE A 73 10.379 7.202 -4.938 1.00 0.00 H new ATOM 1170 N ASP A 74 8.542 14.365 -4.214 1.00 0.00 N ATOM 1171 CA ASP A 74 8.982 15.612 -4.827 1.00 0.00 C ATOM 1172 C ASP A 74 10.480 15.818 -4.607 1.00 0.00 C ATOM 1173 O ASP A 74 11.208 14.868 -4.321 1.00 0.00 O ATOM 1174 CB ASP A 74 8.192 16.790 -4.250 1.00 0.00 C ATOM 1175 CG ASP A 74 7.779 17.786 -5.317 1.00 0.00 C ATOM 1176 OD1 ASP A 74 7.586 17.366 -6.477 1.00 0.00 O ATOM 1177 OD2 ASP A 74 7.650 18.984 -4.991 1.00 0.00 O ATOM 0 H ASP A 74 9.054 14.107 -3.370 1.00 0.00 H new ATOM 0 HA ASP A 74 8.797 15.557 -5.900 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.303 16.415 -3.743 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.797 17.297 -3.498 1.00 0.00 H new ATOM 1182 N ASP A 75 10.936 17.061 -4.741 1.00 0.00 N ATOM 1183 CA ASP A 75 12.346 17.379 -4.554 1.00 0.00 C ATOM 1184 C ASP A 75 12.841 16.904 -3.190 1.00 0.00 C ATOM 1185 O ASP A 75 14.035 16.670 -2.999 1.00 0.00 O ATOM 1186 CB ASP A 75 12.573 18.886 -4.695 1.00 0.00 C ATOM 1187 CG ASP A 75 14.000 19.224 -5.079 1.00 0.00 C ATOM 1188 OD1 ASP A 75 14.858 19.299 -4.174 1.00 0.00 O ATOM 1189 OD2 ASP A 75 14.261 19.412 -6.286 1.00 0.00 O ATOM 0 H ASP A 75 10.350 17.862 -4.978 1.00 0.00 H new ATOM 0 HA ASP A 75 12.913 16.857 -5.325 1.00 0.00 H new ATOM 0 HB2 ASP A 75 11.893 19.284 -5.449 1.00 0.00 H new ATOM 0 HB3 ASP A 75 12.327 19.377 -3.753 1.00 0.00 H new ATOM 1194 N GLY A 76 11.917 16.764 -2.243 1.00 0.00 N ATOM 1195 CA GLY A 76 12.281 16.316 -0.911 1.00 0.00 C ATOM 1196 C GLY A 76 11.548 15.052 -0.502 1.00 0.00 C ATOM 1197 O GLY A 76 10.810 15.046 0.484 1.00 0.00 O ATOM 0 H GLY A 76 10.923 16.953 -2.375 1.00 0.00 H new ATOM 0 HA2 GLY A 76 13.356 16.138 -0.872 1.00 0.00 H new ATOM 0 HA3 GLY A 76 12.063 17.107 -0.193 1.00 0.00 H new ATOM 1201 N ALA A 77 11.753 13.979 -1.259 1.00 0.00 N ATOM 1202 CA ALA A 77 11.108 12.703 -0.971 1.00 0.00 C ATOM 1203 C ALA A 77 12.144 11.607 -0.729 1.00 0.00 C ATOM 1204 O ALA A 77 12.764 11.114 -1.671 1.00 0.00 O ATOM 1205 CB ALA A 77 10.183 12.311 -2.113 1.00 0.00 C ATOM 0 H ALA A 77 12.362 13.968 -2.078 1.00 0.00 H new ATOM 0 HA ALA A 77 10.518 12.819 -0.062 1.00 0.00 H new ATOM 0 HB1 ALA A 77 9.708 11.357 -1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 77 9.417 13.076 -2.240 1.00 0.00 H new ATOM 0 HB3 ALA A 77 10.760 12.219 -3.033 1.00 0.00 H new ATOM 1211 N PRO A 78 12.348 11.208 0.540 1.00 0.00 N ATOM 1212 CA PRO A 78 13.317 10.168 0.900 1.00 0.00 C ATOM 1213 C PRO A 78 13.273 8.962 -0.041 1.00 0.00 C ATOM 1214 O PRO A 78 12.392 8.110 0.069 1.00 0.00 O ATOM 1215 CB PRO A 78 12.877 9.764 2.304 1.00 0.00 C ATOM 1216 CG PRO A 78 12.289 11.005 2.880 1.00 0.00 C ATOM 1217 CD PRO A 78 11.652 11.742 1.729 1.00 0.00 C ATOM 0 HA PRO A 78 14.344 10.529 0.837 1.00 0.00 H new ATOM 0 HB2 PRO A 78 12.147 8.955 2.274 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.720 9.411 2.898 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.551 10.767 3.646 1.00 0.00 H new ATOM 0 HG3 PRO A 78 13.057 11.615 3.356 1.00 0.00 H new ATOM 0 HD2 PRO A 78 10.579 11.557 1.681 1.00 0.00 H new ATOM 0 HD3 PRO A 78 11.786 12.820 1.821 1.00 0.00 H new ATOM 1225 N PRO A 79 14.226 8.880 -0.989 1.00 0.00 N ATOM 1226 CA PRO A 79 14.288 7.777 -1.955 1.00 0.00 C ATOM 1227 C PRO A 79 14.594 6.398 -1.340 1.00 0.00 C ATOM 1228 O PRO A 79 14.101 5.389 -1.841 1.00 0.00 O ATOM 1229 CB PRO A 79 15.412 8.191 -2.911 1.00 0.00 C ATOM 1230 CG PRO A 79 16.241 9.165 -2.149 1.00 0.00 C ATOM 1231 CD PRO A 79 15.307 9.865 -1.203 1.00 0.00 C ATOM 0 HA PRO A 79 13.316 7.639 -2.429 1.00 0.00 H new ATOM 0 HB2 PRO A 79 16.003 7.329 -3.219 1.00 0.00 H new ATOM 0 HB3 PRO A 79 15.010 8.642 -3.818 1.00 0.00 H new ATOM 0 HG2 PRO A 79 17.036 8.656 -1.605 1.00 0.00 H new ATOM 0 HG3 PRO A 79 16.720 9.877 -2.821 1.00 0.00 H new ATOM 0 HD2 PRO A 79 15.804 10.125 -0.268 1.00 0.00 H new ATOM 0 HD3 PRO A 79 14.925 10.793 -1.630 1.00 0.00 H new ATOM 1239 N PRO A 80 15.419 6.306 -0.267 1.00 0.00 N ATOM 1240 CA PRO A 80 15.762 5.014 0.340 1.00 0.00 C ATOM 1241 C PRO A 80 14.548 4.122 0.596 1.00 0.00 C ATOM 1242 O PRO A 80 13.451 4.602 0.878 1.00 0.00 O ATOM 1243 CB PRO A 80 16.444 5.384 1.667 1.00 0.00 C ATOM 1244 CG PRO A 80 16.290 6.861 1.810 1.00 0.00 C ATOM 1245 CD PRO A 80 16.101 7.408 0.426 1.00 0.00 C ATOM 0 HA PRO A 80 16.396 4.432 -0.329 1.00 0.00 H new ATOM 0 HB2 PRO A 80 15.981 4.861 2.503 1.00 0.00 H new ATOM 0 HB3 PRO A 80 17.496 5.100 1.657 1.00 0.00 H new ATOM 0 HG2 PRO A 80 15.435 7.102 2.442 1.00 0.00 H new ATOM 0 HG3 PRO A 80 17.169 7.298 2.283 1.00 0.00 H new ATOM 0 HD2 PRO A 80 15.501 8.318 0.429 1.00 0.00 H new ATOM 0 HD3 PRO A 80 17.052 7.655 -0.045 1.00 0.00 H new ATOM 1253 N GLY A 81 14.774 2.815 0.497 1.00 0.00 N ATOM 1254 CA GLY A 81 13.720 1.838 0.717 1.00 0.00 C ATOM 1255 C GLY A 81 13.223 1.814 2.151 1.00 0.00 C ATOM 1256 O GLY A 81 12.114 1.339 2.427 1.00 0.00 O ATOM 0 H GLY A 81 15.681 2.410 0.265 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.884 2.057 0.052 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.089 0.848 0.449 1.00 0.00 H new ATOM 1260 N LYS A 82 14.051 2.312 3.070 1.00 0.00 N ATOM 1261 CA LYS A 82 13.700 2.330 4.486 1.00 0.00 C ATOM 1262 C LYS A 82 12.338 2.976 4.690 1.00 0.00 C ATOM 1263 O LYS A 82 11.603 2.616 5.611 1.00 0.00 O ATOM 1264 CB LYS A 82 14.757 3.094 5.287 1.00 0.00 C ATOM 1265 CG LYS A 82 15.104 2.439 6.615 1.00 0.00 C ATOM 1266 CD LYS A 82 14.365 3.097 7.770 1.00 0.00 C ATOM 1267 CE LYS A 82 14.528 2.306 9.057 1.00 0.00 C ATOM 1268 NZ LYS A 82 13.363 1.416 9.314 1.00 0.00 N ATOM 0 H LYS A 82 14.967 2.707 2.857 1.00 0.00 H new ATOM 0 HA LYS A 82 13.660 1.300 4.840 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.663 3.182 4.687 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.399 4.106 5.473 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.851 1.379 6.576 1.00 0.00 H new ATOM 0 HG3 LYS A 82 16.179 2.505 6.785 1.00 0.00 H new ATOM 0 HD2 LYS A 82 14.741 4.110 7.914 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.306 3.182 7.525 1.00 0.00 H new ATOM 0 HE2 LYS A 82 15.437 1.707 9.002 1.00 0.00 H new ATOM 0 HE3 LYS A 82 14.650 2.995 9.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.514 0.894 10.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 12.499 1.989 9.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 13.261 0.742 8.529 1.00 0.00 H new ATOM 1282 N VAL A 83 11.988 3.908 3.812 1.00 0.00 N ATOM 1283 CA VAL A 83 10.695 4.564 3.896 1.00 0.00 C ATOM 1284 C VAL A 83 9.594 3.521 3.763 1.00 0.00 C ATOM 1285 O VAL A 83 8.653 3.483 4.559 1.00 0.00 O ATOM 1286 CB VAL A 83 10.524 5.635 2.802 1.00 0.00 C ATOM 1287 CG1 VAL A 83 9.217 6.392 2.989 1.00 0.00 C ATOM 1288 CG2 VAL A 83 11.708 6.591 2.810 1.00 0.00 C ATOM 0 H VAL A 83 12.577 4.223 3.041 1.00 0.00 H new ATOM 0 HA VAL A 83 10.632 5.063 4.863 1.00 0.00 H new ATOM 0 HB VAL A 83 10.489 5.137 1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.116 7.143 2.206 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.381 5.695 2.932 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.216 6.881 3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.574 7.343 2.032 1.00 0.00 H new ATOM 0 HG22 VAL A 83 11.773 7.082 3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.626 6.034 2.623 1.00 0.00 H new ATOM 1298 N VAL A 84 9.750 2.644 2.772 1.00 0.00 N ATOM 1299 CA VAL A 84 8.799 1.565 2.547 1.00 0.00 C ATOM 1300 C VAL A 84 8.625 0.786 3.840 1.00 0.00 C ATOM 1301 O VAL A 84 7.519 0.380 4.199 1.00 0.00 O ATOM 1302 CB VAL A 84 9.282 0.631 1.406 1.00 0.00 C ATOM 1303 CG1 VAL A 84 9.294 -0.833 1.832 1.00 0.00 C ATOM 1304 CG2 VAL A 84 8.422 0.820 0.165 1.00 0.00 C ATOM 0 H VAL A 84 10.528 2.663 2.113 1.00 0.00 H new ATOM 0 HA VAL A 84 7.841 1.986 2.243 1.00 0.00 H new ATOM 0 HB VAL A 84 10.310 0.908 1.170 1.00 0.00 H new ATOM 0 HG11 VAL A 84 9.639 -1.450 1.003 1.00 0.00 H new ATOM 0 HG12 VAL A 84 9.965 -0.959 2.682 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.287 -1.137 2.117 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.774 0.158 -0.626 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.385 0.583 0.402 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.490 1.855 -0.171 1.00 0.00 H new ATOM 1314 N GLU A 85 9.732 0.612 4.546 1.00 0.00 N ATOM 1315 CA GLU A 85 9.716 -0.087 5.821 1.00 0.00 C ATOM 1316 C GLU A 85 8.902 0.708 6.843 1.00 0.00 C ATOM 1317 O GLU A 85 8.278 0.132 7.735 1.00 0.00 O ATOM 1318 CB GLU A 85 11.140 -0.307 6.331 1.00 0.00 C ATOM 1319 CG GLU A 85 12.081 -0.893 5.286 1.00 0.00 C ATOM 1320 CD GLU A 85 12.162 -2.407 5.349 1.00 0.00 C ATOM 1321 OE1 GLU A 85 11.507 -3.002 6.232 1.00 0.00 O ATOM 1322 OE2 GLU A 85 12.880 -2.998 4.513 1.00 0.00 O ATOM 0 H GLU A 85 10.652 0.945 4.257 1.00 0.00 H new ATOM 0 HA GLU A 85 9.249 -1.062 5.679 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.543 0.644 6.678 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.109 -0.973 7.193 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.746 -0.593 4.293 1.00 0.00 H new ATOM 0 HG3 GLU A 85 13.078 -0.474 5.426 1.00 0.00 H new ATOM 1329 N ASP A 86 8.918 2.037 6.709 1.00 0.00 N ATOM 1330 CA ASP A 86 8.185 2.910 7.626 1.00 0.00 C ATOM 1331 C ASP A 86 6.682 2.660 7.548 1.00 0.00 C ATOM 1332 O ASP A 86 6.026 2.452 8.571 1.00 0.00 O ATOM 1333 CB ASP A 86 8.483 4.377 7.310 1.00 0.00 C ATOM 1334 CG ASP A 86 8.574 5.229 8.562 1.00 0.00 C ATOM 1335 OD1 ASP A 86 7.528 5.757 8.997 1.00 0.00 O ATOM 1336 OD2 ASP A 86 9.689 5.369 9.105 1.00 0.00 O ATOM 0 H ASP A 86 9.429 2.529 5.976 1.00 0.00 H new ATOM 0 HA ASP A 86 8.516 2.683 8.639 1.00 0.00 H new ATOM 0 HB2 ASP A 86 9.421 4.444 6.759 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.702 4.772 6.660 1.00 0.00 H new ATOM 1341 N TRP A 87 6.135 2.662 6.336 1.00 0.00 N ATOM 1342 CA TRP A 87 4.709 2.415 6.160 1.00 0.00 C ATOM 1343 C TRP A 87 4.382 0.975 6.547 1.00 0.00 C ATOM 1344 O TRP A 87 3.283 0.680 7.015 1.00 0.00 O ATOM 1345 CB TRP A 87 4.280 2.710 4.715 1.00 0.00 C ATOM 1346 CG TRP A 87 3.372 1.677 4.112 1.00 0.00 C ATOM 1347 CD1 TRP A 87 3.712 0.742 3.179 1.00 0.00 C ATOM 1348 CD2 TRP A 87 1.981 1.473 4.397 1.00 0.00 C ATOM 1349 NE1 TRP A 87 2.621 -0.028 2.863 1.00 0.00 N ATOM 1350 CE2 TRP A 87 1.546 0.401 3.594 1.00 0.00 C ATOM 1351 CE3 TRP A 87 1.059 2.090 5.250 1.00 0.00 C ATOM 1352 CZ2 TRP A 87 0.233 -0.065 3.617 1.00 0.00 C ATOM 1353 CZ3 TRP A 87 -0.246 1.624 5.272 1.00 0.00 C ATOM 1354 CH2 TRP A 87 -0.648 0.556 4.458 1.00 0.00 C ATOM 0 H TRP A 87 6.650 2.830 5.472 1.00 0.00 H new ATOM 0 HA TRP A 87 4.150 3.086 6.813 1.00 0.00 H new ATOM 0 HB2 TRP A 87 3.778 3.677 4.689 1.00 0.00 H new ATOM 0 HB3 TRP A 87 5.172 2.798 4.095 1.00 0.00 H new ATOM 0 HD1 TRP A 87 4.697 0.625 2.751 1.00 0.00 H new ATOM 0 HE1 TRP A 87 2.612 -0.796 2.192 1.00 0.00 H new ATOM 0 HE3 TRP A 87 1.359 2.914 5.