USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1100 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 93 HIS : no HD1:sc= -1.55 K(o=-2,f=-2.8!) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= -0.464 USER MOD Set 2.1: A 14 SER OG : rot -170:sc= -0.116 USER MOD Set 2.2: A 27 ASN : amide:sc= -0.829 X(o=-0.91,f=-1.2) USER MOD Set 2.3: A 76 THR OG1 : rot 180:sc= 0.0375 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0229 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -30:sc= -0.187 USER MOD Single : A 18 ASN : amide:sc= -0.243 K(o=-0.24,f=-8.2!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -122:sc= -2.58 (180deg=-7.65!) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -103:sc= -0.553 (180deg=-4.18!) USER MOD Single : A 43 THR OG1 : rot 59:sc= -3.23! USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -148:sc= -1.87 (180deg=-3.78!) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0409 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -1.91! C(o=-1.9!,f=-4.1!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 152:sc= 0.0627 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0334 K(o=-0.033,f=-2.2) USER MOD Single : A 88 GLN : amide:sc=-0.00168 X(o=-0.0017,f=-0.022) USER MOD Single : A 98 SER OG : rot -120:sc= -0.498 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0246 USER MOD Single : A 116 SER OG : rot -61:sc= 1.03 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 170:sc= 0.498 (180deg=0.454) USER MOD Single : A 125 MET CE :methyl -128:sc= -6.38! (180deg=-6.95!) USER MOD Single : A 127 MET CE :methyl -153:sc= -2.86! (180deg=-5.32!) USER MOD Single : A 128 ASN : amide:sc=-0.00379 K(o=-0.0038,f=-0.58) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.461 -6.891 18.266 1.00 0.00 N ATOM 2 CA GLY A 1 -25.380 -6.080 17.063 1.00 0.00 C ATOM 3 C GLY A 1 -25.942 -6.833 15.856 1.00 0.00 C ATOM 4 O GLY A 1 -27.153 -7.013 15.740 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.074 -6.358 19.071 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.455 -7.132 18.456 1.00 0.00 H new ATOM 0 H3 GLY A 1 -24.913 -7.765 18.133 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -25.934 -5.152 17.207 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -24.342 -5.806 16.874 1.00 0.00 H new ATOM 8 N SER A 2 -25.034 -7.254 14.986 1.00 0.00 N ATOM 9 CA SER A 2 -25.424 -7.983 13.792 1.00 0.00 C ATOM 10 C SER A 2 -24.506 -9.191 13.593 1.00 0.00 C ATOM 11 O SER A 2 -24.976 -10.324 13.500 1.00 0.00 O ATOM 12 CB SER A 2 -25.386 -7.080 12.558 1.00 0.00 C ATOM 13 OG SER A 2 -24.141 -6.397 12.433 1.00 0.00 O ATOM 0 H SER A 2 -24.030 -7.104 15.085 1.00 0.00 H new ATOM 0 HA SER A 2 -26.449 -8.330 13.924 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.562 -7.680 11.665 1.00 0.00 H new ATOM 0 HB3 SER A 2 -26.195 -6.351 12.617 1.00 0.00 H new ATOM 0 HG SER A 2 -24.157 -5.832 11.632 1.00 0.00 H new ATOM 19 N SER A 3 -23.213 -8.908 13.535 1.00 0.00 N ATOM 20 CA SER A 3 -22.225 -9.957 13.349 1.00 0.00 C ATOM 21 C SER A 3 -22.501 -10.711 12.047 1.00 0.00 C ATOM 22 O SER A 3 -23.625 -10.704 11.547 1.00 0.00 O ATOM 23 CB SER A 3 -22.222 -10.926 14.533 1.00 0.00 C ATOM 24 OG SER A 3 -21.579 -10.370 15.677 1.00 0.00 O ATOM 0 H SER A 3 -22.827 -7.967 13.614 1.00 0.00 H new ATOM 0 HA SER A 3 -21.240 -9.493 13.291 1.00 0.00 H new ATOM 0 HB2 SER A 3 -23.248 -11.191 14.787 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.717 -11.848 14.246 1.00 0.00 H new ATOM 0 HG SER A 3 -21.600 -11.019 16.411 1.00 0.00 H new ATOM 30 N GLY A 4 -21.455 -11.343 11.534 1.00 0.00 N ATOM 31 CA GLY A 4 -21.571 -12.101 10.299 1.00 0.00 C ATOM 32 C GLY A 4 -20.969 -11.328 9.124 1.00 0.00 C ATOM 33 O GLY A 4 -21.190 -10.125 8.989 1.00 0.00 O ATOM 0 H GLY A 4 -20.524 -11.346 11.951 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.063 -13.059 10.407 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.620 -12.317 10.098 1.00 0.00 H new ATOM 37 N SER A 5 -20.221 -12.050 8.303 1.00 0.00 N ATOM 38 CA SER A 5 -19.587 -11.447 7.143 1.00 0.00 C ATOM 39 C SER A 5 -18.972 -12.533 6.258 1.00 0.00 C ATOM 40 O SER A 5 -18.125 -13.302 6.711 1.00 0.00 O ATOM 41 CB SER A 5 -18.517 -10.437 7.563 1.00 0.00 C ATOM 42 OG SER A 5 -18.030 -9.683 6.457 1.00 0.00 O ATOM 0 H SER A 5 -20.040 -13.047 8.418 1.00 0.00 H new ATOM 0 HA SER A 5 -20.350 -10.914 6.576 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.932 -9.759 8.309 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.688 -10.963 8.036 1.00 0.00 H new ATOM 0 HG SER A 5 -17.350 -9.049 6.767 1.00 0.00 H new ATOM 48 N SER A 6 -19.423 -12.563 5.013 1.00 0.00 N ATOM 49 CA SER A 6 -18.928 -13.543 4.061 1.00 0.00 C ATOM 50 C SER A 6 -17.646 -13.031 3.402 1.00 0.00 C ATOM 51 O SER A 6 -17.621 -12.777 2.199 1.00 0.00 O ATOM 52 CB SER A 6 -19.982 -13.859 2.998 1.00 0.00 C ATOM 53 OG SER A 6 -20.890 -14.869 3.429 1.00 0.00 O ATOM 0 H SER A 6 -20.126 -11.924 4.641 1.00 0.00 H new ATOM 0 HA SER A 6 -18.708 -14.464 4.601 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.537 -12.952 2.757 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.487 -14.183 2.082 1.00 0.00 H new ATOM 0 HG SER A 6 -21.548 -15.040 2.723 1.00 0.00 H new ATOM 59 N GLY A 7 -16.612 -12.894 4.220 1.00 0.00 N ATOM 60 CA GLY A 7 -15.330 -12.417 3.731 1.00 0.00 C ATOM 61 C GLY A 7 -15.334 -10.895 3.576 1.00 0.00 C ATOM 62 O GLY A 7 -16.328 -10.314 3.144 1.00 0.00 O ATOM 0 H GLY A 7 -16.636 -13.105 5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.540 -12.714 4.421 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.106 -12.883 2.771 1.00 0.00 H new ATOM 66 N LEU A 8 -14.211 -10.293 3.939 1.00 0.00 N ATOM 67 CA LEU A 8 -14.072 -8.849 3.846 1.00 0.00 C ATOM 68 C LEU A 8 -14.039 -8.438 2.372 1.00 0.00 C ATOM 69 O LEU A 8 -15.084 -8.224 1.760 1.00 0.00 O ATOM 70 CB LEU A 8 -12.856 -8.375 4.644 1.00 0.00 C ATOM 71 CG LEU A 8 -13.014 -8.366 6.166 1.00 0.00 C ATOM 72 CD1 LEU A 8 -14.408 -7.880 6.569 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.693 -9.740 6.758 1.00 0.00 C ATOM 0 H LEU A 8 -13.389 -10.778 4.298 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.932 -8.354 4.296 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.009 -9.012 4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.604 -7.366 4.319 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.294 -7.660 6.581 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.494 -7.883 7.656 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.562 -6.868 6.196 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -15.162 -8.543 6.143 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.813 -9.707 7.841 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.372 -10.484 6.341 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.665 -10.010 6.515 1.00 0.00 H new ATOM 85 N GLY A 9 -12.827 -8.340 1.846 1.00 0.00 N ATOM 86 CA GLY A 9 -12.644 -7.959 0.455 1.00 0.00 C ATOM 87 C GLY A 9 -11.223 -8.273 -0.017 1.00 0.00 C ATOM 88 O GLY A 9 -10.509 -9.044 0.622 1.00 0.00 O ATOM 0 H GLY A 9 -11.962 -8.518 2.357 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.364 -8.489 -0.169 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.843 -6.894 0.337 1.00 0.00 H new ATOM 92 N THR A 10 -10.856 -7.660 -1.133 1.00 0.00 N ATOM 93 CA THR A 10 -9.533 -7.865 -1.698 1.00 0.00 C ATOM 94 C THR A 10 -8.765 -6.542 -1.750 1.00 0.00 C ATOM 95 O THR A 10 -9.324 -5.484 -1.468 1.00 0.00 O ATOM 96 CB THR A 10 -9.702 -8.524 -3.068 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.333 -9.768 -2.780 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.364 -8.921 -3.695 1.00 0.00 C ATOM 0 H THR A 10 -11.451 -7.022 -1.661 1.00 0.00 H new ATOM 0 HA THR A 10 -8.934 -8.528 -1.074 1.00 0.00 H new ATOM 0 HB THR A 10 -10.228 -7.842 -3.736 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.482 -10.260 -3.614 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.540 -9.384 -4.666 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.745 -8.033 -3.824 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.852 -9.629 -3.043 1.00 0.00 H new ATOM 106 N LEU A 11 -7.495 -6.647 -2.113 1.00 0.00 N ATOM 107 CA LEU A 11 -6.644 -5.473 -2.206 1.00 0.00 C ATOM 108 C LEU A 11 -5.725 -5.609 -3.421 1.00 0.00 C ATOM 109 O LEU A 11 -4.988 -6.587 -3.540 1.00 0.00 O ATOM 110 CB LEU A 11 -5.896 -5.248 -0.890 1.00 0.00 C ATOM 111 CG LEU A 11 -4.674 -4.329 -0.962 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.384 -5.142 -1.084 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.820 -3.311 -2.095 1.00 0.00 C ATOM 0 H LEU A 11 -7.035 -7.527 -2.346 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.246 -4.577 -2.361 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.595 -4.834 -0.164 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.575 -6.217 -0.507 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.613 -3.767 -0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.531 -4.465 -1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.281 -5.793 -0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.420 -5.747 -1.990 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.939 -2.670 -2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.919 -3.836 -3.045 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.707 -2.701 -1.924 1.00 0.00 H new ATOM 125 N PHE A 12 -5.797 -4.614 -4.292 1.00 0.00 N ATOM 126 CA PHE A 12 -4.981 -4.610 -5.494 1.00 0.00 C ATOM 127 C PHE A 12 -3.877 -3.554 -5.404 1.00 0.00 C ATOM 128 O PHE A 12 -4.105 -2.454 -4.903 1.00 0.00 O ATOM 129 CB PHE A 12 -5.906 -4.265 -6.663 1.00 0.00 C ATOM 130 CG PHE A 12 -7.181 -5.110 -6.718 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.102 -6.465 -6.645 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.393 -4.504 -6.839 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.285 -7.249 -6.696 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.576 -5.288 -6.890 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.497 -6.644 -6.817 1.00 0.00 C ATOM 0 H PHE A 12 -6.408 -3.804 -4.189 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.507 -5.583 -5.624 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.182 -3.213 -6.596 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.358 -4.392 -7.597 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.140 -6.945 -6.548 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.455 -3.427 -6.896 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.222 -8.326 -6.639 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.538 -4.808 -6.987 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.397 -7.240 -6.855 1.00 0.00 H new ATOM 145 N PHE A 13 -2.705 -3.926 -5.897 1.00 0.00 N ATOM 146 CA PHE A 13 -1.565 -3.025 -5.879 1.00 0.00 C ATOM 147 C PHE A 13 -0.475 -3.500 -6.841 1.00 0.00 C ATOM 148 O PHE A 13 -0.499 -4.642 -7.296 1.00 0.00 O ATOM 149 CB PHE A 13 -1.011 -3.035 -4.453 1.00 0.00 C ATOM 150 CG PHE A 13 -0.439 -4.385 -4.017 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.251 -5.473 -3.936 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.881 -4.498 -3.710 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.720 -6.727 -3.531 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.412 -5.751 -3.306 1.00 0.00 C ATOM 155 CZ PHE A 13 0.600 -6.839 -3.224 1.00 0.00 C ATOM 0 H PHE A 13 -2.520 -4.839 -6.312 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.874 -2.027 -6.189 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.231 -2.278 -4.372 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.805 -2.749 -3.764 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.299 -5.384 -4.180 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.526 -3.634 -3.774 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.365 -7.591 -3.467 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.461 -5.840 -3.064 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.004 -7.792 -2.915 1.00 0.00 H new ATOM 165 N SER A 14 0.455 -2.599 -7.122 1.00 0.00 N ATOM 166 CA SER A 14 1.553 -2.912 -8.022 1.00 0.00 C ATOM 167 C SER A 14 2.857 -2.326 -7.479 1.00 0.00 C ATOM 168 O SER A 14 2.919 -1.144 -7.143 1.00 0.00 O ATOM 169 CB SER A 14 1.278 -2.383 -9.430 1.00 0.00 C ATOM 170 OG SER A 14 0.843 -1.026 -9.415 1.00 0.00 O ATOM 0 H SER A 14 0.471 -1.652 -6.743 1.00 0.00 H new ATOM 0 HA SER A 14 1.648 -3.996 -8.083 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.183 -2.467 -10.032 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.519 -3.002 -9.908 1.00 0.00 H new ATOM 0 HG SER A 14 0.528 -0.774 -10.308 1.00 0.00 H new ATOM 176 N LEU A 15 3.869 -3.179 -7.411 1.00 0.00 N ATOM 177 CA LEU A 15 5.169 -2.760 -6.915 1.00 0.00 C ATOM 178 C LEU A 15 6.035 -2.301 -8.091 1.00 0.00 C ATOM 179 O LEU A 15 5.927 -2.838 -9.192 1.00 0.00 O ATOM 180 CB LEU A 15 5.807 -3.871 -6.078 1.00 0.00 C ATOM 181 CG LEU A 15 5.067 -4.253 -4.795 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.102 -5.766 -4.571 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.618 -3.483 -3.594 1.00 0.00 C ATOM 0 H LEU A 15 3.815 -4.158 -7.691 1.00 0.00 H new ATOM 0 HA LEU A 15 5.064 -1.908 -6.244 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.897 -4.761 -6.700 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.818 -3.563 -5.813 1.00 0.00 H new ATOM 0 HG LEU A 15 4.021 -3.969 -4.907 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.569 -6.010 -3.652 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.625 -6.269 -5.412 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.137 -6.098 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.074 -3.773 -2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.676 -3.713 -3.469 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.497 -2.413 -3.761 1.00 0.00 H new ATOM 195 N GLU A 16 6.874 -1.313 -7.816 1.00 0.00 N ATOM 196 CA GLU A 16 7.757 -0.776 -8.837 1.00 0.00 C ATOM 197 C GLU A 16 8.967 -0.099 -8.189 1.00 0.00 C ATOM 198 O GLU A 16 8.811 0.775 -7.338 1.00 0.00 O ATOM 199 CB GLU A 16 7.010 0.195 -9.753 1.00 0.00 C ATOM 200 CG GLU A 16 7.988 1.015 -10.597 1.00 0.00 C ATOM 201 CD GLU A 16 7.530 1.083 -12.055 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.725 1.990 -12.356 1.00 0.00 O ATOM 203 OE2 GLU A 16 7.996 0.226 -12.837 1.00 0.00 O ATOM 0 H GLU A 16 6.961 -0.871 -6.901 1.00 0.00 H new ATOM 0 HA GLU A 16 8.114 -1.602 -9.453 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.337 -0.360 -10.406 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.392 0.864 -9.154 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.069 2.023 -10.190 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.981 0.570 -10.544 1.00 0.00 H new ATOM 210 N TYR A 17 10.145 -0.528 -8.618 1.00 0.00 N ATOM 211 CA TYR A 17 11.380 0.026 -8.090 1.00 0.00 C ATOM 212 C TYR A 17 12.011 1.004 -9.084 1.00 0.00 C ATOM 213 O TYR A 17 12.230 0.660 -10.244 1.00 0.00 O ATOM 214 CB TYR A 17 12.324 -1.161 -7.892 1.00 0.00 C ATOM 215 CG TYR A 17 13.620 -0.810 -7.158 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.645 -0.783 -5.778 1.00 0.00 C ATOM 217 CD2 TYR A 17 14.763 -0.522 -7.875 1.00 0.00 C ATOM 218 CE1 TYR A 17 14.865 -0.452 -5.087 1.00 0.00 C ATOM 219 CE2 TYR A 17 15.983 -0.191 -7.184 1.00 0.00 C ATOM 220 CZ TYR A 17 15.973 -0.173 -5.824 1.00 0.00 C ATOM 221 OH TYR A 17 17.125 0.139 -5.171 1.00 0.00 O ATOM 0 H TYR A 17 10.270 -1.253 -9.325 1.00 0.00 H new ATOM 0 HA TYR A 17 11.192 0.569 -7.164 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.802 -1.938 -7.334 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.573 -1.581 -8.867 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.751 -1.010 -5.217 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.743 -0.545 -8.955 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.899 -0.426 -4.008 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.885 0.038 -7.733 1.00 0.00 H new ATOM 0 HH TYR A 17 16.911 0.574 -4.319 1.00 0.00 H new ATOM 231 N ASN A 18 12.284 2.203 -8.592 1.00 0.00 N ATOM 232 CA ASN A 18 12.885 3.233 -9.422 1.00 0.00 C ATOM 233 C ASN A 18 14.325 2.838 -9.755 1.00 0.00 C ATOM 234 O ASN A 18 15.226 3.016 -8.937 1.00 0.00 O ATOM 235 CB ASN A 18 12.920 4.578 -8.693 1.00 0.00 C ATOM 236 CG ASN A 18 13.216 5.722 -9.666 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.891 5.559 -10.669 1.00 0.00 O ATOM 238 ND2 ASN A 18 12.675 6.884 -9.314 1.00 0.00 N ATOM 0 H ASN A 18 12.100 2.484 -7.629 1.00 0.00 H new ATOM 0 HA ASN A 18 12.285 3.329 -10.327 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.964 4.753 -8.200 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.681 4.553 -7.913 1.00 0.00 H new ATOM 0 HD21 ASN A 18 12.814 7.709 -9.897 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.120 6.951 -8.461 1.00 0.00 H new ATOM 245 N PHE A 19 14.497 2.309 -10.957 1.00 0.00 N ATOM 246 CA PHE A 19 15.813 1.887 -11.408 1.00 0.00 C ATOM 247 C PHE A 19 16.692 3.095 -11.738 1.00 0.00 C ATOM 248 O PHE A 19 17.901 3.067 -11.513 1.00 0.00 O ATOM 249 CB PHE A 19 15.606 1.059 -12.678 1.00 0.00 C ATOM 250 CG PHE A 19 15.794 -0.446 -12.477 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.026 -1.112 -11.575 1.00 0.00 C ATOM 252 CD2 PHE A 19 16.729 -1.117 -13.202 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.200 -2.509 -11.388 1.00 0.00 C ATOM 254 CE2 PHE A 19 16.904 -2.514 -13.015 1.00 0.00 C ATOM 255 CZ PHE A 19 16.136 -3.180 -12.113 1.00 