USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=35 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 :FLIP no HD1:sc= 0.00166 F(o=-0.69,f=0.002) USER MOD Set 1.2: A 95 THR OG1 : rot -136:sc= 0.00035 USER MOD Set 2.1: A 84 TYR OH : rot 141:sc= 0.00279 USER MOD Set 2.2: A 121 SER OG : rot 180:sc= 0.0121 USER MOD Set 3.1: A 56 LYS NZ :NH3+ -172:sc= 0 (180deg=0) USER MOD Set 3.2: A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 49 LYS NZ :NH3+ -153:sc= 0 (180deg=0) USER MOD Set 4.2: A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 27 ASN : amide:sc= -0.134 K(o=0.52,f=-0.42) USER MOD Set 5.2: A 76 THR OG1 : rot 136:sc= 0.651 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.115 (180deg=0) USER MOD Single : A 2 SER OG : rot 55:sc= 0.0209 USER MOD Single : A 3 SER OG : rot 57:sc= 1.28 USER MOD Single : A 5 SER OG : rot 36:sc= 0.669 USER MOD Single : A 6 SER OG : rot 65:sc= 0.363 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 15:sc= -0.295 USER MOD Single : A 17 TYR OH : rot -16:sc= 0.547 USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=-0.84) 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 161:sc= -1.14 (180deg=-1.79) USER MOD Single : A 40 GLN : amide:sc= -0.395 K(o=-0.4,f=-3.2!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 49:sc= -1.25 USER MOD Single : A 44 SER OG : rot 27:sc= 0.868 USER MOD Single : A 47 TYR OH : rot 180:sc= -0.0335 USER MOD Single : A 50 MET CE :methyl -120:sc= -0.021 (180deg=-2.17) USER MOD Single : A 51 THR OG1 : rot -28:sc= 0.0833 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.0838 X(o=-0.084,f=-0.084) USER MOD Single : A 62 THR OG1 : rot -88:sc= 0.944 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= -0.381 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.456 USER MOD Single : A 85 THR OG1 : rot 180:sc=0.000849 USER MOD Single : A 86 GLN : amide:sc= -0.0163 X(o=-0.016,f=-0.016) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 SER OG : rot -79:sc= -0.0579 USER MOD Single : A 103 SER OG : rot -157:sc= -0.97 USER MOD Single : A 116 SER OG : rot 75:sc= 1.15 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl -172:sc= -3.62 (180deg=-4.28) USER MOD Single : A 127 MET CE :methyl -147:sc= -2.36! (180deg=-5.68!) USER MOD Single : A 128 ASN : amide:sc= -0.0376 X(o=-0.038,f=-0.4) USER MOD Single : A 133 SER OG : rot 180:sc=-0.00305 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 -16.772 -6.592 17.947 1.00 0.00 N ATOM 2 CA GLY A 1 -17.913 -6.165 17.155 1.00 0.00 C ATOM 3 C GLY A 1 -18.595 -7.361 16.487 1.00 0.00 C ATOM 4 O GLY A 1 -18.228 -8.508 16.736 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.940 -6.365 18.948 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.641 -7.618 17.842 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.917 -6.099 17.619 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.627 -5.643 17.792 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.587 -5.456 16.394 1.00 0.00 H new ATOM 8 N SER A 2 -19.576 -7.051 15.652 1.00 0.00 N ATOM 9 CA SER A 2 -20.313 -8.086 14.947 1.00 0.00 C ATOM 10 C SER A 2 -21.193 -7.457 13.865 1.00 0.00 C ATOM 11 O SER A 2 -22.310 -7.024 14.142 1.00 0.00 O ATOM 12 CB SER A 2 -21.167 -8.910 15.913 1.00 0.00 C ATOM 13 OG SER A 2 -20.684 -10.244 16.048 1.00 0.00 O ATOM 0 H SER A 2 -19.877 -6.098 15.448 1.00 0.00 H new ATOM 0 HA SER A 2 -19.594 -8.757 14.477 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.177 -8.427 16.890 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.197 -8.932 15.558 1.00 0.00 H new ATOM 0 HG SER A 2 -19.740 -10.225 16.311 1.00 0.00 H new ATOM 19 N SER A 3 -20.656 -7.426 12.654 1.00 0.00 N ATOM 20 CA SER A 3 -21.378 -6.857 11.529 1.00 0.00 C ATOM 21 C SER A 3 -20.587 -7.070 10.237 1.00 0.00 C ATOM 22 O SER A 3 -19.610 -6.369 9.980 1.00 0.00 O ATOM 23 CB SER A 3 -21.650 -5.367 11.745 1.00 0.00 C ATOM 24 OG SER A 3 -22.882 -5.142 12.424 1.00 0.00 O ATOM 0 H SER A 3 -19.729 -7.786 12.427 1.00 0.00 H new ATOM 0 HA SER A 3 -22.338 -7.366 11.447 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.834 -4.929 12.320 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.669 -4.859 10.781 1.00 0.00 H new ATOM 0 HG SER A 3 -22.874 -5.615 13.282 1.00 0.00 H new ATOM 30 N GLY A 4 -21.039 -8.042 9.458 1.00 0.00 N ATOM 31 CA GLY A 4 -20.385 -8.357 8.199 1.00 0.00 C ATOM 32 C GLY A 4 -21.410 -8.516 7.074 1.00 0.00 C ATOM 33 O GLY A 4 -22.529 -8.016 7.173 1.00 0.00 O ATOM 0 H GLY A 4 -21.850 -8.622 9.674 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.679 -7.567 7.944 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.809 -9.277 8.304 1.00 0.00 H new ATOM 37 N SER A 5 -20.990 -9.214 6.029 1.00 0.00 N ATOM 38 CA SER A 5 -21.857 -9.446 4.886 1.00 0.00 C ATOM 39 C SER A 5 -21.327 -10.616 4.055 1.00 0.00 C ATOM 40 O SER A 5 -22.057 -11.566 3.778 1.00 0.00 O ATOM 41 CB SER A 5 -21.974 -8.190 4.020 1.00 0.00 C ATOM 42 OG SER A 5 -23.039 -7.344 4.448 1.00 0.00 O ATOM 0 H SER A 5 -20.061 -9.627 5.950 1.00 0.00 H new ATOM 0 HA SER A 5 -22.852 -9.694 5.256 1.00 0.00 H new ATOM 0 HB2 SER A 5 -21.035 -7.637 4.055 1.00 0.00 H new ATOM 0 HB3 SER A 5 -22.136 -8.479 2.982 1.00 0.00 H new ATOM 0 HG SER A 5 -23.110 -7.376 5.425 1.00 0.00 H new ATOM 48 N SER A 6 -20.060 -10.508 3.681 1.00 0.00 N ATOM 49 CA SER A 6 -19.424 -11.545 2.887 1.00 0.00 C ATOM 50 C SER A 6 -18.012 -11.109 2.492 1.00 0.00 C ATOM 51 O SER A 6 -17.842 -10.156 1.733 1.00 0.00 O ATOM 52 CB SER A 6 -20.248 -11.868 1.639 1.00 0.00 C ATOM 53 OG SER A 6 -20.909 -13.126 1.746 1.00 0.00 O ATOM 0 H SER A 6 -19.457 -9.718 3.913 1.00 0.00 H new ATOM 0 HA SER A 6 -19.363 -12.449 3.492 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.987 -11.083 1.479 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.596 -11.874 0.766 1.00 0.00 H new ATOM 0 HG SER A 6 -21.570 -13.088 2.469 1.00 0.00 H new ATOM 59 N GLY A 7 -17.034 -11.828 3.024 1.00 0.00 N ATOM 60 CA GLY A 7 -15.642 -11.527 2.736 1.00 0.00 C ATOM 61 C GLY A 7 -15.282 -10.111 3.190 1.00 0.00 C ATOM 62 O GLY A 7 -16.139 -9.230 3.226 1.00 0.00 O ATOM 0 H GLY A 7 -17.178 -12.618 3.653 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.999 -12.249 3.239 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.458 -11.628 1.666 1.00 0.00 H new ATOM 66 N LEU A 8 -14.012 -9.936 3.526 1.00 0.00 N ATOM 67 CA LEU A 8 -13.528 -8.643 3.976 1.00 0.00 C ATOM 68 C LEU A 8 -13.233 -7.762 2.760 1.00 0.00 C ATOM 69 O LEU A 8 -13.315 -6.537 2.842 1.00 0.00 O ATOM 70 CB LEU A 8 -12.332 -8.815 4.915 1.00 0.00 C ATOM 71 CG LEU A 8 -12.651 -8.834 6.411 1.00 0.00 C ATOM 72 CD1 LEU A 8 -11.388 -9.085 7.237 1.00 0.00 C ATOM 73 CD2 LEU A 8 -13.368 -7.551 6.835 1.00 0.00 C ATOM 0 H LEU A 8 -13.304 -10.669 3.495 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.293 -8.133 4.562 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.826 -9.746 4.660 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -11.627 -8.006 4.724 1.00 0.00 H new ATOM 0 HG LEU A 8 -13.333 -9.662 6.605 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.642 -9.094 8.297 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -10.957 -10.047 6.959 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -10.664 -8.294 7.044 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.583 -7.590 7.903 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -12.731 -6.692 6.625 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -14.301 -7.455 6.280 1.00 0.00 H new ATOM 85 N GLY A 9 -12.897 -8.419 1.660 1.00 0.00 N ATOM 86 CA GLY A 9 -12.590 -7.711 0.429 1.00 0.00 C ATOM 87 C GLY A 9 -11.173 -8.033 -0.049 1.00 0.00 C ATOM 88 O GLY A 9 -10.441 -8.766 0.614 1.00 0.00 O ATOM 0 H GLY A 9 -12.831 -9.435 1.595 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.309 -7.986 -0.342 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.689 -6.637 0.588 1.00 0.00 H new ATOM 92 N THR A 10 -10.829 -7.469 -1.198 1.00 0.00 N ATOM 93 CA THR A 10 -9.512 -7.686 -1.773 1.00 0.00 C ATOM 94 C THR A 10 -8.742 -6.367 -1.856 1.00 0.00 C ATOM 95 O THR A 10 -9.340 -5.292 -1.834 1.00 0.00 O ATOM 96 CB THR A 10 -9.696 -8.368 -3.130 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.194 -9.663 -2.803 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.365 -8.647 -3.830 1.00 0.00 C ATOM 0 H THR A 10 -11.439 -6.862 -1.746 1.00 0.00 H new ATOM 0 HA THR A 10 -8.908 -8.339 -1.143 1.00 0.00 H new ATOM 0 HB THR A 10 -10.318 -7.742 -3.769 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.343 -10.173 -3.626 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.552 -9.132 -4.788 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.837 -7.708 -3.995 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.756 -9.301 -3.206 1.00 0.00 H new ATOM 106 N LEU A 11 -7.426 -6.491 -1.949 1.00 0.00 N ATOM 107 CA LEU A 11 -6.568 -5.322 -2.036 1.00 0.00 C ATOM 108 C LEU A 11 -5.683 -5.435 -3.279 1.00 0.00 C ATOM 109 O LEU A 11 -4.933 -6.399 -3.426 1.00 0.00 O ATOM 110 CB LEU A 11 -5.782 -5.138 -0.736 1.00 0.00 C ATOM 111 CG LEU A 11 -4.576 -4.199 -0.809 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.273 -4.990 -0.942 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.744 -3.177 -1.935 1.00 0.00 C ATOM 0 H LEU A 11 -6.933 -7.384 -1.966 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.166 -4.418 -2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.464 -4.763 0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.436 -6.116 -0.402 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.520 -3.641 0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.431 -4.299 -0.992 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.155 -5.644 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.303 -5.591 -1.851 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.873 -2.522 -1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.839 -3.698 -2.888 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.639 -2.582 -1.756 1.00 0.00 H new ATOM 125 N PHE A 12 -5.799 -4.437 -4.141 1.00 0.00 N ATOM 126 CA PHE A 12 -5.019 -4.412 -5.367 1.00 0.00 C ATOM 127 C PHE A 12 -3.875 -3.401 -5.268 1.00 0.00 C ATOM 128 O PHE A 12 -4.063 -2.292 -4.770 1.00 0.00 O ATOM 129 CB PHE A 12 -5.966 -3.984 -6.491 1.00 0.00 C ATOM 130 CG PHE A 12 -7.277 -4.772 -6.533 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.270 -6.115 -6.324 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.449 -4.128 -6.780 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.487 -6.846 -6.363 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.666 -4.858 -6.820 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.659 -6.202 -6.610 1.00 0.00 C ATOM 0 H PHE A 12 -6.422 -3.639 -4.015 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.585 -5.395 -5.552 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.194 -2.924 -6.376 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.454 -4.098 -7.447 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.339 -6.626 -6.128 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.454 -3.061 -6.946 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.482 -7.913 -6.197 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.597 -4.347 -7.017 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.585 -6.758 -6.639 1.00 0.00 H new ATOM 145 N PHE A 13 -2.714 -3.820 -5.751 1.00 0.00 N ATOM 146 CA PHE A 13 -1.540 -2.966 -5.723 1.00 0.00 C ATOM 147 C PHE A 13 -0.437 -3.519 -6.628 1.00 0.00 C ATOM 148 O PHE A 13 -0.514 -4.661 -7.078 1.00 0.00 O ATOM 149 CB PHE A 13 -1.035 -2.945 -4.279 1.00 0.00 C ATOM 150 CG PHE A 13 -0.428 -4.270 -3.813 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.225 -5.358 -3.633 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.908 -4.361 -3.579 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.661 -6.587 -3.201 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.472 -5.590 -3.146 1.00 0.00 C ATOM 155 CZ PHE A 13 0.675 -6.677 -2.966 1.00 0.00 C ATOM 0 H PHE A 13 -2.562 -4.740 -6.164 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.798 -1.968 -6.078 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.287 -2.159 -4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.862 -2.684 -3.619 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.287 -5.287 -3.819 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.541 -3.498 -3.723 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.293 -7.451 -3.059 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.533 -5.661 -2.960 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.103 -7.612 -2.636 1.00 0.00 H new ATOM 165 N SER A 14 0.563 -2.684 -6.867 1.00 0.00 N ATOM 166 CA SER A 14 1.680 -3.076 -7.710 1.00 0.00 C ATOM 167 C SER A 14 2.984 -2.504 -7.150 1.00 0.00 C ATOM 168 O SER A 14 2.995 -1.410 -6.588 1.00 0.00 O ATOM 169 CB SER A 14 1.472 -2.608 -9.152 1.00 0.00 C ATOM 170 OG SER A 14 2.499 -3.080 -10.020 1.00 0.00 O ATOM 0 H SER A 14 0.623 -1.737 -6.492 1.00 0.00 H new ATOM 0 HA SER A 14 1.740 -4.164 -7.714 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.504 -2.959 -9.511 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.446 -1.519 -9.179 1.00 0.00 H new ATOM 0 HG SER A 14 2.994 -3.802 -9.579 1.00 0.00 H new ATOM 176 N LEU A 15 4.051 -3.271 -7.323 1.00 0.00 N ATOM 177 CA LEU A 15 5.357 -2.855 -6.842 1.00 0.00 C ATOM 178 C LEU A 15 6.224 -2.435 -8.031 1.00 0.00 C ATOM 179 O LEU A 15 6.159 -3.045 -9.097 1.00 0.00 O ATOM 180 CB LEU A 15 5.985 -3.952 -5.980 1.00 0.00 C ATOM 181 CG LEU A 15 5.226 -4.318 -4.703 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.319 -5.819 -4.421 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.712 -3.482 -3.517 1.00 0.00 C ATOM 0 H LEU A 15 4.037 -4.178 -7.790 1.00 0.00 H new ATOM 0 HA LEU A 15 5.264 -1.985 -6.192 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.087 -4.851 -6.588 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.991 -3.638 -5.703 1.00 0.00 H new ATOM 0 HG LEU A 15 4.172 -4.083 -4.853 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.771 -6.052 -3.508 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.888 -6.373 -5.255 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.364 -6.102 -4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.156 -3.762 -2.622 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.775 -3.663 -3.355 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.552 -2.425 -3.727 1.00 0.00 H new ATOM 195 N GLU A 16 7.015 -1.396 -7.808 1.00 0.00 N ATOM 196 CA GLU A 16 7.894 -0.887 -8.847 1.00 0.00 C ATOM 197 C GLU A 16 9.105 -0.190 -8.224 1.00 0.00 C ATOM 198 O GLU A 16 8.952 0.757 -7.454 1.00 0.00 O ATOM 199 CB GLU A 16 7.141 0.057 -9.788 1.00 0.00 C ATOM 200 CG GLU A 16 8.116 0.888 -10.625 1.00 0.00 C ATOM 201 CD GLU A 16 7.698 0.904 -12.097 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.762 1.670 -12.413 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.324 0.150 -12.873 1.00 0.00 O ATOM 0 H GLU A 16 7.066 -0.892 -6.922 1.00 0.00 H new ATOM 0 HA GLU A 16 8.250 -1.730 -9.440 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.492 -0.521 -10.446 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.498 0.719 -9.207 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.152 1.908 -10.242 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.122 0.477 -10.533 1.00 0.00 H new ATOM 210 N TYR A 17 10.281 -0.685 -8.581 1.00 0.00 N ATOM 211 CA TYR A 17 11.517 -0.122 -8.067 1.00 0.00 C ATOM 212 C TYR A 17 12.157 0.821 -9.088 1.00 0.00 C ATOM 213 O TYR A 17 12.287 0.475 -10.261 1.00 0.00 O ATOM 214 CB TYR A 17 12.454 -1.308 -7.829 1.00 0.00 C ATOM 215 CG TYR A 17 13.738 -0.946 -7.079 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.751 -0.931 -5.700 1.00 0.00 C ATOM 217 CD2 TYR A 17 14.884 -0.635 -7.783 1.00 0.00 C ATOM 218 CE1 TYR A 17 14.959 -0.590 -4.994 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.092 -0.295 -7.078 1.00 0.00 C ATOM 220 CZ TYR A 17 16.070 -0.289 -5.718 1.00 0.00 C ATOM 221 OH TYR A 17 17.211 0.033 -5.052 1.00 0.00 O ATOM 0 H TYR A 17 10.404 -1.470 -9.220 1.00 0.00 H new ATOM 0 HA TYR A 17 11.329 0.451 -7.159 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.920 -2.073 -7.265 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.719 -1.747 -8.791 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.855 -1.175 -5.149 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.874 -0.647 -8.863 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.982 -0.574 -3.914 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.995 -0.050 -7.617 1.00 0.00 H new ATOM 0 HH TYR A 17 16.996 0.247 -4.120 1.00 0.00 H new ATOM 231 N ASN A 18 12.538 1.994 -8.605 1.00 0.00 N ATOM 232 CA ASN A 18 13.161 2.990 -9.461 1.00 0.00 C ATOM 233 C ASN A 18 14.615 2.594 -9.722 1.00 0.00 C ATOM 234 O ASN A 18 15.498 2.896 -8.920 1.00 0.00 O ATOM 235 CB ASN A 18 13.158 4.367 -8.796 1.00 0.00 C ATOM 236 CG ASN A 18 13.092 5.481 -9.842 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.601 5.364 -10.944 1.00 0.00 O ATOM 238 ND2 ASN A 18 12.438 6.566 -9.437 1.00 0.00 N ATOM 0 H ASN A 18 12.427 2.278 -7.631 1.00 0.00 H new ATOM 0 HA ASN A 18 12.594 3.038 -10.391 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.306 4.447 -8.121 1.00 0.00 H new ATOM 0 HB3 ASN A 18 14.057 4.484 -8.191 1.00 0.00 H new ATOM 0 HD21 ASN A 18 12.339 7.365 -10.063 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.035 6.599 -8.500 1.00 0.00 H new ATOM 245 N PHE A 19 14.820 1.923 -10.846 1.00 0.00 N ATOM 246 CA PHE A 19 16.152 1.482 -11.223 1.00 0.00 C ATOM 247 C PHE A 19 17.017 2.666 -11.661 1.00 0.00 C ATOM 248 O PHE A 19 18.231 2.659 -11.461 1.00 0.00 O ATOM 249 CB PHE A 19 15.989 0.521 -12.402 1.00 0.00 C ATOM 250 CG PHE A 19 16.140 -0.954 -12.027 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.215 -1.551 -11.228 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.199 -1.670 -12.493 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.355 -2.921 -10.880 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.338 -3.039 -12.145 1.00 0.00 C ATOM 255 CZ PHE A 19 16.413 -3.636 -11.346 1.00 0.00 C ATOM 0 H PHE A 19 14.085 1.674 -11.508 1.00 0.00 H new ATOM 0 HA PHE A 19 16.640 1.004 -10.374 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.006 0.673 -12.848 1.00 0.00 H new ATOM 0 HB3 PHE A 19 16.727 0.769 -13.165 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.374 -0.983 -10.858 1.00 0.00 H new ATOM 0 HD2 PHE A 19 17.934 -1.197 -13.128 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.621 -3.395 -10.245 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.179 -3.607 -12.515 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.519 -4.678 -11.082 1.00 0.00 H new ATOM 265 N GLU A 20 16.359 3.653 -12.250 1.00 0.00 N ATOM 266 CA GLU A 20 17.053 4.841 -12.718 1.00 0.00 C ATOM 267 C GLU A 20 17.675 5.592 -11.539 1.00 0.00 C ATOM 268 O GLU A 20 18.820 6.034 -11.615 1.00 0.00 O ATOM 269 CB GLU A 20 16.111 5.749 -13.511 1.00 0.00 C ATOM 270 CG GLU A 20 16.868 6.939 -14.104 1.00 0.00 C ATOM 271 CD GLU A 20 16.992 6.807 -15.624 1.00 0.00 C ATOM 272 OE1 GLU A 20 15.935 6.626 -16.266 1.00 0.00 O ATOM 273 OE2 GLU A 20 18.141 6.890 -16.108 1.00 0.00 O ATOM 0 H GLU A 20 15.352 3.655 -12.414 1.00 0.00 H new ATOM 0 HA GLU A 20 17.854 4.530 -13.388 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.638 5.179 -14.311 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.313 6.108 -12.861 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.349 7.865 -13.857 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.861 7.002 -13.658 1.00 0.00 H new ATOM 280 N ARG A 21 16.893 5.712 -10.476 1.00 0.00 N ATOM 281 CA ARG A 21 17.353 6.401 -9.282 1.00 0.00 C ATOM 282 C ARG A 21 17.474 5.419 -8.116 1.00 0.00 C ATOM 283 O ARG A 21 17.460 5.824 -6.954 1.00 0.00 O ATOM 284 CB ARG A 21 16.394 7.528 -8.893 1.00 0.00 C ATOM 285 CG ARG A 21 16.016 8.371 -10.113 1.00 0.00 C ATOM 286 CD ARG A 21 14.850 9.308 -9.791 1.00 0.00 C ATOM 287 NE ARG A 21 15.332 10.705 -9.704 1.00 0.00 N ATOM 288 CZ ARG A 21 15.667 11.452 -10.764 1.00 0.00 C ATOM 289 NH1 ARG A 21 15.574 10.941 -12.000 1.00 0.00 N ATOM 290 NH2 ARG A 21 16.095 12.710 -10.590 1.00 0.00 N ATOM 0 H ARG A 21 15.944 5.344 -10.417 1.00 0.00 H new ATOM 0 HA ARG A 21 18.330 6.830 -9.503 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.494 7.106 -8.445 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.859 8.162 -8.138 1.00 0.00 H new ATOM 0 HG2 ARG A 21 16.878 8.955 -10.437 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.744 7.717 -10.941 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.084 9.226 -10.562 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.387 9.015 -8.849 1.00 0.00 H new ATOM 0 HE ARG A 21 15.414 11.125 -8.778 1.00 0.00 H new ATOM 0 HH11 ARG A 21 15.248 9.984 -12.133 1.00 0.00 H new ATOM 0 HH12 ARG A 21 15.829 11.510 -12.807 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.166 13.099 -9.650 1.00 0.00 H new ATOM 0 HH22 ARG A 21 16.350 13.278 -11.398 1.00 0.00 H new ATOM 304 N LYS A 22 17.591 4.146 -8.465 1.00 0.00 N ATOM 305 CA LYS A 22 17.715 3.103 -7.461 1.00 0.00 C ATOM 306 C LYS A 22 16.834 3.450 -6.259 1.00 0.00 C ATOM 307 O LYS A 22 17.342 3.778 -5.188 1.00 0.00 O ATOM 308 CB LYS A 22 19.185 2.877 -7.102 1.00 0.00 C ATOM 309 CG LYS A 22 19.796 1.770 -7.964 1.00 0.00 C ATOM 310 CD LYS A 22 20.163 0.552 -7.113 1.00 0.00 C ATOM 311 CE LYS A 22 20.281 -0.705 -7.978 1.00 0.00 C ATOM 312 NZ LYS A 22 21.070 -1.743 -7.277 1.00 0.00 N ATOM 0 H LYS A 22 17.603 3.813 -9.429 1.00 0.00 H new ATOM 0 HA LYS A 22 17.357 2.151 -7.854 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.744 3.802 -7.242 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.269 2.611 -6.048 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.089 1.476 -8.740 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.685 2.147 -8.469 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.107 0.734 -6.599 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.405 0.399 -6.344 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.288 -1.089 -8.210 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.756 -0.457 -8.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 21.141 -2.589 -7.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.024 -1.379 -7.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 20.601 -1.991 -6.383 1.00 0.00 H new ATOM 326 N ALA A 23 15.530 3.367 -6.478 1.00 0.00 N ATOM 327 CA ALA A 23 14.574 3.668 -5.426 1.00 0.00 C ATOM 328 C ALA A 23 13.462 2.618 -5.436 1.00 0.00 C ATOM 329 O ALA A 23 13.456 1.723 -6.281 1.00 0.00 O ATOM 330 CB ALA A 23 14.037 5.088 -5.616 1.00 0.00 C ATOM 0 H ALA A 23 15.113 3.096 -7.368 1.00 0.00 H new ATOM 0 HA ALA A 23 15.054 3.629 -4.448 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.320 5.314 -4.827 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.863 5.798 -5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.546 5.164 -6.586 1.00 0.00 H new ATOM 336 N PHE A 24 12.547 2.761 -4.489 1.00 0.00 N ATOM 337 CA PHE A 24 11.432 1.836 -4.379 1.00 0.00 C ATOM 338 C PHE A 24 10.095 2.575 -4.466 1.00 0.00 C ATOM 339 O PHE A 24 9.935 3.645 -3.882 1.00 0.00 O ATOM 340 CB PHE A 24 11.542 1.165 -3.008 1.00 0.00 C ATOM 341 CG PHE A 24 10.485 0.087 -2.757 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.963 -0.610 -3.802 1.00 0.00 C ATOM 343 CD2 PHE A 24 10.068 -0.174 -1.489 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.982 -1.610 -3.569 1.00 0.00 C ATOM 345 CE2 PHE A 24 9.087 -1.174 -1.256 1.00 0.00 C ATOM 346 CZ PHE A 24 8.565 -1.871 -2.301 1.00 0.00 C ATOM 0 H PHE A 24 12.555 3.504 -3.790 1.00 0.00 H new ATOM 0 HA PHE A 24 11.469 1.111 -5.192 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.532 0.719 -2.912 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.460 1.928 -2.234 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.295 -0.403 -4.809 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.483 0.379 -0.659 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.567 -2.163 -4.399 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.755 -1.381 -0.249 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.819 -2.632 -2.124 1.00 0.00 H new ATOM 356 N VAL A 25 9.170 1.974 -5.201 1.00 0.00 N ATOM 357 CA VAL A 25 7.853 2.562 -5.372 1.00 0.00 C ATOM 358 C VAL A 25 6.786 1.496 -5.112 1.00 0.00 C ATOM 359 O VAL A 25 6.786 0.445 -5.750 1.00 0.00 O ATOM 360 CB VAL A 25 7.739 3.195 -6.760 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.622 4.240 -6.796 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.073 3.804 -7.196 1.00 0.00 C ATOM 0 H VAL A 25 9.307 1.086 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 25 7.696 3.363 -4.650 1.00 0.00 H new ATOM 0 HB VAL A 25 7.483 2.406 -7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.562 4.675 -7.794 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.672 3.766 -6.549 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.835 5.025 -6.071 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.964 4.247 -8.186 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.371 4.574 -6.484 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.835 3.025 -7.229 1.00 0.00 H new ATOM 372 N VAL A 26 5.903 1.806 -4.174 1.00 0.00 N ATOM 373 CA VAL A 26 4.833 0.888 -3.821 1.00 0.00 C ATOM 374 C VAL A 26 3.488 1.510 -4.200 1.00 0.00 C ATOM 375 O VAL A 26 2.859 2.183 -3.385 1.00 0.00 O ATOM 376 CB VAL A 26 4.926 0.521 -2.339 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.738 -0.345 -1.913 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.252 -0.176 -2.028 1.00 0.00 C ATOM 0 H VAL A 26 5.907 2.680 -3.648 1.00 0.00 H new ATOM 0 HA VAL A 26 4.929 -0.043 -4.379 1.00 0.00 H new ATOM 0 HB VAL A 26 4.891 1.445 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.829 -0.592 -0.855 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.810 0.202 -2.080 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.728 -1.263 -2.500 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.292 -0.426 -0.968 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.331 -1.088 -2.619 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.079 0.489 -2.275 1.00 0.00 H new ATOM 388 N ASN A 27 3.085 1.262 -5.438 1.00 0.00 N ATOM 389 CA ASN A 27 1.826 1.790 -5.935 1.00 0.00 C ATOM 390 C ASN A 27 0.668 1.093 -5.218 1.00 0.00 C ATOM 391 O ASN A 27 0.640 -0.133 -5.122 1.00 0.00 O ATOM 392 CB ASN A 27 1.675 1.534 -7.436 1.00 0.00 C ATOM 393 CG ASN A 27 0.237 1.784 -7.893 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.511 0.871 -8.204 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.108 3.068 -7.917 1.00 0.00 N ATOM 0 H ASN A 27 3.608 0.702 -6.111 1.00 0.00 H new ATOM 0 HA ASN A 27 1.814 2.864 -5.750 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.354 2.183 -7.989 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.959 0.507 -7.664 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.047 3.338 -8.208 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.567 3.783 -7.644 1.00 0.00 H new ATOM 402 N ILE A 28 -0.260 1.905 -4.733 1.00 0.00 N ATOM 403 CA ILE A 28 -1.418 1.382 -4.028 1.00 0.00 C ATOM 404 C ILE A 28 -2.669 1.595 -4.882 1.00 0.00 C ATOM 405 O ILE A 28 -3.223 2.693 -4.916 1.00 0.00 O ATOM 406 CB ILE A 28 -1.516 1.996 -2.630 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.256 1.704 -1.813 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.784 1.528 -1.913 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.528 1.848 -0.315 1.00 0.00 C ATOM 0 H ILE A 28 -0.233 2.921 -4.814 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.317 0.308 -3.873 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.587 3.078 -2.737 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.095 0.694 -2.027 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.540 2.387 -2.109 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.829 1.979 -0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.659 1.829 -2.489 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.768 0.442 -1.817 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.384 1.635 0.243 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.855 2.865 -0.101 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.307 1.146 -0.018 1.00 0.00 H new ATOM 421 N LYS A 29 -3.079 0.527 -5.552 1.00 0.00 N ATOM 422 CA LYS A 29 -4.254 0.583 -6.404 1.00 0.00 C ATOM 423 C LYS A 29 -5.485 0.886 -5.547 1.00 0.00 C ATOM 424 O LYS A 29 -5.412 1.673 -4.605 1.00 0.00 O ATOM 425 CB LYS A 29 -4.379 -0.699 -7.229 1.00 0.00 C ATOM 426 CG LYS A 29 -5.177 -0.450 -8.511 1.00 0.00 C ATOM 427 CD LYS A 29 -4.252 -0.055 -9.664 1.00 0.00 C ATOM 428 CE LYS A 29 -4.647 -0.776 -10.955 1.00 0.00 C ATOM 429 NZ LYS A 29 -4.164 -0.026 -12.136 1.00 0.00 N ATOM 0 H LYS A 29 -2.618 -0.382 -5.521 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.162 1.392 -7.128 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.386 -1.072 -7.481 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.869 -1.471 -6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.733 -1.349 -8.778 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.909 0.339 -8.340 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.296 1.023 -9.817 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.221 -0.299 -9.408 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.228 -1.782 -10.959 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.731 -0.882 -11.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.440 -0.529 -13.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.584 0.925 -12.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.128 0.053 -12.097 1.00 0.00 H new ATOM 443 N GLU A 30 -6.588 0.245 -5.906 1.00 0.00 N ATOM 444 CA GLU A 30 -7.833 0.436 -5.182 1.00 0.00 C ATOM 445 C GLU A 30 -8.244 -0.861 -4.481 1.00 0.00 C ATOM 446 O GLU A 30 -7.682 -1.921 -4.751 1.00 0.00 O ATOM 447 CB GLU A 30 -8.941 0.929 -6.116 1.00 0.00 C ATOM 448 CG GLU A 30 -9.298 -0.137 -7.154 1.00 0.00 C ATOM 449 CD GLU A 30 -9.955 0.493 -8.383 1.00 0.00 C ATOM 450 OE1 GLU A 30 -9.200 1.051 -9.208 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.199 0.401 -8.471 1.00 0.00 O ATOM 0 H GLU A 30 -6.645 -0.407 -6.688 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.675 1.202 -4.423 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.826 1.185 -5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.618 1.839 -6.621 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.398 -0.674 -7.453 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -9.973 -0.869 -6.711 1.00 0.00 H new ATOM 458 N ALA A 31 -9.221 -0.733 -3.596 1.00 0.00 N ATOM 459 CA ALA A 31 -9.714 -1.882 -2.855 1.00 0.00 C ATOM 460 C ALA A 31 -11.202 -2.076 -3.153 1.00 0.00 C ATOM 461 O ALA A 31 -11.954 -1.106 -3.236 1.00 0.00 O ATOM 462 CB ALA A 31 -9.439 -1.682 -1.363 1.00 0.00 C ATOM 0 H ALA A 31 -9.685 0.148 -3.375 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.196 -2.790 -3.164 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.808 -2.543 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.366 -1.579 -1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.946 -0.782 -1.017 1.00 0.00 H new ATOM 468 N ARG A 32 -11.583 -3.336 -3.305 1.00 0.00 N ATOM 469 CA ARG A 32 -12.967 -3.670 -3.592 1.00 0.00 C ATOM 470 C ARG A 32 -13.486 -4.695 -2.582 1.00 0.00 C ATOM 471 O ARG A 32 -12.755 -5.596 -2.175 1.00 0.00 O ATOM 472 CB ARG A 32 -13.116 -4.236 -5.006 1.00 0.00 C ATOM 473 CG ARG A 32 -13.728 -3.199 -5.950 1.00 0.00 C ATOM 474 CD ARG A 32 -14.859 -3.813 -6.778 1.00 0.00 C ATOM 475 NE ARG A 32 -14.995 -3.089 -8.062 1.00 0.00 N ATOM 476 CZ ARG A 32 -14.284 -3.371 -9.162 1.00 0.00 C ATOM 477 NH1 ARG A 32 -13.381 -4.361 -9.141 1.00 0.00 N ATOM 478 NH2 ARG A 32 -14.474 -2.662 -10.283 1.00 0.00 N ATOM 0 H ARG A 32 -10.957 -4.138 -3.235 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.552 -2.753 -3.517 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.141 -4.545 -5.382 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.745 -5.126 -4.981 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.110 -2.357 -5.373 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.958 -2.807 -6.614 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.653 -4.867 -6.965 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.796 -3.765 -6.222 1.00 0.00 H new ATOM 0 HE ARG A 32 -15.672 -2.328 -8.112 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.235 -4.900 -8.287 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -12.840 -4.576 -9.979 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.160 -1.907 -10.299 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -13.933 -2.877 -11.120 1.00 0.00 H new ATOM 492 N GLY A 33 -14.745 -4.524 -2.207 1.00 0.00 N ATOM 493 CA GLY A 33 -15.371 -5.424 -1.253 1.00 0.00 C ATOM 494 C GLY A 33 -15.070 -4.994 0.185 1.00 0.00 C ATOM 495 O GLY A 33 -14.631 -5.804 1.000 1.00 0.00 O ATOM 0 H GLY A 33 -15.349 -3.775 -2.547 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.449 -5.438 -1.414 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.011 -6.440 -1.416 1.00 0.00 H new ATOM 499 N LEU A 34 -15.318 -3.720 0.452 1.00 0.00 N ATOM 500 CA LEU A 34 -15.079 -3.173 1.776 1.00 0.00 C ATOM 501 C LEU A 34 -16.400 -3.117 2.546 1.00 0.00 C ATOM 502 O LEU A 34 -17.373 -2.531 2.074 1.00 0.00 O ATOM 503 CB LEU A 34 -14.367 -1.822 1.678 1.00 0.00 C ATOM 504 CG LEU A 34 -12.841 -1.859 1.786 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.257 -2.975 0.918 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.235 -0.495 1.450 1.00 0.00 C ATOM 0 H LEU A 34 -15.682 -3.051 -0.227 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.408 -3.821 2.340 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.633 -1.362 0.727 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.752 -1.173 2.465 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.577 -2.083 2.819 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.171 -2.979 1.013 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.654 -3.936 1.245 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.529 -2.806 -0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.150 -0.548 1.534 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.507 -0.217 0.432 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -12.616 0.254 2.144 1.00 0.00 H new ATOM 518 N PRO A 35 -16.391 -3.750 3.750 1.00 0.00 N ATOM 519 CA PRO A 35 -17.577 -3.778 4.589 1.00 0.00 C ATOM 520 C PRO A 35 -17.802 -2.424 5.265 1.00 0.00 C ATOM 521 O PRO A 35 -16.851 -1.780 5.707 1.00 0.00 O ATOM 522 CB PRO A 35 -17.330 -4.902 5.582 1.00 0.00 C ATOM 523 CG PRO A 35 -15.831 -5.155 5.561 1.00 0.00 C ATOM 524 CD PRO A 35 -15.257 -4.454 4.341 1.00 0.00 C ATOM 0 HA PRO A 35 -18.490 -3.959 4.021 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -17.665 -4.621 6.581 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -17.882 -5.799 5.301 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.367 -4.777 6.472 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -15.625 -6.225 5.519 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.463 -3.762 4.619 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -14.826 -5.169 3.640 1.00 0.00 H new ATOM 532 N ALA A 36 -19.066 -2.030 5.324 1.00 0.00 N ATOM 533 CA ALA A 36 -19.428 -0.764 5.938 1.00 0.00 C ATOM 534 C ALA A 36 -19.277 -0.878 7.457 1.00 0.00 C ATOM 535 O ALA A 36 -19.541 -1.932 8.033 1.00 0.00 O ATOM 536 CB ALA A 36 -20.849 -0.382 5.520 1.00 0.00 C ATOM 0 H ALA A 36 -19.852 -2.566 4.956 1.00 0.00 H new ATOM 0 HA ALA A 36 -18.764 0.031 5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.121 0.568 5.981 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.896 -0.286 4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.544 -1.155 5.846 1.00 0.00 H new ATOM 542 N MET A 37 -18.854 0.223 8.061 1.00 0.00 N ATOM 543 CA MET A 37 -18.666 0.260 9.501 1.00 0.00 C ATOM 544 C MET A 37 -19.872 0.896 10.196 1.00 0.00 C ATOM 545 O MET A 37 -20.397 0.346 11.163 1.00 0.00 O ATOM 546 CB MET A 37 -17.405 1.063 9.831 1.00 0.00 C ATOM 547 CG MET A 37 -16.167 0.164 9.827 1.00 0.00 C ATOM 548 SD MET A 37 -16.173 -0.889 11.268 1.00 0.00 S ATOM 549 CE MET A 37 -14.758 -1.916 10.907 1.00 0.00 C ATOM 0 H MET A 37 -18.636 1.095 7.580 1.00 0.00 H new ATOM 0 HA MET A 37 -18.561 -0.764 9.861 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.279 1.865 9.103 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.514 1.533 10.808 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.152 -0.444 8.922 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.264 0.774 9.816 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.410 -2.392 11.824 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.039 -2.682 10.185 1.00 0.00 H new ATOM 0 HE3 MET A 37 -13.959 -1.302 10.492 1.00 0.00 H new ATOM 559 N ASP A 38 -20.275 2.046 9.676 1.00 0.00 N ATOM 560 CA ASP A 38 -21.410 2.762 10.234 1.00 0.00 C ATOM 561 C ASP A 38 -22.699 2.247 9.591 1.00 0.00 C ATOM 562 O ASP A 38 -22.662 1.615 8.536 1.00 0.00 O ATOM 563 CB ASP A 38 -21.307 4.262 9.951 1.00 0.00 C ATOM 564 CG ASP A 38 -21.817 5.168 11.073 1.00 0.00 C ATOM 565 OD1 ASP A 38 -22.773 4.742 11.757 1.00 0.00 O ATOM 566 OD2 ASP A 38 -21.239 6.266 11.223 1.00 0.00 O ATOM 0 H ASP A 38 -19.836 2.500 8.875 1.00 0.00 H new ATOM 0 HA ASP A 38 -21.416 2.597 11.311 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -20.264 4.508 9.751 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -21.866 4.484 9.042 1.00 0.00 H new ATOM 571 N GLU A 39 -23.809 2.535 10.255 1.00 0.00 N ATOM 572 CA GLU A 39 -25.108 2.109 9.761 1.00 0.00 C ATOM 573 C GLU A 39 -25.962 3.324 9.394 1.00 0.00 C ATOM 574 O GLU A 39 -27.009 3.556 9.996 1.00 0.00 O ATOM 575 CB GLU A 39 -25.822 1.227 10.788 1.00 0.00 C ATOM 576 CG GLU A 39 -25.051 -0.074 11.024 1.00 0.00 C ATOM 577 CD GLU A 39 -25.779 -1.264 10.396 1.00 0.00 C ATOM 578 OE1 GLU A 39 -26.782 -1.700 11.001 1.00 0.00 O ATOM 579 OE2 GLU A 39 -25.315 -1.711 9.325 1.00 0.00 O ATOM 0 H GLU A 39 -23.836 3.058 11.130 1.00 0.00 H new ATOM 0 HA GLU A 39 -24.955 1.513 8.861 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -25.925 1.768 11.728 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -26.829 0.999 10.439 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -24.050 0.010 10.600 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -24.930 -0.240 12.094 1.00 0.00 H new ATOM 586 N GLN A 40 -25.482 4.068 8.408 1.00 0.00 N ATOM 587 CA GLN A 40 -26.188 5.254 7.954 1.00 0.00 C ATOM 588 C GLN A 40 -26.698 5.053 6.525 1.00 0.00 C ATOM 589 O GLN A 40 -27.902 4.935 6.303 1.00 0.00 O ATOM 590 CB GLN A 40 -25.296 6.493 8.049 1.00 0.00 C ATOM 591 CG GLN A 40 -25.264 7.038 9.478 1.00 0.00 C ATOM 592 CD GLN A 40 -25.884 8.435 9.547 1.00 0.00 C ATOM 593 OE1 GLN A 40 -26.351 8.984 8.562 1.00 0.00 O ATOM 594 NE2 GLN A 40 -25.862 8.978 10.761 1.00 0.00 N ATOM 0 H GLN A 40 -24.613 3.872 7.911 1.00 0.00 H new ATOM 0 HA GLN A 40 -27.046 5.415 8.606 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -24.285 6.243 7.729 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -25.664 7.263 7.371 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -25.806 6.363 10.141 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -24.234 7.075 9.834 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -25.456 8.464 11.542 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -26.251 9.909 10.910 1.00 0.00 H new ATOM 603 N SER A 41 -25.756 5.022 5.594 1.00 0.00 N ATOM 604 CA SER A 41 -26.095 4.837 4.193 1.00 0.00 C ATOM 605 C SER A 41 -25.207 3.754 3.578 1.00 0.00 C ATOM 606 O SER A 41 -24.707 3.914 2.466 1.00 0.00 O ATOM 607 CB SER A 41 -25.951 6.147 3.415 1.00 0.00 C ATOM 608 OG SER A 41 -27.169 6.884 3.380 1.00 0.00 O ATOM 0 H SER A 41 -24.758 5.122 5.782 1.00 0.00 H new ATOM 0 HA SER A 41 -27.136 4.521 4.132 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.172 6.756 3.873 1.00 0.00 H new ATOM 0 HB3 SER A 41 -25.629 5.930 2.396 1.00 0.00 H new ATOM 0 HG SER A 41 -27.035 7.714 2.876 1.00 0.00 H new ATOM 614 N MET A 42 -25.038 2.676 4.329 1.00 0.00 N ATOM 615 CA MET A 42 -24.219 1.566 3.871 1.00 0.00 C ATOM 616 C MET A 42 -22.965 2.069 3.154 1.00 0.00 C ATOM 617 O MET A 42 -22.709 1.697 2.009 1.00 0.00 O ATOM 618 CB MET A 42 -25.034 0.688 2.920 1.00 0.00 C ATOM 619 CG MET A 42 -24.207 -0.502 2.428 1.00 0.00 C ATOM 620 SD MET A 42 -25.194 -1.989 2.470 1.00 0.00 S ATOM 621 CE MET A 42 -24.316 -2.909 3.723 1.00 0.00 C ATOM 0 H MET A 42 -25.454 2.547 5.251 1.00 0.00 H new ATOM 0 HA MET A 42 -23.909 0.985 4.740 1.00 0.00 H new ATOM 0 HB2 MET A 42 -25.929 0.328 3.428 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.368 1.281 2.068 1.00 0.00 H new ATOM 0 HG2 MET A 42 -23.856 -0.317 1.413 1.00 0.00 H new ATOM 0 HG3 MET A 42 -23.323 -0.625 3.053 1.00 0.00 H new ATOM 0 HE1 MET A 42 -24.803 -3.872 3.876 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.287 -3.070 3.402 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.321 -2.348 4.657 1.00 0.00 H new ATOM 631 N THR A 43 -22.217 2.908 3.855 1.00 0.00 N ATOM 632 CA THR A 43 -20.996 3.466 3.299 1.00 0.00 C ATOM 633 C THR A 43 -20.052 3.907 4.420 1.00 0.00 C ATOM 634 O THR A 43 -20.482 4.108 5.555 1.00 0.00 O ATOM 635 CB THR A 43 -21.384 4.601 2.350 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.163 4.944 1.701 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.781 5.877 3.095 1.00 0.00 C ATOM 0 H THR A 43 -22.433 3.215 4.803 1.00 0.00 H new ATOM 0 HA THR A 43 -20.445 2.719 2.727 1.00 0.00 H new ATOM 0 HB THR A 43 -22.211 4.278 1.717 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.728 4.130 1.371 1.00 0.00 H new ATOM 0 HG21 THR A 43 -22.047 6.651 2.375 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.636 5.671 3.739 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.943 6.219 3.702 1.00 0.00 H new ATOM 645 N SER A 44 -18.784 4.045 4.063 1.00 0.00 N ATOM 646 CA SER A 44 -17.776 4.459 5.024 1.00 0.00 C ATOM 647 C SER A 44 -16.587 5.091 4.297 1.00 0.00 C ATOM 648 O SER A 44 -16.555 5.127 3.068 1.00 0.00 O ATOM 649 CB SER A 44 -17.310 3.277 5.877 1.00 0.00 C ATOM 650 OG SER A 44 -18.198 3.018 6.961 1.00 0.00 O ATOM 0 H SER A 44 -18.431 3.877 3.121 1.00 0.00 H new ATOM 0 HA SER A 44 -18.221 5.199 5.689 1.00 0.00 H new ATOM 0 HB2 SER A 44 -17.232 2.387 5.252 1.00 0.00 H new ATOM 0 HB3 SER A 44 -16.313 3.482 6.266 1.00 0.00 H new ATOM 0 HG SER A 44 -19.100 3.318 6.723 1.00 0.00 H new ATOM 656 N ASP A 45 -15.639 5.572 5.087 1.00 0.00 N ATOM 657 CA ASP A 45 -14.452 6.200 4.534 1.00 0.00 C ATOM 658 C ASP A 45 -13.214 5.411 4.967 1.00 0.00 C ATOM 659 O ASP A 45 -12.444 5.871 5.809 1.00 0.00 O ATOM 660 CB ASP A 45 -14.300 7.635 5.043 1.00 0.00 C ATOM 661 CG ASP A 45 -15.602 8.434 5.123 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.103 8.812 4.042 1.00 0.00 O ATOM 663 OD2 ASP A 45 -16.066 8.650 6.264 1.00 0.00 O ATOM 0 H ASP A 45 -15.669 5.539 6.106 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.551 6.211 3.449 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.847 7.607 6.034 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.606 8.164 4.390 1.00 0.00 H new ATOM 668 N PRO A 46 -13.058 4.207 4.356 1.00 0.00 N ATOM 669 CA PRO A 46 -11.927 3.350 4.669 1.00 0.00 C ATOM 670 C PRO A 46 -10.643 3.880 4.029 1.00 0.00 C ATOM 671 O PRO A 46 -10.689 4.771 3.182 1.00 0.00 O ATOM 672 CB PRO A 46 -12.322 1.974 4.156 1.00 0.00 C ATOM 673 CG PRO A 46 -13.451 2.207 3.166 1.00 0.00 C ATOM 674 CD PRO A 46 -13.950 3.631 3.354 1.00 0.00 C ATOM 0 HA PRO A 46 -11.709 3.315 5.736 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.478 1.479 3.676 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.646 1.330 4.974 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.100 2.057 2.145 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.259 1.494 3.333 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.910 4.191 2.420 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -14.986 3.646 3.691 1.00 0.00 H new ATOM 682 N TYR A 47 -9.526 3.311 4.458 1.00 0.00 N ATOM 683 CA TYR A 47 -8.232 3.715 3.937 1.00 0.00 C ATOM 684 C TYR A 47 -7.150 2.697 4.305 1.00 0.00 C ATOM 685 O TYR A 47 -7.124 2.192 5.427 1.00 0.00 O ATOM 686 CB TYR A 47 -7.906 5.052 4.607 1.00 0.00 C ATOM 687 CG TYR A 47 -7.732 4.961 6.124 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.841 4.920 6.945 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.466 4.921 6.672 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.677 4.835 8.373 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.303 4.835 8.100 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.416 4.797 8.880 1.00 0.00 C ATOM 693 OH TYR A 47 -7.261 4.716 10.229 1.00 0.00 O ATOM 0 H TYR A 47 -9.491 2.573 5.161 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.262 3.788 2.850 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -6.991 5.452 4.170 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.703 5.762 4.385 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.832 4.952 6.516 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.598 4.954 6.030 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.536 4.802 9.027 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.318 4.801 8.542 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.306 4.696 10.448 1.00 0.00 H new ATOM 703 N ILE A 48 -6.284 2.427 3.340 1.00 0.00 N ATOM 704 CA ILE A 48 -5.203 1.478 3.549 1.00 0.00 C ATOM 705 C ILE A 48 -3.962 2.226 4.041 1.00 0.00 C ATOM 706 O ILE A 48 -3.677 3.332 3.584 1.00 0.00 O ATOM 707 CB ILE A 48 -4.962 0.654 2.283 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.240 -0.062 1.843 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.797 -0.319 2.476 1.00 0.00 C ATOM 710 CD1 ILE A 48 -5.946 -1.081 0.740 1.00 0.00 C ATOM 0 H ILE A 48 -6.308 2.848 2.411 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.471 0.759 4.324 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.683 1.336 1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.691 -0.566 2.698 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.965 0.668 1.484 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.647 -0.893 1.561 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.890 0.240 2.707 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.023 -0.999 3.298 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.872 -1.576 0.446 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.517 -0.570 -0.122 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.239 -1.824 1.110 1.00 0.00 H new ATOM 722 N LYS A 49 -3.257 1.592 4.967 1.00 0.00 N ATOM 723 CA LYS A 49 -2.054 2.184 5.526 1.00 0.00 C ATOM 724 C LYS A 49 -0.840 1.350 5.110 1.00 0.00 C ATOM 725 O LYS A 49 -0.812 0.139 5.324 1.00 0.00 O ATOM 726 CB LYS A 49 -2.194 2.352 7.041 1.00 0.00 C ATOM 727 CG LYS A 49 -3.015 3.598 7.380 1.00 0.00 C ATOM 728 CD LYS A 49 -3.083 3.815 8.893 1.00 0.00 C ATOM 729 CE LYS A 49 -2.907 5.293 9.244 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.898 5.456 10.314 1.00 0.00 N ATOM 0 H LYS A 49 -3.496 0.675 5.344 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.903 3.188 5.129 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.673 1.470 7.466 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.206 2.428 7.495 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.570 4.472 6.903 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.023 3.494 6.978 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.041 3.459 9.272 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.308 3.226 9.383 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.599 5.849 8.358 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.860 5.712 9.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.097 6.325 10.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.936 4.638 10.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.950 5.520 9.891 1.00 0.00 H new ATOM 744 N MET A 50 0.133 2.032 4.523 1.00 0.00 N ATOM 745 CA MET A 50 1.346 1.370 4.075 1.00 0.00 C ATOM 746 C MET A 50 2.456 1.493 5.121 1.00 0.00 C ATOM 747 O MET A 50 2.518 2.480 5.852 1.00 0.00 O ATOM 748 CB MET A 50 1.812 1.994 2.759 1.00 0.00 C ATOM 749 CG MET A 50 2.405 0.934 1.828 1.00 0.00 C ATOM 750 SD MET A 50 4.063 0.525 2.346 1.00 0.00 S ATOM 751 CE MET A 50 4.946 1.938 1.704 1.00 0.00 C ATOM 0 H MET A 50 0.106 3.036 4.347 1.00 0.00 H new ATOM 0 HA MET A 50 1.127 0.312 3.928 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.972 2.485 2.268 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.557 2.763 2.961 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.781 0.040 1.837 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.416 1.304 0.803 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.699 1.603 0.990 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.246 2.609 1.205 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.433 2.466 2.524 1.00 0.00 H new ATOM 761 N THR A 51 3.304 0.476 5.159 1.00 0.00 N ATOM 762 CA THR A 51 4.409 0.458 6.103 1.00 0.00 C ATOM 763 C THR A 51 5.513 -0.481 5.614 1.00 0.00 C ATOM 764 O THR A 51 5.247 -1.633 5.271 1.00 0.00 O ATOM 765 CB THR A 51 3.851 0.077 7.476 1.00 0.00 C ATOM 766 OG1 THR A 51 2.921 1.115 7.773 1.00 0.00 O ATOM 767 CG2 THR A 51 4.900 0.187 8.585 1.00 0.00 C ATOM 0 H THR A 51 3.248 -0.342 4.552 1.00 0.00 H new ATOM 0 HA THR A 51 4.875 1.440 6.186 1.00 0.00 H new ATOM 0 HB THR A 51 3.465 -0.942 7.441 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.197 1.940 7.323 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.453 -0.094 9.538 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.734 -0.480 8.365 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.262 1.214 8.643 1.00 0.00 H new ATOM 775 N ILE A 52 6.729 0.045 5.597 1.00 0.00 N ATOM 776 CA ILE A 52 7.875 -0.732 5.155 1.00 0.00 C ATOM 777 C ILE A 52 8.449 -1.506 6.343 1.00 0.00 C ATOM 778 O ILE A 52 9.160 -0.940 7.172 1.00 0.00 O ATOM 779 CB ILE A 52 8.895 0.168 4.456 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.281 0.844 3.229 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.165 -0.611 4.107 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.363 1.245 2.224 1.00 0.00 C ATOM 0 H ILE A 52 6.946 1.000 5.882 1.00 0.00 H new ATOM 0 HA ILE A 52 7.572 -1.468 4.411 1.00 0.00 H new ATOM 0 HB ILE A 52 9.183 0.959 5.148 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.571 0.167 2.754 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.721 1.727 3.538 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.874 0.052 3.611 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.613 -1.004 5.020 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.914 -1.437 3.441 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.899 1.723 1.361 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.057 1.941 2.695 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.905 0.357 1.899 1.00 0.00 H new ATOM 794 N LEU A 53 8.119 -2.789 6.388 1.00 0.00 N ATOM 795 CA LEU A 53 8.593 -3.646 7.461 1.00 0.00 C ATOM 796 C LEU A 53 9.924 -4.280 7.052 1.00 0.00 C ATOM 797 O LEU A 53 10.235 -4.367 5.865 1.00 0.00 O ATOM 798 CB LEU A 53 7.520 -4.666 7.847 1.00 0.00 C ATOM 799 CG LEU A 53 6.297 -4.108 8.577 1.00 0.00 C ATOM 800 CD1 LEU A 53 5.098 -5.048 8.436 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.622 -3.810 10.043 1.00 0.00 C ATOM 0 H LEU A 53 7.529 -3.255 5.699 1.00 0.00 H new ATOM 0 HA LEU A 53 8.781 -3.060 8.360 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.180 -5.167 6.941 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.980 -5.426 8.478 1.00 0.00 H new ATOM 0 HG LEU A 53 6.022 -3.163 8.109 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.242 -4.628 8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.851 -5.167 7.381 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.346 -6.020 8.862 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.736 -3.414 10.539 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.937 -4.728 10.540 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.425 -3.075 10.095 1.00 0.00 H new ATOM 813 N PRO A 54 10.695 -4.716 8.084 1.00 0.00 N ATOM 814 CA PRO A 54 10.253 -4.574 9.461 1.00 0.00 C ATOM 815 C PRO A 54 10.383 -3.124 9.931 1.00 0.00 C ATOM 816 O PRO A 54 9.512 -2.615 10.636 1.00 0.00 