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -0.078 -0.889 2.992 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -0.966 2.092 5.928 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -1.673 0.217 4.496 1.00 0.00 H new ATOM 1365 N LEU A 88 5.352 0.085 6.353 1.00 0.00 N ATOM 1366 CA LEU A 88 5.175 -1.322 6.688 1.00 0.00 C ATOM 1367 C LEU A 88 4.889 -1.486 8.176 1.00 0.00 C ATOM 1368 O LEU A 88 3.954 -2.184 8.563 1.00 0.00 O ATOM 1369 CB LEU A 88 6.422 -2.119 6.302 1.00 0.00 C ATOM 1370 CG LEU A 88 6.464 -2.587 4.848 1.00 0.00 C ATOM 1371 CD1 LEU A 88 7.773 -3.303 4.556 1.00 0.00 C ATOM 1372 CD2 LEU A 88 5.277 -3.490 4.548 1.00 0.00 C ATOM 0 H LEU A 88 6.267 0.315 5.966 1.00 0.00 H new ATOM 0 HA LEU A 88 4.323 -1.705 6.126 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.302 -1.505 6.496 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.493 -2.992 6.951 1.00 0.00 H new ATOM 0 HG LEU A 88 6.403 -1.713 4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.785 -3.629 3.516 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.607 -2.624 4.733 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.867 -4.170 5.209 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.321 -3.815 3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.308 -4.361 5.202 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.350 -2.941 4.718 1.00 0.00 H new ATOM 1384 N SER A 89 5.696 -0.830 9.005 1.00 0.00 N ATOM 1385 CA SER A 89 5.522 -0.896 10.449 1.00 0.00 C ATOM 1386 C SER A 89 4.174 -0.307 10.843 1.00 0.00 C ATOM 1387 O SER A 89 3.465 -0.855 11.687 1.00 0.00 O ATOM 1388 CB SER A 89 6.651 -0.144 11.158 1.00 0.00 C ATOM 1389 OG SER A 89 7.720 -1.016 11.481 1.00 0.00 O ATOM 0 H SER A 89 6.476 -0.248 8.700 1.00 0.00 H new ATOM 0 HA SER A 89 5.554 -1.942 10.755 1.00 0.00 H new ATOM 0 HB2 SER A 89 7.014 0.660 10.518 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.268 0.320 12.067 1.00 0.00 H new ATOM 0 HG SER A 89 8.429 -0.511 11.931 1.00 0.00 H new ATOM 1395 N LEU A 90 3.822 0.812 10.214 1.00 0.00 N ATOM 1396 CA LEU A 90 2.552 1.477 10.484 1.00 0.00 C ATOM 1397 C LEU A 90 1.388 0.509 10.289 1.00 0.00 C ATOM 1398 O LEU A 90 0.533 0.356 11.165 1.00 0.00 O ATOM 1399 CB LEU A 90 2.392 2.687 9.559 1.00 0.00 C ATOM 1400 CG LEU A 90 1.354 3.724 10.000 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -0.055 3.202 9.768 1.00 0.00 C ATOM 1402 CD2 LEU A 90 1.556 4.098 11.461 1.00 0.00 C ATOM 0 H LEU A 90 4.400 1.277 9.513 1.00 0.00 H new ATOM 0 HA LEU A 90 2.548 1.816 11.520 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.359 3.183 9.468 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.122 2.329 8.565 1.00 0.00 H new ATOM 0 HG LEU A 90 1.489 4.622 9.397 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.778 3.952 10.087 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.195 2.991 8.708 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.203 2.288 10.342 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.809 4.835 11.754 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.451 3.208 12.082 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.553 4.518 11.594 1.00 0.00 H new ATOM 1414 N VAL A 91 1.368 -0.152 9.135 1.00 0.00 N ATOM 1415 CA VAL A 91 0.318 -1.111 8.821 1.00 0.00 C ATOM 1416 C VAL A 91 0.465 -2.378 9.658 1.00 0.00 C ATOM 1417 O VAL A 91 -0.529 -2.976 10.066 1.00 0.00 O ATOM 1418 CB VAL A 91 0.321 -1.488 7.326 1.00 0.00 C ATOM 1419 CG1 VAL A 91 1.665 -2.075 6.924 1.00 0.00 C ATOM 1420 CG2 VAL A 91 -0.814 -2.458 7.013 1.00 0.00 C ATOM 0 H VAL A 91 2.069 -0.040 8.402 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.630 -0.629 9.059 1.00 0.00 H new ATOM 0 HB VAL A 91 0.160 -0.581 6.743 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.647 -2.335 5.866 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.451 -1.342 7.104 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.862 -2.970 7.514 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.794 -2.711 5.953 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.691 -3.365 7.605 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.769 -1.992 7.257 1.00 0.00 H new ATOM 1430 N LYS A 92 1.708 -2.781 9.915 1.00 0.00 N ATOM 1431 CA LYS A 92 1.968 -3.978 10.710 1.00 0.00 C ATOM 1432 C LYS A 92 1.284 -3.877 12.068 1.00 0.00 C ATOM 1433 O LYS A 92 0.648 -4.826 12.528 1.00 0.00 O ATOM 1434 CB LYS A 92 3.474 -4.183 10.899 1.00 0.00 C ATOM 1435 CG LYS A 92 3.945 -5.589 10.557 1.00 0.00 C ATOM 1436 CD LYS A 92 4.090 -6.446 11.803 1.00 0.00 C ATOM 1437 CE LYS A 92 4.971 -7.658 11.544 1.00 0.00 C ATOM 1438 NZ LYS A 92 5.172 -8.471 12.776 1.00 0.00 N ATOM 0 H LYS A 92 2.545 -2.300 9.587 1.00 0.00 H new ATOM 0 HA LYS A 92 1.562 -4.836 10.174 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.011 -3.467 10.276 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.735 -3.963 11.934 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.235 -6.056 9.874 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.901 -5.537 10.037 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.517 -5.849 12.609 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.106 -6.775 12.137 1.00 0.00 H new ATOM 0 HE2 LYS A 92 4.518 -8.277 10.770 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.938 -7.329 11.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 5.778 -9.288 12.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 5.627 -7.887 13.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 4.251 -8.806 13.125 1.00 0.00 H new ATOM 1452 N ALA A 93 1.417 -2.719 12.702 1.00 0.00 N ATOM 1453 CA ALA A 93 0.809 -2.487 14.005 1.00 0.00 C ATOM 1454 C ALA A 93 -0.710 -2.405 13.892 1.00 0.00 C ATOM 1455 O ALA A 93 -1.435 -2.936 14.732 1.00 0.00 O ATOM 1456 CB ALA A 93 1.363 -1.213 14.627 1.00 0.00 C ATOM 0 H ALA A 93 1.941 -1.925 12.334 1.00 0.00 H new ATOM 0 HA ALA A 93 1.056 -3.330 14.650 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.900 -1.052 15.600 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.442 -1.307 14.750 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.145 -0.366 13.977 1.00 0.00 H new ATOM 1462 N LYS A 94 -1.186 -1.732 12.847 1.00 0.00 N ATOM 1463 CA LYS A 94 -2.621 -1.579 12.628 1.00 0.00 C ATOM 1464 C LYS A 94 -3.272 -2.910 12.253 1.00 0.00 C ATOM 1465 O LYS A 94 -4.441 -3.145 12.559 1.00 0.00 O ATOM 1466 CB LYS A 94 -2.880 -0.543 11.531 1.00 0.00 C ATOM 1467 CG LYS A 94 -3.450 0.765 12.055 1.00 0.00 C ATOM 1468 CD LYS A 94 -2.347 1.740 12.439 1.00 0.00 C ATOM 1469 CE LYS A 94 -1.966 1.598 13.904 1.00 0.00 C ATOM 1470 NZ LYS A 94 -0.506 1.794 14.120 1.00 0.00 N ATOM 0 H LYS A 94 -0.601 -1.285 12.141 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.067 -1.235 13.561 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.946 -0.339 11.007 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.570 -0.964 10.800 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.087 1.216 11.294 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.080 0.567 12.922 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.471 1.564 11.815 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.677 2.760 12.245 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.521 2.326 14.496 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -2.256 0.610 14.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.223 1.340 15.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.022 1.367 13.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.296 2.811 14.167 1.00 0.00 H new ATOM 1484 N PHE A 95 -2.513 -3.776 11.588 1.00 0.00 N ATOM 1485 CA PHE A 95 -3.024 -5.079 11.170 1.00 0.00 C ATOM 1486 C PHE A 95 -2.959 -6.087 12.312 1.00 0.00 C ATOM 1487 O PHE A 95 -3.850 -6.922 12.466 1.00 0.00 O ATOM 1488 CB PHE A 95 -2.238 -5.598 9.960 1.00 0.00 C ATOM 1489 CG PHE A 95 -2.977 -5.470 8.654 1.00 0.00 C ATOM 1490 CD1 PHE A 95 -3.933 -4.480 8.472 1.00 0.00 C ATOM 1491 CD2 PHE A 95 -2.718 -6.341 7.606 1.00 0.00 C ATOM 1492 CE1 PHE A 95 -4.613 -4.364 7.275 1.00 0.00 C ATOM 1493 CE2 PHE A 95 -3.394 -6.228 6.407 1.00 0.00 C ATOM 1494 CZ PHE A 95 -4.342 -5.239 6.242 1.00 0.00 C ATOM 0 H PHE A 95 -1.543 -3.600 11.327 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.069 -4.955 10.886 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.297 -5.053 9.889 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.988 -6.646 10.124 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -4.148 -3.792 9.276 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.978 -7.118 7.729 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.355 -3.590 7.148 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -3.181 -6.913 5.600 1.00 0.00 H new ATOM 0 HZ PHE A 95 -4.872 -5.149 5.305 1.00 0.00 H new ATOM 1504 N CYS A 96 -1.901 -6.006 13.112 1.00 0.00 N ATOM 1505 CA CYS A 96 -1.727 -6.915 14.239 1.00 0.00 C ATOM 1506 C CYS A 96 -2.712 -6.590 15.356 1.00 0.00 C ATOM 1507 O CYS A 96 -3.351 -7.483 15.914 1.00 0.00 O ATOM 1508 CB CYS A 96 -0.293 -6.838 14.768 1.00 0.00 C ATOM 1509 SG CYS A 96 0.067 -8.008 16.097 1.00 0.00 S ATOM 0 H CYS A 96 -1.153 -5.322 13.001 1.00 0.00 H new ATOM 0 HA CYS A 96 -1.923 -7.929 13.890 1.00 0.00 H new ATOM 0 HB2 CYS A 96 0.397 -7.018 13.944 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -0.104 -5.827 15.128 1.00 0.00 H new ATOM 0 HG CYS A 96 1.303 -7.868 16.476 1.00 0.00 H new ATOM 1515 N GLU A 97 -2.829 -5.307 15.680 1.00 0.00 N ATOM 1516 CA GLU A 97 -3.735 -4.862 16.733 1.00 0.00 C ATOM 1517 C GLU A 97 -5.184 -4.871 16.254 1.00 0.00 C ATOM 1518 O GLU A 97 -6.103 -5.123 17.034 1.00 0.00 O ATOM 1519 CB GLU A 97 -3.354 -3.457 17.201 1.00 0.00 C ATOM 1520 CG GLU A 97 -4.100 -3.007 18.447 1.00 0.00 C ATOM 1521 CD GLU A 97 -3.384 -1.894 19.185 1.00 0.00 C ATOM 1522 OE1 GLU A 97 -3.100 -0.852 18.558 1.00 0.00 O ATOM 1523 OE2 GLU A 97 -3.106 -2.064 20.391 1.00 0.00 O ATOM 0 H GLU A 97 -2.307 -4.556 15.228 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.644 -5.557 17.568 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.282 -3.427 17.399 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.549 -2.749 16.395 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.097 -2.669 18.166 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.228 -3.858 19.116 1.00 0.00 H new ATOM 1530 N ALA A 98 -5.382 -4.591 14.971 1.00 0.00 N ATOM 1531 CA ALA A 98 -6.722 -4.560 14.394 1.00 0.00 C ATOM 1532 C ALA A 98 -6.900 -5.651 13.342 1.00 0.00 C ATOM 1533 O ALA A 98 -6.642 -5.431 12.159 1.00 0.00 O ATOM 1534 CB ALA A 98 -7.002 -3.192 13.791 1.00 0.00 C ATOM 0 H ALA A 98 -4.633 -4.382 14.311 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.438 -4.749 15.194 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.005 -3.181 13.364 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.930 -2.430 14.568 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.272 -2.983 13.009 1.00 0.00 H new ATOM 1540 N PRO A 99 -7.351 -6.848 13.759 1.00 0.00 N ATOM 1541 CA PRO A 99 -7.567 -7.971 12.846 1.00 0.00 C ATOM 1542 C PRO A 99 -8.840 -7.807 12.020 1.00 0.00 C ATOM 1543 O PRO A 99 -9.913 -7.545 12.564 1.00 0.00 O ATOM 1544 CB PRO A 99 -7.693 -9.165 13.789 1.00 0.00 C ATOM 1545 CG PRO A 99 -8.248 -8.591 15.047 1.00 0.00 C ATOM 1546 CD PRO A 99 -7.688 -7.196 15.154 1.00 0.00 C ATOM 0 HA PRO A 99 -6.764 -8.068 12.115 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.353 -9.928 13.376 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -6.726 -9.638 13.961 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.337 -8.572 15.019 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.962 -9.193 15.909 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.416 -6.503 15.575 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -6.809 -7.165 15.798 1.00 0.00 H new ATOM 1554 N GLY A 100 -8.715 -7.962 10.706 1.00 0.00 N ATOM 1555 CA GLY A 100 -9.865 -7.826 9.831 1.00 0.00 C ATOM 1556 C GLY A 100 -10.480 -6.442 9.894 1.00 0.00 C ATOM 1557 O GLY A 100 -11.668 -6.295 10.180 1.00 0.00 O ATOM 0 H GLY A 100 -7.839 -8.179 10.232 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.565 -8.041 8.805 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.616 -8.567 10.105 1.00 0.00 H new ATOM 1561 N SER A 101 -9.668 -5.423 9.629 1.00 0.00 N ATOM 1562 CA SER A 101 -10.136 -4.042 9.660 1.00 0.00 C ATOM 1563 C SER A 101 -10.397 -3.519 8.249 1.00 0.00 C ATOM 1564 O SER A 101 -10.490 -4.294 7.297 1.00 0.00 O ATOM 1565 CB SER A 101 -9.111 -3.156 10.367 1.00 0.00 C ATOM 1566 OG SER A 101 -9.746 -2.114 11.087 1.00 0.00 O ATOM 0 H SER A 101 -8.682 -5.528 9.390 1.00 0.00 H new ATOM 0 HA SER A 101 -11.075 -4.014 10.212 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.512 -3.760 11.048 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.427 -2.730 9.633 1.00 0.00 H new ATOM 0 HG SER A 101 -9.743 -1.295 10.549 1.00 0.00 H new ATOM 1572 N CYS A 102 -10.521 -2.200 8.124 1.00 0.00 N ATOM 1573 CA CYS A 102 -10.777 -1.575 6.832 1.00 0.00 C ATOM 1574 C CYS A 102 -9.725 -0.516 6.509 1.00 0.00 C ATOM 1575 O CYS A 102 -9.653 0.517 7.166 1.00 0.00 O ATOM 1576 CB CYS A 102 -12.170 -0.950 6.860 1.00 0.00 C ATOM 1577 SG CYS A 102 -13.464 -2.087 6.305 1.00 0.00 S ATOM 0 H CYS A 102 -10.448 -1.545 8.902 1.00 0.00 H new ATOM 0 HA CYS A 102 -10.723 -2.334 6.052 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -12.394 -0.620 7.874 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -12.177 -0.063 6.227 1.00 0.00 H new ATOM 0 HG CYS A 102 -13.467 -2.141 5.006 1.00 0.00 H new ATOM 1583 N VAL A 103 -8.921 -0.776 5.481 1.00 0.00 N ATOM 1584 CA VAL A 103 -7.865 0.154 5.081 1.00 0.00 C ATOM 1585 C VAL A 103 -8.229 0.930 3.823 1.00 0.00 C ATOM 1586 O VAL A 103 -8.949 0.434 2.960 1.00 0.00 O ATOM 1587 CB VAL A 103 -6.529 -0.592 4.845 1.00 0.00 C ATOM 1588 CG1 VAL A 103 -5.512 0.297 4.130 1.00 0.00 C ATOM 1589 CG2 VAL A 103 -5.965 -1.098 6.164 1.00 0.00 C ATOM 0 H VAL A 103 -8.979 -1.620 4.911 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.751 0.862 5.902 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.732 -1.447 4.200 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.586 -0.258 3.980 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.912 0.603 3.163 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.312 1.181 4.736 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.026 -1.620 5.982 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.788 -0.255 6.831 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.677 -1.782 6.626 1.00 0.00 H new ATOM 1599 N ALA A 104 -7.696 2.145 3.725 1.00 0.00 N ATOM 1600 CA ALA A 104 -7.933 2.998 2.564 1.00 0.00 C ATOM 1601 C ALA A 104 -6.602 3.403 1.929 1.00 0.00 C ATOM 1602 O ALA A 104 -5.646 3.724 2.629 1.00 0.00 O ATOM 1603 CB ALA A 104 -8.753 4.221 2.959 1.00 0.00 C ATOM 0 H ALA A 104 -7.096 2.562 4.437 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.506 2.439 1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.920 4.846 2.082 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.713 3.900 3.364 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -8.213 4.793 3.714 1.00 0.00 H new ATOM 1609 N VAL A 105 -6.529 3.341 0.604 1.00 0.00 N ATOM 1610 CA VAL A 105 -5.291 3.663 -0.112 1.00 0.00 C ATOM 1611 C VAL A 105 -5.552 4.580 -1.314 1.00 0.00 C ATOM 1612 O VAL A 105 -6.693 4.758 -1.729 1.00 0.00 O ATOM 1613 CB VAL A 105 -4.604 2.369 -0.607 1.00 0.00 C ATOM 1614 CG1 VAL A 105 -3.176 2.637 -1.063 1.00 0.00 C ATOM 1615 CG2 VAL A 105 -4.627 1.295 0.474 1.00 0.00 C ATOM 0 H VAL A 105 -7.307 3.072 0.002 1.00 0.00 H new ATOM 0 HA VAL A 105 -4.641 4.186 0.589 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.167 2.006 -1.467 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.722 1.707 -1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.184 3.358 -1.880 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.598 3.039 -0.231 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.138 0.394 0.103 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -4.100 1.656 1.357 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.660 1.065 0.737 1.00 0.00 H new ATOM 1625 N HIS A 106 -4.481 5.160 -1.866 1.00 0.00 N ATOM 1626 CA HIS A 106 -4.599 6.056 -3.022 1.00 0.00 C ATOM 1627 C HIS A 106 -5.049 5.282 -4.271 1.00 0.00 C ATOM 1628 O HIS A 106 -4.880 4.067 -4.355 1.00 0.00 O ATOM 1629 CB HIS A 106 -3.267 6.780 -3.279 1.00 0.00 C ATOM 1630 CG HIS A 106 -3.058 7.188 -4.708 1.00 0.00 C ATOM 1631 ND1 HIS A 106 -2.796 6.449 -5.812 1.00 0.00 N flip ATOM 1632 CD2 HIS A 106 -3.117 8.497 -5.134 1.00 0.00 C flip ATOM 1633 CE1 HIS A 106 -2.707 7.315 -6.874 1.00 0.00 C flip ATOM 1634 NE2 HIS A 106 -2.904 8.546 -6.437 1.00 0.00 N flip ATOM 0 H HIS A 106 -3.526 5.026 -1.533 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.359 6.804 -2.799 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -3.221 7.668 -2.648 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.447 6.129 -2.974 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.308 9.351 -4.501 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.509 7.036 -7.898 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -2.893 9.391 -7.008 1.00 0.00 H new ATOM 1642 N CYS A 107 -5.664 6.002 -5.213 1.00 0.00 N ATOM 1643 CA CYS A 107 -6.198 5.402 -6.442 1.00 0.00 C ATOM 1644 C CYS A 107 -5.112 4.903 -7.396 1.00 0.00 C ATOM 1645 O CYS A 107 -4.445 5.684 -8.076 1.00 0.00 O ATOM 1646 CB CYS A 107 -7.091 6.410 -7.166 1.00 0.00 C ATOM 1647 SG CYS A 107 -7.903 5.756 -8.643 1.00 0.00 S ATOM 0 H CYS A 107 -5.806 7.010 -5.148 1.00 0.00 H new ATOM 0 HA CYS A 107 -6.774 4.529 -6.136 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -7.854 6.766 -6.473 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -6.489 7.274 -7.448 1.00 0.00 H new ATOM 0 HG CYS A 107 -7.898 6.660 -9.577 1.00 0.00 H new ATOM 1653 N VAL A 108 -4.973 3.582 -7.443 1.00 0.00 N ATOM 1654 CA VAL A 108 -4.015 2.903 -8.310 1.00 0.00 C ATOM 1655 C VAL A 108 -4.474 2.874 -9.776 1.00 0.00 C ATOM 1656 O VAL A 108 -3.796 2.296 -10.626 1.00 0.00 O ATOM 1657 CB VAL A 108 -3.760 1.457 -7.830 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.613 1.420 -6.319 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.878 0.522 -8.278 1.00 0.00 C ATOM 0 H VAL A 108 -5.529 2.945 -6.873 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.090 3.477 -8.252 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.831 1.111 -8.283 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -3.434 0.395 -5.996 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -2.773 2.047 -6.020 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -4.527 1.792 -5.855 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.671 -0.488 -7.925 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.826 0.864 -7.863 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.938 0.521 -9.366 1.00 0.00 H new ATOM 1669 N ALA A 109 -5.639 3.460 -10.067 1.00 0.00 N ATOM 1670 CA ALA A 109 -6.180 3.446 -11.428 1.00 0.00 C ATOM 1671 C ALA A 109 -5.244 4.121 -12.430 1.00 0.00 C ATOM 1672 O ALA A 109 -5.449 4.029 -13.641 1.00 0.00 O ATOM 1673 CB ALA A 109 -7.545 4.119 -11.452 1.00 0.00 C ATOM 0 H ALA A 109 -6.221 3.946 -9.385 1.00 0.00 H new ATOM 0 HA ALA A 109 -6.279 2.403 -11.729 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.940 4.104 -12.468 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -8.226 3.584 -10.790 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.448 5.151 -11.115 1.00 0.00 H new ATOM 1679 N GLY A 110 -4.200 4.763 -11.927 1.00 0.00 N ATOM 1680 CA GLY A 110 -3.228 5.400 -12.790 1.00 0.00 C ATOM 1681 C GLY A 110 -1.832 4.961 -12.419 1.00 0.00 C ATOM 1682 O GLY A 110 -1.623 3.801 -12.063 1.00 0.00 O ATOM 0 H GLY A 110 -4.008 4.854 -10.929 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.432 5.145 -13.830 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -3.311 6.484 -12.705 1.00 0.00 H new ATOM 1686 N LEU A 111 -0.881 5.881 -12.456 1.00 0.00 N ATOM 1687 CA LEU A 111 0.482 5.555 -12.069 1.00 0.00 C ATOM 1688 C LEU A 111 0.769 6.180 -10.713 1.00 0.00 C ATOM 1689 O LEU A 111 0.554 7.376 -10.517 1.00 0.00 O ATOM 1690 CB LEU A 111 1.490 6.055 -13.112 1.00 0.00 C ATOM 1691 CG LEU A 111 1.571 5.240 -14.414 1.00 0.00 C ATOM 1692 CD1 LEU A 111 2.982 5.295 -14.982 1.00 0.00 C ATOM 1693 CD2 LEU A 111 1.152 3.792 -14.191 1.00 0.00 C ATOM 0 H LEU A 111 -1.025 6.848 -12.746 1.00 0.00 H new ATOM 0 HA LEU A 111 0.585 4.472 -12.008 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.240 7.085 -13.366 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.479 6.071 -12.654 1.00 0.00 H new ATOM 0 HG LEU A 111 0.879 5.684 -15.130 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.026 4.714 -15.903 1.00 0.00 H new ATOM 0 HD12 LEU A 111 3.249 6.331 -15.193 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.682 4.880 -14.257 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.221 3.244 -15.131 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.810 3.332 -13.454 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.125 3.762 -13.828 1.00 0.00 H new ATOM 1705 N GLY A 112 1.234 5.369 -9.772 1.00 0.00 N ATOM 1706 CA GLY A 112 1.510 5.884 -8.449 1.00 0.00 C ATOM 1707 C GLY A 112 2.383 4.970 -7.618 1.00 0.00 C ATOM 1708 O GLY A 112 3.120 4.140 -8.148 1.00 0.00 O ATOM 0 H GLY A 112 1.423 4.375 -9.900 1.00 0.00 H new ATOM 0 HA2 GLY A 112 1.996 6.855 -8.540 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.567 6.047 -7.927 1.00 0.00 H new ATOM 1712 N ARG A 113 2.311 5.153 -6.307 1.00 0.00 N ATOM 1713 CA ARG A 113 3.111 4.376 -5.372 1.00 0.00 C ATOM 1714 C ARG A 113 2.235 3.632 -4.349 1.00 0.00 C ATOM 1715 O ARG A 113 2.710 2.738 -3.639 1.00 0.00 O ATOM 1716 CB ARG A 113 4.081 5.319 -4.652 1.00 0.00 C ATOM 1717 CG ARG A 113 4.724 6.368 -5.565 1.00 0.00 C ATOM 1718 CD ARG A 113 3.776 7.523 -5.903 1.00 0.00 C ATOM 1719 NE ARG A 113 4.498 8.708 -6.381 1.00 0.00 N ATOM 1720 CZ ARG A 113 4.017 9.956 -6.340 1.00 0.00 C ATOM 1721 NH1 ARG A 113 2.824 10.210 -5.822 1.00 0.00 N ATOM 1722 NH2 ARG A 113 4.733 10.962 -6.820 1.00 0.00 N ATOM 0 H ARG A 113 1.700 5.840 -5.864 1.00 0.00 H new ATOM 0 HA ARG A 113 3.663 3.620 -5.931 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.548 5.829 -3.850 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.868 4.727 -4.186 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.616 6.766 -5.081 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.049 5.889 -6.488 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.068 7.199 -6.665 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.195 7.785 -5.019 1.00 0.00 H new ATOM 0 HE ARG A 113 5.430 8.571 -6.771 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.258 9.449 -5.447 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.472 11.167 -5.798 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.654 10.786 -7.222 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.364 11.912 -6.787 1.00 0.00 H new ATOM 1736 N ALA A 114 0.963 4.020 -4.266 1.00 0.00 N ATOM 1737 CA ALA A 114 0.025 3.415 -3.321 1.00 0.00 C ATOM 1738 C ALA A 114 -0.127 1.902 -3.501 1.00 0.00 C ATOM 1739 O ALA A 114 -0.103 1.161 -2.520 1.00 0.00 O ATOM 1740 CB ALA A 114 -1.332 4.087 -3.441 1.00 0.00 C ATOM 0 H ALA A 114 0.557 4.755 -4.845 1.00 0.00 H new ATOM 0 HA ALA A 114 0.440 3.571 -2.325 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -2.027 3.632 -2.735 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -1.233 5.150 -3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.712 3.962 -4.455 1.00 0.00 H new ATOM 1746 N PRO A 115 -0.308 1.412 -4.742 1.00 0.00 N ATOM 1747 CA PRO A 115 -0.490 -0.021 -4.996 1.00 0.00 C ATOM 1748 C PRO A 115 0.612 -0.865 -4.371 1.00 0.00 C ATOM 1749 O PRO A 115 0.336 -1.850 -3.679 1.00 0.00 O ATOM 1750 CB PRO A 115 -0.448 -0.133 -6.529 1.00 0.00 C ATOM 1751 CG PRO A 115 0.026 1.196 -7.019 1.00 0.00 C ATOM 1752 CD PRO A 115 -0.390 2.193 -5.980 1.00 0.00 C ATOM 0 HA PRO A 115 -1.417 -0.391 -4.558 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.226 -0.930 -6.845 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -1.433 -0.370 -6.931 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.108 1.199 -7.152 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -0.415 1.435 -7.987 1.00 0.00 H new ATOM 0 HD2 PRO A 115 0.273 3.058 -5.959 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -1.398 2.568 -6.158 1.00 0.00 H new ATOM 1760 N VAL A 116 1.862 -0.475 -4.590 1.00 0.00 N ATOM 1761 CA VAL A 116 2.982 -1.206 -4.020 1.00 0.00 C ATOM 1762 C VAL A 116 2.869 -1.243 -2.505 1.00 0.00 C ATOM 1763 O VAL A 116 2.932 -2.310 -1.896 1.00 0.00 O ATOM 1764 CB VAL A 116 