0.00 C ATOM 0 H PHE A 19 13.747 2.163 -11.633 1.00 0.00 H new ATOM 0 HA PHE A 19 16.309 1.313 -10.625 1.00 0.00 H new ATOM 0 HB2 PHE A 19 14.601 1.242 -13.059 1.00 0.00 H new ATOM 0 HB3 PHE A 19 16.304 1.403 -13.442 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.283 -0.579 -11.000 1.00 0.00 H new ATOM 0 HD2 PHE A 19 17.338 -0.588 -13.920 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.590 -3.038 -10.671 1.00 0.00 H new ATOM 0 HE2 PHE A 19 17.647 -3.047 -13.589 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.269 -4.242 -11.971 1.00 0.00 H new ATOM 265 N GLU A 20 16.051 4.127 -12.267 1.00 0.00 N ATOM 266 CA GLU A 20 16.760 5.342 -12.631 1.00 0.00 C ATOM 267 C GLU A 20 17.415 5.964 -11.396 1.00 0.00 C ATOM 268 O GLU A 20 18.549 6.437 -11.461 1.00 0.00 O ATOM 269 CB GLU A 20 15.824 6.339 -13.316 1.00 0.00 C ATOM 270 CG GLU A 20 16.604 7.535 -13.866 1.00 0.00 C ATOM 271 CD GLU A 20 16.348 7.713 -15.364 1.00 0.00 C ATOM 272 OE1 GLU A 20 17.005 6.988 -16.142 1.00 0.00 O ATOM 273 OE2 GLU A 20 15.502 8.571 -15.697 1.00 0.00 O ATOM 0 H GLU A 20 15.048 4.147 -12.452 1.00 0.00 H new ATOM 0 HA GLU A 20 17.544 5.083 -13.343 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.291 5.844 -14.127 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.073 6.685 -12.606 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.312 8.440 -13.333 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.670 7.391 -13.690 1.00 0.00 H new ATOM 280 N ARG A 21 16.673 5.943 -10.298 1.00 0.00 N ATOM 281 CA ARG A 21 17.168 6.499 -9.050 1.00 0.00 C ATOM 282 C ARG A 21 17.297 5.400 -7.994 1.00 0.00 C ATOM 283 O ARG A 21 17.332 5.685 -6.798 1.00 0.00 O ATOM 284 CB ARG A 21 16.235 7.593 -8.527 1.00 0.00 C ATOM 285 CG ARG A 21 15.756 8.497 -9.665 1.00 0.00 C ATOM 286 CD ARG A 21 14.575 9.361 -9.219 1.00 0.00 C ATOM 287 NE ARG A 21 15.054 10.699 -8.808 1.00 0.00 N ATOM 288 CZ ARG A 21 14.261 11.770 -8.664 1.00 0.00 C ATOM 289 NH1 ARG A 21 12.946 11.666 -8.897 1.00 0.00 N ATOM 290 NH2 ARG A 21 14.784 12.945 -8.286 1.00 0.00 N ATOM 0 H ARG A 21 15.733 5.550 -10.247 1.00 0.00 H new ATOM 0 HA ARG A 21 18.147 6.936 -9.246 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.376 7.138 -8.034 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.754 8.190 -7.777 1.00 0.00 H new ATOM 0 HG2 ARG A 21 16.575 9.136 -9.995 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.463 7.887 -10.520 1.00 0.00 H new ATOM 0 HD2 ARG A 21 13.856 9.457 -10.033 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.055 8.881 -8.390 1.00 0.00 H new ATOM 0 HE ARG A 21 16.050 10.814 -8.623 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.548 10.772 -9.184 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.343 12.481 -8.787 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.785 13.024 -8.108 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.181 13.760 -8.176 1.00 0.00 H new ATOM 304 N LYS A 22 17.364 4.167 -8.474 1.00 0.00 N ATOM 305 CA LYS A 22 17.488 3.024 -7.585 1.00 0.00 C ATOM 306 C LYS A 22 16.679 3.282 -6.313 1.00 0.00 C ATOM 307 O LYS A 22 17.248 3.498 -5.244 1.00 0.00 O ATOM 308 CB LYS A 22 18.962 2.707 -7.323 1.00 0.00 C ATOM 309 CG LYS A 22 19.447 1.570 -8.224 1.00 0.00 C ATOM 310 CD LYS A 22 19.752 0.314 -7.406 1.00 0.00 C ATOM 311 CE LYS A 22 19.663 -0.942 -8.275 1.00 0.00 C ATOM 312 NZ LYS A 22 21.012 -1.373 -8.704 1.00 0.00 N ATOM 0 H LYS A 22 17.335 3.934 -9.467 1.00 0.00 H new ATOM 0 HA LYS A 22 17.072 2.131 -8.052 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.566 3.597 -7.498 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.098 2.430 -6.277 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.687 1.345 -8.973 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.341 1.884 -8.762 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.749 0.391 -6.973 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.050 0.237 -6.576 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.179 -1.744 -7.717 1.00 0.00 H new ATOM 0 HE3 LYS A 22 19.043 -0.743 -9.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.933 -2.227 -9.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.461 -0.613 -9.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.592 -1.583 -7.867 1.00 0.00 H new ATOM 326 N ALA A 23 15.364 3.250 -6.470 1.00 0.00 N ATOM 327 CA ALA A 23 14.470 3.477 -5.347 1.00 0.00 C ATOM 328 C ALA A 23 13.315 2.476 -5.409 1.00 0.00 C ATOM 329 O ALA A 23 13.220 1.689 -6.350 1.00 0.00 O ATOM 330 CB ALA A 23 13.985 4.928 -5.366 1.00 0.00 C ATOM 0 H ALA A 23 14.896 3.070 -7.358 1.00 0.00 H new ATOM 0 HA ALA A 23 14.992 3.320 -4.403 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.314 5.099 -4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.841 5.599 -5.290 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.454 5.122 -6.298 1.00 0.00 H new ATOM 336 N PHE A 24 12.466 2.537 -4.393 1.00 0.00 N ATOM 337 CA PHE A 24 11.321 1.645 -4.320 1.00 0.00 C ATOM 338 C PHE A 24 10.010 2.431 -4.370 1.00 0.00 C ATOM 339 O PHE A 24 9.878 3.467 -3.720 1.00 0.00 O ATOM 340 CB PHE A 24 11.412 0.910 -2.981 1.00 0.00 C ATOM 341 CG PHE A 24 10.324 -0.146 -2.777 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.940 -0.937 -3.814 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.741 -0.294 -1.557 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.931 -1.917 -3.624 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.732 -1.275 -1.367 1.00 0.00 C ATOM 346 CZ PHE A 24 8.348 -2.066 -2.405 1.00 0.00 C ATOM 0 H PHE A 24 12.548 3.190 -3.614 1.00 0.00 H new ATOM 0 HA PHE A 24 11.332 0.955 -5.164 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.388 0.431 -2.907 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.353 1.639 -2.173 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.403 -0.820 -4.783 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.045 0.334 -0.733 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.626 -2.545 -4.448 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.269 -1.393 -0.398 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.580 -2.812 -2.261 1.00 0.00 H new ATOM 356 N VAL A 25 9.073 1.909 -5.147 1.00 0.00 N ATOM 357 CA VAL A 25 7.776 2.548 -5.291 1.00 0.00 C ATOM 358 C VAL A 25 6.673 1.515 -5.051 1.00 0.00 C ATOM 359 O VAL A 25 6.598 0.508 -5.753 1.00 0.00 O ATOM 360 CB VAL A 25 7.675 3.225 -6.659 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.553 4.265 -6.675 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.011 3.854 -7.060 1.00 0.00 C ATOM 0 H VAL A 25 9.186 1.049 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 25 7.652 3.333 -4.545 1.00 0.00 H new ATOM 0 HB VAL A 25 7.432 2.458 -7.394 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.503 4.731 -7.659 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.603 3.778 -6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.753 5.027 -5.922 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.911 4.328 -8.036 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.298 4.602 -6.321 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.777 3.080 -7.109 1.00 0.00 H new ATOM 372 N VAL A 26 5.845 1.801 -4.057 1.00 0.00 N ATOM 373 CA VAL A 26 4.750 0.909 -3.716 1.00 0.00 C ATOM 374 C VAL A 26 3.421 1.591 -4.048 1.00 0.00 C ATOM 375 O VAL A 26 2.907 2.378 -3.254 1.00 0.00 O ATOM 376 CB VAL A 26 4.855 0.487 -2.249 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.663 -0.380 -1.841 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.177 -0.235 -1.980 1.00 0.00 C ATOM 0 H VAL A 26 5.910 2.638 -3.477 1.00 0.00 H new ATOM 0 HA VAL A 26 4.804 -0.005 -4.307 1.00 0.00 H new ATOM 0 HB VAL A 26 4.836 1.390 -1.638 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.763 -0.666 -0.794 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.740 0.183 -1.977 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.636 -1.276 -2.461 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.227 -0.524 -0.930 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.239 -1.126 -2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.009 0.430 -2.213 1.00 0.00 H new ATOM 388 N ASN A 27 2.902 1.264 -5.223 1.00 0.00 N ATOM 389 CA ASN A 27 1.642 1.835 -5.669 1.00 0.00 C ATOM 390 C ASN A 27 0.484 1.061 -5.037 1.00 0.00 C ATOM 391 O ASN A 27 0.499 -0.169 -5.004 1.00 0.00 O ATOM 392 CB ASN A 27 1.502 1.738 -7.190 1.00 0.00 C ATOM 393 CG ASN A 27 0.050 1.953 -7.621 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.764 1.044 -7.624 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.227 3.202 -7.984 1.00 0.00 N ATOM 0 H ASN A 27 3.331 0.611 -5.879 1.00 0.00 H new ATOM 0 HA ASN A 27 1.622 2.883 -5.371 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.140 2.482 -7.666 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.845 0.760 -7.529 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.169 3.448 -8.289 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.502 3.914 -7.958 1.00 0.00 H new ATOM 402 N ILE A 28 -0.493 1.813 -4.552 1.00 0.00 N ATOM 403 CA ILE A 28 -1.657 1.213 -3.923 1.00 0.00 C ATOM 404 C ILE A 28 -2.886 1.446 -4.805 1.00 0.00 C ATOM 405 O ILE A 28 -3.452 2.538 -4.811 1.00 0.00 O ATOM 406 CB ILE A 28 -1.820 1.730 -2.493 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.588 1.403 -1.647 1.00 0.00 C ATOM 408 CG2 ILE A 28 -3.107 1.197 -1.860 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.816 1.770 -0.180 1.00 0.00 C ATOM 0 H ILE A 28 -0.502 2.833 -4.582 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.528 0.134 -3.834 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.905 2.816 -2.531 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.359 0.341 -1.728 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.276 1.946 -2.031 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.198 1.580 -0.844 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.964 1.523 -2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.077 0.108 -1.836 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.075 1.527 0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.021 2.838 -0.100 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.665 1.207 0.208 1.00 0.00 H new ATOM 421 N LYS A 29 -3.261 0.402 -5.530 1.00 0.00 N ATOM 422 CA LYS A 29 -4.412 0.480 -6.414 1.00 0.00 C ATOM 423 C LYS A 29 -5.667 0.764 -5.586 1.00 0.00 C ATOM 424 O LYS A 29 -5.654 1.625 -4.708 1.00 0.00 O ATOM 425 CB LYS A 29 -4.514 -0.782 -7.272 1.00 0.00 C ATOM 426 CG LYS A 29 -5.297 -0.508 -8.558 1.00 0.00 C ATOM 427 CD LYS A 29 -4.355 -0.390 -9.758 1.00 0.00 C ATOM 428 CE LYS A 29 -4.514 -1.585 -10.700 1.00 0.00 C ATOM 429 NZ LYS A 29 -5.580 -1.325 -11.693 1.00 0.00 N ATOM 0 H LYS A 29 -2.788 -0.502 -5.523 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.299 1.307 -7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.515 -1.140 -7.520 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.004 -1.573 -6.705 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.013 -1.312 -8.731 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.871 0.412 -8.450 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.563 0.534 -10.298 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.324 -0.331 -9.411 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.572 -1.780 -11.212 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -4.755 -2.479 -10.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.674 -2.146 -12.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.481 -1.162 -11.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.335 -0.484 -12.254 1.00 0.00 H new ATOM 443 N GLU A 30 -6.722 0.025 -5.896 1.00 0.00 N ATOM 444 CA GLU A 30 -7.982 0.186 -5.192 1.00 0.00 C ATOM 445 C GLU A 30 -8.301 -1.070 -4.379 1.00 0.00 C ATOM 446 O GLU A 30 -7.649 -2.100 -4.540 1.00 0.00 O ATOM 447 CB GLU A 30 -9.116 0.512 -6.166 1.00 0.00 C ATOM 448 CG GLU A 30 -9.259 -0.581 -7.226 1.00 0.00 C ATOM 449 CD GLU A 30 -10.726 -0.977 -7.411 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.581 -0.081 -7.245 1.00 0.00 O ATOM 451 OE2 GLU A 30 -10.958 -2.168 -7.714 1.00 0.00 O ATOM 0 H GLU A 30 -6.730 -0.687 -6.626 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.886 1.025 -4.503 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.052 0.617 -5.618 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.921 1.469 -6.650 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.851 -0.229 -8.174 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.677 -1.455 -6.933 1.00 0.00 H new ATOM 458 N ALA A 31 -9.305 -0.943 -3.523 1.00 0.00 N ATOM 459 CA ALA A 31 -9.718 -2.056 -2.685 1.00 0.00 C ATOM 460 C ALA A 31 -11.211 -2.319 -2.894 1.00 0.00 C ATOM 461 O ALA A 31 -12.020 -1.392 -2.855 1.00 0.00 O ATOM 462 CB ALA A 31 -9.379 -1.749 -1.225 1.00 0.00 C ATOM 0 H ALA A 31 -9.844 -0.087 -3.392 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.181 -2.964 -2.960 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.689 -2.584 -0.596 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.304 -1.599 -1.125 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.902 -0.845 -0.912 1.00 0.00 H new ATOM 468 N ARG A 32 -11.532 -3.586 -3.110 1.00 0.00 N ATOM 469 CA ARG A 32 -12.913 -3.982 -3.325 1.00 0.00 C ATOM 470 C ARG A 32 -13.314 -5.072 -2.328 1.00 0.00 C ATOM 471 O ARG A 32 -12.586 -6.046 -2.142 1.00 0.00 O ATOM 472 CB ARG A 32 -13.122 -4.501 -4.749 1.00 0.00 C ATOM 473 CG ARG A 32 -13.654 -3.395 -5.663 1.00 0.00 C ATOM 474 CD ARG A 32 -15.097 -3.679 -6.086 1.00 0.00 C ATOM 475 NE ARG A 32 -15.558 -2.646 -7.040 1.00 0.00 N ATOM 476 CZ ARG A 32 -16.840 -2.452 -7.376 1.00 0.00 C ATOM 477 NH1 ARG A 32 -17.797 -3.220 -6.837 1.00 0.00 N ATOM 478 NH2 ARG A 32 -17.166 -1.490 -8.250 1.00 0.00 N ATOM 0 H ARG A 32 -10.859 -4.352 -3.141 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.538 -3.101 -3.176 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.180 -4.882 -5.143 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.823 -5.336 -4.736 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.605 -2.436 -5.146 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.022 -3.313 -6.547 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -15.162 -4.665 -6.546 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.746 -3.692 -5.210 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.855 -2.044 -7.469 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.549 -3.952 -6.171 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -18.773 -3.073 -7.093 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -16.438 -0.905 -8.660 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -18.142 -1.343 -8.506 1.00 0.00 H new ATOM 492 N GLY A 33 -14.470 -4.871 -1.714 1.00 0.00 N ATOM 493 CA GLY A 33 -14.977 -5.824 -0.741 1.00 0.00 C ATOM 494 C GLY A 33 -14.840 -5.280 0.682 1.00 0.00 C ATOM 495 O GLY A 33 -14.370 -5.982 1.576 1.00 0.00 O ATOM 0 H GLY A 33 -15.071 -4.062 -1.871 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.024 -6.042 -0.952 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.432 -6.764 -0.829 1.00 0.00 H new ATOM 499 N LEU A 34 -15.259 -4.034 0.848 1.00 0.00 N ATOM 500 CA LEU A 34 -15.189 -3.388 2.148 1.00 0.00 C ATOM 501 C LEU A 34 -16.603 -3.225 2.708 1.00 0.00 C ATOM 502 O LEU A 34 -17.429 -2.524 2.126 1.00 0.00 O ATOM 503 CB LEU A 34 -14.411 -2.074 2.051 1.00 0.00 C ATOM 504 CG LEU A 34 -13.158 -2.099 1.175 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.199 -0.969 1.556 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.478 -3.469 1.229 1.00 0.00 C ATOM 0 H LEU A 34 -15.648 -3.455 0.104 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.636 -4.009 2.853 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.082 -1.305 1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.121 -1.772 3.057 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.461 -1.930 0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.316 -1.010 0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.698 -0.009 1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.899 -1.082 2.598 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.590 -3.459 0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.190 -3.692 2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.169 -4.233 0.872 1.00 0.00 H new ATOM 518 N PRO A 35 -16.845 -3.903 3.863 1.00 0.00 N ATOM 519 CA PRO A 35 -18.145 -3.841 4.509 1.00 0.00 C ATOM 520 C PRO A 35 -18.343 -2.498 5.215 1.00 0.00 C ATOM 521 O PRO A 35 -17.477 -2.055 5.968 1.00 0.00 O ATOM 522 CB PRO A 35 -18.167 -5.023 5.464 1.00 0.00 C ATOM 523 CG PRO A 35 -16.715 -5.428 5.659 1.00 0.00 C ATOM 524 CD PRO A 35 -15.891 -4.743 4.581 1.00 0.00 C ATOM 0 HA PRO A 35 -18.970 -3.904 3.800 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.627 -4.749 6.414 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.750 -5.847 5.053 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.367 -5.135 6.649 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.608 -6.511 5.591 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.088 -4.148 5.015 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.425 -5.471 3.916 1.00 0.00 H new ATOM 532 N ALA A 36 -19.488 -1.887 4.946 1.00 0.00 N ATOM 533 CA ALA A 36 -19.810 -0.604 5.546 1.00 0.00 C ATOM 534 C ALA A 36 -19.301 -0.578 6.989 1.00 0.00 C ATOM 535 O ALA A 36 -19.252 -1.613 7.652 1.00 0.00 O ATOM 536 CB ALA A 