O ATOM 817 CB PRO A 54 11.121 -5.536 10.254 1.00 0.00 C ATOM 818 CG PRO A 54 12.323 -5.836 9.374 1.00 0.00 C ATOM 819 CD PRO A 54 12.003 -5.354 7.968 1.00 0.00 C ATOM 0 HA PRO A 54 9.197 -4.812 9.591 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.431 -5.093 11.200 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.575 -6.448 10.493 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.211 -5.334 9.757 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.537 -6.905 9.372 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.756 -4.652 7.609 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.978 -6.183 7.261 1.00 0.00 H new ATOM 827 N GLU A 55 11.477 -2.499 9.522 1.00 0.00 N ATOM 828 CA GLU A 55 11.733 -1.117 9.894 1.00 0.00 C ATOM 829 C GLU A 55 10.449 -0.458 10.401 1.00 0.00 C ATOM 830 O GLU A 55 10.368 -0.061 11.562 1.00 0.00 O ATOM 831 CB GLU A 55 12.325 -0.335 8.720 1.00 0.00 C ATOM 832 CG GLU A 55 11.761 -0.834 7.388 1.00 0.00 C ATOM 833 CD GLU A 55 12.886 -1.208 6.421 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.666 -2.116 6.782 1.00 0.00 O ATOM 835 OE2 GLU A 55 12.942 -0.577 5.344 1.00 0.00 O ATOM 0 H GLU A 55 12.196 -2.924 8.937 1.00 0.00 H new ATOM 0 HA GLU A 55 12.466 -1.107 10.701 1.00 0.00 H new ATOM 0 HB2 GLU A 55 12.105 0.726 8.837 1.00 0.00 H new ATOM 0 HB3 GLU A 55 13.410 -0.437 8.721 1.00 0.00 H new ATOM 0 HG2 GLU A 55 11.123 -1.700 7.561 1.00 0.00 H new ATOM 0 HG3 GLU A 55 11.135 -0.061 6.942 1.00 0.00 H new ATOM 842 N LYS A 56 9.477 -0.361 9.505 1.00 0.00 N ATOM 843 CA LYS A 56 8.201 0.243 9.847 1.00 0.00 C ATOM 844 C LYS A 56 8.371 1.761 9.946 1.00 0.00 C ATOM 845 O LYS A 56 7.496 2.455 10.462 1.00 0.00 O ATOM 846 CB LYS A 56 7.628 -0.395 11.114 1.00 0.00 C ATOM 847 CG LYS A 56 6.123 -0.141 11.223 1.00 0.00 C ATOM 848 CD LYS A 56 5.654 -0.248 12.675 1.00 0.00 C ATOM 849 CE LYS A 56 4.413 -1.138 12.786 1.00 0.00 C ATOM 850 NZ LYS A 56 3.453 -0.569 13.758 1.00 0.00 N ATOM 0 H LYS A 56 9.548 -0.691 8.542 1.00 0.00 H new ATOM 0 HA LYS A 56 7.468 0.054 9.063 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.820 -1.468 11.104 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.133 0.011 11.990 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.888 0.849 10.833 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.583 -0.862 10.608 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.455 -0.657 13.291 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.429 0.746 13.063 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.938 -1.233 11.810 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.704 -2.141 13.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.683 -1.248 13.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.942 -0.374 14.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.059 0.316 13.379 1.00 0.00 H new ATOM 864 N LYS A 57 9.503 2.232 9.443 1.00 0.00 N ATOM 865 CA LYS A 57 9.798 3.654 9.468 1.00 0.00 C ATOM 866 C LYS A 57 8.891 4.377 8.470 1.00 0.00 C ATOM 867 O LYS A 57 7.894 4.983 8.859 1.00 0.00 O ATOM 868 CB LYS A 57 11.290 3.896 9.229 1.00 0.00 C ATOM 869 CG LYS A 57 11.897 4.735 10.355 1.00 0.00 C ATOM 870 CD LYS A 57 12.027 6.201 9.937 1.00 0.00 C ATOM 871 CE LYS A 57 12.319 7.092 11.146 1.00 0.00 C ATOM 872 NZ LYS A 57 13.605 7.803 10.967 1.00 0.00 N ATOM 0 H LYS A 57 10.227 1.654 9.016 1.00 0.00 H new ATOM 0 HA LYS A 57 9.584 4.070 10.453 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.811 2.941 9.161 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.431 4.404 8.275 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.273 4.661 11.246 1.00 0.00 H new ATOM 0 HG3 LYS A 57 12.878 4.340 10.619 1.00 0.00 H new ATOM 0 HD2 LYS A 57 12.826 6.304 9.203 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.106 6.528 9.454 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.513 7.814 11.277 1.00 0.00 H new ATOM 0 HE3 LYS A 57 12.354 6.486 12.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 13.788 8.403 11.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 14.374 7.110 10.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 13.558 8.396 10.114 1.00 0.00 H new ATOM 886 N HIS A 58 9.268 4.289 7.203 1.00 0.00 N ATOM 887 CA HIS A 58 8.501 4.926 6.147 1.00 0.00 C ATOM 888 C HIS A 58 7.037 4.495 6.245 1.00 0.00 C ATOM 889 O HIS A 58 6.642 3.490 5.655 1.00 0.00 O ATOM 890 CB HIS A 58 9.116 4.635 4.777 1.00 0.00 C ATOM 891 CG HIS A 58 10.584 4.971 4.678 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.143 6.077 5.295 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.603 4.336 4.030 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.440 6.097 5.023 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.722 5.017 4.238 1.00 0.00 N ATOM 0 H HIS A 58 10.096 3.785 6.884 1.00 0.00 H new ATOM 0 HA HIS A 58 8.533 6.008 6.271 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.979 3.579 4.546 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.573 5.200 4.019 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.514 3.432 3.446 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.149 6.838 5.363 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.642 4.773 3.871 1.00 0.00 H new ATOM 903 N LYS A 59 6.271 5.275 6.993 1.00 0.00 N ATOM 904 CA LYS A 59 4.859 4.986 7.175 1.00 0.00 C ATOM 905 C LYS A 59 4.030 5.984 6.364 1.00 0.00 C ATOM 906 O LYS A 59 4.058 7.184 6.633 1.00 0.00 O ATOM 907 CB LYS A 59 4.505 4.959 8.663 1.00 0.00 C ATOM 908 CG LYS A 59 5.074 3.710 9.339 1.00 0.00 C ATOM 909 CD LYS A 59 4.640 3.634 10.805 1.00 0.00 C ATOM 910 CE LYS A 59 3.197 3.142 10.925 1.00 0.00 C ATOM 911 NZ LYS A 59 2.858 2.871 12.340 1.00 0.00 N ATOM 0 H LYS A 59 6.602 6.108 7.480 1.00 0.00 H new ATOM 0 HA LYS A 59 4.622 3.992 6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 59 4.898 5.851 9.150 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.422 4.981 8.783 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.736 2.819 8.809 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.162 3.723 9.278 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.303 2.962 11.350 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.732 4.617 11.267 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.516 3.890 10.519 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.065 2.236 10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 1.875 2.538 12.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.496 2.141 12.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.965 3.744 12.896 1.00 0.00 H new ATOM 925 N VAL A 60 3.311 5.451 5.387 1.00 0.00 N ATOM 926 CA VAL A 60 2.475 6.279 4.535 1.00 0.00 C ATOM 927 C VAL A 60 1.060 5.698 4.494 1.00 0.00 C ATOM 928 O VAL A 60 0.881 4.485 4.591 1.00 0.00 O ATOM 929 CB VAL A 60 3.108 6.409 3.148 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.374 7.267 3.201 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.404 5.033 2.549 1.00 0.00 C ATOM 0 H VAL A 60 3.290 4.455 5.167 1.00 0.00 H new ATOM 0 HA VAL A 60 2.400 7.288 4.940 1.00 0.00 H new ATOM 0 HB VAL A 60 2.390 6.910 2.498 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.804 7.343 2.202 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.123 8.263 3.565 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.098 6.806 3.873 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.853 5.154 1.563 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.094 4.494 3.199 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.476 4.469 2.458 1.00 0.00 H new ATOM 941 N LYS A 61 0.092 6.591 4.351 1.00 0.00 N ATOM 942 CA LYS A 61 -1.301 6.181 4.296 1.00 0.00 C ATOM 943 C LYS A 61 -1.959 6.791 3.057 1.00 0.00 C ATOM 944 O LYS A 61 -1.585 7.880 2.623 1.00 0.00 O ATOM 945 CB LYS A 61 -2.013 6.529 5.605 1.00 0.00 C ATOM 946 CG LYS A 61 -2.083 8.044 5.805 1.00 0.00 C ATOM 947 CD LYS A 61 -2.426 8.390 7.256 1.00 0.00 C ATOM 948 CE LYS A 61 -1.175 8.362 8.136 1.00 0.00 C ATOM 949 NZ LYS A 61 -1.508 8.759 9.523 1.00 0.00 N ATOM 0 H LYS A 61 0.245 7.596 4.272 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.376 5.098 4.197 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.020 6.113 5.597 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.486 6.072 6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.128 8.495 5.536 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.834 8.468 5.139 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.884 9.378 7.300 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.160 7.681 7.639 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.742 7.362 8.132 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.422 9.037 7.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.648 8.735 10.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.900 9.722 9.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.211 8.099 9.914 1.00 0.00 H new ATOM 963 N THR A 62 -2.928 6.063 2.522 1.00 0.00 N ATOM 964 CA THR A 62 -3.642 6.519 1.341 1.00 0.00 C ATOM 965 C THR A 62 -4.842 7.379 1.742 1.00 0.00 C ATOM 966 O THR A 62 -5.510 7.094 2.735 1.00 0.00 O ATOM 967 CB THR A 62 -4.024 5.289 0.515 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.785 4.489 1.416 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.816 4.416 0.171 1.00 0.00 C ATOM 0 H THR A 62 -3.236 5.161 2.884 1.00 0.00 H new ATOM 0 HA THR A 62 -3.015 7.161 0.723 1.00 0.00 H new ATOM 0 HB THR A 62 -4.515 5.608 -0.405 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.184 3.901 1.920 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.143 3.557 -0.415 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.099 4.999 -0.407 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.344 4.069 1.090 1.00 0.00 H new ATOM 977 N ARG A 63 -5.080 8.413 0.949 1.00 0.00 N ATOM 978 CA ARG A 63 -6.188 9.316 1.209 1.00 0.00 C ATOM 979 C ARG A 63 -7.500 8.534 1.300 1.00 0.00 C ATOM 980 O ARG A 63 -7.859 7.807 0.375 1.00 0.00 O ATOM 981 CB ARG A 63 -6.308 10.372 0.109 1.00 0.00 C ATOM 982 CG ARG A 63 -6.269 9.727 -1.278 1.00 0.00 C ATOM 983 CD ARG A 63 -7.503 10.110 -2.097 1.00 0.00 C ATOM 984 NE ARG A 63 -7.098 10.529 -3.457 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.943 11.014 -4.377 1.00 0.00 C ATOM 986 NH1 ARG A 63 -9.245 11.145 -4.087 1.00 0.00 N ATOM 987 NH2 ARG A 63 -7.487 11.369 -5.586 1.00 0.00 N ATOM 0 H ARG A 63 -4.524 8.646 0.126 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.992 9.816 2.157 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.240 10.925 0.231 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.495 11.093 0.202 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.367 10.042 -1.804 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.217 8.643 -1.177 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.187 9.263 -2.157 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.040 10.920 -1.603 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.114 10.443 -3.710 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.592 10.876 -3.166 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.889 11.514 -4.787 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.496 11.270 -5.807 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.131 11.738 -6.286 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.180 8.710 2.424 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.445 8.030 2.648 1.00 0.00 C ATOM 1003 C VAL A 64 -10.531 8.689 1.796 1.00 0.00 C ATOM 1004 O VAL A 64 -10.707 9.906 1.840 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.778 8.023 4.141 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.503 8.057 4.987 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.706 9.184 4.501 1.00 0.00 C ATOM 0 H VAL A 64 -7.879 9.314 3.189 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.378 6.987 2.339 1.00 0.00 H new ATOM 0 HB VAL A 64 -10.303 7.094 4.363 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.768 8.051 6.044 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.893 7.182 4.761 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -7.939 8.962 4.759 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.927 9.156 5.568 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.219 10.128 4.256 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.634 9.097 3.936 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.233 7.857 1.040 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.297 8.344 0.180 1.00 0.00 C ATOM 1019 C LEU A 65 -13.490 8.765 1.040 1.00 0.00 C ATOM 1020 O LEU A 65 -13.513 8.510 2.243 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.645 7.302 -0.885 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.648 7.162 -2.038 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.482 8.489 -2.782 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.309 6.612 -1.541 1.00 0.00 C ATOM 0 H LEU A 65 -11.085 6.848 1.006 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.969 9.228 -0.367 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.745 6.332 -0.397 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.621 7.550 -1.303 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.048 6.441 -2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.769 8.363 -3.596 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.444 8.802 -3.188 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.115 9.249 -2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.619 6.522 -2.380 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.890 7.290 -0.798 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.463 5.631 -1.091 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.453 9.402 0.390 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.646 9.861 1.081 1.00 0.00 C ATOM 1038 C ARG A 66 -16.870 9.077 0.603 1.00 0.00 C ATOM 1039 O ARG A 66 -17.103 8.956 -0.599 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.880 11.354 0.843 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.696 12.182 1.347 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.131 11.598 2.644 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.326 12.620 3.350 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.841 13.715 3.926 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -15.162 13.936 3.884 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -13.035 14.588 4.546 1.00 0.00 N ATOM 0 H ARG A 66 -14.431 9.611 -0.608 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.497 9.694 2.148 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.030 11.537 -0.221 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.791 11.669 1.352 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.916 12.209 0.586 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.013 13.211 1.515 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.945 11.258 3.284 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.515 10.727 2.422 1.00 0.00 H new ATOM 0 HE ARG A 66 -12.317 12.482 3.401 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.776 13.271 3.414 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -15.554 14.769 4.322 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.030 14.419 4.579 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -13.427 15.421 4.984 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.620 8.566 1.568 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.814 7.798 1.261 1.00 0.00 C ATOM 1062 C LYS A 67 -18.538 6.894 0.058 1.00 0.00 C ATOM 1063 O LYS A 67 -18.772 7.286 -1.085 1.00 0.00 O ATOM 1064 CB LYS A 67 -20.014 8.727 1.069 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.768 8.927 2.386 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.287 10.361 2.508 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.475 10.753 3.975 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.629 11.668 4.123 1.00 0.00 N ATOM 0 H LYS A 67 -17.424 8.669 2.564 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.074 7.148 2.096 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.675 9.691 0.690 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.687 8.308 0.320 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -21.603 8.228 2.441 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -20.109 8.702 3.224 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.587 11.047 2.031 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.235 10.455 1.978 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -21.632 9.859 4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.571 11.235 4.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.743 11.924 5.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -22.464 12.528 3.