4.338 -0.581 -4.403 1.00 0.00 C ATOM 1765 CG1 VAL A 116 5.488 -1.335 -3.745 1.00 0.00 C ATOM 1766 CG2 VAL A 116 4.507 -0.555 -5.915 1.00 0.00 C ATOM 0 H VAL A 116 2.122 0.335 -5.153 1.00 0.00 H new ATOM 0 HA VAL A 116 2.942 -2.216 -4.427 1.00 0.00 H new ATOM 0 HB VAL A 116 4.355 0.446 -4.038 1.00 0.00 H new ATOM 0 HG11 VAL A 116 6.435 -0.876 -4.030 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.377 -1.295 -2.661 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.476 -2.375 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.470 -0.110 -6.166 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.465 -1.573 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.707 0.037 -6.360 1.00 0.00 H new ATOM 1776 N LEU A 117 2.704 -0.068 -1.905 1.00 0.00 N ATOM 1777 CA LEU A 117 2.589 0.038 -0.455 1.00 0.00 C ATOM 1778 C LEU A 117 1.520 -0.906 0.099 1.00 0.00 C ATOM 1779 O LEU A 117 1.769 -1.641 1.056 1.00 0.00 O ATOM 1780 CB LEU A 117 2.278 1.479 -0.044 1.00 0.00 C ATOM 1781 CG LEU A 117 3.401 2.495 -0.292 1.00 0.00 C ATOM 1782 CD1 LEU A 117 3.213 3.716 0.591 1.00 0.00 C ATOM 1783 CD2 LEU A 117 4.769 1.870 -0.045 1.00 0.00 C ATOM 0 H LEU A 117 2.647 0.822 -2.400 1.00 0.00 H new ATOM 0 HA LEU A 117 3.549 -0.256 -0.031 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.389 1.808 -0.582 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.030 1.490 1.017 1.00 0.00 H new ATOM 0 HG LEU A 117 3.353 2.804 -1.336 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.017 4.428 0.404 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.255 4.184 0.366 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.232 3.414 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.546 2.612 -0.228 1.00 0.00 H new ATOM 0 HD22 LEU A 117 4.831 1.527 0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.909 1.024 -0.718 1.00 0.00 H new ATOM 1795 N VAL A 118 0.329 -0.889 -0.497 1.00 0.00 N ATOM 1796 CA VAL A 118 -0.755 -1.752 -0.037 1.00 0.00 C ATOM 1797 C VAL A 118 -0.285 -3.196 0.064 1.00 0.00 C ATOM 1798 O VAL A 118 -0.483 -3.856 1.085 1.00 0.00 O ATOM 1799 CB VAL A 118 -1.979 -1.690 -0.970 1.00 0.00 C ATOM 1800 CG1 VAL A 118 -3.066 -2.647 -0.501 1.00 0.00 C ATOM 1801 CG2 VAL A 118 -2.517 -0.274 -1.039 1.00 0.00 C ATOM 0 H VAL A 118 0.092 -0.294 -1.291 1.00 0.00 H new ATOM 0 HA VAL A 118 -1.050 -1.387 0.947 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.664 -1.994 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.920 -2.586 -1.175 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.678 -3.666 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.379 -2.376 0.507 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -3.382 -0.245 -1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.813 0.052 -0.042 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.743 0.391 -1.423 1.00 0.00 H new ATOM 1811 N ALA A 119 0.344 -3.680 -0.998 1.00 0.00 N ATOM 1812 CA ALA A 119 0.849 -5.044 -1.019 1.00 0.00 C ATOM 1813 C ALA A 119 1.768 -5.297 0.174 1.00 0.00 C ATOM 1814 O ALA A 119 1.630 -6.299 0.875 1.00 0.00 O ATOM 1815 CB ALA A 119 1.581 -5.313 -2.325 1.00 0.00 C ATOM 0 H ALA A 119 0.516 -3.150 -1.853 1.00 0.00 H new ATOM 0 HA ALA A 119 0.003 -5.728 -0.947 1.00 0.00 H new ATOM 0 HB1 ALA A 119 1.954 -6.337 -2.329 1.00 0.00 H new ATOM 0 HB2 ALA A 119 0.896 -5.173 -3.161 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.418 -4.621 -2.422 1.00 0.00 H new ATOM 1821 N LEU A 120 2.701 -4.375 0.400 1.00 0.00 N ATOM 1822 CA LEU A 120 3.646 -4.488 1.511 1.00 0.00 C ATOM 1823 C LEU A 120 2.910 -4.654 2.835 1.00 0.00 C ATOM 1824 O LEU A 120 3.397 -5.312 3.752 1.00 0.00 O ATOM 1825 CB LEU A 120 4.562 -3.260 1.578 1.00 0.00 C ATOM 1826 CG LEU A 120 4.905 -2.622 0.232 1.00 0.00 C ATOM 1827 CD1 LEU A 120 5.944 -1.525 0.409 1.00 0.00 C ATOM 1828 CD2 LEU A 120 5.388 -3.676 -0.754 1.00 0.00 C ATOM 0 H LEU A 120 2.824 -3.539 -0.172 1.00 0.00 H new ATOM 0 HA LEU A 120 4.258 -5.373 1.335 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.086 -2.507 2.207 1.00 0.00 H new ATOM 0 HB3 LEU A 120 5.490 -3.547 2.072 1.00 0.00 H new ATOM 0 HG LEU A 120 4.001 -2.169 -0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.175 -1.083 -0.560 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.551 -0.756 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.851 -1.949 0.840 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.627 -3.202 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.279 -4.164 -0.358 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.605 -4.419 -0.905 1.00 0.00 H new ATOM 1840 N ALA A 121 1.729 -4.056 2.928 1.00 0.00 N ATOM 1841 CA ALA A 121 0.929 -4.152 4.141 1.00 0.00 C ATOM 1842 C ALA A 121 0.345 -5.549 4.276 1.00 0.00 C ATOM 1843 O ALA A 121 0.494 -6.200 5.308 1.00 0.00 O ATOM 1844 CB ALA A 121 -0.176 -3.109 4.132 1.00 0.00 C ATOM 0 H ALA A 121 1.306 -3.503 2.183 1.00 0.00 H new ATOM 0 HA ALA A 121 1.572 -3.961 5.000 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.764 -3.194 5.046 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.264 -2.113 4.076 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.821 -3.270 3.268 1.00 0.00 H new ATOM 1850 N LEU A 122 -0.307 -6.010 3.217 1.00 0.00 N ATOM 1851 CA LEU A 122 -0.897 -7.339 3.206 1.00 0.00 C ATOM 1852 C LEU A 122 0.193 -8.411 3.214 1.00 0.00 C ATOM 1853 O LEU A 122 -0.076 -9.586 3.461 1.00 0.00 O ATOM 1854 CB LEU A 122 -1.794 -7.499 1.975 1.00 0.00 C ATOM 1855 CG LEU A 122 -2.315 -8.915 1.706 1.00 0.00 C ATOM 1856 CD1 LEU A 122 -2.762 -9.589 2.997 1.00 0.00 C ATOM 1857 CD2 LEU A 122 -3.459 -8.869 0.705 1.00 0.00 C ATOM 0 H LEU A 122 -0.440 -5.482 2.355 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.502 -7.462 4.104 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -2.650 -6.832 2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -1.239 -7.164 1.099 1.00 0.00 H new ATOM 0 HG LEU A 122 -1.501 -9.505 1.285 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.127 -10.592 2.776 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.919 -9.653 3.685 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.560 -9.005 3.455 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.822 -9.880 0.521 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.269 -8.260 1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.107 -8.434 -0.230 1.00 0.00 H new ATOM 1869 N ILE A 123 1.424 -7.991 2.940 1.00 0.00 N ATOM 1870 CA ILE A 123 2.562 -8.899 2.909 1.00 0.00 C ATOM 1871 C ILE A 123 2.733 -9.617 4.251 1.00 0.00 C ATOM 1872 O ILE A 123 3.101 -10.789 4.295 1.00 0.00 O ATOM 1873 CB ILE A 123 3.851 -8.125 2.505 1.00 0.00 C ATOM 1874 CG1 ILE A 123 4.025 -8.197 0.981 1.00 0.00 C ATOM 1875 CG2 ILE A 123 5.101 -8.628 3.239 1.00 0.00 C ATOM 1876 CD1 ILE A 123 5.397 -7.809 0.480 1.00 0.00 C ATOM 0 H ILE A 123 1.658 -7.020 2.735 1.00 0.00 H new ATOM 0 HA ILE A 123 2.376 -9.667 2.158 1.00 0.00 H new ATOM 0 HB ILE A 123 3.732 -7.085 2.809 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.808 -9.213 0.652 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.286 -7.546 0.514 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.968 -8.052 2.917 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.964 -8.509 4.314 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.259 -9.681 3.008 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.424 -7.891 -0.607 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.614 -6.782 0.772 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.144 -8.475 0.913 1.00 0.00 H new ATOM 1888 N GLU A 124 2.459 -8.908 5.338 1.00 0.00 N ATOM 1889 CA GLU A 124 2.582 -9.479 6.678 1.00 0.00 C ATOM 1890 C GLU A 124 1.615 -10.649 6.898 1.00 0.00 C ATOM 1891 O GLU A 124 1.760 -11.405 7.859 1.00 0.00 O ATOM 1892 CB GLU A 124 2.344 -8.401 7.739 1.00 0.00 C ATOM 1893 CG GLU A 124 0.959 -7.775 7.679 1.00 0.00 C ATOM 1894 CD GLU A 124 0.978 -6.284 7.963 1.00 0.00 C ATOM 1895 OE1 GLU A 124 2.082 -5.700 8.012 1.00 0.00 O ATOM 1896 OE2 GLU A 124 -0.112 -5.699 8.132 1.00 0.00 O ATOM 0 H GLU A 124 2.150 -7.936 5.321 1.00 0.00 H new ATOM 0 HA GLU A 124 3.597 -9.866 6.772 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.493 -8.838 8.727 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.092 -7.617 7.621 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.529 -7.947 6.692 1.00 0.00 H new ATOM 0 HG3 GLU A 124 0.309 -8.270 8.401 1.00 0.00 H new ATOM 1903 N SER A 125 0.611 -10.773 6.032 1.00 0.00 N ATOM 1904 CA SER A 125 -0.398 -11.826 6.169 1.00 0.00 C ATOM 1905 C SER A 125 0.073 -13.193 5.653 1.00 0.00 C ATOM 1906 O SER A 125 -0.735 -14.114 5.527 1.00 0.00 O ATOM 1907 CB SER A 125 -1.678 -11.417 5.440 1.00 0.00 C ATOM 1908 OG SER A 125 -2.824 -11.710 6.219 1.00 0.00 O ATOM 0 H SER A 125 0.473 -10.160 5.229 1.00 0.00 H new ATOM 0 HA SER A 125 -0.585 -11.939 7.237 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.649 -10.350 5.218 1.00 0.00 H new ATOM 0 HB3 SER A 125 -1.740 -11.940 4.486 1.00 0.00 H new ATOM 0 HG SER A 125 -3.601 -11.814 5.631 1.00 0.00 H new ATOM 1914 N GLY A 126 1.363 -13.337 5.366 1.00 0.00 N ATOM 1915 CA GLY A 126 1.868 -14.616 4.883 1.00 0.00 C ATOM 1916 C GLY A 126 2.432 -14.532 3.479 1.00 0.00 C ATOM 1917 O GLY A 126 3.593 -14.169 3.297 1.00 0.00 O ATOM 0 H GLY A 126 2.064 -12.601 5.457 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.643 -14.975 5.560 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.063 -15.350 4.903 1.00 0.00 H new ATOM 1921 N MET A 127 1.607 -14.864 2.485 1.00 0.00 N ATOM 1922 CA MET A 127 2.036 -14.812 1.088 1.00 0.00 C ATOM 1923 C MET A 127 2.385 -13.377 0.721 1.00 0.00 C ATOM 1924 O MET A 127 1.606 -12.679 0.082 1.00 0.00 O ATOM 1925 CB MET A 127 0.935 -15.346 0.162 1.00 0.00 C ATOM 1926 CG MET A 127 -0.458 -14.819 0.483 1.00 0.00 C ATOM 1927 SD MET A 127 -1.644 -15.137 -0.841 1.00 0.00 S ATOM 1928 CE MET A 127 -2.926 -13.944 -0.457 1.00 0.00 C ATOM 0 H MET A 127 0.643 -15.170 2.621 1.00 0.00 H new ATOM 0 HA MET A 127 2.916 -15.442 0.963 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.182 -15.085 -0.867 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.922 -16.434 0.220 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.814 -15.282 1.403 1.00 0.00 H new ATOM 0 HG3 MET A 127 -0.403 -13.746 0.666 1.00 0.00 H new ATOM 0 HE1 MET A 127 -3.843 -14.469 -0.188 1.00 0.00 H new ATOM 0 HE2 MET A 127 -2.605 -13.322 0.378 1.00 0.00 H new ATOM 0 HE3 MET A 127 -3.111 -13.315 -1.328 1.00 0.00 H new ATOM 1938 N LYS A 128 3.540 -12.930 1.189 1.00 0.00 N ATOM 1939 CA LYS A 128 3.979 -11.559 0.977 1.00 0.00 C ATOM 1940 C LYS A 128 4.400 -11.243 -0.459 1.00 0.00 C ATOM 1941 O LYS A 128 3.749 -10.450 -1.140 1.00 0.00 O ATOM 1942 CB LYS A 128 5.138 -11.240 1.924 1.00 0.00 C ATOM 1943 CG LYS A 128 6.169 -12.353 2.060 1.00 0.00 C ATOM 1944 CD LYS A 128 6.225 -12.894 3.480 1.00 0.00 C ATOM 1945 CE LYS A 128 7.323 -12.220 4.289 1.00 0.00 C ATOM 1946 NZ LYS A 128 8.680 -12.629 3.834 1.00 0.00 N ATOM 0 H LYS A 128 4.195 -13.502 1.722 1.00 0.00 H new ATOM 0 HA LYS A 128 3.111 -10.933 1.184 1.00 0.00 H new ATOM 0 HB2 LYS A 128 5.640 -10.338 1.572 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.733 -11.015 2.911 1.00 0.00 H new ATOM 0 HG2 LYS A 128 5.925 -13.162 1.371 1.00 0.00 H new ATOM 0 HG3 LYS A 128 7.151 -11.977 1.774 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.263 -12.738 3.968 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.398 -13.970 3.454 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.223 -11.138 4.205 1.00 0.00 H new ATOM 0 HE3 LYS A 128 7.203 -12.471 5.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 9.230 -12.973 4.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 8.595 -13.388 3.