36 -21.318 -0.362 5.456 1.00 0.00 C ATOM 0 H ALA A 36 -20.204 -2.257 4.321 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.317 0.205 5.008 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.560 0.601 5.906 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.624 -0.360 4.410 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.846 -1.154 5.988 1.00 0.00 H new ATOM 542 N MET A 37 -18.934 0.616 7.432 1.00 0.00 N ATOM 543 CA MET A 37 -18.430 0.790 8.784 1.00 0.00 C ATOM 544 C MET A 37 -19.344 1.711 9.595 1.00 0.00 C ATOM 545 O MET A 37 -19.603 1.456 10.770 1.00 0.00 O ATOM 546 CB MET A 37 -17.022 1.385 8.731 1.00 0.00 C ATOM 547 CG MET A 37 -15.960 0.284 8.777 1.00 0.00 C ATOM 548 SD MET A 37 -15.268 0.171 10.418 1.00 0.00 S ATOM 549 CE MET A 37 -15.252 -1.602 10.626 1.00 0.00 C ATOM 0 H MET A 37 -18.976 1.472 6.879 1.00 0.00 H new ATOM 0 HA MET A 37 -18.404 -0.185 9.271 1.00 0.00 H new ATOM 0 HB2 MET A 37 -16.905 1.971 7.819 1.00 0.00 H new ATOM 0 HB3 MET A 37 -16.880 2.068 9.569 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.402 -0.671 8.493 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.172 0.497 8.055 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.837 -1.870 11.506 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.684 -2.076 9.745 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.225 -1.944 10.755 1.00 0.00 H new ATOM 559 N ASP A 38 -19.807 2.763 8.936 1.00 0.00 N ATOM 560 CA ASP A 38 -20.686 3.723 9.581 1.00 0.00 C ATOM 561 C ASP A 38 -22.133 3.431 9.181 1.00 0.00 C ATOM 562 O ASP A 38 -22.382 2.709 8.217 1.00 0.00 O ATOM 563 CB ASP A 38 -20.354 5.152 9.146 1.00 0.00 C ATOM 564 CG ASP A 38 -18.955 5.637 9.530 1.00 0.00 C ATOM 565 OD1 ASP A 38 -18.305 4.923 10.325 1.00 0.00 O ATOM 566 OD2 ASP A 38 -18.566 6.710 9.020 1.00 0.00 O ATOM 0 H ASP A 38 -19.590 2.972 7.961 1.00 0.00 H new ATOM 0 HA ASP A 38 -20.551 3.634 10.659 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -20.461 5.220 8.063 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -21.089 5.828 9.582 1.00 0.00 H new ATOM 571 N GLU A 39 -23.051 4.008 9.943 1.00 0.00 N ATOM 572 CA GLU A 39 -24.468 3.819 9.681 1.00 0.00 C ATOM 573 C GLU A 39 -25.111 5.141 9.259 1.00 0.00 C ATOM 574 O GLU A 39 -25.947 5.687 9.977 1.00 0.00 O ATOM 575 CB GLU A 39 -25.178 3.229 10.901 1.00 0.00 C ATOM 576 CG GLU A 39 -24.600 1.860 11.263 1.00 0.00 C ATOM 577 CD GLU A 39 -25.665 0.767 11.145 1.00 0.00 C ATOM 578 OE1 GLU A 39 -26.206 0.620 10.028 1.00 0.00 O ATOM 579 OE2 GLU A 39 -25.913 0.104 12.175 1.00 0.00 O ATOM 0 H GLU A 39 -22.841 4.607 10.742 1.00 0.00 H new ATOM 0 HA GLU A 39 -24.574 3.108 8.861 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -25.076 3.907 11.749 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -26.244 3.135 10.695 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -23.762 1.629 10.605 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -24.209 1.884 12.280 1.00 0.00 H new ATOM 586 N GLN A 40 -24.696 5.619 8.094 1.00 0.00 N ATOM 587 CA GLN A 40 -25.221 6.867 7.568 1.00 0.00 C ATOM 588 C GLN A 40 -26.009 6.611 6.281 1.00 0.00 C ATOM 589 O GLN A 40 -27.218 6.835 6.235 1.00 0.00 O ATOM 590 CB GLN A 40 -24.098 7.878 7.330 1.00 0.00 C ATOM 591 CG GLN A 40 -23.637 8.506 8.647 1.00 0.00 C ATOM 592 CD GLN A 40 -23.824 10.024 8.625 1.00 0.00 C ATOM 593 OE1 GLN A 40 -22.897 10.787 8.408 1.00 0.00 O ATOM 594 NE2 GLN A 40 -25.072 10.419 8.862 1.00 0.00 N ATOM 0 H GLN A 40 -24.002 5.164 7.500 1.00 0.00 H new ATOM 0 HA GLN A 40 -25.898 7.293 8.308 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -23.256 7.384 6.844 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -24.444 8.658 6.652 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -24.202 8.078 9.475 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -22.588 8.268 8.820 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -25.801 9.728 9.036 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -25.300 11.413 8.869 1.00 0.00 H new ATOM 603 N SER A 41 -25.293 6.145 5.269 1.00 0.00 N ATOM 604 CA SER A 41 -25.910 5.856 3.986 1.00 0.00 C ATOM 605 C SER A 41 -25.292 4.595 3.380 1.00 0.00 C ATOM 606 O SER A 41 -24.906 4.588 2.212 1.00 0.00 O ATOM 607 CB SER A 41 -25.759 7.036 3.024 1.00 0.00 C ATOM 608 OG SER A 41 -26.946 7.266 2.270 1.00 0.00 O ATOM 0 H SER A 41 -24.291 5.960 5.311 1.00 0.00 H new ATOM 0 HA SER A 41 -26.975 5.689 4.149 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.509 7.934 3.589 1.00 0.00 H new ATOM 0 HB3 SER A 41 -24.929 6.845 2.344 1.00 0.00 H new ATOM 0 HG SER A 41 -26.809 8.028 1.669 1.00 0.00 H new ATOM 614 N MET A 42 -25.216 3.558 4.201 1.00 0.00 N ATOM 615 CA MET A 42 -24.651 2.294 3.761 1.00 0.00 C ATOM 616 C MET A 42 -23.322 2.511 3.035 1.00 0.00 C ATOM 617 O MET A 42 -23.112 1.979 1.946 1.00 0.00 O ATOM 618 CB MET A 42 -25.637 1.593 2.824 1.00 0.00 C ATOM 619 CG MET A 42 -25.688 0.090 3.107 1.00 0.00 C ATOM 620 SD MET A 42 -25.527 -0.824 1.581 1.00 0.00 S ATOM 621 CE MET A 42 -23.754 -0.790 1.385 1.00 0.00 C ATOM 0 H MET A 42 -25.537 3.567 5.169 1.00 0.00 H new ATOM 0 HA MET A 42 -24.467 1.674 4.638 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.631 2.024 2.947 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.343 1.762 1.788 1.00 0.00 H new ATOM 0 HG2 MET A 42 -24.887 -0.187 3.793 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.628 -0.165 3.596 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.485 -0.051 0.630 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.288 -0.525 2.334 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.404 -1.773 1.071 1.00 0.00 H new ATOM 631 N THR A 43 -22.460 3.293 3.668 1.00 0.00 N ATOM 632 CA THR A 43 -21.157 3.586 3.096 1.00 0.00 C ATOM 633 C THR A 43 -20.187 4.045 4.186 1.00 0.00 C ATOM 634 O THR A 43 -20.576 4.203 5.342 1.00 0.00 O ATOM 635 CB THR A 43 -21.351 4.617 1.982 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.031 4.862 1.502 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.812 5.975 2.514 1.00 0.00 C ATOM 0 H THR A 43 -22.638 3.733 4.571 1.00 0.00 H new ATOM 0 HA THR A 43 -20.707 2.694 2.659 1.00 0.00 H new ATOM 0 HB THR A 43 -22.081 4.242 1.264 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.638 4.023 1.183 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.934 6.669 1.682 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.764 5.859 3.032 1.00 0.00 H new ATOM 0 HG23 THR A 43 -21.067 6.366 3.207 1.00 0.00 H new ATOM 645 N SER A 44 -18.942 4.247 3.779 1.00 0.00 N ATOM 646 CA SER A 44 -17.913 4.685 4.707 1.00 0.00 C ATOM 647 C SER A 44 -16.685 5.172 3.935 1.00 0.00 C ATOM 648 O SER A 44 -16.645 5.089 2.709 1.00 0.00 O ATOM 649 CB SER A 44 -17.525 3.561 5.669 1.00 0.00 C ATOM 650 OG SER A 44 -17.493 2.292 5.023 1.00 0.00 O ATOM 0 H SER A 44 -18.623 4.115 2.819 1.00 0.00 H new ATOM 0 HA SER A 44 -18.313 5.509 5.297 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.546 3.774 6.099 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.236 3.529 6.495 1.00 0.00 H new ATOM 0 HG SER A 44 -17.240 1.602 5.671 1.00 0.00 H new ATOM 656 N ASP A 45 -15.712 5.668 4.686 1.00 0.00 N ATOM 657 CA ASP A 45 -14.486 6.167 4.087 1.00 0.00 C ATOM 658 C ASP A 45 -13.305 5.326 4.577 1.00 0.00 C ATOM 659 O ASP A 45 -12.533 5.769 5.425 1.00 0.00 O ATOM 660 CB ASP A 45 -14.229 7.621 4.489 1.00 0.00 C ATOM 661 CG ASP A 45 -15.335 8.604 4.100 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.399 8.117 3.661 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.092 9.821 4.252 1.00 0.00 O ATOM 0 H ASP A 45 -15.748 5.735 5.703 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.590 6.105 3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.088 7.664 5.569 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.295 7.949 4.033 1.00 0.00 H new ATOM 668 N PRO A 46 -13.200 4.096 4.006 1.00 0.00 N ATOM 669 CA PRO A 46 -12.127 3.189 4.375 1.00 0.00 C ATOM 670 C PRO A 46 -10.799 3.629 3.754 1.00 0.00 C ATOM 671 O PRO A 46 -10.784 4.372 2.774 1.00 0.00 O ATOM 672 CB PRO A 46 -12.584 1.822 3.893 1.00 0.00 C ATOM 673 CG PRO A 46 -13.673 2.085 2.867 1.00 0.00 C ATOM 674 CD PRO A 46 -14.097 3.539 2.998 1.00 0.00 C ATOM 0 HA PRO A 46 -11.938 3.175 5.448 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.757 1.267 3.451 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.964 1.223 4.721 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.306 1.884 1.861 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.523 1.423 3.034 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -14.002 4.066 2.049 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.139 3.622 3.306 1.00 0.00 H new ATOM 682 N TYR A 47 -9.717 3.151 4.351 1.00 0.00 N ATOM 683 CA TYR A 47 -8.388 3.486 3.869 1.00 0.00 C ATOM 684 C TYR A 47 -7.358 2.457 4.340 1.00 0.00 C ATOM 685 O TYR A 47 -7.402 2.009 5.485 1.00 0.00 O ATOM 686 CB TYR A 47 -8.047 4.846 4.480 1.00 0.00 C ATOM 687 CG TYR A 47 -7.851 4.816 5.997 1.00 0.00 C ATOM 688 CD1 TYR A 47 -6.609 4.529 6.526 1.00 0.00 C ATOM 689 CD2 TYR A 47 -8.915 5.074 6.836 1.00 0.00 C ATOM 690 CE1 TYR A 47 -6.423 4.500 7.953 1.00 0.00 C ATOM 691 CE2 TYR A 47 -8.730 5.045 8.264 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.493 4.760 8.752 1.00 0.00 C ATOM 693 OH TYR A 47 -7.318 4.732 10.100 1.00 0.00 O ATOM 0 H TYR A 47 -9.734 2.535 5.164 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.368 3.500 2.779 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.137 5.224 4.014 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.844 5.550 4.241 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.776 4.326 5.869 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -9.887 5.298 6.422 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.456 4.277 8.380 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -9.555 5.245 8.932 1.00 0.00 H new ATOM 0 HH TYR A 47 -8.167 4.938 10.544 1.00 0.00 H new ATOM 703 N ILE A 48 -6.456 2.112 3.433 1.00 0.00 N ATOM 704 CA ILE A 48 -5.417 1.144 3.742 1.00 0.00 C ATOM 705 C ILE A 48 -4.175 1.879 4.250 1.00 0.00 C ATOM 706 O ILE A 48 -3.886 2.992 3.813 1.00 0.00 O ATOM 707 CB ILE A 48 -5.148 0.243 2.535 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.350 -0.657 2.243 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.862 -0.562 2.727 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.146 -1.440 0.944 1.00 0.00 C ATOM 0 H ILE A 48 -6.423 2.485 2.484 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.743 0.478 4.541 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.002 0.878 1.661 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.499 -1.351 3.070 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.253 -0.051 2.169 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.695 -1.194 1.855 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.020 0.120 2.848 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.953 -1.187 3.615 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -7.015 -2.072 0.760 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -6.022 -0.743 0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.256 -2.063 1.031 1.00 0.00 H new ATOM 722 N LYS A 49 -3.474 1.227 5.166 1.00 0.00 N ATOM 723 CA LYS A 49 -2.270 1.805 5.738 1.00 0.00 C ATOM 724 C LYS A 49 -1.048 1.043 5.221 1.00 0.00 C ATOM 725 O LYS A 49 -0.985 -0.181 5.327 1.00 0.00 O ATOM 726 CB LYS A 49 -2.369 1.847 7.264 1.00 0.00 C ATOM 727 CG LYS A 49 -2.948 3.181 7.741 1.00 0.00 C ATOM 728 CD LYS A 49 -2.870 3.299 9.264 1.00 0.00 C ATOM 729 CE LYS A 49 -3.202 4.722 9.720 1.00 0.00 C ATOM 730 NZ LYS A 49 -2.130 5.249 10.594 1.00 0.00 N ATOM 0 H LYS A 49 -3.717 0.304 5.526 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.157 2.842 5.421 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.998 1.028 7.614 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.381 1.699 7.700 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.402 4.004 7.280 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.986 3.267 7.419 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.564 2.595 9.723 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.870 3.028 9.603 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.323 5.370 8.852 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.151 4.727 10.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.371 6.215 10.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.034 4.640 11.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.231 5.263 10.071 1.00 0.00 H new ATOM 744 N MET A 50 -0.108 1.799 4.673 1.00 0.00 N ATOM 745 CA MET A 50 1.109 1.209 4.140 1.00 0.00 C ATOM 746 C MET A 50 2.280 1.403 5.105 1.00 0.00 C ATOM 747 O MET A 50 2.496 2.502 5.613 1.00 0.00 O ATOM 748 CB MET A 50 1.442 1.857 2.794 1.00 0.00 C ATOM 749 CG MET A 50 2.359 0.956 1.965 1.00 0.00 C ATOM 750 SD MET A 50 3.218 1.925 0.736 1.00 0.00 S ATOM 751 CE MET A 50 4.794 2.131 1.551 1.00 0.00 C ATOM 0 H MET A 50 -0.164 2.814 4.586 1.00 0.00 H new ATOM 0 HA MET A 50 0.946 0.139 4.008 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.522 2.052 2.243 1.00 0.00 H new ATOM 0 HB3 MET A 50 1.925 2.820 2.959 1.00 0.00 H new ATOM 0 HG2 MET A 50 3.078 0.458 2.615 1.00 0.00 H new ATOM 0 HG3 MET A 50 1.774 0.175 1.480 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.225 3.093 1.272 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.652 2.096 2.631 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.468 1.330 1.248 1.00 0.00 H new ATOM 761 N THR A 51 3.007 0.318 5.327 1.00 0.00 N ATOM 762 CA THR A 51 4.152 0.355 6.222 1.00 0.00 C ATOM 763 C THR A 51 5.308 -0.463 5.642 1.00 0.00 C ATOM 764 O THR A 51 5.089 -1.501 5.022 1.00 0.00 O ATOM 765 CB THR A 51 3.693 -0.133 7.598 1.00 0.00 C ATOM 766 OG1 THR A 51 2.795 0.880 8.043 1.00 0.00 O ATOM 767 CG2 THR A 51 4.820 -0.113 8.632 1.00 0.00 C ATOM 0 H THR A 51 2.826 -0.592 4.903 1.00 0.00 H new ATOM 0 HA THR A 51 4.535 1.369 6.332 1.00 0.00 H new ATOM 0 HB THR A 51 3.298 -1.145 7.511 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.448 0.643 8.928 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.441 -0.468 9.590 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.631 -0.761 8.299 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.193 0.905 8.744 1.00 0.00 H new ATOM 775 N ILE A 52 6.515 0.038 5.866 1.00 0.00 N ATOM 776 CA ILE A 52 7.706 -0.633 5.374 1.00 0.00 C ATOM 777 C ILE A 52 8.327 -1.455 6.505 1.00 0.00 C ATOM 778 O ILE A 52 9.080 -0.925 7.320 1.00 0.00 O ATOM 779 CB ILE A 52 8.669 0.377 4.747 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.073 0.986 3.476 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.038 -0.257 4.491 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.160 1.640 2.620 1.00 0.00 C ATOM 0 H ILE A 52 6.693 0.900 6.381 1.00 0.00 H new ATOM 0 HA ILE A 52 7.449 -1.331 4.577 1.00 0.00 H new ATOM 0 HB ILE A 52 8.819 1.192 5.455 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.568 0.211 2.899 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.320 1.727 3.742 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.704 0.482 4.045 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.461 -0.604 5.434 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.926 -1.102 3.811 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.710 2.065 1.723 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.647 2.431 3.191 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.899 0.891 2.335 1.00 0.00 H new ATOM 794 N LEU A 53 7.988 -2.736 6.518 1.00 0.00 N ATOM 795 CA LEU A 53 8.503 -3.636 7.536 1.00 0.00 C ATOM 796 C LEU A 53 9.817 -4.251 7.048 1.00 0.00 C ATOM 797 O LEU A 53 10.093 -4.265 5.850 1.00 0.00 O ATOM 798 CB LEU A 53 7.445 -4.671 7.921 1.00 0.00 C ATOM 799 CG LEU A 53 6.227 -4.136 8.677 1.00 0.00 C ATOM 800 CD1 LEU A 53 5.041 -5.095 8.555 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.576 -3.840 10.137 1.00 0.00 C ATOM 0 H LEU A 53 7.363 -3.172 5.840 1.00 0.00 H new ATOM 0 HA LEU A 53 8.727 -3.088 8.451 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.097 -5.161 7.012 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.921 -5.437 8.534 1.00 0.00 H new ATOM 0 HG LEU A 53 5.927 -3.193 8.219 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.189 -4.691 9.101 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.776 -5.214 7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.313 -6.065 8.972 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.693 -3.461 10.652 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.915 -4.755 10.623 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.369 -3.093 10.177 1.00 0.00 H new ATOM 813 N PRO A 54 10.612 -4.759 8.028 1.00 0.00 N ATOM 814 CA PRO A 54 10.210 -4.702 9.423 1.00 0.00 C ATOM 815 C PRO A 54 10.366 -3.286 9.981 1.00 0.00 C ATOM 816 O PRO A 54 9.529 -2.824 10.756 1.00 0.00 O ATOM 817 CB PRO A 54 11.092 -5.719 10.128 1.00 0.00 C ATOM 818 CG PRO A 54 12.266 -5.971 9.196 1.00 0.00 C ATOM 819 CD PRO A 54 11.911 -5.397 7.834 1.00 0.00 C ATOM 0 HA PRO A 54 9.156 -4.940 9.567 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.433 -5.339 11.091 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.545 -6.641 10.324 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.170 -5.501 9.585 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.470 -7.039 9.119 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.659 -4.678 7.500 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.859 -6.179 7.076 1.00 0.00 H new ATOM 827 N GLU A 55 11.444 -2.636 9.567 1.00 0.00 N ATOM 828 CA GLU A 55 11.721 -1.283 10.016 1.00 0.00 C ATOM 829 C GLU A 55 10.435 -0.612 10.503 1.00 0.00 C ATOM 830 O GLU A 55 10.392 -0.071 11.607 1.00 0.00 O ATOM 831 CB GLU A 55 12.382 -0.461 8.908 1.00 0.00 C ATOM 832 CG GLU A 55 11.657 -0.657 7.574 1.00 0.00 C ATOM 833 CD GLU A 55 12.649 -0.678 6.409 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.504 -1.590 6.409 1.00 0.00 O ATOM 835 OE2 GLU A 55 12.530 0.218 5.546 1.00 0.00 O ATOM 0 H GLU A 55 12.136 -3.022 8.925 1.00 0.00 H new ATOM 0 HA GLU A 55 12.420 -1.335 10.851 1.00 0.00 H new ATOM 0 HB2 GLU A 55 12.374 0.595 9.179 1.00 0.00 H new ATOM 0 HB3 GLU A 55 13.426 -0.756 8.805 1.00 0.00 H new ATOM 0 HG2 GLU A 55 11.095 -1.591 7.595 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.935 0.146 7.427 1.00 0.00 H new ATOM 842 N LYS A 56 9.418 -0.668 9.655 1.00 0.00 N ATOM 843 CA LYS A 56 8.135 -0.072 9.985 1.00 0.00 C ATOM 844 C LYS A 56 8.309 1.437 10.165 1.00 0.00 C ATOM 845 O LYS A 56 7.415 2.112 10.674 1.00 0.00 O ATOM 846 CB LYS A 56 7.517 -0.769 11.199 1.00 0.00 C ATOM 847 CG LYS A 56 6.034 -0.420 11.336 1.00 0.00 C ATOM 848 CD LYS A 56 5.575 -0.535 12.791 1.00 0.00 C ATOM 849 CE LYS A 56 4.328 -1.415 12.905 1.00 0.00 C ATOM 850 NZ LYS A 56 3.423 -0.897 13.955 1.00 0.00 N ATOM 0 H LYS A 56 9.457 -1.117 8.740 1.00 0.00 H new ATOM 0 HA LYS A 56 7.427 -0.216 9.169 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.633 -1.848 11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.049 -0.472 12.103 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.861 0.594 10.975 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.441 -1.087 10.710 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.378 -0.955 13.397 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.362 0.457 13.188 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.806 -1.443 11.948 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.618 -2.439 13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.582 -1.505 14.