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.492 11.195 3.787 1.00 0.00 H new ATOM 1082 N THR A 68 -18.045 5.700 0.355 1.00 0.00 N ATOM 1083 CA THR A 68 -17.735 4.738 -0.688 1.00 0.00 C ATOM 1084 C THR A 68 -17.293 3.408 -0.072 1.00 0.00 C ATOM 1085 O THR A 68 -16.528 3.390 0.891 1.00 0.00 O ATOM 1086 CB THR A 68 -16.684 5.360 -1.609 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.682 4.514 -2.755 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.266 5.232 -1.049 1.00 0.00 C ATOM 0 H THR A 68 -17.853 5.378 1.303 1.00 0.00 H new ATOM 0 HA THR A 68 -18.616 4.507 -1.287 1.00 0.00 H new ATOM 0 HB THR A 68 -16.918 6.413 -1.768 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.029 4.846 -3.406 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.559 5.689 -1.741 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.209 5.737 -0.085 1.00 0.00 H new ATOM 0 HG23 THR A 68 -15.019 4.178 -0.922 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.794 2.328 -0.653 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.461 0.998 -0.174 1.00 0.00 C ATOM 1098 C LEU A 69 -16.330 0.421 -1.028 1.00 0.00 C ATOM 1099 O LEU A 69 -15.983 -0.752 -0.896 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.710 0.115 -0.130 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.648 0.340 1.058 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.507 -0.899 1.320 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -18.865 0.768 2.301 1.00 0.00 C ATOM 0 H LEU A 69 -18.428 2.347 -1.452 1.00 0.00 H new ATOM 0 HA LEU A 69 -17.095 1.044 0.852 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.275 0.273 -1.049 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.394 -0.928 -0.125 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.327 1.156 0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.165 -0.713 2.169 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -21.108 -1.119 0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.862 -1.749 1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.555 0.921 3.131 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.148 -0.009 2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.334 1.697 2.094 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.787 1.272 -1.887 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.704 0.861 -2.763 1.00 0.00 C ATOM 1117 C ASP A 70 -13.842 2.078 -3.105 1.00 0.00 C ATOM 1118 O ASP A 70 -14.051 2.722 -4.132 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.243 0.281 -4.072 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.520 -0.550 -3.933 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.476 -0.024 -3.325 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -16.511 -1.694 -4.438 1.00 0.00 O ATOM 0 H ASP A 70 -16.077 2.244 -1.994 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.122 0.099 -2.245 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -15.435 1.101 -4.764 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -14.470 -0.341 -4.522 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.866 2.364 -2.202 1.00 0.00 N ATOM 1128 CA PRO A 71 -11.971 3.492 -2.399 1.00 0.00 C ATOM 1129 C PRO A 71 -10.931 3.185 -3.478 1.00 0.00 C ATOM 1130 O PRO A 71 -10.542 2.033 -3.661 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.353 3.746 -1.033 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.567 2.470 -0.235 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.589 1.623 -0.975 1.00 0.00 C ATOM 0 HA PRO A 71 -12.488 4.381 -2.760 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.292 3.978 -1.122 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.825 4.597 -0.543 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.629 1.927 -0.125 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.920 2.703 0.770 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.197 0.629 -1.192 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.493 1.486 -0.382 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.510 4.237 -4.164 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.522 4.095 -5.221 1.00 0.00 C ATOM 1143 C ALA A 72 -8.413 5.130 -5.018 1.00 0.00 C ATOM 1144 O ALA A 72 -8.494 6.242 -5.537 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.207 4.233 -6.582 1.00 0.00 C ATOM 0 H ALA A 72 -10.835 5.191 -4.009 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.062 3.108 -5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.466 4.127 -7.375 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.966 3.458 -6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.678 5.213 -6.655 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.402 4.726 -4.263 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.278 5.604 -3.986 1.00 0.00 C ATOM 1153 C PHE A 73 -5.324 5.667 -5.180 1.00 0.00 C ATOM 1154 O PHE A 73 -4.857 6.743 -5.550 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.535 5.014 -2.785 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.450 4.369 -1.743 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.092 5.145 -0.828 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.622 3.020 -1.730 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -7.941 4.547 0.140 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.472 2.422 -0.762 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.113 3.198 0.153 1.00 0.00 C ATOM 0 H PHE A 73 -7.338 3.803 -3.835 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.635 6.614 -3.787 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.824 4.268 -3.141 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.955 5.803 -2.306 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -6.956 6.216 -0.838 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.112 2.404 -2.456 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.450 5.163 0.866 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.609 1.351 -0.752 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.758 2.743 0.890 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.063 4.500 -5.751 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.173 4.409 -6.896 1.00 0.00 C ATOM 1173 C ASP A 74 -3.021 5.400 -6.720 1.00 0.00 C ATOM 1174 O ASP A 74 -2.630 6.077 -7.670 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.906 4.761 -8.192 1.00 0.00 C ATOM 1176 CG ASP A 74 -5.429 6.197 -8.270 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -6.523 6.433 -7.712 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -4.724 7.025 -8.885 1.00 0.00 O ATOM 0 H ASP A 74 -5.452 3.609 -5.442 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.804 3.385 -6.957 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.232 4.590 -9.031 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.746 4.077 -8.314 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.509 5.453 -5.499 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.409 6.349 -5.188 1.00 0.00 C ATOM 1185 C GLU A 75 -0.069 5.648 -5.423 1.00 0.00 C ATOM 1186 O GLU A 75 -0.035 4.480 -5.807 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.512 6.865 -3.751 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.157 8.252 -3.711 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.197 9.286 -3.120 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.368 8.875 -2.279 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -1.314 10.464 -3.521 1.00 0.00 O ATOM 0 H GLU A 75 -2.836 4.890 -4.714 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.468 7.210 -5.854 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.100 6.169 -3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.519 6.909 -3.305 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.445 8.552 -4.718 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.069 8.216 -3.116 1.00 0.00 H new ATOM 1198 N THR A 76 1.001 6.391 -5.183 1.00 0.00 N ATOM 1199 CA THR A 76 2.340 5.855 -5.365 1.00 0.00 C ATOM 1200 C THR A 76 3.329 6.565 -4.438 1.00 0.00 C ATOM 1201 O THR A 76 3.408 7.793 -4.433 1.00 0.00 O ATOM 1202 CB THR A 76 2.701 5.976 -6.846 1.00 0.00 C ATOM 1203 OG1 THR A 76 2.010 4.892 -7.462 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.177 5.678 -7.116 1.00 0.00 C ATOM 0 H THR A 76 0.969 7.359 -4.864 1.00 0.00 H new ATOM 0 HA THR A 76 2.385 4.801 -5.090 1.00 0.00 H new ATOM 0 HB THR A 76 2.464 6.981 -7.196 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.583 5.203 -8.287 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.379 5.778 -8.182 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.798 6.382 -6.561 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.407 4.661 -6.797 1.00 0.00 H new ATOM 1212 N PHE A 77 4.058 5.763 -3.677 1.00 0.00 N ATOM 1213 CA PHE A 77 5.039 6.300 -2.749 1.00 0.00 C ATOM 1214 C PHE A 77 6.453 5.851 -3.125 1.00 0.00 C ATOM 1215 O PHE A 77 6.739 4.656 -3.163 1.00 0.00 O ATOM 1216 CB PHE A 77 4.693 5.748 -1.364 1.00 0.00 C ATOM 1217 CG PHE A 77 3.250 6.014 -0.931 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.887 7.252 -0.500 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.331 5.013 -0.977 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.547 7.499 -0.098 1.00 0.00 C ATOM 1221 CE2 PHE A 77 0.991 5.260 -0.575 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.628 6.498 -0.144 1.00 0.00 C ATOM 0 H PHE A 77 3.989 4.745 -3.684 1.00 0.00 H new ATOM 0 HA PHE A 77 5.015 7.390 -2.771 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.871 4.673 -1.358 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.369 6.187 -0.630 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.617 8.047 -0.463 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.620 4.030 -1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.258 8.482 0.244 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.261 4.465 -0.612 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.391 6.686 0.162 1.00 0.00 H new ATOM 1232 N THR A 78 7.299 6.835 -3.393 1.00 0.00 N ATOM 1233 CA THR A 78 8.676 6.557 -3.764 1.00 0.00 C ATOM 1234 C THR A 78 9.591 6.669 -2.544 1.00 0.00 C ATOM 1235 O THR A 78 9.399 7.542 -1.698 1.00 0.00 O ATOM 1236 CB THR A 78 9.060 7.506 -4.901 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.688 6.801 -6.083 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.574 7.680 -5.033 1.00 0.00 C ATOM 0 H THR A 78 7.057 7.825 -3.361 1.00 0.00 H new ATOM 0 HA THR A 78 8.790 5.534 -4.122 1.00 0.00 H new ATOM 0 HB THR A 78 8.596 8.478 -4.734 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.901 7.346 -6.869 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.792 8.363 -5.854 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.976 8.088 -4.106 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.035 6.713 -5.233 1.00 0.00 H new ATOM 1246 N PHE A 79 10.566 5.774 -2.490 1.00 0.00 N ATOM 1247 CA PHE A 79 11.512 5.762 -1.387 1.00 0.00 C ATOM 1248 C PHE A 79 12.943 5.570 -1.893 1.00 0.00 C ATOM 1249 O PHE A 79 13.246 4.571 -2.544 1.00 0.00 O ATOM 1250 CB PHE A 79 11.138 4.580 -0.490 1.00 0.00 C ATOM 1251 CG PHE A 79 9.685 4.599 -0.010 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.294 5.494 0.937 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.786 3.722 -0.529 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.946 5.511 1.383 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.437 3.739 -0.083 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.046 4.633 0.864 1.00 0.00 C ATOM 0 H PHE A 79 10.722 5.051 -3.193 1.00 0.00 H new ATOM 0 HA PHE A 79 11.469 6.710 -0.850 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.318 3.653 -1.034 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.797 4.573 0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 79 10.008 6.191 1.349 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.097 3.012 -1.281 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.635 6.221 2.135 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.723 3.042 -0.496 1.00 0.00 H new ATOM 0 HZ PHE A 79 6.021 4.646 1.204 1.00 0.00 H new ATOM 1266 N TYR A 80 13.784 6.542 -1.575 1.00 0.00 N ATOM 1267 CA TYR A 80 15.176 6.493 -1.990 1.00 0.00 C ATOM 1268 C TYR A 80 16.078 6.062 -0.831 1.00 0.00 C ATOM 1269 O TYR A 80 15.978 6.598 0.271 1.00 0.00 O ATOM 1270 CB TYR A 80 15.544 7.919 -2.403 1.00 0.00 C ATOM 1271 CG TYR A 80 14.634 8.509 -3.482 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.857 8.213 -4.811 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.588 9.337 -3.126 1.00 0.00 C ATOM 1274 CE1 TYR A 80 14.000 8.767 -5.827 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.731 9.892 -4.142 1.00 0.00 C ATOM 1276 CZ TYR A 80 12.980 9.579 -5.442 1.00 0.00 C ATOM 1277 OH TYR A 80 12.170 10.103 -6.401 1.00 0.00 O ATOM 0 H TYR A 80 13.529 7.369 -1.035 1.00 0.00 H new ATOM 0 HA TYR A 80 15.310 5.776 -2.800 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.510 8.561 -1.523 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.572 7.928 -2.765 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.675 7.565 -5.090 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.412 9.569 -2.086 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.164 8.543 -6.871 1.00 0.00 H new ATOM 0 HE2 TYR A 80 11.910 10.542 -3.878 1.00 0.00 H new ATOM 0 HH TYR A 80 11.484 10.663 -5.980 1.00 0.00 H new ATOM 1287 N GLY A 81 16.939 5.097 -1.121 1.00 0.00 N ATOM 1288 CA GLY A 81 17.858 4.588 -0.117 1.00 0.00 C ATOM 1289 C GLY A 81 17.939 3.061 -0.172 1.00 0.00 C ATOM 1290 O GLY A 81 19.027 2.491 -0.119 1.00 0.00 O ATOM 0 H GLY A 81 17.019 4.655 -2.037 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.849 5.014 -0.276 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.531 4.903 0.874 1.00 0.00 H new ATOM 1294 N ILE A 82 16.772 2.442 -0.278 1.00 0.00 N ATOM 1295 CA ILE A 82 16.697 0.992 -0.341 1.00 0.00 C ATOM 1296 C ILE A 82 17.777 0.470 -1.291 1.00 0.00 C ATOM 1297 O ILE A 82 17.764 0.780 -2.481 1.00 0.00 O ATOM 1298 CB ILE A 82 15.282 0.544 -0.714 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.249 1.136 0.248 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.191 -0.981 -0.785 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.554 2.349 -0.373 1.00 0.00 C ATOM 0 H ILE A 82 15.871 2.918 -0.322 1.00 0.00 H new ATOM 0 HA ILE A 82 16.896 0.558 0.639 1.00 0.00 H new ATOM 0 HB ILE A 82 15.053 0.927 -1.709 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.508 0.378 0.503 1.00 0.00 H new ATOM 0 HG13 ILE A 82 14.738 1.429 1.177 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.175 -1.273 -1.052 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.885 -1.352 -1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.448 -1.406 0.185 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.825 2.751 0.331 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.295 3.114 -0.604 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.046 2.048 -1.289 1.00 0.00 H new ATOM 1313 N PRO A 83 18.711 -0.333 -0.714 1.00 0.00 N ATOM 1314 CA PRO A 83 19.796 -0.900 -1.496 1.00 0.00 C ATOM 1315 C PRO A 83 19.297 -2.051 -2.373 1.00 0.00 C ATOM 1316 O PRO A 83 20.092 -2.838 -2.883 1.00 0.00 O ATOM 1317 CB PRO A 83 20.831 -1.339 -0.473 1.00 0.00 C ATOM 1318 CG PRO A 83 20.094 -1.427 0.853 1.00 0.00 C ATOM 1319 CD PRO A 83 18.758 -0.721 0.692 1.00 0.00 C ATOM 0 HA PRO A 83 20.227 -0.185 -2.197 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.264 -2.302 -0.744 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.652 -0.625 -0.417 1.00 0.00 H new ATOM 0 HG2 PRO A 83 19.943 -2.468 1.138 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.679 -0.961 1.646 1.00 0.00 H new ATOM 0 HD2 PRO A 83 17.929 -1.380 0.949 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.688 0.149 1.345 1.00 0.00 H new ATOM 1327 N TYR A 84 17.981 -2.112 -2.521 1.00 0.00 N ATOM 1328 CA TYR A 84 17.367 -3.154 -3.326 1.00 0.00 C ATOM 1329 C TYR A 84 17.520 -4.523 -2.662 1.00 0.00 C ATOM 1330 O TYR A 84 16.530 -5.207 -2.405 1.00 0.00 O ATOM 1331 CB TYR A 84 18.122 -3.158 -4.657 1.00 0.00 C ATOM 1332 CG TYR A 84 17.458 -4.003 -5.746 1.00 0.00 C ATOM 1333 CD1 TYR A 84 16.162 -3.733 -6.134 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.156 -5.035 -6.341 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.537 -4.528 -7.160 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.531 -5.829 -7.366 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.252 -5.537 -7.725 1.00 0.00 C ATOM 1338 OH TYR A 84 15.662 -6.288 -8.694 1.00 0.00 O ATOM 0 H TYR A 84 17.324 -1.457 -2.097 1.00 0.00 H new ATOM 0 HA TYR A 84 16.301 -2.964 -3.450 1.00 0.00 H new ATOM 0 HB2 TYR A 84 18.215 -2.132 -5.013 1.00 0.00 H new ATOM 0 HB3 TYR A 84 19.133 -3.530 -4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.616 -2.926 -5.669 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.171 -5.246 -6.037 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.523 -4.327 -7.473 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.066 -6.639 -7.840 1.00 0.00 H new ATOM 0 HH TYR A 84 16.316 -6.490 -9.395 1.00 0.00 H new ATOM 1348 N THR A 85 18.768 -4.884 -2.402 1.00 0.00 N ATOM 1349 CA THR A 85 19.063 -6.159 -1.773 1.00 0.00 C ATOM 1350 C THR A 85 18.335 -6.274 -0.432 1.00 0.00 C ATOM 1351 O THR A 85 18.206 -7.367 0.117 1.00 0.00 O ATOM 1352 CB THR A 85 20.583 -6.286 -1.651 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.966 -5.150 -0.881 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.296 -6.086 -2.990 1.00 0.00 C ATOM 0 H THR A 85 19.587 -4.315 -2.616 1.00 0.00 H new ATOM 0 HA THR A 85 18.700 -6.991 -2.377 1.00 0.00 H new ATOM 0 HB THR A 85 20.834 -7.267 -1.249 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.938 -5.154 -0.753 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.372 -6.186 -2.848 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.952 -6.837 -3.701 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.072 -5.092 -3.376 1.00 0.00 H new ATOM 1362 N GLN A 86 17.878 -5.130 0.056 1.00 0.00 N ATOM 1363 CA GLN A 86 17.166 -5.088 1.322 1.00 0.00 C ATOM 1364 C GLN A 86 15.667 -5.295 1.095 1.00 0.00 C ATOM 1365 O GLN A 86 14.914 -5.501 2.046 1.00 0.00 O ATOM 1366 CB GLN A 86 17.432 -3.773 2.057 1.00 0.00 C ATOM 1367 CG GLN A 86 17.067 -3.889 3.538 1.00 0.00 C ATOM 1368 CD GLN A 86 18.200 -3.367 4.425 1.00 0.00 C