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 9.164 -11.813 3.409 1.00 0.00 H new ATOM 1960 N TYR A 129 5.495 -11.832 -0.908 1.00 0.00 N ATOM 1961 CA TYR A 129 6.004 -11.571 -2.246 1.00 0.00 C ATOM 1962 C TYR A 129 5.074 -12.143 -3.310 1.00 0.00 C ATOM 1963 O TYR A 129 4.941 -11.587 -4.401 1.00 0.00 O ATOM 1964 CB TYR A 129 7.410 -12.157 -2.369 1.00 0.00 C ATOM 1965 CG TYR A 129 8.120 -11.826 -3.664 1.00 0.00 C ATOM 1966 CD1 TYR A 129 7.989 -10.576 -4.254 1.00 0.00 C ATOM 1967 CD2 TYR A 129 8.935 -12.763 -4.290 1.00 0.00 C ATOM 1968 CE1 TYR A 129 8.647 -10.270 -5.430 1.00 0.00 C ATOM 1969 CE2 TYR A 129 9.593 -12.464 -5.467 1.00 0.00 C ATOM 1970 CZ TYR A 129 9.446 -11.217 -6.032 1.00 0.00 C ATOM 1971 OH TYR A 129 10.101 -10.915 -7.205 1.00 0.00 O ATOM 0 H TYR A 129 6.050 -12.495 -0.366 1.00 0.00 H new ATOM 0 HA TYR A 129 6.050 -10.494 -2.408 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.014 -11.796 -1.536 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.347 -13.241 -2.271 1.00 0.00 H new ATOM 0 HD1 TYR A 129 7.363 -9.831 -3.786 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.055 -13.741 -3.848 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.535 -9.292 -5.875 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.220 -13.205 -5.942 1.00 0.00 H new ATOM 0 HH TYR A 129 10.623 -11.691 -7.497 1.00 0.00 H new ATOM 1981 N GLU A 130 4.424 -13.249 -2.978 1.00 0.00 N ATOM 1982 CA GLU A 130 3.497 -13.897 -3.898 1.00 0.00 C ATOM 1983 C GLU A 130 2.206 -13.093 -4.043 1.00 0.00 C ATOM 1984 O GLU A 130 1.763 -12.816 -5.158 1.00 0.00 O ATOM 1985 CB GLU A 130 3.176 -15.313 -3.419 1.00 0.00 C ATOM 1986 CG GLU A 130 4.397 -16.214 -3.325 1.00 0.00 C ATOM 1987 CD GLU A 130 4.388 -17.081 -2.082 1.00 0.00 C ATOM 1988 OE1 GLU A 130 3.306 -17.589 -1.719 1.00 0.00 O ATOM 1989 OE2 GLU A 130 5.463 -17.252 -1.469 1.00 0.00 O ATOM 0 H GLU A 130 4.521 -13.718 -2.077 1.00 0.00 H new ATOM 0 HA GLU A 130 3.979 -13.948 -4.874 1.00 0.00 H new ATOM 0 HB2 GLU A 130 2.699 -15.257 -2.440 1.00 0.00 H new ATOM 0 HB3 GLU A 130 2.454 -15.763 -4.100 1.00 0.00 H new ATOM 0 HG2 GLU A 130 4.442 -16.852 -4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 130 5.298 -15.600 -3.329 1.00 0.00 H new ATOM 1996 N ASP A 131 1.600 -12.730 -2.915 1.00 0.00 N ATOM 1997 CA ASP A 131 0.354 -11.968 -2.935 1.00 0.00 C ATOM 1998 C ASP A 131 0.583 -10.545 -3.417 1.00 0.00 C ATOM 1999 O ASP A 131 -0.225 -9.996 -4.158 1.00 0.00 O ATOM 2000 CB ASP A 131 -0.283 -11.935 -1.549 1.00 0.00 C ATOM 2001 CG ASP A 131 -1.724 -11.470 -1.590 1.00 0.00 C ATOM 2002 OD1 ASP A 131 -2.400 -11.717 -2.611 1.00 0.00 O ATOM 2003 OD2 ASP A 131 -2.180 -10.861 -0.600 1.00 0.00 O ATOM 0 H ASP A 131 1.948 -12.949 -1.982 1.00 0.00 H new ATOM 0 HA ASP A 131 -0.320 -12.469 -3.630 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -0.237 -12.930 -1.107 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.292 -11.272 -0.903 1.00 0.00 H new ATOM 2008 N ALA A 132 1.676 -9.939 -2.991 1.00 0.00 N ATOM 2009 CA ALA A 132 1.971 -8.576 -3.394 1.00 0.00 C ATOM 2010 C ALA A 132 2.145 -8.479 -4.900 1.00 0.00 C ATOM 2011 O ALA A 132 1.561 -7.613 -5.537 1.00 0.00 O ATOM 2012 CB ALA A 132 3.204 -8.058 -2.675 1.00 0.00 C ATOM 0 H ALA A 132 2.368 -10.363 -2.373 1.00 0.00 H new ATOM 0 HA ALA A 132 1.124 -7.951 -3.113 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.407 -7.035 -2.992 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.033 -8.077 -1.599 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.059 -8.689 -2.918 1.00 0.00 H new ATOM 2018 N ILE A 133 2.941 -9.366 -5.473 1.00 0.00 N ATOM 2019 CA ILE A 133 3.158 -9.341 -6.909 1.00 0.00 C ATOM 2020 C ILE A 133 1.930 -9.842 -7.670 1.00 0.00 C ATOM 2021 O ILE A 133 1.565 -9.280 -8.699 1.00 0.00 O ATOM 2022 CB ILE A 133 4.399 -10.168 -7.309 1.00 0.00 C ATOM 2023 CG1 ILE A 133 5.624 -9.691 -6.524 1.00 0.00 C ATOM 2024 CG2 ILE A 133 4.654 -10.066 -8.808 1.00 0.00 C ATOM 2025 CD1 ILE A 133 6.043 -8.275 -6.857 1.00 0.00 C ATOM 0 H ILE A 133 3.441 -10.102 -4.975 1.00 0.00 H new ATOM 0 HA ILE A 133 3.334 -8.301 -7.183 1.00 0.00 H new ATOM 0 HB ILE A 133 4.212 -11.214 -7.067 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.410 -9.756 -5.457 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.458 -10.364 -6.723 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.533 -10.656 -9.069 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.788 -10.445 -9.351 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.824 -9.024 -9.078 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.917 -8.005 -6.264 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.289 -8.208 -7.917 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.225 -7.591 -6.631 1.00 0.00 H new ATOM 2037 N GLN A 134 1.298 -10.901 -7.169 1.00 0.00 N ATOM 2038 CA GLN A 134 0.119 -11.466 -7.829 1.00 0.00 C ATOM 2039 C GLN A 134 -1.139 -10.611 -7.633 1.00 0.00 C ATOM 2040 O GLN A 134 -1.840 -10.294 -8.599 1.00 0.00 O ATOM 2041 CB GLN A 134 -0.141 -12.883 -7.315 1.00 0.00 C ATOM 2042 CG GLN A 134 0.934 -13.881 -7.715 1.00 0.00 C ATOM 2043 CD GLN A 134 0.609 -15.294 -7.274 1.00 0.00 C ATOM 2044 OE1 GLN A 134 -0.514 -15.768 -7.446 1.00 0.00 O ATOM 2045 NE2 GLN A 134 1.594 -15.977 -6.701 1.00 0.00 N ATOM 0 H GLN A 134 1.578 -11.383 -6.315 1.00 0.00 H new ATOM 0 HA GLN A 134 0.335 -11.486 -8.897 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -0.216 -12.858 -6.228 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -1.104 -13.227 -7.693 1.00 0.00 H new ATOM 0 HG2 GLN A 134 1.058 -13.862 -8.798 1.00 0.00 H new ATOM 0 HG3 GLN A 134 1.886 -13.578 -7.279 1.00 0.00 H new ATOM 0 HE21 GLN A 134 2.510 -15.545 -6.578 1.00 0.00 H new ATOM 0 HE22 GLN A 134 1.434 -16.933 -6.384 1.00 0.00 H new ATOM 2054 N PHE A 135 -1.432 -10.244 -6.385 1.00 0.00 N ATOM 2055 CA PHE A 135 -2.620 -9.442 -6.092 1.00 0.00 C ATOM 2056 C PHE A 135 -2.478 -8.037 -6.661 1.00 0.00 C ATOM 2057 O PHE A 135 -3.437 -7.476 -7.192 1.00 0.00 O ATOM 2058 CB PHE A 135 -2.889 -9.381 -4.577 1.00 0.00 C ATOM 2059 CG PHE A 135 -4.292 -9.752 -4.174 1.00 0.00 C ATOM 2060 CD1 PHE A 135 -5.011 -10.711 -4.873 1.00 0.00 C ATOM 2061 CD2 PHE A 135 -4.889 -9.142 -3.082 1.00 0.00 C ATOM 2062 CE1 PHE A 135 -6.297 -11.048 -4.491 1.00 0.00 C ATOM 2063 CE2 PHE A 135 -6.173 -9.475 -2.696 1.00 0.00 C ATOM 2064 CZ PHE A 135 -6.879 -10.428 -3.402 1.00 0.00 C ATOM 0 H PHE A 135 -0.870 -10.486 -5.569 1.00 0.00 H new ATOM 0 HA PHE A 135 -3.472 -9.925 -6.570 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -2.191 -10.048 -4.070 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -2.679 -8.371 -4.224 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.562 -11.200 -5.725 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -4.342 -8.396 -2.525 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -6.846 -11.796 -5.044 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -6.624 -8.990 -1.843 1.00 0.00 H new ATOM 0 HZ PHE A 135 -7.884 -10.688 -3.104 1.00 0.00 H new ATOM 2074 N ILE A 136 -1.280 -7.470 -6.559 1.00 0.00 N ATOM 2075 CA ILE A 136 -1.040 -6.133 -7.079 1.00 0.00 C ATOM 2076 C ILE A 136 -0.955 -6.152 -8.605 1.00 0.00 C ATOM 2077 O ILE A 136 -1.289 -5.169 -9.263 1.00 0.00 O ATOM 2078 CB ILE A 136 0.236 -5.501 -6.469 1.00 0.00 C ATOM 2079 CG1 ILE A 136 -0.002 -4.023 -6.174 1.00 0.00 C ATOM 2080 CG2 ILE A 136 1.445 -5.679 -7.380 1.00 0.00 C ATOM 2081 CD1 ILE A 136 -0.979 -3.783 -5.043 1.00 0.00 C ATOM 0 H ILE A 136 -0.469 -7.912 -6.125 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.887 -5.512 -6.786 1.00 0.00 H new ATOM 0 HB ILE A 136 0.454 -6.020 -5.536 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.950 -3.552 -5.928 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.375 -3.536 -7.075 1.00 0.00 H new ATOM 0 HG21 ILE A 136 2.320 -5.222 -6.917 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.630 -6.742 -7.536 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.251 -5.200 -8.340 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -1.100 -2.711 -4.888 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.943 -4.225 -5.295 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -0.598 -4.241 -4.130 1.00 0.00 H new ATOM 2093 N ARG A 137 -0.521 -7.283 -9.164 1.00 0.00 N ATOM 2094 CA ARG A 137 -0.413 -7.421 -10.612 1.00 0.00 C ATOM 2095 C ARG A 137 -1.794 -7.337 -11.253 1.00 0.00 C ATOM 2096 O ARG A 137 -1.968 -6.695 -12.289 1.00 0.00 O ATOM 2097 CB ARG A 137 0.263 -8.746 -10.984 1.00 0.00 C ATOM 2098 CG ARG A 137 0.145 -9.107 -12.457 1.00 0.00 C ATOM 2099 CD ARG A 137 1.378 -9.849 -12.949 1.00 0.00 C ATOM 2100 NE ARG A 137 2.348 -8.947 -13.568 1.00 0.00 N ATOM 2101 CZ ARG A 137 2.242 -8.484 -14.811 1.00 0.00 C ATOM 2102 NH1 ARG A 137 1.210 -8.833 -15.571 1.00 0.00 N ATOM 2103 NH2 ARG A 137 3.168 -7.669 -15.296 1.00 0.00 N ATOM 0 H ARG A 137 -0.241 -8.110 -8.637 1.00 0.00 H new ATOM 0 HA ARG A 137 0.203 -6.604 -10.989 1.00 0.00 H new ATOM 0 HB2 ARG A 137 1.318 -8.691 -10.717 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -0.176 -9.546 -10.388 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -0.739 -9.726 -12.611 1.00 0.00 H new ATOM 0 HG3 ARG A 137 0.006 -8.200 -13.045 1.00 0.00 H new ATOM 0 HD2 ARG A 137 1.847 -10.368 -12.113 1.00 0.00 H new ATOM 0 HD3 ARG A 137 1.080 -10.611 -13.669 1.00 0.00 H new ATOM 0 HE ARG A 137 3.154 -8.655 -13.014 1.00 0.00 H new ATOM 0 HH11 ARG A 137 0.494 -9.459 -15.202 1.00 0.00 H new ATOM 0 HH12 ARG A 137 1.134 -8.475 -16.523 1.00 0.00 H new ATOM 0 HH21 ARG A 137 3.962 -7.397 -14.716 1.00 0.00 H new ATOM 0 HH22 ARG A 137 3.087 -7.314 -16.249 1.00 0.00 H new ATOM 2117 N GLN A 138 -2.776 -7.982 -10.629 1.00 0.00 N ATOM 2118 CA GLN A 138 -4.140 -7.963 -11.147 1.00 0.00 C ATOM 2119 C GLN A 138 -4.652 -6.527 -11.221 1.00 0.00 C ATOM 2120 O GLN A 138 -5.288 -6.130 -12.197 1.00 0.00 O ATOM 2121 CB GLN A 138 -5.060 -8.807 -10.261 1.00 0.00 C ATOM 2122 CG GLN A 138 -5.919 -9.790 -11.039 1.00 0.00 C ATOM 2123 CD GLN A 138 -6.777 -9.110 -12.089 1.00 0.00 C ATOM 2124 OE1 GLN A 138 -6.273 -8.632 -13.105 1.00 0.00 O ATOM 2125 NE2 GLN A 138 -8.082 -9.065 -11.847 1.00 0.00 N ATOM 0 H GLN A 138 -2.654 -8.520 -9.771 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.138 -8.390 -12.150 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -4.453 -9.357 -9.542 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.709 -8.144 -9.689 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -5.276 -10.526 -11.521 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.561 -10.333 -10.346 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -8.456 -9.474 -10.991 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -8.710 -8.621 -12.517 1.00 0.00 H new ATOM 2134 N LYS A 139 -4.347 -5.751 -10.187 1.00 0.00 N ATOM 2135 CA LYS A 139 -4.747 -4.350 -10.126 1.00 0.00 C ATOM 2136 C LYS A 139 -3.701 -3.476 -10.810 1.00 0.00 C ATOM 2137 O LYS A 139 -2.524 -3.832 -10.857 1.00 0.00 O ATOM 2138 CB LYS A 139 -4.930 -3.909 -8.672 1.00 0.00 C ATOM 2139 CG LYS A 139 -6.361 -4.039 -8.173 1.00 0.00 C ATOM 2140 CD LYS A 139 -6.873 -5.463 -8.312 1.00 0.00 C ATOM 2141 CE LYS A 139 -7.882 -5.801 -7.227 1.00 0.00 C ATOM 2142 NZ LYS A 139 -8.750 -6.948 -7.610 1.00 0.00 N ATOM 0 H LYS A 139 -3.820 -6.071 -9.374 1.00 0.00 H new ATOM 0 HA LYS A 139 -5.698 -4.237 -10.646 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -4.276 -4.505 -8.035 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -4.612 -2.871 -8.573 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -6.412 -3.733 -7.128 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -7.006 -3.363 -8.735 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -7.334 -5.591 -9.291 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -6.035 -6.159 -8.261 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -7.355 -6.038 -6.303 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -8.503 -4.928 -7.