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.918 -0.893 14.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.132 0.072 13.715 1.00 0.00 H new ATOM 864 N LYS A 57 9.465 1.922 9.738 1.00 0.00 N ATOM 865 CA LYS A 57 9.768 3.339 9.845 1.00 0.00 C ATOM 866 C LYS A 57 8.925 4.115 8.831 1.00 0.00 C ATOM 867 O LYS A 57 8.073 4.917 9.211 1.00 0.00 O ATOM 868 CB LYS A 57 11.273 3.578 9.705 1.00 0.00 C ATOM 869 CG LYS A 57 11.554 4.909 9.004 1.00 0.00 C ATOM 870 CD LYS A 57 10.904 6.072 9.755 1.00 0.00 C ATOM 871 CE LYS A 57 10.129 6.979 8.796 1.00 0.00 C ATOM 872 NZ LYS A 57 9.476 8.080 9.539 1.00 0.00 N ATOM 0 H LYS A 57 10.204 1.359 9.317 1.00 0.00 H new ATOM 0 HA LYS A 57 9.500 3.712 10.834 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.738 3.577 10.691 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.723 2.763 9.139 1.00 0.00 H new ATOM 0 HG2 LYS A 57 12.630 5.070 8.939 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.175 4.873 7.983 1.00 0.00 H new ATOM 0 HD2 LYS A 57 10.230 5.685 10.519 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.671 6.651 10.270 1.00 0.00 H new ATOM 0 HE2 LYS A 57 10.806 7.389 8.047 1.00 0.00 H new ATOM 0 HE3 LYS A 57 9.378 6.397 8.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 8.954 8.686 8.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.815 7.683 10.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 10.199 8.645 10.028 1.00 0.00 H new ATOM 886 N HIS A 58 9.192 3.849 7.561 1.00 0.00 N ATOM 887 CA HIS A 58 8.469 4.512 6.489 1.00 0.00 C ATOM 888 C HIS A 58 6.985 4.146 6.568 1.00 0.00 C ATOM 889 O HIS A 58 6.568 3.114 6.046 1.00 0.00 O ATOM 890 CB HIS A 58 9.089 4.182 5.130 1.00 0.00 C ATOM 891 CG HIS A 58 10.525 4.628 4.985 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.098 5.585 5.804 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.495 4.237 4.111 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.358 5.755 5.429 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.602 4.919 4.379 1.00 0.00 N ATOM 0 H HIS A 58 9.899 3.183 7.250 1.00 0.00 H new ATOM 0 HA HIS A 58 8.548 5.593 6.606 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.036 3.105 4.970 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.493 4.651 4.347 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.382 3.497 3.332 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.067 6.436 5.876 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.488 4.832 3.882 1.00 0.00 H new ATOM 903 N LYS A 59 6.230 5.013 7.227 1.00 0.00 N ATOM 904 CA LYS A 59 4.802 4.794 7.381 1.00 0.00 C ATOM 905 C LYS A 59 4.041 5.749 6.458 1.00 0.00 C ATOM 906 O LYS A 59 4.298 6.952 6.457 1.00 0.00 O ATOM 907 CB LYS A 59 4.398 4.909 8.852 1.00 0.00 C ATOM 908 CG LYS A 59 3.703 3.633 9.332 1.00 0.00 C ATOM 909 CD LYS A 59 3.405 3.701 10.831 1.00 0.00 C ATOM 910 CE LYS A 59 4.637 3.316 11.652 1.00 0.00 C ATOM 911 NZ LYS A 59 4.784 4.215 12.819 1.00 0.00 N ATOM 0 H LYS A 59 6.580 5.868 7.660 1.00 0.00 H new ATOM 0 HA LYS A 59 4.538 3.780 7.080 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.282 5.097 9.462 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.732 5.762 8.984 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.774 3.491 8.779 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.335 2.770 9.122 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.087 4.709 11.097 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.579 3.032 11.072 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.548 2.283 11.990 1.00 0.00 H new ATOM 0 HE3 LYS A 59 5.529 3.372 11.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.625 3.940 13.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.890 5.196 12.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.940 4.142 13.422 1.00 0.00 H new ATOM 925 N VAL A 60 3.121 5.177 5.696 1.00 0.00 N ATOM 926 CA VAL A 60 2.321 5.962 4.772 1.00 0.00 C ATOM 927 C VAL A 60 0.928 5.340 4.653 1.00 0.00 C ATOM 928 O VAL A 60 0.772 4.128 4.793 1.00 0.00 O ATOM 929 CB VAL A 60 3.041 6.078 3.426 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.259 6.998 3.534 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.440 4.699 2.897 1.00 0.00 C ATOM 0 H VAL A 60 2.912 4.179 5.700 1.00 0.00 H new ATOM 0 HA VAL A 60 2.192 6.978 5.146 1.00 0.00 H new ATOM 0 HB VAL A 60 2.348 6.522 2.712 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.753 7.063 2.564 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.938 7.992 3.845 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.955 6.595 4.269 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.950 4.810 1.940 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.108 4.215 3.610 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.547 4.088 2.764 1.00 0.00 H new ATOM 941 N LYS A 61 -0.048 6.198 4.396 1.00 0.00 N ATOM 942 CA LYS A 61 -1.423 5.747 4.256 1.00 0.00 C ATOM 943 C LYS A 61 -2.023 6.343 2.981 1.00 0.00 C ATOM 944 O LYS A 61 -1.507 7.323 2.447 1.00 0.00 O ATOM 945 CB LYS A 61 -2.222 6.068 5.521 1.00 0.00 C ATOM 946 CG LYS A 61 -2.380 7.579 5.701 1.00 0.00 C ATOM 947 CD LYS A 61 -2.780 7.921 7.138 1.00 0.00 C ATOM 948 CE LYS A 61 -1.545 8.087 8.026 1.00 0.00 C ATOM 949 NZ LYS A 61 -1.847 8.973 9.172 1.00 0.00 N ATOM 0 H LYS A 61 0.085 7.203 4.281 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.461 4.663 4.149 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.205 5.600 5.463 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.719 5.645 6.390 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.444 8.078 5.452 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.135 7.954 5.010 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.365 8.840 7.147 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.418 7.133 7.539 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.217 7.113 8.388 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.724 8.504 7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.999 9.075 9.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.139 9.907 8.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.616 8.560 9.737 1.00 0.00 H new ATOM 963 N THR A 62 -3.106 5.725 2.531 1.00 0.00 N ATOM 964 CA THR A 62 -3.782 6.182 1.329 1.00 0.00 C ATOM 965 C THR A 62 -4.963 7.085 1.691 1.00 0.00 C ATOM 966 O THR A 62 -5.600 6.893 2.726 1.00 0.00 O ATOM 967 CB THR A 62 -4.186 4.950 0.517 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.928 4.155 1.438 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.988 4.073 0.148 1.00 0.00 C ATOM 0 H THR A 62 -3.531 4.912 2.977 1.00 0.00 H new ATOM 0 HA THR A 62 -3.123 6.794 0.713 1.00 0.00 H new ATOM 0 HB THR A 62 -4.697 5.266 -0.392 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.585 3.616 0.950 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.330 3.213 -0.427 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.283 4.652 -0.449 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.495 3.729 1.057 1.00 0.00 H new ATOM 977 N ARG A 63 -5.218 8.050 0.820 1.00 0.00 N ATOM 978 CA ARG A 63 -6.311 8.983 1.035 1.00 0.00 C ATOM 979 C ARG A 63 -7.641 8.231 1.123 1.00 0.00 C ATOM 980 O ARG A 63 -7.981 7.457 0.229 1.00 0.00 O ATOM 981 CB ARG A 63 -6.388 10.011 -0.094 1.00 0.00 C ATOM 982 CG ARG A 63 -6.271 9.334 -1.461 1.00 0.00 C ATOM 983 CD ARG A 63 -7.324 9.874 -2.432 1.00 0.00 C ATOM 984 NE ARG A 63 -6.689 10.786 -3.410 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.354 11.711 -4.116 1.00 0.00 C ATOM 986 NH1 ARG A 63 -8.677 11.851 -3.958 1.00 0.00 N ATOM 987 NH2 ARG A 63 -6.696 12.495 -4.981 1.00 0.00 N ATOM 0 H ARG A 63 -4.686 8.206 -0.036 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.122 9.505 1.973 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.331 10.554 -0.033 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.590 10.744 0.022 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.274 9.501 -1.870 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.393 8.257 -1.349 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.808 9.048 -2.953 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.102 10.403 -1.881 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.683 10.705 -3.556 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.178 11.254 -3.300 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.183 12.555 -4.495 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.689 12.388 -5.102 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.202 13.199 -5.518 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.357 8.486 2.208 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.643 7.843 2.424 1.00 0.00 C ATOM 1003 C VAL A 64 -10.687 8.481 1.505 1.00 0.00 C ATOM 1004 O VAL A 64 -10.779 9.704 1.419 1.00 0.00 O ATOM 1005 CB VAL A 64 -10.023 7.917 3.904 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.778 7.884 4.792 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.868 9.160 4.191 1.00 0.00 C ATOM 0 H VAL A 64 -8.072 9.129 2.947 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.589 6.785 2.169 1.00 0.00 H new ATOM 0 HB VAL A 64 -10.626 7.040 4.140 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.076 7.938 5.839 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.231 6.957 4.618 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.138 8.733 4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.125 9.189 5.250 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.301 10.054 3.931 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.781 9.124 3.597 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.448 7.622 0.842 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.483 8.086 -0.066 1.00 0.00 C ATOM 1019 C LEU A 65 -13.708 8.518 0.741 1.00 0.00 C ATOM 1020 O LEU A 65 -13.803 8.232 1.934 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.786 7.021 -1.122 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.759 6.880 -2.247 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.652 8.173 -3.057 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.402 6.434 -1.698 1.00 0.00 C ATOM 0 H LEU A 65 -11.368 6.608 0.916 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.141 8.961 -0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.881 6.058 -0.621 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.755 7.245 -1.568 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.103 6.101 -2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.915 8.046 -3.850 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.621 8.408 -3.497 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.343 8.988 -2.402 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.690 6.341 -2.518 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.038 7.172 -0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.510 5.470 -1.201 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.617 9.200 0.059 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.832 9.674 0.698 1.00 0.00 C ATOM 1038 C ARG A 66 -17.041 8.885 0.191 1.00 0.00 C ATOM 1039 O ARG A 66 -17.338 8.894 -1.003 1.00 0.00 O ATOM 1040 CB ARG A 66 -16.054 11.163 0.424 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.787 11.969 0.720 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.178 11.561 2.063 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.175 12.562 2.489 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.481 13.778 2.960 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.763 14.152 3.069 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.505 14.621 3.324 1.00 0.00 N ATOM 0 H ARG A 66 -14.536 9.435 -0.930 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.721 9.526 1.772 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.345 11.306 -0.617 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.876 11.531 1.038 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -14.059 11.813 -0.076 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.023 13.033 0.732 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.961 11.476 2.816 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.711 10.580 1.977 1.00 0.00 H new ATOM 0 HE ARG A 66 -12.189 12.310 2.420 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.507 13.511 2.793 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -14.995 15.078 3.428 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.529 14.337 3.242 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.738 15.547 3.683 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.707 8.220 1.124 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.876 7.427 0.787 1.00 0.00 C ATOM 1062 C LYS A 67 -18.537 6.494 -0.377 1.00 0.00 C ATOM 1063 O LYS A 67 -18.849 6.793 -1.528 1.00 0.00 O ATOM 1064 CB LYS A 67 -20.079 8.333 0.518 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.465 9.119 1.773 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.958 9.454 1.773 1.00 0.00 C ATOM 1067 CE LYS A 67 -22.435 9.829 3.178 1.00 0.00 C ATOM 1068 NZ LYS A 67 -23.770 10.466 3.118 1.00 0.00 N ATOM 0 H LYS A 67 -17.459 8.215 2.113 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.163 6.796 1.628 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.844 9.025 -0.291 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.925 7.731 0.187 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -20.219 8.537 2.661 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.882 10.039 1.824 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -22.149 10.280 1.088 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.526 8.599 1.408 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.478 8.938 3.804 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -21.721 10.510 3.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -24.080 10.714 4.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -23.718 11.327 2.