ATOM 1369 OE1 GLN A 86 19.315 -3.861 4.406 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.852 -2.343 5.199 1.00 0.00 N ATOM 0 H GLN A 86 17.987 -4.225 -0.402 1.00 0.00 H new ATOM 0 HA GLN A 86 17.534 -5.899 1.951 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.483 -3.503 1.958 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.853 -2.972 1.598 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.156 -3.325 3.737 1.00 0.00 H new ATOM 0 HG3 GLN A 86 16.858 -4.930 3.784 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.900 -1.978 5.165 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.537 -1.922 5.827 1.00 0.00 H new ATOM 1379 N ILE A 87 15.278 -5.234 -0.170 1.00 0.00 N ATOM 1380 CA ILE A 87 13.883 -5.413 -0.534 1.00 0.00 C ATOM 1381 C ILE A 87 13.391 -6.761 -0.004 1.00 0.00 C ATOM 1382 O ILE A 87 12.378 -6.827 0.691 1.00 0.00 O ATOM 1383 CB ILE A 87 13.696 -5.240 -2.043 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.202 -3.872 -2.505 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.239 -5.478 -2.446 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.162 -2.783 -2.236 1.00 0.00 C ATOM 0 H ILE A 87 15.905 -5.063 -0.956 1.00 0.00 H new ATOM 0 HA ILE A 87 13.267 -4.643 -0.070 1.00 0.00 H new ATOM 0 HB ILE A 87 14.298 -5.994 -2.550 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.130 -3.630 -1.987 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.431 -3.906 -3.570 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.134 -5.349 -3.523 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.947 -6.492 -2.172 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.597 -4.763 -1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.547 -1.821 -2.574 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.244 -3.016 -2.775 1.00 0.00 H new ATOM 0 HD13 ILE A 87 12.953 -2.735 -1.167 1.00 0.00 H new ATOM 1398 N GLN A 88 14.130 -7.804 -0.353 1.00 0.00 N ATOM 1399 CA GLN A 88 13.782 -9.147 0.080 1.00 0.00 C ATOM 1400 C GLN A 88 13.532 -9.171 1.589 1.00 0.00 C ATOM 1401 O GLN A 88 12.816 -10.037 2.089 1.00 0.00 O ATOM 1402 CB GLN A 88 14.871 -10.148 -0.312 1.00 0.00 C ATOM 1403 CG GLN A 88 15.082 -10.164 -1.827 1.00 0.00 C ATOM 1404 CD GLN A 88 16.543 -10.459 -2.173 1.00 0.00 C ATOM 1405 OE1 GLN A 88 17.125 -11.440 -1.739 1.00 0.00 O ATOM 1406 NE2 GLN A 88 17.101 -9.559 -2.978 1.00 0.00 N ATOM 0 H GLN A 88 14.969 -7.746 -0.931 1.00 0.00 H new ATOM 0 HA GLN A 88 12.863 -9.444 -0.425 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.805 -9.888 0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.594 -11.145 0.031 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.438 -10.918 -2.280 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.792 -9.202 -2.249 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.557 -8.761 -3.305 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.073 -9.667 -3.268 1.00 0.00 H new ATOM 1415 N GLU A 89 14.136 -8.209 2.272 1.00 0.00 N ATOM 1416 CA GLU A 89 13.987 -8.109 3.714 1.00 0.00 C ATOM 1417 C GLU A 89 12.819 -7.185 4.064 1.00 0.00 C ATOM 1418 O GLU A 89 12.232 -7.301 5.139 1.00 0.00 O ATOM 1419 CB GLU A 89 15.284 -7.625 4.366 1.00 0.00 C ATOM 1420 CG GLU A 89 16.263 -8.784 4.565 1.00 0.00 C ATOM 1421 CD GLU A 89 16.163 -9.349 5.984 1.00 0.00 C ATOM 1422 OE1 GLU A 89 15.018 -9.620 6.407 1.00 0.00 O ATOM 1423 OE2 GLU A 89 17.233 -9.496 6.613 1.00 0.00 O ATOM 0 H GLU A 89 14.729 -7.492 1.854 1.00 0.00 H new ATOM 0 HA GLU A 89 13.769 -9.102 4.108 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.744 -6.858 3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.061 -7.163 5.328 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.053 -9.571 3.841 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.281 -8.442 4.377 1.00 0.00 H new ATOM 1430 N LEU A 90 12.517 -6.288 3.137 1.00 0.00 N ATOM 1431 CA LEU A 90 11.430 -5.345 3.334 1.00 0.00 C ATOM 1432 C LEU A 90 10.101 -6.102 3.359 1.00 0.00 C ATOM 1433 O LEU A 90 10.080 -7.329 3.272 1.00 0.00 O ATOM 1434 CB LEU A 90 11.485 -4.235 2.282 1.00 0.00 C ATOM 1435 CG LEU A 90 12.284 -2.987 2.665 1.00 0.00 C ATOM 1436 CD1 LEU A 90 13.272 -3.293 3.792 1.00 0.00 C ATOM 1437 CD2 LEU A 90 12.978 -2.384 1.442 1.00 0.00 C ATOM 0 H LEU A 90 13.007 -6.194 2.247 1.00 0.00 H new ATOM 0 HA LEU A 90 11.531 -4.845 4.297 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.911 -4.649 1.368 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.464 -3.931 2.049 1.00 0.00 H new ATOM 0 HG LEU A 90 11.588 -2.238 3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.827 -2.389 4.045 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.727 -3.641 4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 90 13.967 -4.066 3.466 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.539 -1.499 1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 90 13.660 -3.117 1.012 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.230 -2.106 0.700 1.00 0.00 H new ATOM 1449 N ALA A 91 9.024 -5.340 3.478 1.00 0.00 N ATOM 1450 CA ALA A 91 7.694 -5.924 3.515 1.00 0.00 C ATOM 1451 C ALA A 91 6.656 -4.810 3.666 1.00 0.00 C ATOM 1452 O ALA A 91 6.797 -3.937 4.521 1.00 0.00 O ATOM 1453 CB ALA A 91 7.618 -6.950 4.648 1.00 0.00 C ATOM 0 H ALA A 91 9.045 -4.323 3.550 1.00 0.00 H new ATOM 0 HA ALA A 91 7.480 -6.450 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.620 -7.388 4.676 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.355 -7.735 4.478 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.825 -6.458 5.599 1.00 0.00 H new ATOM 1459 N LEU A 92 5.636 -4.877 2.823 1.00 0.00 N ATOM 1460 CA LEU A 92 4.575 -3.885 2.852 1.00 0.00 C ATOM 1461 C LEU A 92 3.432 -4.393 3.732 1.00 0.00 C ATOM 1462 O LEU A 92 3.002 -5.538 3.598 1.00 0.00 O ATOM 1463 CB LEU A 92 4.142 -3.521 1.430 1.00 0.00 C ATOM 1464 CG LEU A 92 5.260 -3.088 0.479 1.00 0.00 C ATOM 1465 CD1 LEU A 92 6.399 -2.410 1.243 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.755 -4.269 -0.359 1.00 0.00 C ATOM 0 H LEU A 92 5.522 -5.603 2.116 1.00 0.00 H new ATOM 0 HA LEU A 92 4.933 -2.957 3.298 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.634 -4.382 0.994 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.410 -2.716 1.489 1.00 0.00 H new ATOM 0 HG LEU A 92 4.853 -2.350 -0.213 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.180 -2.112 0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.018 -1.528 1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.812 -3.106 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.549 -3.934 -1.026 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.139 -5.047 0.300 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.930 -4.668 -0.949 1.00 0.00 H new ATOM 1478 N HIS A 93 2.971 -3.517 4.613 1.00 0.00 N ATOM 1479 CA HIS A 93 1.886 -3.863 5.515 1.00 0.00 C ATOM 1480 C HIS A 93 0.665 -2.993 5.207 1.00 0.00 C ATOM 1481 O HIS A 93 0.635 -1.814 5.556 1.00 0.00 O ATOM 1482 CB HIS A 93 2.336 -3.757 6.974 1.00 0.00 C ATOM 1483 CG HIS A 93 1.303 -4.222 7.971 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.738 -5.449 8.162 1.00 0.00 N flip ATOM 1485 CD2 HIS A 93 0.739 -3.381 8.914 1.00 0.00 C flip ATOM 1486 CE1 HIS A 93 -0.124 -5.362 9.168 1.00 0.00 C flip ATOM 1487 NE2 HIS A 93 -0.125 -4.081 9.635 1.00 0.00 N flip ATOM 0 H HIS A 93 3.329 -2.568 4.721 1.00 0.00 H new ATOM 0 HA HIS A 93 1.597 -4.903 5.359 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.244 -4.345 7.107 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.593 -2.720 7.190 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.965 -2.332 9.041 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.725 -6.172 9.553 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.691 -3.724 10.404 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.311 -3.609 4.556 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.530 -2.906 4.196 1.00 0.00 C ATOM 1497 C PHE A 94 -2.641 -3.180 5.212 1.00 0.00 C ATOM 1498 O PHE A 94 -3.132 -4.303 5.314 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.965 -3.436 2.828 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.911 -3.268 1.732 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.381 -2.041 1.480 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.504 -4.346 1.010 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.597 -1.885 0.463 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.475 -4.190 -0.008 1.00 0.00 C ATOM 1505 CZ PHE A 94 1.004 -2.962 -0.260 1.00 0.00 C ATOM 0 H PHE A 94 -0.282 -4.587 4.269 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.348 -1.831 4.177 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.212 -4.494 2.921 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.876 -2.921 2.523 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.704 -1.185 2.054 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.925 -5.320 1.210 1.00 0.00 H new ATOM 0 HE1 PHE A 94 1.018 -0.911 0.264 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.799 -5.046 -0.582 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.747 -2.843 -1.034 1.00 0.00 H new ATOM 1515 N THR A 95 -3.004 -2.134 5.940 1.00 0.00 N ATOM 1516 CA THR A 95 -4.048 -2.247 6.945 1.00 0.00 C ATOM 1517 C THR A 95 -5.318 -1.534 6.477 1.00 0.00 C ATOM 1518 O THR A 95 -5.294 -0.338 6.193 1.00 0.00 O ATOM 1519 CB THR A 95 -3.496 -1.702 8.263 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.305 -2.454 8.478 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.381 -2.056 9.460 1.00 0.00 C ATOM 0 H THR A 95 -2.594 -1.204 5.854 1.00 0.00 H new ATOM 0 HA THR A 95 -4.336 -3.287 7.102 1.00 0.00 H new ATOM 0 HB THR A 95 -3.396 -0.619 8.194 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.257 -2.730 9.417 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.944 -1.645 10.370 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.376 -1.636 9.314 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.455 -3.140 9.550 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.398 -2.300 6.411 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.676 -1.756 5.983 1.00 0.00 C ATOM 1531 C ILE A 96 -8.440 -1.240 7.204 1.00 0.00 C ATOM 1532 O ILE A 96 -9.160 -1.996 7.855 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.450 -2.791 5.165 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.655 -3.220 3.930 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.842 -2.270 4.798 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.805 -4.456 4.227 1.00 0.00 C ATOM 0 H ILE A 96 -6.414 -3.292 6.647 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.526 -0.905 5.318 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.590 -3.679 5.782 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.339 -3.434 3.109 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.012 -2.402 3.605 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.371 -3.025 4.217 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.402 -2.055 5.708 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.745 -1.359 4.207 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.250 -4.740 3.333 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -6.105 -4.231 5.032 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.453 -5.279 4.528 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.257 0.043 7.477 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.921 0.669 8.608 1.00 0.00 C ATOM 1550 C LEU A 97 -10.220 1.325 8.133 1.00 0.00 C ATOM 1551 O LEU A 97 -10.680 1.065 7.022 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.971 1.634 9.320 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.658 1.031 9.824 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.526 1.268 8.823 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.310 1.561 11.217 1.00 0.00 C ATOM 0 H LEU A 97 -7.659 0.666 6.935 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.194 -0.080 9.351 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.735 2.450 8.637 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.497 2.071 10.169 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.790 -0.047 9.913 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.604 0.830 9.206 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.780 0.804 7.870 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.386 2.339 8.679 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.373 1.117 11.552 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.204 2.645 11.178 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.105 1.299 11.915 1.00 0.00 H new ATOM 1567 N SER A 98 -10.773 2.162 8.998 1.00 0.00 N ATOM 1568 CA SER A 98 -12.010 2.856 8.680 1.00 0.00 C ATOM 1569 C SER A 98 -12.118 4.137 9.509 1.00 0.00 C ATOM 1570 O SER A 98 -12.131 4.087 10.738 1.00 0.00 O ATOM 1571 CB SER A 98 -13.224 1.959 8.928 1.00 0.00 C ATOM 1572 OG SER A 98 -14.419 2.518 8.389 1.00 0.00 O ATOM 0 H SER A 98 -10.388 2.375 9.918 1.00 0.00 H new ATOM 0 HA SER A 98 -11.995 3.116 7.621 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.049 0.980 8.482 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.347 1.804 10.000 1.00 0.00 H new ATOM 0 HG SER A 98 -14.761 3.206 8.997 1.00 0.00 H new ATOM 1578 N PHE A 99 -12.192 5.256 8.804 1.00 0.00 N ATOM 1579 CA PHE A 99 -12.299 6.549 9.459 1.00 0.00 C ATOM 1580 C PHE A 99 -13.762 6.912 9.721 1.00 0.00 C ATOM 1581 O PHE A 99 -14.619 6.708 8.863 1.00 0.00 O ATOM 1582 CB PHE A 99 -11.691 7.583 8.510 1.00 0.00 C ATOM 1583 CG PHE A 99 -11.574 8.986 9.110 1.00 0.00 C ATOM 1584 CD1 PHE A 99 -12.694 9.721 9.343 1.00 0.00 C ATOM 1585 CD2 PHE A 99 -10.350 9.497 9.410 1.00 0.00 C ATOM 1586 CE1 PHE A 99 -12.586 11.023 9.900 1.00 0.00 C ATOM 1587 CE2 PHE A 99 -10.241 10.799 9.967 1.00 0.00 C ATOM 1588 CZ PHE A 99 -11.361 11.534 10.200 1.00 0.00 C ATOM 0 H PHE A 99 -12.180 5.294 7.785 1.00 0.00 H new ATOM 0 HA PHE A 99 -11.782 6.524 10.418 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.700 7.245 8.207 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -12.300 7.635 7.607 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.666 9.315 9.104 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.461 8.913 9.225 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -13.475 11.607 10.085 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.269 11.205 10.205 1.00 0.00 H new ATOM 0 HZ PHE A 99 -11.278 12.524 10.623 1.00 0.00 H new ATOM 1598 N ASP A 100 -14.003 7.443 10.911 1.00 0.00 N ATOM 1599 CA ASP A 100 -15.347 7.836 11.296 1.00 0.00 C ATOM 1600 C ASP A 100 -15.287 8.630 12.603 1.00 0.00 C ATOM 1601 O ASP A 100 -15.643 8.117 13.662 1.00 0.00 O ATOM 1602 CB ASP A 100 -16.234 6.612 11.528 1.00 0.00 C ATOM 1603 CG ASP A 100 -16.623 5.846 10.262 1.00 0.00 C ATOM 1604 OD1 ASP A 100 -17.640 6.240 9.650 1.00 0.00 O ATOM 1605 OD2 ASP A 100 -15.895 4.885 9.933 1.00 0.00 O ATOM 0 H ASP A 100 -13.290 7.610 11.621 1.00 0.00 H new ATOM 0 HA ASP A 100 -15.766 8.437 10.489 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -15.717 5.930 12.203 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -17.144 6.932 12.035 1.00 0.00 H new ATOM 1610 N ARG A 101 -14.832 9.869 12.485 1.00 0.00 N ATOM 1611 CA ARG A 101 -14.721 10.739 13.643 1.00 0.00 C ATOM 1612 C ARG A 101 -14.187 9.956 14.845 1.00 0.00 C ATOM 1613 O ARG A 101 -14.963 9.425 15.638 1.00 0.00 O ATOM 1614 CB ARG A 101 -16.075 11.353 14.004 1.00 0.00 C ATOM 1615 CG ARG A 101 -16.091 12.855 13.713 1.00 0.00 C ATOM 1616 CD ARG A 101 -15.232 13.619 14.723 1.00 0.00 C ATOM 1617 NE ARG A 101 -15.398 15.076 14.529 1.00 0.00 N ATOM 1618 CZ ARG A 101 -16.454 15.776 14.966 1.00 0.00 C ATOM 1619 NH1 ARG A 101 -17.444 15.156 15.623 1.00 0.00 N ATOM 1620 NH2 ARG A 101 -16.521 17.096 14.745 1.00 0.00 N ATOM 0 H ARG A 101 -14.536 10.291 11.605 1.00 0.00 H new ATOM 0 HA ARG A 101 -14.028 11.541 13.390 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -16.865 10.861 13.436 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -16.286 11.181 15.059 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -15.721 13.037 12.704 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -17.116 13.225 13.748 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.519 13.344 15.738 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.184 13.345 14.602 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.663 15.579 14.032 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.394 14.151 15.791 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.248 15.689 15.955 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -15.768 17.568 14.244 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.325 17.629 15.078 1.00 0.00 H new ATOM 1634 N PHE A 102 -12.867 9.910 14.942 1.00 0.00 N ATOM 1635 CA PHE A 102 -12.221 9.201 16.033 1.00 0.00 C ATOM 1636 C PHE A 102 -12.959 7.901 16.356 1.00 0.00 C ATOM 1637 O PHE A 102 -13.560 7.772 17.422 1.00 0.00 O ATOM 1638 CB PHE A 102 -12.272 10.120 17.256 1.00 0.00 C ATOM 1639 CG PHE A 102 -11.973 11.588 16.944 1.00 0.00 C ATOM 1640 CD1 PHE A 102 -10.685 12.022 16.887 1.00 0.00 C ATOM 1641 CD2 PHE A 102 -12.995 12.458 16.725 1.00 0.00 C ATOM 1642 CE1 PHE A 102 -10.408 13.384 16.598 1.00 0.00 C ATOM 1643 CE2 PHE A 102 -12.717 13.821 16.435 1.00 0.00 C ATOM 1644 CZ PHE A 102 -11.429 14.255 16.378 1.00 0.00 C ATOM 0 H PHE A 102 -12.227 10.352 14.283 1.00 0.00 H new ATOM 0 HA PHE A 102 -11.198 8.947 15.757 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -13.261 10.050 17.710 