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -9.423 -7.145 -6.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -9.273 -6.713 -8.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -8.161 -7.788 -7.778 1.00 0.00 H new ATOM 2156 N ARG A 140 -4.124 -2.338 -11.348 1.00 0.00 N ATOM 2157 CA ARG A 140 -3.196 -1.443 -12.028 1.00 0.00 C ATOM 2158 C ARG A 140 -2.304 -0.727 -11.019 1.00 0.00 C ATOM 2159 O ARG A 140 -2.781 0.039 -10.184 1.00 0.00 O ATOM 2160 CB ARG A 140 -3.967 -0.421 -12.864 1.00 0.00 C ATOM 2161 CG ARG A 140 -3.315 -0.119 -14.202 1.00 0.00 C ATOM 2162 CD ARG A 140 -2.322 1.025 -14.091 1.00 0.00 C ATOM 2163 NE ARG A 140 -2.887 2.285 -14.569 1.00 0.00 N ATOM 2164 CZ ARG A 140 -3.286 2.489 -15.824 1.00 0.00 C ATOM 2165 NH1 ARG A 140 -3.148 1.534 -16.735 1.00 0.00 N ATOM 2166 NH2 ARG A 140 -3.821 3.651 -16.169 1.00 0.00 N ATOM 0 H ARG A 140 -5.092 -2.016 -11.327 1.00 0.00 H new ATOM 0 HA ARG A 140 -2.565 -2.038 -12.688 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -4.977 -0.792 -13.036 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -4.060 0.505 -12.297 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -2.806 -1.010 -14.569 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -4.083 0.134 -14.933 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -2.012 1.137 -13.052 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.428 0.787 -14.667 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.981 3.052 -13.904 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -2.735 0.638 -16.476 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.455 1.696 -17.694 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.928 4.390 -15.474 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -4.126 3.807 -17.130 1.00 0.00 H new ATOM 2180 N ARG A 141 -1.003 -0.988 -11.105 1.00 0.00 N ATOM 2181 CA ARG A 141 -0.032 -0.380 -10.204 1.00 0.00 C ATOM 2182 C ARG A 141 0.922 0.540 -10.960 1.00 0.00 C ATOM 2183 O ARG A 141 1.032 0.461 -12.184 1.00 0.00 O ATOM 2184 CB ARG A 141 0.763 -1.464 -9.475 1.00 0.00 C ATOM 2185 CG ARG A 141 1.559 -2.364 -10.405 1.00 0.00 C ATOM 2186 CD ARG A 141 0.820 -3.659 -10.697 1.00 0.00 C ATOM 2187 NE ARG A 141 1.581 -4.540 -11.579 1.00 0.00 N ATOM 2188 CZ ARG A 141 1.620 -4.411 -12.904 1.00 0.00 C ATOM 2189 NH1 ARG A 141 0.946 -3.437 -13.504 1.00 0.00 N ATOM 2190 NH2 ARG A 141 2.335 -5.259 -13.631 1.00 0.00 N ATOM 0 H ARG A 141 -0.596 -1.620 -11.794 1.00 0.00 H new ATOM 0 HA ARG A 141 -0.580 0.218 -9.476 1.00 0.00 H new ATOM 0 HB2 ARG A 141 1.446 -0.990 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG A 141 0.076 -2.076 -8.891 1.00 0.00 H new ATOM 0 HG2 ARG A 141 1.757 -1.839 -11.339 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.526 -2.589 -9.955 1.00 0.00 H new ATOM 0 HD2 ARG A 141 0.612 -4.176 -9.760 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.142 -3.431 -11.156 1.00 0.00 H new ATOM 0 HE ARG A 141 2.114 -5.299 -11.155 1.00 0.00 H new ATOM 0 HH11 ARG A 141 0.394 -2.782 -12.950 1.00 0.00 H new ATOM 0 HH12 ARG A 141 0.980 -3.344 -14.519 1.00 0.00 H new ATOM 0 HH21 ARG A 141 2.854 -6.009 -13.175 1.00 0.00 H new ATOM 0 HH22 ARG A 141 2.365 -5.161 -14.646 1.00 0.00 H new ATOM 2204 N GLY A 142 1.621 1.401 -10.224 1.00 0.00 N ATOM 2205 CA GLY A 142 2.570 2.308 -10.848 1.00 0.00 C ATOM 2206 C GLY A 142 3.621 1.559 -11.646 1.00 0.00 C ATOM 2207 O GLY A 142 3.465 0.367 -11.912 1.00 0.00 O ATOM 0 H GLY A 142 1.548 1.487 -9.210 1.00 0.00 H new ATOM 0 HA2 GLY A 142 2.038 2.997 -11.504 1.00 0.00 H new ATOM 0 HA3 GLY A 142 3.056 2.910 -10.081 1.00 0.00 H new ATOM 2211 N ALA A 143 4.692 2.242 -12.035 1.00 0.00 N ATOM 2212 CA ALA A 143 5.743 1.594 -12.809 1.00 0.00 C ATOM 2213 C ALA A 143 6.816 0.990 -11.905 1.00 0.00 C ATOM 2214 O ALA A 143 7.710 1.689 -11.432 1.00 0.00 O ATOM 2215 CB ALA A 143 6.369 2.587 -13.776 1.00 0.00 C ATOM 0 H ALA A 143 4.854 3.228 -11.831 1.00 0.00 H new ATOM 0 HA ALA A 143 5.288 0.780 -13.374 1.00 0.00 H new ATOM 0 HB1 ALA A 143 7.153 2.092 -14.349 1.00 0.00 H new ATOM 0 HB2 ALA A 143 5.605 2.963 -14.456 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.798 3.418 -13.217 1.00 0.00 H new ATOM 2221 N ILE A 144 6.729 -0.321 -11.693 1.00 0.00 N ATOM 2222 CA ILE A 144 7.705 -1.037 -10.873 1.00 0.00 C ATOM 2223 C ILE A 144 8.884 -1.493 -11.724 1.00 0.00 C ATOM 2224 O ILE A 144 8.735 -2.385 -12.559 1.00 0.00 O ATOM 2225 CB ILE A 144 7.074 -2.263 -10.177 1.00 0.00 C ATOM 2226 CG1 ILE A 144 6.229 -3.073 -11.165 1.00 0.00 C ATOM 2227 CG2 ILE A 144 6.228 -1.821 -8.993 1.00 0.00 C ATOM 2228 CD1 ILE A 144 5.721 -4.379 -10.595 1.00 0.00 C ATOM 0 H ILE A 144 5.991 -0.911 -12.078 1.00 0.00 H new ATOM 0 HA ILE A 144 8.052 -0.345 -10.106 1.00 0.00 H new ATOM 0 HB ILE A 144 7.878 -2.902 -9.812 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.379 -2.470 -11.484 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.824 -3.281 -12.054 1.00 0.00 H new ATOM 0 HG21 ILE A 144 5.790 -2.696 -8.512 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.854 -1.289 -8.277 1.00 0.00 H new ATOM 0 HG23 ILE A 144 5.433 -1.161 -9.340 1.00 0.00 H new ATOM 0 HD11 ILE A 144 5.131 -4.900 -11.349 1.00 0.00 H new ATOM 0 HD12 ILE A 144 6.566 -5.002 -10.302 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.099 -4.178 -9.723 1.00 0.00 H new ATOM 2240 N ASN A 145 10.054 -0.882 -11.540 1.00 0.00 N ATOM 2241 CA ASN A 145 11.212 -1.265 -12.341 1.00 0.00 C ATOM 2242 C ASN A 145 12.324 -1.930 -11.525 1.00 0.00 C ATOM 2243 O ASN A 145 12.511 -3.144 -11.597 1.00 0.00 O ATOM 2244 CB ASN A 145 11.775 -0.038 -13.060 1.00 0.00 C ATOM 2245 CG ASN A 145 11.051 0.253 -14.359 1.00 0.00 C ATOM 2246 OD1 ASN A 145 11.655 0.264 -15.431 1.00 0.00 O ATOM 2247 ND2 ASN A 145 9.747 0.492 -14.269 1.00 0.00 N ATOM 0 H ASN A 145 10.222 -0.139 -10.862 1.00 0.00 H new ATOM 0 HA ASN A 145 10.859 -2.005 -13.059 1.00 0.00 H new ATOM 0 HB2 ASN A 145 11.702 0.830 -12.404 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.834 -0.194 -13.265 1.00 0.00 H new ATOM 0 HD21 ASN A 145 9.206 0.695 -15.110 1.00 0.00 H new ATOM 0 HD22 ASN A 145 9.287 0.473 -13.359 1.00 0.00 H new ATOM 2254 N SER A 146 13.087 -1.128 -10.782 1.00 0.00 N ATOM 2255 CA SER A 146 14.207 -1.657 -10.002 1.00 0.00 C ATOM 2256 C SER A 146 13.900 -1.861 -8.517 1.00 0.00 C ATOM 2257 O SER A 146 14.019 -2.969 -7.998 1.00 0.00 O ATOM 2258 CB SER A 146 15.415 -0.730 -10.144 1.00 0.00 C ATOM 2259 OG SER A 146 16.611 -1.391 -9.769 1.00 0.00 O ATOM 0 H SER A 146 12.953 -0.120 -10.704 1.00 0.00 H new ATOM 0 HA SER A 146 14.415 -2.646 -10.411 1.00 0.00 H new ATOM 0 HB2 SER A 146 15.494 -0.386 -11.175 1.00 0.00 H new ATOM 0 HB3 SER A 146 15.274 0.154 -9.522 1.00 0.00 H new ATOM 0 HG SER A 146 17.369 -0.778 -9.870 1.00 0.00 H new ATOM 2265 N LYS A 147 13.566 -0.774 -7.828 1.00 0.00 N ATOM 2266 CA LYS A 147 13.317 -0.820 -6.386 1.00 0.00 C ATOM 2267 C LYS A 147 12.093 -1.638 -5.997 1.00 0.00 C ATOM 2268 O LYS A 147 12.166 -2.461 -5.094 1.00 0.00 O ATOM 2269 CB LYS A 147 13.175 0.596 -5.823 1.00 0.00 C ATOM 2270 CG LYS A 147 13.551 0.709 -4.351 1.00 0.00 C ATOM 2271 CD LYS A 147 12.343 0.522 -3.441 1.00 0.00 C ATOM 2272 CE LYS A 147 12.752 0.448 -1.975 1.00 0.00 C ATOM 2273 NZ LYS A 147 11.574 0.519 -1.058 1.00 0.00 N ATOM 0 H LYS A 147 13.461 0.152 -8.243 1.00 0.00 H new ATOM 0 HA LYS A 147 14.184 -1.320 -5.955 1.00 0.00 H new ATOM 0 HB2 LYS A 147 13.803 1.273 -6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 147 12.145 0.928 -5.952 1.00 0.00 H new ATOM 0 HG2 LYS A 147 14.306 -0.039 -4.111 1.00 0.00 H new ATOM 0 HG3 LYS A 147 13.999 1.685 -4.164 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.647 1.349 -3.584 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.815 -0.390 -3.719 1.00 0.00 H new ATOM 0 HE2 LYS A 147 13.294 -0.481 -1.797 1.00 0.00 H new ATOM 0 HE3 LYS A 147 13.437 1.265 -1.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 11.844 0.167 -0.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 11.254 1.505 -0.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 10.803 -0.066 -1.438 1.00 0.00 H new ATOM 2287 N GLN A 148 10.964 -1.384 -6.636 1.00 0.00 N ATOM 2288 CA GLN A 148 9.727 -2.080 -6.287 1.00 0.00 C ATOM 2289 C GLN A 148 9.856 -3.604 -6.371 1.00 0.00 C ATOM 2290 O GLN A 148 9.523 -4.313 -5.416 1.00 0.00 O ATOM 2291 CB GLN A 148 8.587 -1.592 -7.182 1.00 0.00 C ATOM 2292 CG GLN A 148 8.513 -0.073 -7.292 1.00 0.00 C ATOM 2293 CD GLN A 148 7.243 0.501 -6.695 1.00 0.00 C ATOM 2294 OE1 GLN A 148 7.138 0.457 -5.372 1.00 0.00 O flip ATOM 2295 NE2 GLN A 148 6.369 0.985 -7.416 1.00 0.00 N flip ATOM 0 H GLN A 148 10.873 -0.707 -7.394 1.00 0.00 H new ATOM 0 HA GLN A 148 9.508 -1.843 -5.246 1.00 0.00 H new ATOM 0 HB2 GLN A 148 8.710 -2.016 -8.179 1.00 0.00 H new ATOM 0 HB3 GLN A 148 7.641 -1.967 -6.791 1.00 0.00 H new ATOM 0 HG2 GLN A 148 9.375 0.365 -6.789 1.00 0.00 H new ATOM 0 HG3 GLN A 148 8.577 0.214 -8.342 1.00 0.00 H new ATOM 0 HE21 GLN A 148 6.492 0.998 -8.428 1.00 0.00 H new ATOM 0 HE22 GLN A 148 5.522 1.373 -7.000 1.00 0.00 H new ATOM 2304 N LEU A 149 10.334 -4.114 -7.501 1.00 0.00 N ATOM 2305 CA LEU A 149 10.483 -5.558 -7.670 1.00 0.00 C ATOM 2306 C LEU A 149 11.650 -6.101 -6.848 1.00 0.00 C ATOM 2307 O LEU A 149 11.517 -7.117 -6.165 1.00 0.00 O ATOM 2308 CB LEU A 149 10.669 -5.912 -9.149 1.00 0.00 C ATOM 2309 CG LEU A 149 9.491 -6.655 -9.792 1.00 0.00 C ATOM 2310 CD1 LEU A 149 9.069 -7.849 -8.941 1.00 0.00 C ATOM 2311 CD2 LEU A 149 8.321 -5.706 -10.003 1.00 0.00 C ATOM 0 H LEU A 149 10.622 -3.558 -8.306 1.00 0.00 H new ATOM 0 HA LEU A 149 9.568 -6.027 -7.306 1.00 0.00 H new ATOM 0 HB2 LEU A 149 10.847 -4.993 -9.707 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.564 -6.525 -9.250 1.00 0.00 H new ATOM 0 HG LEU A 149 9.813 -7.032 -10.763 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.232 -8.359 -9.419 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.906 -8.540 -8.843 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.766 -7.503 -7.953 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.492 -6.246 -10.460 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.004 -5.300 -9.042 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.628 -4.891 -10.658 1.00 0.00 H new ATOM 2323 N THR A 150 12.792 -5.426 -6.921 1.00 0.00 N ATOM 2324 CA THR A 150 13.976 -5.856 -6.183 1.00 0.00 C ATOM 2325 C THR A 150 13.733 -5.817 -4.678 1.00 0.00 C ATOM 2326 O THR A 150 14.181 -6.701 -3.945 1.00 0.00 O ATOM 2327 CB THR A 150 15.175 -4.974 -6.539 1.00 0.00 C ATOM 2328 OG1 THR A 150 15.418 -5.000 -7.934 1.00 0.00 O ATOM 2329 CG2 THR A 150 16.454 -5.394 -5.846 1.00 0.00 C ATOM 0 H THR A 150 12.924 -4.583 -7.480 1.00 0.00 H new ATOM 0 HA THR A 150 14.191 -6.886 -6.469 1.00 0.00 H new ATOM 0 HB THR A 150 14.908 -3.973 -6.201 1.00 0.00 H new ATOM 0 HG1 THR A 150 15.158 -4.141 -8.327 1.00 0.00 H new ATOM 0 HG21 THR A 150 17.264 -4.728 -6.142 1.00 0.00 H new ATOM 0 HG22 THR A 150 16.317 -5.341 -4.766 1.00 0.00 H new ATOM 0 HG23 THR A 150 16.703 -6.416 -6.130 1.00 0.00 H new ATOM 2337 N TYR A 151 13.024 -4.792 -4.218 1.00 0.00 N ATOM 2338 CA TYR A 151 12.734 -4.651 -2.797 1.00 0.00 C ATOM 2339 C TYR A 151 11.898 -5.824 -2.297 1.00 0.00 C ATOM 2340 O TYR A 151 12.238 -6.448 -1.290 1.00 0.00 O ATOM 2341 CB TYR A 151 12.021 -3.317 -2.522 1.00 0.00 C ATOM 2342 CG TYR A 151 10.877 -3.401 -1.536 1.00 0.00 C ATOM 2343 CD1 TYR A 151 11.077 -3.870 -0.243 1.00 0.00 C ATOM 2344 CD2 TYR A 151 9.597 -3.010 -1.904 1.00 0.00 C ATOM 2345 CE1 TYR A 151 10.030 -3.949 0.654 1.00 0.00 C ATOM 2346 CE2 TYR A 151 8.546 -3.085 -1.013 1.00 0.00 C ATOM 2347 CZ TYR A 151 8.768 -3.556 0.265 1.00 0.00 C ATOM 2348 OH TYR A 151 7.724 -3.634 1.158 1.00 0.00 O ATOM 0 H TYR A 151 12.642 -4.051 -4.805 1.00 0.00 H new ATOM 0 HA TYR A 151 13.678 -4.653 -2.253 1.00 0.00 H new ATOM 0 HB2 TYR A 151 12.752 -2.600 -2.148 