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -24.452 9.804 2.695 1.00 0.00 H new ATOM 1082 N THR A 68 -17.902 5.382 -0.037 1.00 0.00 N ATOM 1083 CA THR A 68 -17.516 4.403 -1.039 1.00 0.00 C ATOM 1084 C THR A 68 -16.902 3.171 -0.373 1.00 0.00 C ATOM 1085 O THR A 68 -15.906 3.278 0.341 1.00 0.00 O ATOM 1086 CB THR A 68 -16.576 5.089 -2.033 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.640 4.268 -3.196 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.110 5.011 -1.601 1.00 0.00 C ATOM 0 H THR A 68 -17.645 5.137 0.919 1.00 0.00 H new ATOM 0 HA THR A 68 -18.383 4.037 -1.589 1.00 0.00 H new ATOM 0 HB THR A 68 -16.866 6.134 -2.145 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.060 4.641 -3.892 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.486 5.512 -2.340 1.00 0.00 H new ATOM 0 HG22 THR A 68 -14.989 5.498 -0.634 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.809 3.966 -1.521 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.521 2.028 -0.631 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.048 0.776 -0.065 1.00 0.00 C ATOM 1098 C LEU A 69 -15.818 0.303 -0.843 1.00 0.00 C ATOM 1099 O LEU A 69 -15.010 -0.467 -0.325 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.179 -0.253 -0.018 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.288 0.015 1.002 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -18.701 0.426 2.354 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -20.283 1.049 0.471 1.00 0.00 C ATOM 0 H LEU A 69 -18.346 1.943 -1.225 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.736 0.919 0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.630 -0.313 -1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.746 -1.230 0.194 1.00 0.00 H new ATOM 0 HG LEU A 69 -19.840 -0.912 1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.510 0.611 3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.064 -0.374 2.732 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.110 1.334 2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -21.061 1.221 1.215 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -19.762 1.985 0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -20.736 0.679 -0.449 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.715 0.783 -2.074 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.598 0.418 -2.928 1.00 0.00 C ATOM 1117 C ASP A 70 -13.796 1.674 -3.275 1.00 0.00 C ATOM 1118 O ASP A 70 -14.028 2.296 -4.311 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.085 -0.209 -4.235 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.324 0.451 -4.846 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -16.377 1.699 -4.812 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -17.189 -0.309 -5.333 1.00 0.00 O ATOM 0 H ASP A 70 -16.387 1.421 -2.500 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.984 -0.304 -2.390 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.275 -0.170 -4.963 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.303 -1.262 -4.056 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.845 2.019 -2.366 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.008 3.190 -2.567 1.00 0.00 C ATOM 1129 C PRO A 71 -10.943 2.926 -3.633 1.00 0.00 C ATOM 1130 O PRO A 71 -10.517 1.788 -3.822 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.417 3.489 -1.199 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.573 2.213 -0.388 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.542 1.306 -1.129 1.00 0.00 C ATOM 0 HA PRO A 71 -12.567 4.048 -2.942 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.368 3.774 -1.281 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.937 4.320 -0.723 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.609 1.720 -0.262 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.948 2.438 0.610 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.096 0.332 -1.332 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.444 1.128 -0.544 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.543 3.998 -4.302 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.536 3.897 -5.344 1.00 0.00 C ATOM 1143 C ALA A 72 -8.445 4.941 -5.096 1.00 0.00 C ATOM 1144 O ALA A 72 -8.537 6.067 -5.583 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.199 4.060 -6.713 1.00 0.00 C ATOM 0 H ALA A 72 -10.898 4.941 -4.142 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.063 2.915 -5.326 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.443 3.984 -7.495 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.944 3.277 -6.852 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.683 5.035 -6.769 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.438 4.529 -4.340 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.331 5.415 -4.022 1.00 0.00 C ATOM 1153 C PHE A 73 -5.342 5.497 -5.186 1.00 0.00 C ATOM 1154 O PHE A 73 -4.889 6.582 -5.546 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.619 4.822 -2.804 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.562 4.188 -1.780 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.497 4.950 -1.152 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.467 2.860 -1.498 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.372 4.362 -0.201 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.342 2.272 -0.548 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.276 3.034 0.081 1.00 0.00 C ATOM 0 H PHE A 73 -7.365 3.594 -3.939 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.704 6.420 -3.826 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.908 4.069 -3.143 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.043 5.607 -2.315 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.574 6.004 -1.377 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.726 2.254 -1.997 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.113 4.968 0.298 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.266 1.218 -0.324 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.941 2.586 0.804 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.035 4.334 -5.743 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.108 4.260 -6.859 1.00 0.00 C ATOM 1173 C ASP A 74 -2.982 5.274 -6.649 1.00 0.00 C ATOM 1174 O ASP A 74 -2.576 5.960 -7.586 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.806 4.595 -8.178 1.00 0.00 C ATOM 1176 CG ASP A 74 -3.897 4.595 -9.409 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.366 3.507 -9.721 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -3.755 5.682 -10.010 1.00 0.00 O ATOM 0 H ASP A 74 -5.412 3.435 -5.442 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.717 3.243 -6.906 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.610 3.877 -8.339 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.269 5.577 -8.087 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.508 5.338 -5.413 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.437 6.257 -5.068 1.00 0.00 C ATOM 1185 C GLU A 75 -0.077 5.616 -5.350 1.00 0.00 C ATOM 1186 O GLU A 75 -0.006 4.471 -5.794 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.543 6.698 -3.607 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.521 7.865 -3.456 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.823 9.093 -2.868 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -1.015 8.895 -1.935 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -2.113 10.203 -3.365 1.00 0.00 O ATOM 0 H GLU A 75 -2.847 4.768 -4.638 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.533 7.147 -5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.874 5.860 -2.994 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.560 6.993 -3.240 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.947 8.115 -4.428 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.349 7.569 -2.811 1.00 0.00 H new ATOM 1198 N THR A 76 0.970 6.382 -5.080 1.00 0.00 N ATOM 1199 CA THR A 76 2.324 5.903 -5.299 1.00 0.00 C ATOM 1200 C THR A 76 3.307 6.652 -4.396 1.00 0.00 C ATOM 1201 O THR A 76 3.356 7.881 -4.410 1.00 0.00 O ATOM 1202 CB THR A 76 2.640 6.044 -6.789 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.909 4.984 -7.400 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.101 5.723 -7.111 1.00 0.00 C ATOM 0 H THR A 76 0.908 7.331 -4.712 1.00 0.00 H new ATOM 0 HA THR A 76 2.420 4.851 -5.030 1.00 0.00 H new ATOM 0 HB THR A 76 2.412 7.059 -7.114 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.055 5.002 -8.369 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.272 5.839 -8.181 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.752 6.405 -6.564 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.321 4.697 -6.817 1.00 0.00 H new ATOM 1212 N PHE A 77 4.066 5.879 -3.632 1.00 0.00 N ATOM 1213 CA PHE A 77 5.044 6.454 -2.725 1.00 0.00 C ATOM 1214 C PHE A 77 6.460 6.000 -3.086 1.00 0.00 C ATOM 1215 O PHE A 77 6.708 4.808 -3.262 1.00 0.00 O ATOM 1216 CB PHE A 77 4.703 5.950 -1.321 1.00 0.00 C ATOM 1217 CG PHE A 77 3.224 6.088 -0.953 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.728 7.296 -0.573 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.406 5.003 -1.006 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.356 7.424 -0.231 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.034 5.131 -0.664 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.538 6.339 -0.284 1.00 0.00 C ATOM 0 H PHE A 77 4.023 4.860 -3.623 1.00 0.00 H new ATOM 0 HA PHE A 77 5.013 7.542 -2.786 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.990 4.901 -1.243 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.301 6.499 -0.594 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.378 8.158 -0.531 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.800 4.044 -1.308 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.962 8.383 0.071 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.384 4.269 -0.706 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.506 6.437 -0.024 1.00 0.00 H new ATOM 1232 N THR A 78 7.352 6.974 -3.186 1.00 0.00 N ATOM 1233 CA THR A 78 8.736 6.690 -3.524 1.00 0.00 C ATOM 1234 C THR A 78 9.616 6.764 -2.274 1.00 0.00 C ATOM 1235 O THR A 78 9.296 7.481 -1.327 1.00 0.00 O ATOM 1236 CB THR A 78 9.164 7.661 -4.626 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.691 7.055 -5.826 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.682 7.710 -4.807 1.00 0.00 C ATOM 0 H THR A 78 7.143 7.961 -3.039 1.00 0.00 H new ATOM 0 HA THR A 78 8.849 5.675 -3.904 1.00 0.00 H new ATOM 0 HB THR A 78 8.794 8.659 -4.393 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.924 7.620 -6.592 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.931 8.414 -5.601 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.149 8.032 -3.876 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.049 6.719 -5.073 1.00 0.00 H new ATOM 1246 N PHE A 79 10.707 6.014 -2.312 1.00 0.00 N ATOM 1247 CA PHE A 79 11.635 5.986 -1.194 1.00 0.00 C ATOM 1248 C PHE A 79 13.061 5.703 -1.672 1.00 0.00 C ATOM 1249 O PHE A 79 13.322 4.665 -2.278 1.00 0.00 O ATOM 1250 CB PHE A 79 11.187 4.853 -0.269 1.00 0.00 C ATOM 1251 CG PHE A 79 9.689 4.860 0.042 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.179 5.770 0.915 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.866 3.956 -0.554 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.789 5.777 1.203 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.476 3.962 -0.266 1.00 0.00 C ATOM 1256 CZ PHE A 79 6.966 4.872 0.607 1.00 0.00 C ATOM 0 H PHE A 79 10.969 5.421 -3.099 1.00 0.00 H new ATOM 0 HA PHE A 79 11.635 6.951 -0.686 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.448 3.899 -0.727 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.742 4.920 0.667 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.832 6.488 1.389 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.270 3.233 -1.247 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.385 6.501 1.895 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.823 3.244 -0.740 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.909 4.876 0.827 1.00 0.00 H new ATOM 1266 N TYR A 80 13.946 6.645 -1.382 1.00 0.00 N ATOM 1267 CA TYR A 80 15.338 6.511 -1.775 1.00 0.00 C ATOM 1268 C TYR A 80 16.190 6.001 -0.610 1.00 0.00 C ATOM 1269 O TYR A 80 15.921 6.321 0.547 1.00 0.00 O ATOM 1270 CB TYR A 80 15.807 7.917 -2.156 1.00 0.00 C ATOM 1271 CG TYR A 80 14.800 8.700 -3.001 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.485 8.271 -4.274 1.00 0.00 C ATOM 1273 CD2 TYR A 80 14.206 9.836 -2.489 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.538 9.008 -5.069 1.00 0.00 C ATOM 1275 CE2 TYR A 80 13.258 10.573 -3.284 1.00 0.00 C ATOM 1276 CZ TYR A 80 12.971 10.123 -4.535 1.00 0.00 C ATOM 1277 OH TYR A 80 12.076 10.820 -5.286 1.00 0.00 O ATOM 0 H TYR A 80 13.726 7.505 -0.879 1.00 0.00 H new ATOM 0 HA TYR A 80 15.438 5.800 -2.595 1.00 0.00 H new ATOM 0 HB2 TYR A 80 16.016 8.478 -1.245 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.745 7.840 -2.706 1.00 0.00 H new ATOM 0 HD1 TYR A 80 14.949 7.382 -4.674 1.00 0.00 H new ATOM 0 HD2 TYR A 80 14.452 10.172 -1.493 1.00 0.00 H new ATOM 0 HE1 TYR A 80 13.283 8.683 -6.067 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.786 11.463 -2.896 1.00 0.00 H new ATOM 0 HH TYR A 80 11.752 11.592 -4.776 1.00 0.00 H new ATOM 1287 N GLY A 81 17.199 5.216 -0.956 1.00 0.00 N ATOM 1288 CA GLY A 81 18.092 4.659 0.046 1.00 0.00 C ATOM 1289 C GLY A 81 18.115 3.131 -0.029 1.00 0.00 C ATOM 1290 O GLY A 81 19.112 2.504 0.324 1.00 0.00 O ATOM 0 H GLY A 81 17.418 4.952 -1.917 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.099 5.049 -0.102 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.771 4.973 1.039 1.00 0.00 H new ATOM 1294 N ILE A 82 17.004 2.576 -0.491 1.00 0.00 N ATOM 1295 CA ILE A 82 16.884 1.134 -0.617 1.00 0.00 C ATOM 1296 C ILE A 82 17.873 0.634 -1.673 1.00 0.00 C ATOM 1297 O ILE A 82 17.761 0.983 -2.847 1.00 0.00 O ATOM 1298 CB ILE A 82 15.433 0.739 -0.898 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.488 1.354 0.136 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.284 -0.781 -0.977 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.689 2.510 -0.471 1.00 0.00 C ATOM 0 H ILE A 82 16.179 3.100 -0.783 1.00 0.00 H new ATOM 0 HA ILE A 82 17.146 0.647 0.322 1.00 0.00 H new ATOM 0 HB ILE A 82 15.152 1.141 -1.871 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.805 0.591 0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.062 1.713 0.990 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.243 -1.035 -1.178 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.913 -1.167 -1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.590 -1.226 -0.030 1.00 0.00 H new ATOM 0 HD11 ILE A 82 13.025 2.930 0.285 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.374 3.282 -0.821 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.098 2.143 -1.310 1.00 0.00 H new ATOM 1313 N PRO A 83 18.843 -0.195 -1.205 1.00 0.00 N ATOM 1314 CA PRO A 83 19.851 -0.746 -2.095 1.00 0.00 C ATOM 1315 C PRO A 83 19.265 -1.863 -2.961 1.00 0.00 C ATOM 1316 O PRO A 83 20.005 -2.649 -3.551 1.00 0.00 O ATOM 1317 CB PRO A 83 20.965 -1.227 -1.180 1.00 0.00 C ATOM 1318 CG PRO A 83 20.344 -1.352 0.202 1.00 0.00 C ATOM 1319 CD PRO A 83 19.007 -0.630 0.180 1.00 0.00 C ATOM 0 HA PRO A 83 20.229 -0.013 -2.808 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.362 -2.184 -1.518 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.796 -0.522 -1.172 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.207 -2.401 0.465 1.00 0.00 H new ATOM 0 HG3 PRO A 83 21.000 -0.917 0.956 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.195 -1.290 0.486 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.004 0.218 0.865 1.00 0.00 H new ATOM 1327 N TYR A 84 17.941 -1.898 -3.010 1.00 0.00 N ATOM 1328 CA TYR A 84 17.248 -2.906 -3.794 1.00 0.00 C ATOM 1329 C TYR A 84 17.430 -4.297 -3.184 1.00 0.00 C ATOM 1330 O TYR A 84 16.453 -4.972 -2.865 1.00 0.00 O ATOM 1331 CB TYR A 84 17.895 -2.881 -5.180 1.00 0.00 C ATOM 1332 CG TYR A 84 17.129 -3.676 -6.239 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.801 -3.394 -6.488 1.00 0.00 C ATOM 1334 CD2 TYR A 84 17.766 -4.676 -6.946 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.080 -4.142 -7.485 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.045 -5.424 -7.943 1.00 0.00 C ATOM 1337 CZ TYR A 84 15.738 -5.120 -8.163 1.00 0.00 C ATOM 1338 OH TYR A 84 15.057 -5.827 -9.105 1.00 0.00 O ATOM 0 H TYR A 84 17.330 -1.245 -2.520 1.00 0.00 H new ATOM 0 HA TYR A 84 16.179 -2.697 -3.828 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.982 -1.846 -5.510 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.907 -3.278 -5.104 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.302 -2.612 -5.935 1.00 0.00 H new ATOM 0 HD2 TYR A 84 18.805 -4.897 -6.751 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.041 -3.931 -7.690 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.531 -6.209 -8.503 1.00 0.00 H new ATOM 0 HH TYR A 84 15.653 -6.492 -9.509 1.00 0.00 H new ATOM 1348 N THR A 85 18.689 -4.685 -3.041 1.00 0.00 N ATOM 1349 CA THR A 85 19.013 -5.983 -2.474 1.00 0.00 C ATOM 1350 C THR A 85 18.397 -6.126 -1.081 1.00 0.00 C ATOM 1351 O THR A 85 18.290 -7.233 -0.556 1.00 0.00 O ATOM 1352 CB THR A 85 20.535 -6.138 -2.485 1.00 0.00 C ATOM 1353 OG1 THR A 85 21.000 -5.050 -1.691 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.140 -5.877 -3.866 1.00 0.00 C ATOM 0 H THR A 85 19.497 -4.123 -3.308 1.00 0.00 H new ATOM 0 HA THR A 85 18.586 -6.791 -3.068 1.00 0.00 H new ATOM 0 HB THR A 85 20.800 -7.143 -2.157 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.979 -5.075 -1.643 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.222 -6.000 -3.818 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.726 -6.584 -4.584 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.904 -4.860 -4.180 1.00 0.00 H new ATOM 1362 N GLN A 86 18.009 -4.989 -0.522 1.00 0.00 N ATOM 1363 CA GLN A 86 17.407 -4.973 0.800 1.00 0.00 C ATOM 1364 C GLN A 86 15.889 -5.139 0.695 1.00 0.00 C ATOM 1365 O GLN A 86 15.216 -5.374 1.697 1.00 0.00 O ATOM 1366 CB GLN A 86 17.767 -3.690 1.552 1.00 0.00 C ATOM 1367 CG GLN A 86 17.501 -3.839 3.051 1.00 0.00 C ATOM 1368 CD GLN A 86 18.310 -2.819 3.855 1.00 0.00 C ATOM 1369 OE1 GLN A 86 18.990 -1.963 3.315 1.00 0.00 O ATOM 1370 NE2 GLN A 86 18.198 -2.959 5.173 1.00 0.00 N ATOM 0 H GLN A 86 18.100 -4.073 -0.961 1.00 0.00 H new ATOM 0 HA GLN A 86 17.806 -5.813 1.369 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.818 -3.451 1.388 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.185 -2.857 1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.438 -3.704 3.251 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.760 -4.848 3.372 