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -11.556 9.763 17.996 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -9.874 11.331 17.061 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -14.017 12.113 16.771 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -9.386 13.729 16.553 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -13.528 14.512 16.260 1.00 0.00 H new ATOM 0 HZ PHE A 102 -11.217 15.291 16.158 1.00 0.00 H new ATOM 1654 N SER A 103 -12.891 6.970 15.416 1.00 0.00 N ATOM 1655 CA SER A 103 -13.546 5.684 15.587 1.00 0.00 C ATOM 1656 C SER A 103 -12.584 4.689 16.238 1.00 0.00 C ATOM 1657 O SER A 103 -12.771 3.478 16.130 1.00 0.00 O ATOM 1658 CB SER A 103 -14.048 5.139 14.248 1.00 0.00 C ATOM 1659 OG SER A 103 -15.467 5.015 14.220 1.00 0.00 O ATOM 0 H SER A 103 -12.392 7.080 14.533 1.00 0.00 H new ATOM 0 HA SER A 103 -14.409 5.824 16.238 1.00 0.00 H new ATOM 0 HB2 SER A 103 -13.726 5.801 13.444 1.00 0.00 H new ATOM 0 HB3 SER A 103 -13.595 4.165 14.060 1.00 0.00 H new ATOM 0 HG SER A 103 -15.724 4.354 13.544 1.00 0.00 H new ATOM 1665 N ARG A 104 -11.574 5.237 16.899 1.00 0.00 N ATOM 1666 CA ARG A 104 -10.582 4.412 17.567 1.00 0.00 C ATOM 1667 C ARG A 104 -9.955 3.429 16.577 1.00 0.00 C ATOM 1668 O ARG A 104 -9.734 2.265 16.907 1.00 0.00 O ATOM 1669 CB ARG A 104 -11.205 3.631 18.725 1.00 0.00 C ATOM 1670 CG ARG A 104 -11.830 4.577 19.752 1.00 0.00 C ATOM 1671 CD ARG A 104 -10.989 4.633 21.029 1.00 0.00 C ATOM 1672 NE ARG A 104 -11.070 5.983 21.630 1.00 0.00 N ATOM 1673 CZ ARG A 104 -10.150 6.492 22.460 1.00 0.00 C ATOM 1674 NH1 ARG A 104 -9.074 5.767 22.794 1.00 0.00 N ATOM 1675 NH2 ARG A 104 -10.306 7.727 22.957 1.00 0.00 N ATOM 0 H ARG A 104 -11.422 6.242 16.986 1.00 0.00 H new ATOM 0 HA ARG A 104 -9.812 5.075 17.963 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -11.966 2.951 18.342 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -10.443 3.018 19.206 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.917 5.576 19.326 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.840 4.244 19.992 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -11.343 3.887 21.741 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -9.951 4.389 20.802 1.00 0.00 H new ATOM 0 HE ARG A 104 -11.877 6.562 21.398 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -8.955 4.827 22.416 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -8.374 6.155 23.426 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -11.125 8.279 22.703 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -9.606 8.115 23.589 1.00 0.00 H new ATOM 1689 N ASP A 105 -9.685 3.934 15.382 1.00 0.00 N ATOM 1690 CA ASP A 105 -9.087 3.115 14.341 1.00 0.00 C ATOM 1691 C ASP A 105 -9.893 1.824 14.187 1.00 0.00 C ATOM 1692 O ASP A 105 -9.663 0.854 14.908 1.00 0.00 O ATOM 1693 CB ASP A 105 -7.649 2.734 14.698 1.00 0.00 C ATOM 1694 CG ASP A 105 -6.918 3.735 15.596 1.00 0.00 C ATOM 1695 OD1 ASP A 105 -6.729 4.880 15.132 1.00 0.00 O ATOM 1696 OD2 ASP A 105 -6.567 3.332 16.726 1.00 0.00 O ATOM 0 H ASP A 105 -9.869 4.900 15.112 1.00 0.00 H new ATOM 0 HA ASP A 105 -9.089 3.692 13.416 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.659 1.764 15.194 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -7.081 2.614 13.775 1.00 0.00 H new ATOM 1701 N ASP A 106 -10.823 1.854 13.244 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.665 0.698 12.987 1.00 0.00 C ATOM 1703 C ASP A 106 -10.984 -0.206 11.958 1.00 0.00 C ATOM 1704 O ASP A 106 -11.219 -0.074 10.758 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.022 1.121 12.420 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.161 1.175 13.440 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -13.955 0.637 14.549 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.212 1.753 13.087 1.00 0.00 O ATOM 0 H ASP A 106 -11.012 2.660 12.649 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.815 0.174 13.931 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.917 2.105 11.963 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.299 0.428 11.625 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.151 -1.103 12.465 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.434 -2.029 11.605 1.00 0.00 C ATOM 1715 C ILE A 107 -10.418 -3.044 11.021 1.00 0.00 C ATOM 1716 O ILE A 107 -11.135 -3.716 11.762 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.267 -2.668 12.360 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.097 -1.691 12.490 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.845 -3.984 11.705 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.091 -2.175 13.537 1.00 0.00 C ATOM 0 H ILE A 107 -9.957 -1.208 13.461 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.987 -1.498 10.764 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.602 -2.904 13.370 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.600 -1.583 11.526 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.471 -0.706 12.768 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.014 -4.417 12.261 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.685 -4.678 11.709 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.535 -3.796 10.677 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -5.270 -1.462 13.609 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.585 -2.259 14.505 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.701 -3.150 13.243 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.422 -3.124 9.698 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.307 -4.046 9.007 1.00 0.00 C ATOM 1734 C ILE A 108 -10.567 -5.360 8.750 1.00 0.00 C ATOM 1735 O ILE A 108 -11.124 -6.439 8.946 1.00 0.00 O ATOM 1736 CB ILE A 108 -11.870 -3.400 7.740 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.925 -2.346 8.084 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.411 -4.459 6.778 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.976 -1.252 7.016 1.00 0.00 C ATOM 0 H ILE A 108 -9.826 -2.565 9.087 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.171 -4.282 9.628 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.056 -2.886 7.228 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.903 -2.820 8.171 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.698 -1.902 9.053 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -12.805 -3.973 5.886 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.607 -5.139 6.496 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.207 -5.021 7.266 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.734 -0.516 7.285 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.004 -0.764 6.949 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.227 -1.696 6.052 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.323 -5.227 8.315 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.501 -6.390 8.029 1.00 0.00 C ATOM 1753 C GLY A 109 -7.028 -5.999 7.886 1.00 0.00 C ATOM 1754 O GLY A 109 -6.712 -4.835 7.647 1.00 0.00 O ATOM 0 H GLY A 109 -8.864 -4.331 8.154 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.610 -7.123 8.829 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.845 -6.866 7.111 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.167 -6.995 8.038 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.736 -6.770 7.928 1.00 0.00 C ATOM 1760 C GLU A 110 -4.173 -7.517 6.717 1.00 0.00 C ATOM 1761 O GLU A 110 -4.564 -8.650 6.445 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.016 -7.186 9.212 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.398 -6.270 10.377 1.00 0.00 C ATOM 1764 CD GLU A 110 -4.493 -7.057 11.685 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -3.416 -7.396 12.223 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -5.639 -7.303 12.118 1.00 0.00 O ATOM 0 H GLU A 110 -6.433 -7.959 8.236 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.565 -5.703 7.784 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.270 -8.217 9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.938 -7.151 9.056 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.657 -5.477 10.479 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.353 -5.789 10.168 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.262 -6.850 6.022 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.641 -7.436 4.847 1.00 0.00 C ATOM 1775 C VAL A 111 -1.131 -7.194 4.899 1.00 0.00 C ATOM 1776 O VAL A 111 -0.679 -6.186 5.440 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.293 -6.880 3.579 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.374 -7.056 2.368 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.656 -7.530 3.332 1.00 0.00 C ATOM 0 H VAL A 111 -2.940 -5.910 6.251 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.796 -8.515 4.830 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.454 -5.812 3.726 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.861 -6.653 1.480 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.438 -6.525 2.541 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.168 -8.116 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.097 -7.117 2.425 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.530 -8.607 3.216 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.313 -7.330 4.178 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.394 -8.135 4.328 1.00 0.00 N ATOM 1790 CA LEU A 112 1.056 -8.037 4.303 1.00 0.00 C ATOM 1791 C LEU A 112 1.589 -8.751 3.059 1.00 0.00 C ATOM 1792 O LEU A 112 1.060 -9.786 2.658 1.00 0.00 O ATOM 1793 CB LEU A 112 1.651 -8.557 5.613 1.00 0.00 C ATOM 1794 CG LEU A 112 3.179 -8.612 5.680 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.754 -7.289 6.191 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.648 -9.803 6.519 1.00 0.00 C ATOM 0 H LEU A 112 -0.773 -8.969 3.879 1.00 0.00 H new ATOM 0 HA LEU A 112 1.366 -6.995 4.231 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.294 -7.926 6.427 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.263 -9.560 5.793 1.00 0.00 H new ATOM 0 HG LEU A 112 3.560 -8.759 4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.841 -7.355 6.229 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.463 -6.482 5.519 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.368 -7.086 7.190 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.737 -9.819 6.551 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.257 -9.711 7.532 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.284 -10.728 6.072 1.00 0.00 H new ATOM 1808 N ILE A 113 2.632 -8.169 2.484 1.00 0.00 N ATOM 1809 CA ILE A 113 3.243 -8.737 1.294 1.00 0.00 C ATOM 1810 C ILE A 113 4.765 -8.624 1.404 1.00 0.00 C ATOM 1811 O ILE A 113 5.335 -7.573 1.119 1.00 0.00 O ATOM 1812 CB ILE A 113 2.668 -8.086 0.034 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.577 -9.096 -1.112 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.472 -6.845 -0.357 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.214 -9.789 -1.126 1.00 0.00 C ATOM 0 H ILE A 113 3.069 -7.311 2.820 1.00 0.00 H new ATOM 0 HA ILE A 113 3.006 -9.798 1.214 1.00 0.00 H new ATOM 0 HB ILE A 113 1.653 -7.755 0.253 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.740 -8.588 -2.063 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.366 -9.841 -1.009 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.043 -6.401 -1.255 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.441 -6.120 0.456 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.507 -7.128 -0.551 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.176 -10.501 -1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.064 -10.316 -0.184 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.428 -9.044 -1.254 1.00 0.00 H new ATOM 1827 N PRO A 114 5.395 -9.752 1.830 1.00 0.00 N ATOM 1828 CA PRO A 114 6.839 -9.790 1.982 1.00 0.00 C ATOM 1829 C PRO A 114 7.531 -9.876 0.620 1.00 0.00 C ATOM 1830 O PRO A 114 7.214 -10.747 -0.188 1.00 0.00 O ATOM 1831 CB PRO A 114 7.111 -10.998 2.863 1.00 0.00 C ATOM 1832 CG PRO A 114 5.859 -11.857 2.790 1.00 0.00 C ATOM 1833 CD PRO A 114 4.751 -11.016 2.177 1.00 0.00 C ATOM 0 HA PRO A 114 7.238 -8.884 2.438 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.984 -11.549 2.512 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.317 -10.694 3.889 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.041 -12.746 2.187 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.573 -12.199 3.784 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.327 -11.500 1.297 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.933 -10.864 2.881 1.00 0.00 H new ATOM 1841 N LEU A 115 8.465 -8.959 0.407 1.00 0.00 N ATOM 1842 CA LEU A 115 9.204 -8.920 -0.843 1.00 0.00 C ATOM 1843 C LEU A 115 10.344 -9.940 -0.788 1.00 0.00 C ATOM 1844 O LEU A 115 11.173 -9.999 -1.695 1.00 0.00 O ATOM 1845 CB LEU A 115 9.670 -7.495 -1.146 1.00 0.00 C ATOM 1846 CG LEU A 115 8.626 -6.393 -0.949 1.00 0.00 C ATOM 1847 CD1 LEU A 115 9.231 -5.012 -1.211 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.389 -6.649 -1.812 1.00 0.00 C ATOM 0 H LEU A 115 8.726 -8.238 1.079 1.00 0.00 H new ATOM 0 HA LEU A 115 8.560 -9.204 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.529 -7.272 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.017 -7.459 -2.179 1.00 0.00 H new ATOM 0 HG LEU A 115 8.302 -6.411 0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.469 -4.247 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.056 -4.839 -0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.600 -4.965 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.663 -5.852 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.677 -6.673 -2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.944 -7.605 -1.536 1.00 0.00 H new ATOM 1860 N SER A 116 10.347 -10.719 0.284 1.00 0.00 N ATOM 1861 CA SER A 116 11.371 -11.733 0.469 1.00 0.00 C ATOM 1862 C SER A 116 11.160 -12.877 -0.526 1.00 0.00 C ATOM 1863 O SER A 116 11.002 -14.030 -0.127 1.00 0.00 O ATOM 1864 CB SER A 116 11.364 -12.268 1.902 1.00 0.00 C ATOM 1865 OG SER A 116 12.683 -12.463 2.405 1.00 0.00 O ATOM 0 H SER A 116 9.657 -10.668 1.033 1.00 0.00 H new ATOM 0 HA SER A 116 12.343 -11.275 0.286 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.829 -11.571 2.547 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.820 -13.212 1.934 1.00 0.00 H new ATOM 0 HG SER A 116 13.082 -11.595 2.622 1.00 0.00 H new ATOM 1871 N GLY A 117 11.163 -12.518 -1.801 1.00 0.00 N ATOM 1872 CA GLY A 117 10.974 -13.500 -2.855 1.00 0.00 C ATOM 1873 C GLY A 117 10.548 -12.826 -4.162 1.00 0.00 C ATOM 1874 O GLY A 117 10.906 -13.285 -5.246 1.00 0.00 O ATOM 0 H GLY A 117 11.293 -11.561 -2.128 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.900 -14.053 -3.012 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.218 -14.224 -2.551 1.00 0.00 H new ATOM 1878 N ILE A 118 9.791 -11.749 -4.015 1.00 0.00 N ATOM 1879 CA ILE A 118 9.314 -11.007 -5.170 1.00 0.00 C ATOM 1880 C ILE A 118 10.496 -10.317 -5.853 1.00 0.00 C ATOM 1881 O ILE A 118 11.357 -9.748 -5.184 1.00 0.00 O ATOM 1882 CB ILE A 118 8.192 -10.049 -4.765 1.00 0.00 C ATOM 1883 CG1 ILE A 118 6.884 -10.806 -4.525 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.026 -8.931 -5.797 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.043 -10.867 -5.802 1.00 0.00 C ATOM 0 H ILE A 118 9.496 -11.372 -3.114 1.00 0.00 H new ATOM 0 HA ILE A 118 8.875 -11.684 -5.902 1.00 0.00 H new ATOM 0 HB ILE A 118 8.469 -9.578 -3.822 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.103 -11.817 -4.181 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.316 -10.316 -3.734 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.222 -8.264 -5.485 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.955 -8.367 -5.875 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.782 -9.364 -6.767 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.119 -11.410 -5.604 1.00 0.00 H new ATOM 0 HD12 ILE A 118 5.806 -9.855 -6.130 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.604 -11.379 -6.583 1.00 0.00 H new ATOM 1897 N GLU A 119 10.500 -10.390 -7.175 1.00 0.00 N ATOM 1898 CA GLU A 119 11.562 -9.778 -7.956 1.00 0.00 C ATOM 1899 C GLU A 119 10.982 -8.751 -8.930 1.00 0.00 C ATOM 1900 O GLU A 119 10.108 -9.076 -9.732 1.00 0.00 O ATOM 1901 CB GLU A 119 12.377 -10.839 -8.698 1.00 0.00 C ATOM 1902 CG GLU A 119 11.700 -11.229 -10.014 1.00 0.00 C ATOM 1903 CD GLU A 119 12.430 -12.396 -10.682 1.00 0.00 C ATOM 1904 OE1 GLU A 119 13.419 -12.114 -11.393 1.00 0.00 O ATOM 1905 OE2 GLU A 119 11.984 -13.543 -10.466 1.00 0.00 O ATOM 0 H GLU A 119 9.784 -10.864 -7.726 1.00 0.00 H new ATOM 0 HA GLU A 119 12.236 -9.260 -7.273 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.379 -10.459 -8.899 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.491 -11.721 -8.068 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.662 -11.505 -9.825 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.685 -10.372 -10.687 1.00 0.00 H new ATOM 1912 N LEU A 120 11.492 -7.533 -8.829 1.00 0.00 N ATOM 1913 CA LEU A 120 11.035 -6.456 -9.691 1.00 0.00 C ATOM 1914 C LEU A 120 12.120 -6.140 -10.723 1.00 0.00 C ATOM 1915 O LEU A 120 11.934 -5.276 -11.579 1.00 0.00 O ATOM 1916 CB LEU A 120 10.608 -5.246 -8.857 1.00 0.00 C ATOM 1917 CG LEU A 120 9.509 -5.499 -7.823 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.771 -4.708 -6.540 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.127 -5.200 -8.408 1.00 0.00 C ATOM 0 H LEU A 120 12.218 -7.268 -8.163 1.00 