1.00 0.00 H new ATOM 0 HB3 TYR A 151 11.642 -2.923 -3.465 1.00 0.00 H new ATOM 0 HD1 TYR A 151 12.066 -4.177 0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 151 9.421 -2.641 -2.904 1.00 0.00 H new ATOM 0 HE1 TYR A 151 10.199 -4.317 1.655 1.00 0.00 H new ATOM 0 HE2 TYR A 151 7.556 -2.777 -1.314 1.00 0.00 H new ATOM 0 HH TYR A 151 7.826 -4.437 1.711 1.00 0.00 H new ATOM 2358 N LEU A 152 10.804 -6.127 -2.993 1.00 0.00 N ATOM 2359 CA LEU A 152 9.956 -7.234 -2.577 1.00 0.00 C ATOM 2360 C LEU A 152 10.729 -8.546 -2.626 1.00 0.00 C ATOM 2361 O LEU A 152 10.576 -9.405 -1.753 1.00 0.00 O ATOM 2362 CB LEU A 152 8.686 -7.315 -3.423 1.00 0.00 C ATOM 2363 CG LEU A 152 7.395 -7.321 -2.601 1.00 0.00 C ATOM 2364 CD1 LEU A 152 6.182 -7.536 -3.485 1.00 0.00 C ATOM 2365 CD2 LEU A 152 7.459 -8.389 -1.522 1.00 0.00 C ATOM 0 H LEU A 152 10.491 -5.632 -3.829 1.00 0.00 H new ATOM 0 HA LEU A 152 9.650 -7.053 -1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.664 -6.469 -4.110 1.00 0.00 H new ATOM 0 HB3 LEU A 152 8.723 -8.219 -4.031 1.00 0.00 H new ATOM 0 HG LEU A 152 7.296 -6.345 -2.125 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.281 -7.535 -2.872 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.121 -6.734 -4.221 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.271 -8.493 -3.998 1.00 0.00 H new ATOM 0 HD21 LEU A 152 6.534 -8.380 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 152 7.589 -9.367 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 152 8.300 -8.187 -0.859 1.00 0.00 H new ATOM 2377 N GLU A 153 11.592 -8.683 -3.629 1.00 0.00 N ATOM 2378 CA GLU A 153 12.413 -9.879 -3.755 1.00 0.00 C ATOM 2379 C GLU A 153 13.229 -10.061 -2.479 1.00 0.00 C ATOM 2380 O GLU A 153 13.410 -11.177 -1.991 1.00 0.00 O ATOM 2381 CB GLU A 153 13.340 -9.771 -4.968 1.00 0.00 C ATOM 2382 CG GLU A 153 14.099 -11.052 -5.269 1.00 0.00 C ATOM 2383 CD GLU A 153 15.440 -10.793 -5.927 1.00 0.00 C ATOM 2384 OE1 GLU A 153 16.393 -10.426 -5.208 1.00 0.00 O ATOM 2385 OE2 GLU A 153 15.537 -10.956 -7.162 1.00 0.00 O ATOM 0 H GLU A 153 11.739 -7.986 -4.359 1.00 0.00 H new ATOM 0 HA GLU A 153 11.767 -10.745 -3.901 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.750 -9.494 -5.842 1.00 0.00 H new ATOM 0 HB3 GLU A 153 14.055 -8.966 -4.798 1.00 0.00 H new ATOM 0 HG2 GLU A 153 14.254 -11.605 -4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 153 13.495 -11.684 -5.920 1.00 0.00 H new ATOM 2392 N LYS A 154 13.691 -8.937 -1.930 1.00 0.00 N ATOM 2393 CA LYS A 154 14.459 -8.937 -0.689 1.00 0.00 C ATOM 2394 C LYS A 154 13.525 -9.190 0.493 1.00 0.00 C ATOM 2395 O LYS A 154 13.951 -9.646 1.554 1.00 0.00 O ATOM 2396 CB LYS A 154 15.188 -7.599 -0.514 1.00 0.00 C ATOM 2397 CG LYS A 154 15.748 -7.373 0.884 1.00 0.00 C ATOM 2398 CD LYS A 154 14.696 -6.798 1.823 1.00 0.00 C ATOM 2399 CE LYS A 154 14.983 -5.343 2.165 1.00 0.00 C ATOM 2400 NZ LYS A 154 13.755 -4.620 2.602 1.00 0.00 N ATOM 0 H LYS A 154 13.544 -8.010 -2.330 1.00 0.00 H new ATOM 0 HA LYS A 154 15.204 -9.732 -0.731 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.005 -7.546 -1.234 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.499 -6.789 -0.753 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.118 -8.316 1.285 1.00 0.00 H new ATOM 0 HG3 LYS A 154 16.599 -6.694 0.830 1.00 0.00 H new ATOM 0 HD2 LYS A 154 13.713 -6.876 1.359 1.00 0.00 H new ATOM 0 HD3 LYS A 154 14.664 -7.388 2.739 1.00 0.00 H new ATOM 0 HE2 LYS A 154 15.732 -5.297 2.956 1.00 0.00 H new ATOM 0 HE3 LYS A 154 15.408 -4.843 1.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.440 -3.982 1.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 13.003 -5.308 2.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 13.964 -4.066 3.457 1.00 0.00 H new ATOM 2414 N TYR A 155 12.244 -8.894 0.287 1.00 0.00 N ATOM 2415 CA TYR A 155 11.227 -9.087 1.311 1.00 0.00 C ATOM 2416 C TYR A 155 11.056 -10.570 1.601 1.00 0.00 C ATOM 2417 O TYR A 155 10.796 -10.969 2.735 1.00 0.00 O ATOM 2418 CB TYR A 155 9.901 -8.497 0.828 1.00 0.00 C ATOM 2419 CG TYR A 155 9.093 -7.797 1.896 1.00 0.00 C ATOM 2420 CD1 TYR A 155 9.201 -8.151 3.236 1.00 0.00 C ATOM 2421 CD2 TYR A 155 8.211 -6.783 1.555 1.00 0.00 C ATOM 2422 CE1 TYR A 155 8.449 -7.510 4.203 1.00 0.00 C ATOM 2423 CE2 TYR A 155 7.459 -6.138 2.511 1.00 0.00 C ATOM 2424 CZ TYR A 155 7.578 -6.505 3.835 1.00 0.00 C ATOM 2425 OH TYR A 155 6.828 -5.864 4.794 1.00 0.00 O ATOM 0 H TYR A 155 11.886 -8.516 -0.590 1.00 0.00 H new ATOM 0 HA TYR A 155 11.537 -8.582 2.226 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.105 -7.789 0.025 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.297 -9.298 0.401 1.00 0.00 H new ATOM 0 HD1 TYR A 155 9.882 -8.938 3.526 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.112 -6.493 0.519 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.543 -7.794 5.241 1.00 0.00 H new ATOM 0 HE2 TYR A 155 6.779 -5.349 2.226 1.00 0.00 H new ATOM 0 HH TYR A 155 5.983 -6.343 4.923 1.00 0.00 H new ATOM 2435 N ARG A 156 11.216 -11.383 0.562 1.00 0.00 N ATOM 2436 CA ARG A 156 11.092 -12.829 0.698 1.00 0.00 C ATOM 2437 C ARG A 156 12.468 -13.490 0.627 1.00 0.00 C ATOM 2438 O ARG A 156 12.911 -13.914 -0.440 1.00 0.00 O ATOM 2439 CB ARG A 156 10.179 -13.391 -0.395 1.00 0.00 C ATOM 2440 CG ARG A 156 9.082 -14.300 0.137 1.00 0.00 C ATOM 2441 CD ARG A 156 9.607 -15.697 0.424 1.00 0.00 C ATOM 2442 NE ARG A 156 8.929 -16.313 1.562 1.00 0.00 N ATOM 2443 CZ ARG A 156 8.934 -17.622 1.809 1.00 0.00 C ATOM 2444 NH1 ARG A 156 9.580 -18.454 1.001 1.00 0.00 N ATOM 2445 NH2 ARG A 156 8.292 -18.099 2.866 1.00 0.00 N ATOM 0 H ARG A 156 11.432 -11.065 -0.383 1.00 0.00 H new ATOM 0 HA ARG A 156 10.649 -13.048 1.670 1.00 0.00 H new ATOM 0 HB2 ARG A 156 9.722 -12.563 -0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 156 10.784 -13.946 -1.112 1.00 0.00 H new ATOM 0 HG2 ARG A 156 8.664 -13.873 1.049 1.00 0.00 H new ATOM 0 HG3 ARG A 156 8.271 -14.357 -0.589 1.00 0.00 H new ATOM 0 HD2 ARG A 156 9.475 -16.322 -0.459 1.00 0.00 H new ATOM 0 HD3 ARG A 156 10.678 -15.648 0.623 1.00 0.00 H new ATOM 0 HE ARG A 156 8.422 -15.705 2.205 1.00 0.00 H new ATOM 0 HH11 ARG A 156 10.076 -18.092 0.186 1.00 0.00 H new ATOM 0 HH12 ARG A 156 9.581 -19.455 1.195 1.00 0.00 H new ATOM 0 HH21 ARG A 156 7.794 -17.464 3.490 1.00 0.00 H new ATOM 0 HH22 ARG A 156 8.296 -19.101 3.055 1.00 0.00 H new ATOM 2459 N PRO A 157 13.166 -13.575 1.774 1.00 0.00 N ATOM 2460 CA PRO A 157 14.503 -14.177 1.849 1.00 0.00 C ATOM 2461 C PRO A 157 14.483 -15.686 1.634 1.00 0.00 C ATOM 2462 O PRO A 157 13.485 -16.352 1.911 1.00 0.00 O ATOM 2463 CB PRO A 157 14.965 -13.847 3.270 1.00 0.00 C ATOM 2464 CG PRO A 157 13.706 -13.675 4.045 1.00 0.00 C ATOM 2465 CD PRO A 157 12.709 -13.084 3.088 1.00 0.00 C ATOM 0 HA PRO A 157 15.161 -13.792 1.070 1.00 0.00 H new ATOM 0 HB2 PRO A 157 15.578 -14.648 3.683 1.00 0.00 H new ATOM 0 HB3 PRO A 157 15.569 -12.940 3.290 1.00 0.00 H new ATOM 0 HG2 PRO A 157 13.354 -14.630 4.435 1.00 0.00 H new ATOM 0 HG3 PRO A 157 13.861 -13.019 4.901 1.00 0.00 H new ATOM 0 HD2 PRO A 157 11.694 -13.414 3.310 1.00 0.00 H new ATOM 0 HD3 PRO A 157 12.707 -11.995 3.132 1.00 0.00 H new ATOM 2473 N LYS A 158 15.599 -16.219 1.147 1.00 0.00 N ATOM 2474 CA LYS A 158 15.724 -17.646 0.901 1.00 0.00 C ATOM 2475 C LYS A 158 17.159 -18.101 1.142 1.00 0.00 C ATOM 2476 O LYS A 158 18.098 -17.579 0.541 1.00 0.00 O ATOM 2477 CB LYS A 158 15.303 -17.979 -0.532 1.00 0.00 C ATOM 2478 CG LYS A 158 14.572 -19.306 -0.659 1.00 0.00 C ATOM 2479 CD LYS A 158 14.241 -19.622 -2.108 1.00 0.00 C ATOM 2480 CE LYS A 158 12.900 -19.033 -2.514 1.00 0.00 C ATOM 2481 NZ LYS A 158 13.017 -17.600 -2.902 1.00 0.00 N ATOM 0 H LYS A 158 16.432 -15.678 0.915 1.00 0.00 H new ATOM 0 HA LYS A 158 15.066 -18.174 1.592 1.00 0.00 H new ATOM 0 HB2 LYS A 158 14.661 -17.182 -0.907 1.00 0.00 H new ATOM 0 HB3 LYS A 158 16.189 -18.000 -1.167 1.00 0.00 H new ATOM 0 HG2 LYS A 158 15.188 -20.103 -0.243 1.00 0.00 H new ATOM 0 HG3 LYS A 158 13.653 -19.274 -0.073 1.00 0.00 H new ATOM 0 HD2 LYS A 158 15.024 -19.227 -2.756 1.00 0.00 H new ATOM 0 HD3 LYS A 158 14.223 -20.702 -2.251 1.00 0.00 H new ATOM 0 HE2 LYS A 158 12.491 -19.603 -3.348 1.00 0.00 H new ATOM 0 HE3 LYS A 158 12.196 -19.129 -1.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 12.326 -17.385 -3.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 12.829 -17.000 -2.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 13.977 -17.413 -3.254 1.00 0.00 H new ATOM 2495 N GLN A 159 17.317 -19.072 2.029 1.00 0.00 N ATOM 2496 CA GLN A 159 18.635 -19.602 2.363 1.00 0.00 C ATOM 2497 C GLN A 159 19.227 -20.399 1.200 1.00 0.00 C ATOM 2498 O GLN A 159 20.408 -20.748 1.217 1.00 0.00 O ATOM 2499 CB GLN A 159 18.550 -20.484 3.611 1.00 0.00 C ATOM 2500 CG GLN A 159 19.006 -19.783 4.880 1.00 0.00 C ATOM 2501 CD GLN A 159 18.543 -20.492 6.137 1.00 0.00 C ATOM 2502 OE1 GLN A 159 17.972 -21.582 6.075 1.00 0.00 O ATOM 2503 NE2 GLN A 159 18.789 -19.878 7.288 1.00 0.00 N ATOM 0 H GLN A 159 16.547 -19.512 2.533 1.00 0.00 H new ATOM 0 HA GLN A 159 19.293 -18.757 2.563 1.00 0.00 H new ATOM 0 HB2 GLN A 159 17.521 -20.819 3.740 1.00 0.00 H new ATOM 0 HB3 GLN A 159 19.159 -21.375 3.459 1.00 0.00 H new ATOM 0 HG2 GLN A 159 20.094 -19.718 4.884 1.00 0.00 H new ATOM 0 HG3 GLN A 159 18.626 -18.761 4.883 1.00 0.00 H new ATOM 0 HE21 GLN A 159 19.265 -18.976 7.293 1.00 0.00 H new ATOM 0 HE22 GLN A 159 18.502 -20.308 8.167 1.00 0.00 H new ATOM 2512 N ARG A 160 18.407 -20.686 0.192 1.00 0.00 N ATOM 2513 CA ARG A 160 18.861 -21.442 -0.969 1.00 0.00 C ATOM 2514 C ARG A 160 20.020 -20.731 -1.662 1.00 0.00 C ATOM 2515 O ARG A 160 20.893 -21.373 -2.249 1.00 0.00 O ATOM 2516 CB ARG A 160 17.709 -21.643 -1.956 1.00 0.00 C ATOM 2517 CG ARG A 160 17.718 -23.006 -2.630 1.00 0.00 C ATOM 2518 CD ARG A 160 16.319 -23.429 -3.049 1.00 0.00 C ATOM 2519 NE ARG A 160 16.095 -23.241 -4.480 1.00 0.00 N ATOM 2520 CZ ARG A 160 16.595 -24.041 -5.420 1.00 0.00 C ATOM 2521 NH1 ARG A 160 17.345 -25.083 -5.083 1.00 0.00 N ATOM 2522 NH2 ARG A 160 16.343 -23.799 -6.699 1.00 0.00 N ATOM 0 H ARG A 160 17.427 -20.406 0.157 1.00 0.00 H new ATOM 0 HA ARG A 160 19.209 -22.416 -0.624 1.00 0.00 H new ATOM 0 HB2 ARG A 160 16.763 -21.513 -1.430 1.00 0.00 H new ATOM 0 HB3 ARG A 160 17.757 -20.868 -2.721 1.00 0.00 H new ATOM 0 HG2 ARG A 160 18.368 -22.976 -3.505 1.00 0.00 H new ATOM 0 HG3 ARG A 160 18.135 -23.748 -1.948 1.00 0.00 H new ATOM 0 HD2 ARG A 160 16.165 -24.477 -2.793 1.00 0.00 H new ATOM 0 HD3 ARG A 160 15.583 -22.853 -2.488 1.00 0.00 H new ATOM 0 HE ARG A 160 15.522 -22.451 -4.777 1.00 0.00 H new ATOM 0 HH11 ARG A 160 17.541 -25.274 -4.100 1.00 0.00 H new ATOM 0 HH12 ARG A 160 17.726 -25.693 -5.807 1.00 0.00 H new ATOM 0 HH21 ARG A 160 15.766 -23.000 -6.963 1.00 0.00 H new ATOM 0 HH22 ARG A 160 16.726 -24.412 -7.419 1.00 0.00 H new ATOM 2536 N LEU A 161 20.024 -19.404 -1.589 1.00 0.00 N ATOM 2537 CA LEU A 161 21.078 -18.608 -2.209 1.00 0.00 C ATOM 2538 C LEU A 161 22.272 -18.462 -1.271 1.00 0.00 C ATOM 2539 O LEU A 161 23.422 -18.599 -1.689 1.00 0.00 O ATOM 2540 CB LEU A 161 20.544 -17.226 -2.593 1.00 0.00 C ATOM 2541 CG LEU A 161 19.497 -17.224 -3.708 1.00 0.00 C ATOM 2542 CD1 LEU A 161 18.094 -17.242 -3.124 1.00 0.00 C ATOM 2543 CD2 LEU A 161 19.683 -16.014 -4.612 1.00 0.00 C ATOM 0 H LEU A 161 19.310 -18.857 -1.107 1.00 0.00 H new ATOM 0 HA LEU A 161 21.407 -19.125 -3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 161 20.110 -16.762 -1.707 1.00 0.00 H new ATOM 0 HB3 LEU A 161 21.383 -16.602 -2.902 1.00 0.00 H new ATOM 0 HG LEU A 161 19.631 -18.125 -4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 161 17.363 -17.240 -3.933 1.00 0.00 H new ATOM 0 HD12 LEU A 161 17.963 -18.139 -2.519 1.00 0.00 H new ATOM 0 HD13 LEU A 161 17.948 -16.360 -2.501 1.00 0.00 H new ATOM 0 HD21 LEU A 161 