1.00 0.00 H new ATOM 0 HE21 GLN A 86 17.611 -3.698 5.559 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.699 -2.327 5.797 1.00 0.00 H new ATOM 1379 N ILE A 87 15.396 -5.011 -0.528 1.00 0.00 N ATOM 1380 CA ILE A 87 13.970 -5.144 -0.777 1.00 0.00 C ATOM 1381 C ILE A 87 13.488 -6.495 -0.244 1.00 0.00 C ATOM 1382 O ILE A 87 12.377 -6.600 0.273 1.00 0.00 O ATOM 1383 CB ILE A 87 13.663 -4.923 -2.260 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.157 -3.552 -2.724 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.173 -5.123 -2.547 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.178 -2.449 -2.315 1.00 0.00 C ATOM 0 H ILE A 87 15.958 -4.817 -1.357 1.00 0.00 H new ATOM 0 HA ILE A 87 13.416 -4.373 -0.242 1.00 0.00 H new ATOM 0 HB ILE A 87 14.206 -5.672 -2.836 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.138 -3.350 -2.294 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.278 -3.553 -3.807 1.00 0.00 H new ATOM 0 HG21 ILE A 87 11.982 -4.960 -3.608 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.884 -6.139 -2.278 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.591 -4.413 -1.960 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.553 -1.484 -2.657 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.205 -2.641 -2.767 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.078 -2.435 -1.230 1.00 0.00 H new ATOM 1398 N GLN A 88 14.346 -7.493 -0.388 1.00 0.00 N ATOM 1399 CA GLN A 88 14.021 -8.832 0.073 1.00 0.00 C ATOM 1400 C GLN A 88 14.080 -8.897 1.601 1.00 0.00 C ATOM 1401 O GLN A 88 13.768 -9.928 2.195 1.00 0.00 O ATOM 1402 CB GLN A 88 14.953 -9.870 -0.556 1.00 0.00 C ATOM 1403 CG GLN A 88 14.978 -9.733 -2.079 1.00 0.00 C ATOM 1404 CD GLN A 88 16.326 -10.180 -2.648 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.903 -11.175 -2.239 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.794 -9.393 -3.613 1.00 0.00 N ATOM 0 H GLN A 88 15.267 -7.402 -0.818 1.00 0.00 H new ATOM 0 HA GLN A 88 13.004 -9.066 -0.242 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.961 -9.747 -0.160 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.624 -10.873 -0.283 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.179 -10.332 -2.515 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.787 -8.697 -2.358 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.260 -8.575 -3.908 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.686 -9.607 -4.058 1.00 0.00 H new ATOM 1415 N GLU A 89 14.483 -7.782 2.193 1.00 0.00 N ATOM 1416 CA GLU A 89 14.586 -7.699 3.640 1.00 0.00 C ATOM 1417 C GLU A 89 13.492 -6.787 4.199 1.00 0.00 C ATOM 1418 O GLU A 89 13.449 -6.529 5.401 1.00 0.00 O ATOM 1419 CB GLU A 89 15.974 -7.213 4.063 1.00 0.00 C ATOM 1420 CG GLU A 89 16.957 -8.381 4.165 1.00 0.00 C ATOM 1421 CD GLU A 89 17.283 -8.697 5.626 1.00 0.00 C ATOM 1422 OE1 GLU A 89 17.226 -7.749 6.438 1.00 0.00 O ATOM 1423 OE2 GLU A 89 17.583 -9.880 5.898 1.00 0.00 O ATOM 0 H GLU A 89 14.742 -6.929 1.697 1.00 0.00 H new ATOM 0 HA GLU A 89 14.445 -8.698 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.343 -6.484 3.342 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.908 -6.704 5.025 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.531 -9.262 3.685 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.874 -8.137 3.629 1.00 0.00 H new ATOM 1430 N LEU A 90 12.635 -6.324 3.300 1.00 0.00 N ATOM 1431 CA LEU A 90 11.544 -5.447 3.689 1.00 0.00 C ATOM 1432 C LEU A 90 10.240 -6.246 3.720 1.00 0.00 C ATOM 1433 O LEU A 90 10.260 -7.476 3.704 1.00 0.00 O ATOM 1434 CB LEU A 90 11.492 -4.220 2.777 1.00 0.00 C ATOM 1435 CG LEU A 90 12.789 -3.417 2.659 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.582 -2.164 1.805 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.354 -3.082 4.041 1.00 0.00 C ATOM 0 H LEU A 90 12.674 -6.540 2.304 1.00 0.00 H new ATOM 0 HA LEU A 90 11.706 -5.061 4.695 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.197 -4.546 1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.708 -3.555 3.140 1.00 0.00 H new ATOM 0 HG LEU A 90 13.529 -4.035 2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.519 -1.611 1.737 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.259 -2.454 0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.821 -1.533 2.264 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.276 -2.511 3.929 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.627 -2.491 4.598 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.563 -4.005 4.582 1.00 0.00 H new ATOM 1449 N ALA A 91 9.136 -5.514 3.764 1.00 0.00 N ATOM 1450 CA ALA A 91 7.825 -6.139 3.798 1.00 0.00 C ATOM 1451 C ALA A 91 6.757 -5.063 4.004 1.00 0.00 C ATOM 1452 O ALA A 91 6.852 -4.258 4.930 1.00 0.00 O ATOM 1453 CB ALA A 91 7.796 -7.207 4.893 1.00 0.00 C ATOM 0 H ALA A 91 9.123 -4.494 3.777 1.00 0.00 H new ATOM 0 HA ALA A 91 7.613 -6.637 2.852 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.812 -7.676 4.918 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.553 -7.963 4.684 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.002 -6.744 5.858 1.00 0.00 H new ATOM 1459 N LEU A 92 5.765 -5.083 3.127 1.00 0.00 N ATOM 1460 CA LEU A 92 4.680 -4.119 3.201 1.00 0.00 C ATOM 1461 C LEU A 92 3.527 -4.716 4.011 1.00 0.00 C ATOM 1462 O LEU A 92 3.249 -5.910 3.913 1.00 0.00 O ATOM 1463 CB LEU A 92 4.274 -3.661 1.799 1.00 0.00 C ATOM 1464 CG LEU A 92 5.419 -3.265 0.865 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.990 -3.364 -0.601 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.955 -1.874 1.212 1.00 0.00 C ATOM 0 H LEU A 92 5.689 -5.752 2.361 1.00 0.00 H new ATOM 0 HA LEU A 92 5.005 -3.219 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.707 -4.463 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.601 -2.809 1.897 1.00 0.00 H new ATOM 0 HG LEU A 92 6.237 -3.971 1.010 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.822 -3.077 -1.244 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.695 -4.389 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.147 -2.696 -0.779 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.768 -1.618 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.155 -1.141 1.113 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.325 -1.872 2.237 1.00 0.00 H new ATOM 1478 N HIS A 93 2.888 -3.858 4.791 1.00 0.00 N ATOM 1479 CA HIS A 93 1.772 -4.285 5.618 1.00 0.00 C ATOM 1480 C HIS A 93 0.535 -3.450 5.282 1.00 0.00 C ATOM 1481 O HIS A 93 0.444 -2.286 5.670 1.00 0.00 O ATOM 1482 CB HIS A 93 2.141 -4.229 7.101 1.00 0.00 C ATOM 1483 CG HIS A 93 1.068 -4.760 8.022 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.411 -3.965 8.945 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.545 -6.013 8.151 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.465 -4.716 9.595 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.380 -5.985 9.102 1.00 0.00 N ATOM 0 H HIS A 93 3.122 -2.868 4.868 1.00 0.00 H new ATOM 0 HA HIS A 93 1.533 -5.327 5.403 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.056 -4.800 7.259 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.359 -3.196 7.372 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.835 -6.881 7.577 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.130 -4.382 10.378 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.936 -6.781 9.413 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.386 -4.076 4.565 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.614 -3.405 4.172 1.00 0.00 C ATOM 1497 C PHE A 94 -2.736 -3.686 5.173 1.00 0.00 C ATOM 1498 O PHE A 94 -3.318 -4.771 5.170 1.00 0.00 O ATOM 1499 CB PHE A 94 -2.012 -3.964 2.805 1.00 0.00 C ATOM 1500 CG PHE A 94 -1.011 -3.655 1.691 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.561 -2.384 1.513 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.570 -4.652 0.877 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.368 -2.098 0.478 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.360 -4.366 -0.157 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.809 -3.095 -0.335 1.00 0.00 C ATOM 0 H PHE A 94 -0.307 -5.041 4.246 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.455 -2.327 4.139 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.128 -5.045 2.886 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.985 -3.559 2.528 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.910 -1.592 2.159 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.928 -5.661 1.017 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.724 -1.088 0.336 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.711 -5.158 -0.802 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.516 -2.877 -1.122 1.00 0.00 H new ATOM 1515 N THR A 95 -3.008 -2.692 6.005 1.00 0.00 N ATOM 1516 CA THR A 95 -4.051 -2.819 7.008 1.00 0.00 C ATOM 1517 C THR A 95 -5.366 -2.236 6.488 1.00 0.00 C ATOM 1518 O THR A 95 -5.377 -1.169 5.876 1.00 0.00 O ATOM 1519 CB THR A 95 -3.556 -2.150 8.292 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.273 -2.729 8.513 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.369 -2.565 9.520 1.00 0.00 C ATOM 0 H THR A 95 -2.524 -1.794 6.005 1.00 0.00 H new ATOM 0 HA THR A 95 -4.261 -3.865 7.229 1.00 0.00 H new ATOM 0 HB THR A 95 -3.600 -1.067 8.177 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.879 -2.350 9.326 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.976 -2.062 10.404 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.413 -2.285 9.377 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.298 -3.644 9.656 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.443 -2.962 6.749 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.761 -2.530 6.315 1.00 0.00 C ATOM 1531 C ILE A 96 -8.474 -1.837 7.477 1.00 0.00 C ATOM 1532 O ILE A 96 -9.185 -2.481 8.247 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.543 -3.706 5.726 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.596 -4.794 5.216 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.510 -3.232 4.640 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.650 -4.241 4.148 1.00 0.00 C ATOM 0 H ILE A 96 -6.430 -3.847 7.256 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.677 -1.799 5.511 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.144 -4.149 6.520 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.017 -5.196 6.047 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.174 -5.620 4.802 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.053 -4.087 4.238 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.217 -2.521 5.068 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.950 -2.749 3.839 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.988 -5.035 3.802 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.232 -3.862 3.308 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.056 -3.432 4.572 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.260 -0.533 7.568 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.874 0.255 8.623 1.00 0.00 C ATOM 1550 C LEU A 97 -10.048 1.048 8.045 1.00 0.00 C ATOM 1551 O LEU A 97 -10.465 0.809 6.912 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.827 1.127 9.319 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.517 0.431 9.693 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.489 0.555 8.566 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -5.975 0.960 11.023 1.00 0.00 C ATOM 0 H LEU A 97 -7.670 -0.002 6.928 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.279 -0.396 9.397 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.595 1.970 8.669 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.270 1.537 10.227 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.721 -0.631 9.828 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.567 0.052 8.858 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.884 0.093 7.661 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.283 1.608 8.376 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.043 0.449 11.265 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.790 2.031 10.940 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.705 0.778 11.812 1.00 0.00 H new ATOM 1567 N SER A 98 -10.548 1.975 8.849 1.00 0.00 N ATOM 1568 CA SER A 98 -11.666 2.804 8.431 1.00 0.00 C ATOM 1569 C SER A 98 -11.655 4.125 9.202 1.00 0.00 C ATOM 1570 O SER A 98 -11.316 4.154 10.385 1.00 0.00 O ATOM 1571 CB SER A 98 -12.997 2.079 8.638 1.00 0.00 C ATOM 1572 OG SER A 98 -13.969 2.460 7.669 1.00 0.00 O ATOM 0 H SER A 98 -10.200 2.170 9.788 1.00 0.00 H new ATOM 0 HA SER A 98 -11.559 3.012 7.366 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.835 1.002 8.585 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.376 2.296 9.637 1.00 0.00 H new ATOM 0 HG SER A 98 -14.746 2.850 8.121 1.00 0.00 H new ATOM 1578 N PHE A 99 -12.029 5.186 8.502 1.00 0.00 N ATOM 1579 CA PHE A 99 -12.066 6.506 9.107 1.00 0.00 C ATOM 1580 C PHE A 99 -13.264 6.645 10.048 1.00 0.00 C ATOM 1581 O PHE A 99 -14.412 6.536 9.619 1.00 0.00 O ATOM 1582 CB PHE A 99 -12.209 7.516 7.967 1.00 0.00 C ATOM 1583 CG PHE A 99 -12.510 8.942 8.433 1.00 0.00 C ATOM 1584 CD1 PHE A 99 -11.490 9.794 8.720 1.00 0.00 C ATOM 1585 CD2 PHE A 99 -13.799 9.358 8.560 1.00 0.00 C ATOM 1586 CE1 PHE A 99 -11.769 11.117 9.152 1.00 0.00 C ATOM 1587 CE2 PHE A 99 -14.079 10.682 8.992 1.00 0.00 C ATOM 1588 CZ PHE A 99 -13.058 11.533 9.279 1.00 0.00 C ATOM 0 H PHE A 99 -12.309 5.158 7.522 1.00 0.00 H new ATOM 0 HA PHE A 99 -11.160 6.674 9.689 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -11.289 7.522 7.383 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -13.007 7.186 7.301 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -10.467 9.464 8.619 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -14.610 8.682 8.332 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -10.958 11.793 9.380 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -15.102 11.013 9.092 1.00 0.00 H new ATOM 0 HZ PHE A 99 -13.270 12.540 9.608 1.00 0.00 H new ATOM 1598 N ASP A 100 -12.957 6.883 11.315 1.00 0.00 N ATOM 1599 CA ASP A 100 -13.994 7.037 12.321 1.00 0.00 C ATOM 1600 C ASP A 100 -14.183 8.524 12.629 1.00 0.00 C ATOM 1601 O ASP A 100 -13.259 9.319 12.460 1.00 0.00 O ATOM 1602 CB ASP A 100 -13.609 6.330 13.622 1.00 0.00 C ATOM 1603 CG ASP A 100 -14.786 5.938 14.517 1.00 0.00 C ATOM 1604 OD1 ASP A 100 -15.823 5.535 13.947 1.00 0.00 O ATOM 1605 OD2 ASP A 100 -14.623 6.050 15.751 1.00 0.00 O ATOM 0 H ASP A 100 -12.004 6.973 11.668 1.00 0.00 H new ATOM 0 HA ASP A 100 -14.911 6.597 11.930 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -13.044 5.431 13.376 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -12.942 6.981 14.188 1.00 0.00 H new ATOM 1610 N ARG A 101 -15.385 8.856 13.074 1.00 0.00 N ATOM 1611 CA ARG A 101 -15.707 10.233 13.407 1.00 0.00 C ATOM 1612 C ARG A 101 -14.945 10.668 14.660 1.00 0.00 C ATOM 1613 O ARG A 101 -14.711 11.858 14.867 1.00 0.00 O ATOM 1614 CB ARG A 101 -17.208 10.406 13.646 1.00 0.00 C ATOM 1615 CG ARG A 101 -17.617 11.875 13.528 1.00 0.00 C ATOM 1616 CD ARG A 101 -18.135 12.410 14.864 1.00 0.00 C ATOM 1617 NE ARG A 101 -18.665 13.781 14.690 1.00 0.00 N ATOM 1618 CZ ARG A 101 -19.091 14.555 15.697 1.00 0.00 C ATOM 1619 NH1 ARG A 101 -19.053 14.098 16.956 1.00 0.00 N ATOM 1620 NH2 ARG A 101 -19.556 15.786 15.445 1.00 0.00 N ATOM 0 H ARG A 101 -16.149 8.194 13.212 1.00 0.00 H new ATOM 0 HA ARG A 101 -15.411 10.856 12.563 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -17.766 9.811 12.923 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -17.468 10.031 14.636 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -16.763 12.469 13.201 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -18.389 11.981 12.766 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -18.917 11.755 15.249 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -17.331 12.413 15.600 1.00 0.00 H new ATOM 0 HE ARG A 101 -18.709 14.160 13.744 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -18.700 13.161 17.148 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -19.377 14.688 17.723 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -19.586 16.134 14.487 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -19.880 16.375 16.212 1.00 0.00 H new ATOM 1634 N PHE A 102 -14.578 9.680 15.464 1.00 0.00 N ATOM 1635 CA PHE A 102 -13.846 9.946 16.691 1.00 0.00 C ATOM 1636 C PHE A 102 -12.340 9.779 16.479 1.00 0.00 C ATOM 1637 O PHE A 102 -11.630 10.757 16.249 1.00 0.00 O ATOM 1638 CB PHE A 102 -14.320 8.923 17.724 1.00 0.00 C ATOM 1639 CG PHE A 102 -15.581 9.343 18.483 1.00 0.00 C ATOM 1640 CD1 PHE A 102 -16.626 9.897 17.811 1.00 0.00 C ATOM 1641 CD2 PHE A 102 -15.657 9.162 19.828 1.00 0.00 C ATOM 1642 CE1 PHE A 102 -17.796 10.286 18.515 1.00 0.00 C ATOM 1643 CE2 PHE A 102 -16.827 9.551 20.532 1.00 0.00 C ATOM 1644 CZ PHE A 102 -17.872 10.105 19.861 1.00 0.00 C ATOM 0 H PHE A 102 -14.774 8.694 15.289 1.00 0.00 H new ATOM 0 HA PHE A 102 -14.028 10.970 17.018 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.510 7.975 17.221 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -13.518 8.748 18.441 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -16.566 10.041 16.742 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -14.827 8.722 20.361 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -18.626 10.726 17.982 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -16.887 