0.00 H new ATOM 0 HA LEU A 120 10.147 -6.761 -10.244 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.485 -4.859 -8.338 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.268 -4.464 -9.536 1.00 0.00 H new ATOM 0 HG LEU A 120 9.525 -6.556 -7.559 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.975 -4.906 -5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.728 -5.011 -6.114 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.797 -3.643 -6.768 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.364 -5.388 -7.653 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.081 -4.156 -8.718 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.950 -5.843 -9.270 1.00 0.00 H new ATOM 1931 N SER A 121 13.228 -6.857 -10.607 1.00 0.00 N ATOM 1932 CA SER A 121 14.343 -6.663 -11.519 1.00 0.00 C ATOM 1933 C SER A 121 13.824 -6.470 -12.946 1.00 0.00 C ATOM 1934 O SER A 121 14.385 -5.690 -13.714 1.00 0.00 O ATOM 1935 CB SER A 121 15.312 -7.845 -11.463 1.00 0.00 C ATOM 1936 OG SER A 121 16.672 -7.423 -11.516 1.00 0.00 O ATOM 0 H SER A 121 13.378 -7.573 -9.896 1.00 0.00 H new ATOM 0 HA SER A 121 14.885 -5.769 -11.212 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.143 -8.409 -10.546 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.109 -8.520 -12.295 1.00 0.00 H new ATOM 0 HG SER A 121 17.259 -8.206 -11.476 1.00 0.00 H new ATOM 1942 N GLU A 122 12.758 -7.194 -13.257 1.00 0.00 N ATOM 1943 CA GLU A 122 12.158 -7.112 -14.577 1.00 0.00 C ATOM 1944 C GLU A 122 11.486 -5.751 -14.772 1.00 0.00 C ATOM 1945 O GLU A 122 11.790 -5.036 -15.725 1.00 0.00 O ATOM 1946 CB GLU A 122 11.161 -8.252 -14.798 1.00 0.00 C ATOM 1947 CG GLU A 122 11.822 -9.425 -15.526 1.00 0.00 C ATOM 1948 CD GLU A 122 10.894 -9.995 -16.601 1.00 0.00 C ATOM 1949 OE1 GLU A 122 10.490 -9.203 -17.480 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.612 -11.210 -16.520 1.00 0.00 O ATOM 0 H GLU A 122 12.295 -7.840 -12.617 1.00 0.00 H new ATOM 0 HA GLU A 122 12.948 -7.215 -15.320 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.770 -8.589 -13.838 1.00 0.00 H new ATOM 0 HB3 GLU A 122 10.312 -7.890 -15.379 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.755 -9.095 -15.983 1.00 0.00 H new ATOM 0 HG3 GLU A 122 12.077 -10.206 -14.809 1.00 0.00 H new ATOM 1957 N GLY A 123 10.586 -5.435 -13.853 1.00 0.00 N ATOM 1958 CA GLY A 123 9.869 -4.173 -13.911 1.00 0.00 C ATOM 1959 C GLY A 123 8.738 -4.137 -12.881 1.00 0.00 C ATOM 1960 O GLY A 123 8.873 -4.680 -11.786 1.00 0.00 O ATOM 0 H GLY A 123 10.337 -6.031 -13.064 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.559 -3.350 -13.727 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.460 -4.029 -14.911 1.00 0.00 H new ATOM 1964 N LYS A 124 7.648 -3.490 -13.269 1.00 0.00 N ATOM 1965 CA LYS A 124 6.494 -3.376 -12.393 1.00 0.00 C ATOM 1966 C LYS A 124 5.562 -4.567 -12.626 1.00 0.00 C ATOM 1967 O LYS A 124 5.438 -5.052 -13.750 1.00 0.00 O ATOM 1968 CB LYS A 124 5.814 -2.018 -12.576 1.00 0.00 C ATOM 1969 CG LYS A 124 4.595 -1.887 -11.661 1.00 0.00 C ATOM 1970 CD LYS A 124 3.705 -0.722 -12.097 1.00 0.00 C ATOM 1971 CE LYS A 124 3.555 0.305 -10.973 1.00 0.00 C ATOM 1972 NZ LYS A 124 2.311 1.087 -11.147 1.00 0.00 N ATOM 0 H LYS A 124 7.540 -3.040 -14.178 1.00 0.00 H new ATOM 0 HA LYS A 124 6.804 -3.413 -11.349 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.524 -1.220 -12.359 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.508 -1.898 -13.615 1.00 0.00 H new ATOM 0 HG2 LYS A 124 4.021 -2.814 -11.678 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.922 -1.734 -10.633 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.133 -0.243 -12.977 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.723 -1.098 -12.384 1.00 0.00 H new ATOM 0 HE2 LYS A 124 3.540 -0.203 -10.008 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.415 0.975 -10.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 2.225 1.779 -10.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 2.340 1.587 -12.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.492 0.446 -11.129 1.00 0.00 H new ATOM 1986 N MET A 125 4.931 -5.004 -11.546 1.00 0.00 N ATOM 1987 CA MET A 125 4.014 -6.129 -11.619 1.00 0.00 C ATOM 1988 C MET A 125 2.793 -5.900 -10.726 1.00 0.00 C ATOM 1989 O MET A 125 2.923 -5.413 -9.604 1.00 0.00 O ATOM 1990 CB MET A 125 4.736 -7.405 -11.181 1.00 0.00 C ATOM 1991 CG MET A 125 4.998 -7.397 -9.674 1.00 0.00 C ATOM 1992 SD MET A 125 5.713 -8.952 -9.170 1.00 0.00 S ATOM 1993 CE MET A 125 7.435 -8.489 -9.086 1.00 0.00 C ATOM 0 H MET A 125 5.037 -4.599 -10.616 1.00 0.00 H new ATOM 0 HA MET A 125 3.673 -6.230 -12.649 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.135 -8.276 -11.445 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.681 -7.495 -11.717 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.670 -6.578 -9.418 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.066 -7.224 -9.136 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.043 -9.379 -8.923 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.730 -8.014 -10.022 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.584 -7.791 -8.262 1.00 0.00 H new ATOM 2003 N LEU A 126 1.635 -6.262 -11.258 1.00 0.00 N ATOM 2004 CA LEU A 126 0.392 -6.102 -10.522 1.00 0.00 C ATOM 2005 C LEU A 126 0.242 -7.253 -9.526 1.00 0.00 C ATOM 2006 O LEU A 126 0.602 -8.390 -9.826 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.788 -5.967 -11.487 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.860 -4.947 -11.098 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.244 -5.090 -9.624 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.411 -3.524 -11.438 1.00 0.00 C ATOM 0 H LEU A 126 1.531 -6.665 -12.189 1.00 0.00 H new ATOM 0 HA LEU A 126 0.409 -5.179 -9.943 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.399 -5.699 -12.469 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.263 -6.943 -11.588 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.755 -5.151 -11.685 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.007 -4.353 -9.374 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.634 -6.092 -9.445 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.364 -4.927 -9.001 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.191 -2.818 -11.152 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.495 -3.292 -10.895 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.227 -3.447 -12.510 1.00 0.00 H new ATOM 2022 N MET A 127 -0.289 -6.918 -8.359 1.00 0.00 N ATOM 2023 CA MET A 127 -0.490 -7.909 -7.316 1.00 0.00 C ATOM 2024 C MET A 127 -1.798 -7.655 -6.563 1.00 0.00 C ATOM 2025 O MET A 127 -2.209 -6.508 -6.397 1.00 0.00 O ATOM 2026 CB MET A 127 0.682 -7.862 -6.334 1.00 0.00 C ATOM 2027 CG MET A 127 1.984 -8.292 -7.013 1.00 0.00 C ATOM 2028 SD MET A 127 2.764 -9.592 -6.070 1.00 0.00 S ATOM 2029 CE MET A 127 2.806 -8.824 -4.459 1.00 0.00 C ATOM 0 H MET A 127 -0.586 -5.974 -8.113 1.00 0.00 H new ATOM 0 HA MET A 127 -0.546 -8.893 -7.782 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.790 -6.852 -5.939 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.477 -8.515 -5.486 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.778 -8.639 -8.026 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.658 -7.439 -7.099 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.696 -9.153 -3.922 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.831 -7.740 -4.573 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.917 -9.109 -3.897 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.414 -8.744 -6.128 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.666 -8.654 -5.397 1.00 0.00 C ATOM 2041 C ASN A 128 -3.618 -9.595 -4.192 1.00 0.00 C ATOM 2042 O ASN A 128 -3.177 -10.737 -4.310 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.848 -9.070 -6.275 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.409 -10.070 -7.347 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.816 -9.719 -8.353 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.734 -11.331 -7.076 1.00 0.00 N ATOM 0 H ASN A 128 -2.069 -9.694 -6.268 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.798 -7.619 -5.081 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.627 -9.514 -5.656 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.281 -8.189 -6.749 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.486 -12.073 -7.730 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.231 -11.556 -6.214 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.077 -9.081 -3.061 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.092 -9.862 -1.835 1.00 0.00 C ATOM 2055 C ARG A 129 -5.496 -9.873 -1.229 1.00 0.00 C ATOM 2056 O ARG A 129 -6.243 -8.905 -1.367 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.106 -9.297 -0.811 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.798 -10.091 -0.813 1.00 0.00 C ATOM 2059 CD ARG A 129 -2.028 -11.528 -0.341 1.00 0.00 C ATOM 2060 NE ARG A 129 -1.255 -12.467 -1.185 1.00 0.00 N ATOM 2061 CZ ARG A 129 -1.017 -13.746 -0.862 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.491 -14.245 0.288 1.00 0.00 N ATOM 2063 NH2 ARG A 129 -0.306 -14.524 -1.689 1.00 0.00 N ATOM 0 H ARG A 129 -4.442 -8.133 -2.967 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.794 -10.880 -2.087 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.901 -8.251 -1.037 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.552 -9.326 0.183 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.374 -10.098 -1.817 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.071 -9.603 -0.164 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.726 -11.630 0.701 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -3.090 -11.771 -0.391 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.880 -12.119 -2.067 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.032 -13.652 0.917 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.310 -15.218 0.535 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.054 -14.143 -2.564 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.125 -15.497 -1.444 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.814 -10.978 -0.571 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.116 -11.128 0.056 1.00 0.00 C ATOM 2079 C GLU A 130 -7.083 -10.579 1.484 1.00 0.00 C ATOM 2080 O GLU A 130 -6.058 -10.657 2.159 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.568 -12.589 0.040 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.905 -13.380 1.170 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.307 -14.688 0.646 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -5.885 -14.688 -0.530 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -6.287 -15.658 1.434 1.00 0.00 O ATOM 0 H GLU A 130 -5.192 -11.778 -0.458 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.842 -10.552 -0.517 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.652 -12.639 0.143 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.318 -13.040 -0.920 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.122 -12.777 1.630 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.639 -13.597 1.946 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.217 -10.037 1.902 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.331 -9.476 3.238 1.00 0.00 C ATOM 2094 C ILE A 131 -9.109 -10.446 4.129 1.00 0.00 C ATOM 2095 O ILE A 131 -10.198 -10.890 3.768 1.00 0.00 O ATOM 2096 CB ILE A 131 -8.938 -8.073 3.180 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.017 -7.108 2.430 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.282 -7.565 4.582 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.823 -6.166 1.533 1.00 0.00 C ATOM 0 H ILE A 131 -9.065 -9.974 1.339 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.344 -9.353 3.685 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.872 -8.128 2.620 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.435 -6.526 3.144 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.307 -7.673 1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.712 -6.566 4.512 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.003 -8.238 5.046 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.377 -7.529 5.188 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.144 -5.491 1.012 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.385 -6.750 0.804 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.514 -5.585 2.143 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.519 -10.747 5.277 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.144 -11.657 6.223 1.00 0.00 C ATOM 2113 C ILE A 132 -8.866 -11.173 7.648 1.00 0.00 C ATOM 2114 O ILE A 132 -8.335 -10.081 7.844 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.691 -13.095 5.962 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.206 -13.144 5.597 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.565 -13.761 4.898 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.330 -12.886 6.825 1.00 0.00 C ATOM 0 H ILE A 132 -7.616 -10.377 5.573 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.226 -11.660 6.092 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.815 -13.665 6.883 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.964 -14.118 5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -6.992 -12.400 4.830 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.221 -14.782 4.732 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.601 -13.777 5.236 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.496 -13.199 3.967 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.279 -12.927 6.537 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.557 -11.901 7.233 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.529 -13.646 7.580 1.00 0.00 H new ATOM 2130 N SER A 133 -9.237 -12.010 8.605 1.00 0.00 N ATOM 2131 CA SER A 133 -9.035 -11.682 10.006 1.00 0.00 C ATOM 2132 C SER A 133 -7.630 -12.100 10.444 1.00 0.00 C ATOM 2133 O SER A 133 -7.468 -13.084 11.164 1.00 0.00 O ATOM 2134 CB SER A 133 -10.089 -12.355 10.888 1.00 0.00 C ATOM 2135 OG SER A 133 -9.830 -12.157 12.275 1.00 0.00 O ATOM 0 H SER A 133 -9.677 -12.915 8.438 1.00 0.00 H new ATOM 0 HA SER A 133 -9.139 -10.603 10.123 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.074 -11.958 10.643 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.113 -13.423 10.673 1.00 0.00 H new ATOM 0 HG SER A 133 -10.526 -12.600 12.804 1.00 0.00 H new ATOM 2141 N GLY A 134 -6.650 -11.332 9.991 1.00 0.00 N ATOM 2142 CA GLY A 134 -5.265 -11.611 10.328 1.00 0.00 C ATOM 2143 C GLY A 134 -4.793 -12.912 9.676 1.00 0.00 C ATOM 2144 O GLY A 134 -5.595 -13.812 9.426 1.00 0.00 O ATOM 0 H GLY A 134 -6.788 -10.517 9.394 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -4.634 -10.785 9.999 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -5.158 -11.683 11.410 1.00 0.00 H new ATOM 2148 N PRO A 135 -3.461 -12.973 9.411 1.00 0.00 N ATOM 2149 CA PRO A 135 -2.873 -14.149 8.793 1.00 0.00 C ATOM 2150 C PRO A 135 -2.761 -15.298 9.797 1.00 0.00 C ATOM 2151 O PRO A 135 -1.663 -15.771 10.085 1.00 0.00 O ATOM 2152 CB PRO A 135 -1.524 -13.686 8.268 1.00 0.00 C ATOM 2153 CG PRO A 135 -1.206 -12.400 9.014 1.00 0.00 C ATOM 2154 CD PRO A 135 -2.482 -11.927 9.692 1.00 0.00 C ATOM 0 HA PRO A 135 -3.484 -14.548 7.984 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -0.757 -14.440 8.444 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -1.561 -13.515 7.192 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.422 -12.571 9.752 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -0.836 -11.641 8.325 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.336 -11.799 10.765 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.807 -10.964 9.297 1.00 0.00 H new ATOM 2162 N SER A 136 -3.913 -15.715 10.302 1.00 0.00 N ATOM 2163 CA SER A 136 -3.958 -16.799 11.268 1.00 0.00 C ATOM 2164 C SER A 136 -5.409 -17.210 11.526 1.00 0.00 C ATOM 2165 O SER A 136 -6.235 -16.380 11.906 1.00 0.00 O ATOM 2166 CB SER A 136 -3.279 -16.398 12.579 1.00 0.00 C ATOM 2167 OG SER A 136 -3.554 -17.323 13.627 1.00 0.00 O ATOM 0 H SER A 136 -4.822 -15.321 10.060 1.00 0.00 H new ATOM 0 HA SER A 136 -3.414 -17.648 10.854 1.00 0.00 H new ATOM 0 HB2 SER A 136 -2.202 -16.335 12.425 1.00 0.00 H new ATOM 0 HB3 SER A 136 -3.618 -15.405 12.874 1.00 0.00 H new ATOM 0 HG SER A 136 -3.102 -17.033 14.447 1.00 0.00 H new ATOM 2173 N SER A 137 -5.676 -18.490 11.310 1.00 0.00 N ATOM 2174 CA SER A 137 -7.013 -19.020 11.515 1.00 0.00 C ATOM 2175 C SER A 137 -6.985 -20.549 11.452 1.00 0.00 C ATOM 2176 O SER A 137 -6.136 -21.130 10.779 1.00 0.00 O ATOM 2177 CB SER A 137 -7.991 -18.464 10.478 1.00 0.00 C ATOM 2178 OG SER A 137 -9.090 -17.792 11.087 1.00 0.00 O ATOM 0 H SER A 137 -4.989 -19.175 10.995 1.00 0.00 H new ATOM 0 HA SER A 137 -7.357 -18.709 12.502 1.00 0.00 H new ATOM 0 HB2 SER A 137 -7.466 -17.774 9.817 1.00 0.00 H new ATOM 0 HB3 SER A 137 -8.363 -19.279 9.857 1.00 0.00 H new ATOM 0 HG SER A 137 -9.690 -17.450 10.392 1.00 0.00 H new ATOM 2184 N GLY A 138 -7.924 -21.156 12.164 1.00 0.00 N ATOM 2185 CA GLY A 138 -8.017 -22.605 12.198 1.00 0.00 C ATOM 2186 C GLY A 138 -7.500 -23.157 13.527 1.00 0.00 C ATOM 2187 O GLY A 138 -6.402 -22.812 13.962 1.00 0.00 O ATOM 0 H GLY A 138 -8.627 -20.670 12.721 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -9.053 -22.910 12.052 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -7.441 -23.029 11.375 1.00 0.00 H new TER 2191 GLY A 138