18.930 -16.029 -5.400 1.00 0.00 H new ATOM 0 HD22 LEU A 161 19.577 -15.102 -4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 161 20.676 -16.044 -5.060 1.00 0.00 H new ATOM 2555 N ARG A 162 21.991 -18.181 -0.004 1.00 0.00 N ATOM 2556 CA ARG A 162 23.043 -18.015 0.994 1.00 0.00 C ATOM 2557 C ARG A 162 23.513 -19.367 1.521 1.00 0.00 C ATOM 2558 O ARG A 162 24.579 -19.854 1.144 1.00 0.00 O ATOM 2559 CB ARG A 162 22.543 -17.149 2.152 1.00 0.00 C ATOM 2560 CG ARG A 162 22.480 -15.666 1.820 1.00 0.00 C ATOM 2561 CD ARG A 162 23.839 -15.122 1.408 1.00 0.00 C ATOM 2562 NE ARG A 162 24.264 -14.008 2.253 1.00 0.00 N ATOM 2563 CZ ARG A 162 24.842 -14.156 3.444 1.00 0.00 C ATOM 2564 NH1 ARG A 162 25.068 -15.369 3.935 1.00 0.00 N ATOM 2565 NH2 ARG A 162 25.195 -13.087 4.145 1.00 0.00 N ATOM 0 H ARG A 162 21.044 -18.063 0.357 1.00 0.00 H new ATOM 0 HA ARG A 162 23.888 -17.519 0.516 1.00 0.00 H new ATOM 0 HB2 ARG A 162 21.550 -17.489 2.447 1.00 0.00 H new ATOM 0 HB3 ARG A 162 23.198 -17.293 3.011 1.00 0.00 H new ATOM 0 HG2 ARG A 162 21.764 -15.504 1.014 1.00 0.00 H new ATOM 0 HG3 ARG A 162 22.115 -15.115 2.687 1.00 0.00 H new ATOM 0 HD2 ARG A 162 24.580 -15.920 1.461 1.00 0.00 H new ATOM 0 HD3 ARG A 162 23.798 -14.794 0.369 1.00 0.00 H new ATOM 0 HE ARG A 162 24.109 -13.060 1.910 1.00 0.00 H new ATOM 0 HH11 ARG A 162 24.799 -16.194 3.400 1.00 0.00 H new ATOM 0 HH12 ARG A 162 25.511 -15.475 4.848 1.00 0.00 H new ATOM 0 HH21 ARG A 162 25.024 -12.153 3.772 1.00 0.00 H new ATOM 0 HH22 ARG A 162 25.638 -13.199 5.057 1.00 0.00 H new ATOM 2579 N PHE A 163 22.712 -19.968 2.395 1.00 0.00 N ATOM 2580 CA PHE A 163 23.047 -21.263 2.974 1.00 0.00 C ATOM 2581 C PHE A 163 22.912 -22.375 1.939 1.00 0.00 C ATOM 2582 O PHE A 163 22.473 -22.138 0.812 1.00 0.00 O ATOM 2583 CB PHE A 163 22.144 -21.557 4.173 1.00 0.00 C ATOM 2584 CG PHE A 163 22.614 -20.919 5.450 1.00 0.00 C ATOM 2585 CD1 PHE A 163 22.975 -19.582 5.479 1.00 0.00 C ATOM 2586 CD2 PHE A 163 22.692 -21.657 6.619 1.00 0.00 C ATOM 2587 CE1 PHE A 163 23.408 -18.993 6.652 1.00 0.00 C ATOM 2588 CE2 PHE A 163 23.124 -21.074 7.795 1.00 0.00 C ATOM 2589 CZ PHE A 163 23.481 -19.740 7.812 1.00 0.00 C ATOM 0 H PHE A 163 21.826 -19.578 2.718 1.00 0.00 H new ATOM 0 HA PHE A 163 24.084 -21.225 3.307 1.00 0.00 H new ATOM 0 HB2 PHE A 163 21.135 -21.208 3.952 1.00 0.00 H new ATOM 0 HB3 PHE A 163 22.084 -22.636 4.316 1.00 0.00 H new ATOM 0 HD1 PHE A 163 22.918 -18.993 4.575 1.00 0.00 H new ATOM 0 HD2 PHE A 163 22.412 -22.700 6.612 1.00 0.00 H new ATOM 0 HE1 PHE A 163 23.689 -17.950 6.662 1.00 0.00 H new ATOM 0 HE2 PHE A 163 23.182 -21.661 8.700 1.00 0.00 H new ATOM 0 HZ PHE A 163 23.817 -19.282 8.730 1.00 0.00 H new ATOM 2599 N LYS A 164 23.291 -23.587 2.328 1.00 0.00 N ATOM 2600 CA LYS A 164 23.212 -24.737 1.433 1.00 0.00 C ATOM 2601 C LYS A 164 23.621 -26.017 2.156 1.00 0.00 C ATOM 2602 O LYS A 164 24.788 -26.201 2.501 1.00 0.00 O ATOM 2603 CB LYS A 164 24.103 -24.520 0.209 1.00 0.00 C ATOM 2604 CG LYS A 164 23.459 -24.956 -1.097 1.00 0.00 C ATOM 2605 CD LYS A 164 23.625 -26.450 -1.328 1.00 0.00 C ATOM 2606 CE LYS A 164 22.428 -27.229 -0.806 1.00 0.00 C ATOM 2607 NZ LYS A 164 22.041 -28.336 -1.725 1.00 0.00 N ATOM 0 H LYS A 164 23.656 -23.799 3.257 1.00 0.00 H new ATOM 0 HA LYS A 164 22.178 -24.841 1.105 1.00 0.00 H new ATOM 0 HB2 LYS A 164 24.363 -23.463 0.142 1.00 0.00 H new ATOM 0 HB3 LYS A 164 25.035 -25.069 0.346 1.00 0.00 H new ATOM 0 HG2 LYS A 164 22.399 -24.704 -1.083 1.00 0.00 H new ATOM 0 HG3 LYS A 164 23.906 -24.407 -1.926 1.00 0.00 H new ATOM 0 HD2 LYS A 164 23.750 -26.643 -2.393 1.00 0.00 H new ATOM 0 HD3 LYS A 164 24.531 -26.798 -0.832 1.00 0.00 H new ATOM 0 HE2 LYS A 164 22.662 -27.638 0.177 1.00 0.00 H new ATOM 0 HE3 LYS A 164 21.583 -26.553 -0.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 21.221 -28.842 -1.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 21.793 -27.944 -2.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 22.838 -28.996 -1.829 1.00 0.00 H new ATOM 2621 N ASP A 165 22.651 -26.898 2.383 1.00 0.00 N ATOM 2622 CA ASP A 165 22.909 -28.160 3.066 1.00 0.00 C ATOM 2623 C ASP A 165 23.756 -29.088 2.196 1.00 0.00 C ATOM 2624 O ASP A 165 23.300 -29.558 1.153 1.00 0.00 O ATOM 2625 CB ASP A 165 21.589 -28.847 3.424 1.00 0.00 C ATOM 2626 CG ASP A 165 20.758 -29.176 2.200 1.00 0.00 C ATOM 2627 OD1 ASP A 165 20.855 -28.435 1.200 1.00 0.00 O ATOM 2628 OD2 ASP A 165 20.009 -30.174 2.243 1.00 0.00 O ATOM 0 H ASP A 165 21.680 -26.761 2.104 1.00 0.00 H new ATOM 0 HA ASP A 165 23.461 -27.943 3.981 1.00 0.00 H new ATOM 0 HB2 ASP A 165 21.798 -29.764 3.975 1.00 0.00 H new ATOM 0 HB3 ASP A 165 21.014 -28.200 4.087 1.00 0.00 H new ATOM 2633 N PRO A 166 25.006 -29.369 2.610 1.00 0.00 N ATOM 2634 CA PRO A 166 25.908 -30.247 1.856 1.00 0.00 C ATOM 2635 C PRO A 166 25.268 -31.595 1.538 1.00 0.00 C ATOM 2636 O PRO A 166 24.106 -31.835 1.866 1.00 0.00 O ATOM 2637 CB PRO A 166 27.101 -30.431 2.796 1.00 0.00 C ATOM 2638 CG PRO A 166 27.086 -29.223 3.666 1.00 0.00 C ATOM 2639 CD PRO A 166 25.640 -28.855 3.840 1.00 0.00 C ATOM 0 HA PRO A 166 26.175 -29.821 0.889 1.00 0.00 H new ATOM 0 HB2 PRO A 166 27.005 -31.344 3.384 1.00 0.00 H new ATOM 0 HB3 PRO A 166 28.035 -30.507 2.240 1.00 0.00 H new ATOM 0 HG2 PRO A 166 27.554 -29.430 4.628 1.00 0.00 H new ATOM 0 HG3 PRO A 166 27.644 -28.406 3.209 1.00 0.00 H new ATOM 0 HD2 PRO A 166 25.214 -29.312 4.733 1.00 0.00 H new ATOM 0 HD3 PRO A 166 25.509 -27.778 3.940 1.00 0.00 H new ATOM 2647 N HIS A 167 26.034 -32.471 0.896 1.00 0.00 N ATOM 2648 CA HIS A 167 25.542 -33.796 0.534 1.00 0.00 C ATOM 2649 C HIS A 167 26.702 -34.754 0.280 1.00 0.00 C ATOM 2650 O HIS A 167 26.698 -35.889 0.758 1.00 0.00 O ATOM 2651 CB HIS A 167 24.650 -33.709 -0.706 1.00 0.00 C ATOM 2652 CG HIS A 167 23.350 -34.436 -0.559 1.00 0.00 C ATOM 2653 ND1 HIS A 167 22.617 -34.440 0.609 1.00 0.00 N ATOM 2654 CD2 HIS A 167 22.648 -35.187 -1.442 1.00 0.00 C ATOM 2655 CE1 HIS A 167 21.523 -35.161 0.441 1.00 0.00 C ATOM 2656 NE2 HIS A 167 21.517 -35.625 -0.796 1.00 0.00 N ATOM 0 H HIS A 167 26.997 -32.288 0.616 1.00 0.00 H new ATOM 0 HA HIS A 167 24.954 -34.181 1.367 1.00 0.00 H new ATOM 0 HB2 HIS A 167 24.448 -32.661 -0.926 1.00 0.00 H new ATOM 0 HB3 HIS A 167 25.190 -34.116 -1.561 1.00 0.00 H new ATOM 0 HD2 HIS A 167 22.926 -35.401 -2.463 1.00 0.00 H new ATOM 0 HE1 HIS A 167 20.763 -35.341 1.187 1.00 0.00 H new ATOM 0 HE2 HIS A 167 20.791 -36.213 -1.205 1.00 0.00 H new ATOM 2664 N THR A 168 27.690 -34.291 -0.476 1.00 0.00 N ATOM 2665 CA THR A 168 28.856 -35.107 -0.795 1.00 0.00 C ATOM 2666 C THR A 168 29.651 -35.435 0.464 1.00 0.00 C ATOM 2667 O THR A 168 30.263 -36.499 0.566 1.00 0.00 O ATOM 2668 CB THR A 168 29.751 -34.383 -1.802 1.00 0.00 C ATOM 2669 OG1 THR A 168 30.981 -35.068 -1.963 1.00 0.00 O ATOM 2670 CG2 THR A 168 30.068 -32.958 -1.405 1.00 0.00 C ATOM 0 H THR A 168 27.707 -33.355 -0.880 1.00 0.00 H new ATOM 0 HA THR A 168 28.505 -36.040 -1.236 1.00 0.00 H new ATOM 0 HB THR A 168 29.183 -34.366 -2.732 1.00 0.00 H new ATOM 0 HG1 THR A 168 31.539 -34.590 -2.612 1.00 0.00 H new ATOM 0 HG21 THR A 168 30.706 -32.503 -2.162 1.00 0.00 H new ATOM 0 HG22 THR A 168 29.142 -32.389 -1.321 1.00 0.00 H new ATOM 0 HG23 THR A 168 30.585 -32.954 -0.445 1.00 0.00 H new ATOM 2678 N HIS A 169 29.639 -34.513 1.423 1.00 0.00 N ATOM 2679 CA HIS A 169 30.359 -34.705 2.676 1.00 0.00 C ATOM 2680 C HIS A 169 29.390 -34.978 3.823 1.00 0.00 C ATOM 2681 O HIS A 169 28.253 -34.508 3.813 1.00 0.00 O ATOM 2682 CB HIS A 169 31.213 -33.474 2.991 1.00 0.00 C ATOM 2683 CG HIS A 169 32.674 -33.776 3.116 1.00 0.00 C ATOM 2684 ND1 HIS A 169 33.646 -33.101 2.407 1.00 0.00 N ATOM 2685 CD2 HIS A 169 33.330 -34.686 3.874 1.00 0.00 C ATOM 2686 CE1 HIS A 169 34.835 -33.582 2.722 1.00 0.00 C ATOM 2687 NE2 HIS A 169 34.671 -34.545 3.611 1.00 0.00 N ATOM 0 H HIS A 169 29.139 -33.627 1.355 1.00 0.00 H new ATOM 0 HA HIS A 169 31.012 -35.571 2.564 1.00 0.00 H new ATOM 0 HB2 HIS A 169 31.070 -32.732 2.206 1.00 0.00 H new ATOM 0 HB3 HIS A 169 30.862 -33.026 3.921 1.00 0.00 H new ATOM 0 HD2 HIS A 169 32.882 -35.392 4.558 1.00 0.00 H new ATOM 0 HE1 HIS A 169 35.780 -33.245 2.321 1.00 0.00 H new ATOM 0 HE2 HIS A 169 35.419 -35.095 4.034 1.00 0.00 H new ATOM 2695 N LYS A 170 29.849 -35.740 4.810 1.00 0.00 N ATOM 2696 CA LYS A 170 29.023 -36.075 5.964 1.00 0.00 C ATOM 2697 C LYS A 170 29.856 -36.097 7.242 1.00 0.00 C ATOM 2698 O LYS A 170 31.067 -36.312 7.202 1.00 0.00 O ATOM 2699 CB LYS A 170 28.349 -37.433 5.758 1.00 0.00 C ATOM 2700 CG LYS A 170 26.997 -37.341 5.070 1.00 0.00 C ATOM 2701 CD LYS A 170 26.084 -38.487 5.480 1.00 0.00 C ATOM 2702 CE LYS A 170 26.301 -39.712 4.608 1.00 0.00 C ATOM 2703 NZ LYS A 170 27.205 -40.703 5.255 1.00 0.00 N ATOM 0 H LYS A 170 30.788 -36.137 4.834 1.00 0.00 H new ATOM 0 HA LYS A 170 28.256 -35.307 6.065 1.00 0.00 H new ATOM 0 HB2 LYS A 170 29.006 -38.070 5.166 1.00 0.00 H new ATOM 0 HB3 LYS A 170 28.223 -37.918 6.726 1.00 0.00 H new ATOM 0 HG2 LYS A 170 26.525 -36.391 5.319 1.00 0.00 H new ATOM 0 HG3 LYS A 170 27.136 -37.354 3.989 1.00 0.00 H new ATOM 0 HD2 LYS A 170 26.268 -38.745 6.523 1.00 0.00 H new ATOM 0 HD3 LYS A 170 25.044 -38.168 5.409 1.00 0.00 H new ATOM 0 HE2 LYS A 170 25.340 -40.181 4.396 1.00 0.00 H new ATOM 0 HE3 LYS A 170 26.724 -39.406 3.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 27.327 -41.523 4.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 28.130 -40.264 5.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 26.790 -41.015 6.156 1.00 0.00 H new ATOM 2717 N THR A 171 29.198 -35.874 8.375 1.00 0.00 N ATOM 2718 CA THR A 171 29.878 -35.868 9.665 1.00 0.00 C ATOM 2719 C THR A 171 28.878 -36.035 10.807 1.00 0.00 C ATOM 2720 O THR A 171 27.712 -35.661 10.683 1.00 0.00 O ATOM 2721 CB THR A 171 30.664 -34.570 9.845 1.00 0.00 C ATOM 2722 OG1 THR A 171 30.033 -33.503 9.158 1.00 0.00 O ATOM 2723 CG2 THR A 171 32.090 -34.659 9.347 1.00 0.00 C ATOM 0 H THR A 171 28.195 -35.695 8.426 1.00 0.00 H new ATOM 0 HA THR A 171 30.571 -36.709 9.687 1.00 0.00 H new ATOM 0 HB THR A 171 30.684 -34.391 10.920 1.00 0.00 H new ATOM 0 HG1 THR A 171 30.550 -32.680 9.286 1.00 0.00 H new ATOM 0 HG21 THR A 171 32.591 -33.704 9.505 1.00 0.00 H new ATOM 0 HG22 THR A 171 32.618 -35.440 9.893 1.00 0.00 H new ATOM 0 HG23 THR A 171 32.090 -34.897 8.283 1.00 0.00 H new ATOM 2731 N ARG A 172 29.345 -36.598 11.916 1.00 0.00 N ATOM 2732 CA ARG A 172 28.492 -36.814 13.080 1.00 0.00 C ATOM 2733 C ARG A 172 28.717 -35.728 14.127 1.00 0.00 C ATOM 2734 O ARG A 172 29.887 -35.348 14.343 1.00 0.00 O ATOM 2735 CB ARG A 172 28.763 -38.191 13.688 1.00 0.00 C ATOM 2736 CG ARG A 172 30.236 -38.460 13.951 1.00 0.00 C ATOM 2737 CD ARG A 172 30.439 -39.242 15.239 1.00 0.00 C ATOM 2738 NE ARG A 172 30.490 -40.683 15.002 1.00 0.00 N ATOM 2739 CZ ARG A 172 30.876 -41.571 15.916 1.00 0.00 C ATOM 2740 NH1 ARG A 172 31.245 -41.171 17.127 1.00 0.00 N ATOM 2741 NH2 ARG A 172 30.894 -42.863 15.618 1.00 0.00 N ATOM 2742 OXT ARG A 172 27.721 -35.267 14.723 1.00 0.00 O ATOM 0 H ARG A 172 30.308 -36.913 12.034 1.00 0.00 H new ATOM 0 HA ARG A 172 27.453 -36.768 12.753 1.00 0.00 H new ATOM 0 HB2 ARG A 172 28.213 -38.280 14.625 1.00 0.00 H new ATOM 0 HB3 ARG A 172 28.376 -38.958 13.017 1.00 0.00 H new ATOM 0 HG2 ARG A 172 30.660 -39.017 13.115 1.00 0.00 H new ATOM 0 HG3 ARG A 172 30.775 -37.514 14.010 1.00 0.00 H new ATOM 0 HD2 ARG A 172 31.364 -38.920 15.717 1.00 0.00 H new ATOM 0 HD3 ARG A 172 29.628 -39.017 15.932 1.00 0.00 H new ATOM 0 HE ARG A 172 30.214 -41.029 14.083 1.00 0.00 H new ATOM 0 HH11 ARG A 172 31.234 -40.178 17.362 1.00 0.00 H new ATOM 0 HH12 ARG A 172 31.540 -41.856 17.823 1.00 0.00 H new ATOM 0 HH21 ARG A 172 30.612 -43.176 14.689 1.00 0.00 H new ATOM 0 HH22 ARG A 172 31.190 -43.544 16.318 1.00 0.00 H new TER 2756 ARG A 172