9.407 21.601 1.00 0.00 H new ATOM 0 HZ PHE A 102 -18.762 10.401 20.397 1.00 0.00 H new ATOM 1654 N SER A 103 -11.898 8.533 16.563 1.00 0.00 N ATOM 1655 CA SER A 103 -10.489 8.226 16.383 1.00 0.00 C ATOM 1656 C SER A 103 -10.283 6.710 16.359 1.00 0.00 C ATOM 1657 O SER A 103 -9.536 6.194 15.529 1.00 0.00 O ATOM 1658 CB SER A 103 -9.642 8.860 17.488 1.00 0.00 C ATOM 1659 OG SER A 103 -10.386 9.054 18.687 1.00 0.00 O ATOM 0 H SER A 103 -12.490 7.725 16.753 1.00 0.00 H new ATOM 0 HA SER A 103 -10.166 8.645 15.430 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.781 8.224 17.695 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.255 9.819 17.143 1.00 0.00 H new ATOM 0 HG SER A 103 -9.809 9.459 19.368 1.00 0.00 H new ATOM 1665 N ARG A 104 -10.959 6.039 17.280 1.00 0.00 N ATOM 1666 CA ARG A 104 -10.860 4.592 17.375 1.00 0.00 C ATOM 1667 C ARG A 104 -10.842 3.968 15.978 1.00 0.00 C ATOM 1668 O ARG A 104 -11.858 3.963 15.284 1.00 0.00 O ATOM 1669 CB ARG A 104 -12.030 4.011 18.171 1.00 0.00 C ATOM 1670 CG ARG A 104 -11.906 4.352 19.657 1.00 0.00 C ATOM 1671 CD ARG A 104 -11.166 3.247 20.413 1.00 0.00 C ATOM 1672 NE ARG A 104 -11.940 2.846 21.609 1.00 0.00 N ATOM 1673 CZ ARG A 104 -13.119 2.211 21.563 1.00 0.00 C ATOM 1674 NH1 ARG A 104 -13.667 1.900 20.380 1.00 0.00 N ATOM 1675 NH2 ARG A 104 -13.750 1.886 22.699 1.00 0.00 N ATOM 0 H ARG A 104 -11.577 6.470 17.967 1.00 0.00 H new ATOM 0 HA ARG A 104 -9.931 4.357 17.893 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -12.970 4.403 17.782 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -12.059 2.929 18.044 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.374 5.296 19.774 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.898 4.490 20.086 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -11.017 2.386 19.761 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -10.178 3.597 20.710 1.00 0.00 H new ATOM 0 HE ARG A 104 -11.552 3.067 22.526 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -13.187 2.147 19.515 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -14.564 1.417 20.345 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -13.333 2.122 23.599 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -14.647 1.403 22.664 1.00 0.00 H new ATOM 1689 N ASP A 105 -9.677 3.457 15.608 1.00 0.00 N ATOM 1690 CA ASP A 105 -9.514 2.832 14.306 1.00 0.00 C ATOM 1691 C ASP A 105 -10.136 1.435 14.335 1.00 0.00 C ATOM 1692 O ASP A 105 -9.766 0.604 15.163 1.00 0.00 O ATOM 1693 CB ASP A 105 -8.034 2.684 13.948 1.00 0.00 C ATOM 1694 CG ASP A 105 -7.126 2.275 15.110 1.00 0.00 C ATOM 1695 OD1 ASP A 105 -7.190 1.085 15.488 1.00 0.00 O ATOM 1696 OD2 ASP A 105 -6.388 3.161 15.592 1.00 0.00 O ATOM 0 H ASP A 105 -8.837 3.463 16.187 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.003 3.464 13.564 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.940 1.943 13.155 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -7.677 3.631 13.543 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.070 1.219 13.421 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.747 -0.064 13.331 1.00 0.00 C ATOM 1703 C ASP A 106 -11.094 -0.904 12.232 1.00 0.00 C ATOM 1704 O ASP A 106 -11.486 -0.823 11.068 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.224 0.117 12.973 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.205 -0.189 14.106 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -14.455 0.737 14.907 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -14.684 -1.343 14.146 1.00 0.00 O ATOM 0 H ASP A 106 -11.374 1.911 12.736 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.668 -0.556 14.300 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.380 1.145 12.645 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.459 -0.527 12.125 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.110 -1.692 12.639 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.399 -2.546 11.704 1.00 0.00 C ATOM 1715 C ILE A 107 -10.350 -3.624 11.180 1.00 0.00 C ATOM 1716 O ILE A 107 -10.741 -4.524 11.922 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.129 -3.106 12.348 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.027 -2.046 12.398 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.668 -4.379 11.635 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -5.979 -2.394 13.458 1.00 0.00 C ATOM 0 H ILE A 107 -9.788 -1.757 13.605 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.063 -1.970 10.842 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.360 -3.380 13.378 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.549 -1.967 11.421 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.464 -1.072 12.619 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -6.764 -4.756 12.112 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.452 -5.134 11.695 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.459 -4.155 10.589 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -5.207 -1.625 13.473 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.456 -2.449 14.437 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.527 -3.357 13.220 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.693 -3.498 9.907 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.591 -4.451 9.276 1.00 0.00 C ATOM 1734 C ILE A 108 -10.828 -5.743 8.977 1.00 0.00 C ATOM 1735 O ILE A 108 -11.357 -6.838 9.165 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.253 -3.829 8.045 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -13.061 -2.587 8.426 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -13.103 -4.860 7.300 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.921 -1.494 7.364 1.00 0.00 C ATOM 0 H ILE A 108 -10.366 -2.751 9.295 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.407 -4.711 9.951 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.468 -3.505 7.362 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -14.111 -2.854 8.542 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.720 -2.208 9.390 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.562 -4.392 6.429 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.471 -5.687 6.976 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.882 -5.237 7.963 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.505 -0.623 7.660 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -11.872 -1.212 7.268 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.286 -1.868 6.407 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.598 -5.573 8.517 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.757 -6.712 8.190 1.00 0.00 C ATOM 1753 C GLY A 109 -7.281 -6.310 8.149 1.00 0.00 C ATOM 1754 O GLY A 109 -6.925 -5.199 8.539 1.00 0.00 O ATOM 0 H GLY A 109 -9.163 -4.663 8.363 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.903 -7.500 8.929 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -9.053 -7.122 7.224 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.461 -7.236 7.673 1.00 0.00 N ATOM 1759 CA GLU A 110 -5.032 -6.993 7.577 1.00 0.00 C ATOM 1760 C GLU A 110 -4.443 -7.754 6.388 1.00 0.00 C ATOM 1761 O GLU A 110 -4.959 -8.801 5.999 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.322 -7.373 8.878 1.00 0.00 C ATOM 1763 CG GLU A 110 -3.658 -6.152 9.517 1.00 0.00 C ATOM 1764 CD GLU A 110 -3.240 -6.447 10.959 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -2.145 -7.026 11.125 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -4.025 -6.087 11.862 1.00 0.00 O ATOM 0 H GLU A 110 -6.760 -8.156 7.350 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.875 -5.927 7.415 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -5.039 -7.807 9.574 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.570 -8.136 8.677 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.784 -5.862 8.933 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.348 -5.308 9.500 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.371 -7.199 5.843 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.706 -7.813 4.706 1.00 0.00 C ATOM 1775 C VAL A 111 -1.201 -7.559 4.803 1.00 0.00 C ATOM 1776 O VAL A 111 -0.773 -6.532 5.328 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.317 -7.297 3.401 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.312 -7.390 2.251 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.607 -8.047 3.065 1.00 0.00 C ATOM 0 H VAL A 111 -2.946 -6.330 6.168 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.854 -8.893 4.714 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.569 -6.246 3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.771 -7.017 1.335 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.433 -6.790 2.487 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.015 -8.429 2.111 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.020 -7.661 2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.392 -9.110 2.953 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.330 -7.906 3.869 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.438 -8.511 4.287 1.00 0.00 N ATOM 1790 CA LEU A 112 1.011 -8.404 4.309 1.00 0.00 C ATOM 1791 C LEU A 112 1.583 -9.011 3.026 1.00 0.00 C ATOM 1792 O LEU A 112 1.098 -10.037 2.551 1.00 0.00 O ATOM 1793 CB LEU A 112 1.576 -9.025 5.588 1.00 0.00 C ATOM 1794 CG LEU A 112 3.100 -9.029 5.716 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.600 -7.737 6.365 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.584 -10.272 6.466 1.00 0.00 C ATOM 0 H LEU A 112 -0.796 -9.361 3.851 1.00 0.00 H new ATOM 0 HA LEU A 112 1.315 -7.357 4.330 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.161 -8.490 6.442 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.223 -10.054 5.655 1.00 0.00 H new ATOM 0 HG LEU A 112 3.526 -9.071 4.714 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.687 -7.766 6.444 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.303 -6.884 5.754 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.167 -7.638 7.360 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.671 -10.250 6.543 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.149 -10.286 7.466 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.277 -11.167 5.924 1.00 0.00 H new ATOM 1808 N ILE A 113 2.606 -8.352 2.502 1.00 0.00 N ATOM 1809 CA ILE A 113 3.248 -8.814 1.283 1.00 0.00 C ATOM 1810 C ILE A 113 4.766 -8.691 1.434 1.00 0.00 C ATOM 1811 O ILE A 113 5.330 -7.619 1.221 1.00 0.00 O ATOM 1812 CB ILE A 113 2.689 -8.072 0.068 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.592 -9.001 -1.144 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.511 -6.818 -0.235 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.244 -9.723 -1.175 1.00 0.00 C ATOM 0 H ILE A 113 3.006 -7.502 2.899 1.00 0.00 H new ATOM 0 HA ILE A 113 3.028 -9.868 1.112 1.00 0.00 H new ATOM 0 HB ILE A 113 1.677 -7.743 0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.721 -8.424 -2.060 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.400 -9.732 -1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.092 -6.309 -1.103 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.485 -6.149 0.625 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.543 -7.101 -0.443 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.201 -10.377 -2.046 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.129 -10.318 -0.269 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.440 -8.990 -1.232 1.00 0.00 H new ATOM 1827 N PRO A 114 5.401 -9.834 1.810 1.00 0.00 N ATOM 1828 CA PRO A 114 6.842 -9.864 1.992 1.00 0.00 C ATOM 1829 C PRO A 114 7.565 -9.866 0.644 1.00 0.00 C ATOM 1830 O PRO A 114 7.324 -10.735 -0.193 1.00 0.00 O ATOM 1831 CB PRO A 114 7.109 -11.117 2.811 1.00 0.00 C ATOM 1832 CG PRO A 114 5.869 -11.984 2.661 1.00 0.00 C ATOM 1833 CD PRO A 114 4.765 -11.122 2.072 1.00 0.00 C ATOM 0 HA PRO A 114 7.220 -8.980 2.506 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.996 -11.638 2.450 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.288 -10.869 3.857 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.075 -12.836 2.013 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.565 -12.386 3.628 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.366 -11.560 1.157 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.931 -11.018 2.766 1.00 0.00 H new ATOM 1841 N LEU A 115 8.436 -8.882 0.475 1.00 0.00 N ATOM 1842 CA LEU A 115 9.196 -8.759 -0.758 1.00 0.00 C ATOM 1843 C LEU A 115 10.416 -9.680 -0.694 1.00 0.00 C ATOM 1844 O LEU A 115 11.268 -9.650 -1.581 1.00 0.00 O ATOM 1845 CB LEU A 115 9.544 -7.294 -1.029 1.00 0.00 C ATOM 1846 CG LEU A 115 8.385 -6.300 -0.926 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.834 -4.893 -1.326 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.183 -6.772 -1.746 1.00 0.00 C ATOM 0 H LEU A 115 8.632 -8.163 1.171 1.00 0.00 H new ATOM 0 HA LEU A 115 8.597 -9.082 -1.609 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.321 -6.990 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.971 -7.221 -2.029 1.00 0.00 H new ATOM 0 HG LEU A 115 8.066 -6.254 0.115 1.00 0.00 H new ATOM 0 HD11 LEU A 115 7.992 -4.205 -1.244 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.636 -4.565 -0.664 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.194 -4.905 -2.355 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.374 -6.048 -1.655 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.471 -6.865 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.847 -7.740 -1.375 1.00 0.00 H new ATOM 1860 N SER A 116 10.463 -10.475 0.365 1.00 0.00 N ATOM 1861 CA SER A 116 11.565 -11.402 0.556 1.00 0.00 C ATOM 1862 C SER A 116 11.494 -12.522 -0.484 1.00 0.00 C ATOM 1863 O SER A 116 11.307 -13.686 -0.136 1.00 0.00 O ATOM 1864 CB SER A 116 11.552 -11.989 1.969 1.00 0.00 C ATOM 1865 OG SER A 116 12.422 -13.111 2.089 1.00 0.00 O ATOM 0 H SER A 116 9.756 -10.496 1.100 1.00 0.00 H new ATOM 0 HA SER A 116 12.498 -10.854 0.427 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.850 -11.221 2.683 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.536 -12.288 2.228 1.00 0.00 H new ATOM 0 HG SER A 116 12.126 -13.821 1.481 1.00 0.00 H new ATOM 1871 N GLY A 117 11.648 -12.129 -1.740 1.00 0.00 N ATOM 1872 CA GLY A 117 11.603 -13.085 -2.833 1.00 0.00 C ATOM 1873 C GLY A 117 11.082 -12.430 -4.114 1.00 0.00 C ATOM 1874 O GLY A 117 11.416 -12.861 -5.216 1.00 0.00 O ATOM 0 H GLY A 117 11.804 -11.162 -2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.600 -13.491 -3.007 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.961 -13.923 -2.562 1.00 0.00 H new ATOM 1878 N ILE A 118 10.271 -11.399 -3.925 1.00 0.00 N ATOM 1879 CA ILE A 118 9.701 -10.680 -5.051 1.00 0.00 C ATOM 1880 C ILE A 118 10.821 -9.987 -5.829 1.00 0.00 C ATOM 1881 O ILE A 118 11.775 -9.486 -5.237 1.00 0.00 O ATOM 1882 CB ILE A 118 8.601 -9.728 -4.577 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.329 -10.497 -4.214 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.334 -8.637 -5.617 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.385 -10.594 -5.414 1.00 0.00 C ATOM 0 H ILE A 118 9.995 -11.045 -3.009 1.00 0.00 H new ATOM 0 HA ILE A 118 9.217 -11.373 -5.739 1.00 0.00 H new ATOM 0 HB ILE A 118 8.947 -9.231 -3.670 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.591 -11.498 -3.871 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.822 -9.999 -3.387 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.548 -7.974 -5.255 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.245 -8.062 -5.784 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.018 -9.097 -6.554 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.489 -11.145 -5.129 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.106 -9.592 -5.739 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.886 -11.114 -6.230 1.00 0.00 H new ATOM 1897 N GLU A 119 10.668 -9.980 -7.145 1.00 0.00 N ATOM 1898 CA GLU A 119 11.655 -9.357 -8.011 1.00 0.00 C ATOM 1899 C GLU A 119 11.013 -8.230 -8.822 1.00 0.00 C ATOM 1900 O GLU A 119 9.975 -8.427 -9.452 1.00 0.00 O ATOM 1901 CB GLU A 119 12.309 -10.390 -8.929 1.00 0.00 C ATOM 1902 CG GLU A 119 11.399 -10.726 -10.113 1.00 0.00 C ATOM 1903 CD GLU A 119 11.766 -9.889 -11.341 1.00 0.00 C ATOM 1904 OE1 GLU A 119 12.074 -8.694 -11.142 1.00 0.00 O ATOM 1905 OE2 GLU A 119 11.730 -10.464 -12.450 1.00 0.00 O ATOM 0 H GLU A 119 9.875 -10.396 -7.633 1.00 0.00 H new ATOM 0 HA GLU A 119 12.439 -8.928 -7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.261 -10.005 -9.295 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.527 -11.297 -8.365 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.484 -11.786 -10.352 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.360 -10.543 -9.841 1.00 0.00 H new ATOM 1912 N LEU A 120 11.657 -7.073 -8.781 1.00 0.00 N ATOM 1913 CA LEU A 120 11.162 -5.914 -9.505 1.00 0.00 C ATOM 1914 C LEU A 120 12.150 -5.553 -10.617 1.00 0.00 C ATOM 1915 O LEU A 120 12.030 -4.499 -11.240 1.00 0.00 O ATOM 1916 CB LEU A 120 10.874 -4.762 -8.540 1.00 0.00 C ATOM 1917 CG LEU A 120 9.731 -4.988 -7.549 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.786 -3.971 -6.407 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.377 -4.975 -8.263 1.00 0.00 C ATOM 0 H LEU A 120 12.518 -6.913 -8.258 1.00 0.00 H new ATOM 0 HA LEU A 120 10.210 -6.142 -9.985 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.782 -4.552 -7.975 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.650 -3.871 -9.126 1.00 0.00 H new ATOM 0 HG LEU A 120 9.853 -5.976 -7.106 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.962 -4.154 -5.717 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.733 -4.071 -5.876 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.702 -2.963 -6.813 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.581 -5.138 -7.536 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.232 -4.011 -8.750 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.353 -5.767 -9.011 1.00 0.00 H new ATOM 1931 N SER A 121 13.103 -6.448 -10.832 1.00 0.00 N ATOM 1932 CA SER A 121 14.110 -6.236 -11.858 1.00 0.00 C ATOM 1933 C SER A 121 13.438 -5.884 -13.186 1.00 0.00 C ATOM 1934 O SER A 121 13.645 -4.796 -13.722 1.00 0.00 O ATOM 1935 CB SER A 121 14.996 -7.473 -12.023 1.00 0.00 C ATOM 1936 OG SER A 121 16.307 -7.134 -12.466 1.00 0.00 O ATOM 0 H SER A 121 13.199 -7.321 -10.314 1.00 0.00 H new ATOM 0 HA SER A 121 14.745 -5.406 -11.548 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.060 -8.003 -11.073 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.537 -8.155 -12.738 1.00 0.00 H new ATOM 0 HG SER A 121 16.842 -7.950 -12.558 1.00 0.00 H new ATOM 1942 N GLU A 122 12.646 -6.824 -13.680 1.00 0.00 N ATOM 1943 CA GLU A 122 11.942 -6.627 -14.936 1.00 0.00 C ATOM 1944 C GLU A 122 11.310 -5.234 -14.977 1.00 0.00 C ATOM 1945 O GLU A 122 11.655 -4.417 -15.829 1.00 0.00 O ATOM 1946 CB GLU A 122 10.887 -7.714 -15.150 1.00 0.00 C ATOM 1947 CG GLU A 122 11.443 -8.858 -16.001 1.00 0.00 C ATOM 1948 CD GLU A 122 11.124 -8.645 -17.482 1.00 0.00 C ATOM 1949 OE1 GLU A 122 9.942 -8.359 -17.772 1.00 0.00 O ATOM 1950 OE2 GLU A 122 12.069 -8.772 -18.290 1.00 0.00 O ATOM 0 H GLU A 122 12.476 -7.725 -13.233 1.00 0.00 H new ATOM 0 HA GLU A 122 12.663 -6.702 -15.750 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.557 -8.100 -14.186 1.00 0.00 H new ATOM 0 HB3 GLU A 122 10.012 -7.285 -15.638 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.522 -8.927 -15.864 1.00 0.00 H new ATOM 0 HG3 GLU A 122 11.018 -9.804 -15.666 1.00 0.00 H new ATOM 1957 N GLY A 123 10.396 -5.006 -14.045 1.00 0.00 N ATOM 1958 CA GLY A 123 9.713 -3.726 -13.964 1.00 0.00 C ATOM 1959 C GLY A 123 8.632 -3.750 -12.881 1.00 0.00 C ATOM 1960 O GLY A 123 8.852 -4.275 -11.791 1.00 0.00 O ATOM 0 H GLY A 123 10.113 -5.686 -13.340 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.434 -2.938 -13.746 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.262 -3.488 -14.928 1.00 0.00 H new ATOM 1964 N LYS A 124 7.488 -3.174 -13.219 1.00 0.00 N ATOM 1965 CA LYS A 124 6.373 -3.122 -12.290 1.00 0.00 C ATOM 1966 C LYS A 124 5.553 -4.408 -12.411 1.00 0.00 C ATOM 1967 O LYS A 124 5.401 -4.951 -13.504 1.00 0.00 O ATOM 1968 CB LYS A 124 5.553 -1.848 -12.507 1.00 0.00 C ATOM 1969 CG LYS A 124 4.335 -1.815 -11.582 1.00 0.00 C ATOM 1970 CD LYS A 124 3.369 -0.700 -11.986 1.00 0.00 C ATOM 1971 CE LYS A 124 3.367 0.426 -10.951 1.00 0.00 C ATOM 1972 NZ LYS A 124 3.812 1.697 -11.566 1.00 0.00 N ATOM 0 H LYS A 124 7.309 -2.739 -14.124 1.00 0.00 H new ATOM 0 HA LYS A 124 6.736 -3.070 -11.263 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.177 -0.974 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.227 -1.794 -13.546 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.822 -2.776 -11.617 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.660 -1.664 -10.553 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.654 -0.303 -12.960 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.363 -1.106 -12.089 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.366 0.546 -10.538 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.025 0.167 -10.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 3.645 2.481 -10.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 4.827 1.640 -11.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 3.277 1.865 -12.442 1.00 0.00 H new ATOM 1986 N MET A 125 5.046 -4.858 -11.272 1.00 0.00 N ATOM 1987 CA MET A 125 4.246 -6.070 -11.237 1.00 0.00 C ATOM 1988 C MET A 125 2.929 -5.837 -10.494 1.00 0.00 C ATOM 1989 O MET A 125 2.870 -5.030 -9.567 1.00 0.00 O ATOM 1990 CB MET A 125 5.034 -7.182 -10.541 1.00 0.00 C ATOM 1991 CG MET A 125 5.123 -6.932 -9.035 1.00 0.00 C ATOM 1992 SD MET A 125 5.855 -8.343 -8.223 1.00 0.00 S ATOM 1993 CE MET A 125 7.407 -8.434 -9.099 1.00 0.00 C ATOM 0 H MET A 125 5.174 -4.405 -10.367 1.00 0.00 H new ATOM 0 HA MET A 125 4.017 -6.361 -12.262 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.554 -8.143 -10.726 1.00 0.00 H new ATOM 0 HB3 MET A 125 6.037 -7.240 -10.963 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.720 -6.041 -8.841 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.129 -6.745 -8.630 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.552 -9.445 -9.479 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.396 -7.732 -9.932 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.223 -8.181 -8.422 1.00 0.00 H new ATOM 2003 N LEU A 126 1.905 -6.556 -10.929 1.00 0.00 N ATOM 2004 CA LEU A 126 0.593 -6.437 -10.317 1.00 0.00 C ATOM 2005 C LEU A 126 0.372 -7.612 -9.362 1.00 0.00 C ATOM 2006 O LEU A 126 0.655 -8.758 -9.706 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.489 -6.306 -11.391 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.808 -5.674 -10.940 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.345 -6.363 -9.684 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.654 -4.165 -10.744 1.00 0.00 C ATOM 0 H LEU A 126 1.958 -7.223 -11.698 1.00 0.00 H new ATOM 0 HA LEU A 126 0.531 -5.526 -9.722 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.087 -5.713 -12.213 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.701 -7.299 -11.788 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.545 -5.823 -11.729 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.283 -5.895 -9.385 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.517 -7.419 -9.894 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.618 -6.267 -8.877 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.606 -3.741 -10.424 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.897 -3.972 -9.984 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.350 -3.705 -11.684 1.00 0.00 H new ATOM 2022 N MET A 127 -0.132 -7.286 -8.180 1.00 0.00 N ATOM 2023 CA MET A 127 -0.394 -8.300 -7.173 1.00 0.00 C ATOM 2024 C MET A 127 -1.677 -7.986 -6.401 1.00 0.00 C ATOM 2025 O MET A 127 -2.099 -6.833 -6.333 1.00 0.00 O ATOM 2026 CB MET A 127 0.785 -8.369 -6.200 1.00 0.00 C ATOM 2027 CG MET A 127 2.092 -8.653 -6.942 1.00 0.00 C ATOM 2028 SD MET A 127 3.136 -9.714 -5.955 1.00 0.00 S ATOM 2029 CE MET A 127 3.001 -8.897 -4.374 1.00 0.00 C ATOM 0 H MET A 127 -0.366 -6.334 -7.898 1.00 0.00 H new ATOM 0 HA MET A 127 -0.520 -9.260 -7.674 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.868 -7.428 -5.657 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.606 -9.149 -5.460 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.880 -9.127 -7.900 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.609 -7.718 -7.156 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.898 -9.091 -3.786 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.893 -7.823 -4.527 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.129 -9.277 -3.841 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.261 -9.033 -5.837 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.487 -8.884 -5.072 1.00 0.00 C ATOM 2041 C ASN A 128 -3.374 -9.685 -3.774 1.00 0.00 C ATOM 2042 O ASN A 128 -2.553 -10.596 -3.671 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.691 -9.415 -5.852 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.302 -10.623 -6.706 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.654 -11.553 -6.254 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.731 -10.558 -7.963 1.00 0.00 N ATOM 0 H ASN A 128 -1.908 -9.988 -5.895 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.629 -7.823 -4.867 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.483 -9.696 -5.158 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.091 -8.627 -6.491 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.522 -11.316 -8.613 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.269 -9.750 -8.277 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.210 -9.318 -2.814 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.214 -9.992 -1.526 1.00 0.00 C ATOM 2055 C ARG A 129 -5.626 -10.004 -0.938 1.00 0.00 C ATOM 2056 O ARG A 129 -6.382 -9.048 -1.108 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.265 -9.304 -0.542 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.854 -9.888 -0.643 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.806 -11.308 -0.075 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.842 -12.127 -0.842 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.765 -13.463 -0.768 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.595 -14.138 0.039 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.142 -14.124 -1.500 1.00 0.00 N ATOM 0 H ARG A 129 -4.890 -8.562 -2.902 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.875 -11.015 -1.686 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.235 -8.234 -0.747 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.640 -9.423 0.474 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.535 -9.898 -1.685 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.154 -9.252 -0.101 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.516 -11.279 0.975 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.797 -11.760 -0.120 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.195 -11.645 -1.466 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.285 -13.635 0.597 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.537 -15.155 0.095 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.774 -13.610 -2.114 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.200 -15.141 -1.443 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.940 -11.097 -0.257 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.248 -11.246 0.357 1.00 0.00 C ATOM 2079 C GLU A 130 -7.262 -10.594 1.741 1.00 0.00 C ATOM 2080 O GLU A 130 -6.242 -10.568 2.429 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.649 -12.720 0.442 1.00 0.00 C ATOM 2082 CG GLU A 130 -7.085 -13.370 1.706 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.898 -14.876 1.512 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -6.587 -15.266 0.366 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -7.070 -15.604 2.514 1.00 0.00 O ATOM 0 H GLU A 130 -5.311 -11.887 -0.117 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.982 -10.739 -0.270 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.736 -12.806 0.439 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.285 -13.251 -0.438 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.129 -12.911 1.960 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.758 -13.189 2.544 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.428 -10.083 2.108 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.588 -9.433 3.397 1.00 0.00 C ATOM 2094 C ILE A 131 -9.382 -10.349 4.331 1.00 0.00 C ATOM 2095 O ILE A 131 -10.534 -10.678 4.051 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.207 -8.045 3.224 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.264 -7.115 2.459 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.621 -7.456 4.575 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -9.049 -6.149 1.569 1.00 0.00 C ATOM 0 H ILE A 131 -9.271 -10.106 1.535 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.617 -9.267 3.863 1.00 0.00 H new ATOM 0 HB ILE A 131 -10.113 -8.148 2.626 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.653 -6.551 3.164 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.582 -7.706 1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -10.058 -6.469 4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.355 -8.109 5.047 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.745 -7.370 5.218 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.355 -5.499 1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.640 -6.716 0.850 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.712 -5.543 2.186 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.735 -10.735 5.420 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.366 -11.607 6.397 1.00 0.00 C ATOM 2113 C ILE A 132 -9.244 -10.981 7.787 1.00 0.00 C ATOM 2114 O ILE A 132 -8.812 -9.837 7.921 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.788 -13.020 6.306 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.271 -12.981 6.108 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.488 -13.829 5.212 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.564 -12.528 7.387 1.00 0.00 C ATOM 0 H ILE A 132 -7.780 -10.460 5.648 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.430 -11.709 6.185 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.976 -13.527 7.252 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.912 -13.969 5.820 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.024 -12.302 5.292 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.058 -14.830 5.168 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.552 -13.901 5.437 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.353 -13.334 4.250 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.487 -12.509 7.220 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.907 -11.530 7.658 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.793 -13.223 8.195 1.00 0.00 H new ATOM 2130 N SER A 133 -9.633 -11.758 8.787 1.00 0.00 N ATOM 2131 CA SER A 133 -9.573 -11.294 10.163 1.00 0.00 C ATOM 2132 C SER A 133 -8.215 -11.646 10.775 1.00 0.00 C ATOM 2133 O SER A 133 -8.131 -12.492 11.663 1.00 0.00 O ATOM 2134 CB SER A 133 -10.704 -11.898 10.998 1.00 0.00 C ATOM 2135 OG SER A 133 -10.731 -11.369 12.321 1.00 0.00 O ATOM 0 H SER A 133 -9.991 -12.706 8.672 1.00 0.00 H new ATOM 0 HA SER A 133 -9.696 -10.211 10.164 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.659 -11.703 10.510 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.584 -12.980 11.043 1.00 0.00 H new ATOM 0 HG SER A 133 -11.467 -11.778 12.822 1.00 0.00 H new ATOM 2141 N GLY A 134 -7.186 -10.978 10.275 1.00 0.00 N ATOM 2142 CA GLY A 134 -5.836 -11.210 10.761 1.00 0.00 C ATOM 2143 C GLY A 134 -5.340 -12.600 10.359 1.00 0.00 C ATOM 2144 O GLY A 134 -6.138 -13.511 10.145 1.00 0.00 O ATOM 0 H GLY A 134 -7.260 -10.276 9.538 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -5.165 -10.450 10.359 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -5.815 -11.112 11.846 1.00 0.00 H new ATOM 2148 N PRO A 135 -3.988 -12.723 10.267 1.00 0.00 N ATOM 2149 CA PRO A 135 -3.376 -13.987 9.895 1.00 0.00 C ATOM 2150 C PRO A 135 -3.422 -14.982 11.056 1.00 0.00 C ATOM 2151 O PRO A 135 -2.390 -15.514 11.464 1.00 0.00 O ATOM 2152 CB PRO A 135 -1.959 -13.629 9.475 1.00 0.00 C ATOM 2153 CG PRO A 135 -1.684 -12.256 10.065 1.00 0.00 C ATOM 2154 CD PRO A 135 -3.012 -11.666 10.514 1.00 0.00 C ATOM 0 HA PRO A 135 -3.904 -14.487 9.083 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.244 -14.364 9.846 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -1.866 -13.613 8.389 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.997 -12.333 10.907 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -1.210 -11.611 9.325 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.986 -11.389 11.568 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.255 -10.764 9.953 1.00 0.00 H new ATOM 2162 N SER A 136 -4.629 -15.203 11.556 1.00 0.00 N ATOM 2163 CA SER A 136 -4.823 -16.125 12.663 1.00 0.00 C ATOM 2164 C SER A 136 -4.010 -15.666 13.875 1.00 0.00 C ATOM 2165 O SER A 136 -2.782 -15.606 13.817 1.00 0.00 O ATOM 2166 CB SER A 136 -4.429 -17.550 12.268 1.00 0.00 C ATOM 2167 OG SER A 136 -5.523 -18.456 12.376 1.00 0.00 O ATOM 0 H SER A 136 -5.482 -14.760 11.215 1.00 0.00 H new ATOM 0 HA SER A 136 -5.881 -16.129 12.924 1.00 0.00 H new ATOM 0 HB2 SER A 136 -4.056 -17.552 11.244 1.00 0.00 H new ATOM 0 HB3 SER A 136 -3.613 -17.890 12.905 1.00 0.00 H new ATOM 0 HG SER A 136 -5.231 -19.354 12.114 1.00 0.00 H new ATOM 2173 N SER A 137 -4.727 -15.353 14.944 1.00 0.00 N ATOM 2174 CA SER A 137 -4.087 -14.901 16.168 1.00 0.00 C ATOM 2175 C SER A 137 -4.544 -15.763 17.346 1.00 0.00 C ATOM 2176 O SER A 137 -5.730 -15.800 17.670 1.00 0.00 O ATOM 2177 CB SER A 137 -4.396 -13.427 16.438 1.00 0.00 C ATOM 2178 OG SER A 137 -3.252 -12.720 16.911 1.00 0.00 O ATOM 0 H SER A 137 -5.745 -15.403 14.988 1.00 0.00 H new ATOM 0 HA SER A 137 -3.008 -15.003 16.048 1.00 0.00 H new ATOM 0 HB2 SER A 137 -4.759 -12.959 15.523 1.00 0.00 H new ATOM 0 HB3 SER A 137 -5.197 -13.353 17.173 1.00 0.00 H new ATOM 0 HG SER A 137 -3.489 -11.783 17.070 1.00 0.00 H new ATOM 2184 N GLY A 138 -3.579 -16.437 17.955 1.00 0.00 N ATOM 2185 CA GLY A 138 -3.867 -17.296 19.090 1.00 0.00 C ATOM 2186 C GLY A 138 -2.944 -16.977 20.268 1.00 0.00 C ATOM 2187 O GLY A 138 -3.042 -17.599 21.324 1.00 0.00 O ATOM 0 H GLY A 138 -2.596 -16.405 17.683 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -4.906 -17.168 19.393 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -3.745 -18.340 18.801 1.00 0.00 H new TER 2191 GLY A 138