USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 884 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 67 MET CE :methyl 180:sc= -0.621 (180deg=-0.621) USER MOD Set 1.2: A 90 SER OG : rot -160:sc= 0 USER MOD Set 2.1: A 72 GLN : amide:sc= 0.973 K(o=2.1,f=0.32) USER MOD Set 2.2: A 81 THR OG1 : rot 36:sc= 1.17 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -82:sc= 1.33 USER MOD Single : A 45 TYR OH : rot 28:sc= 1.14 USER MOD Single : A 47 LYS NZ :NH3+ 135:sc= 1.3 (180deg=0.0354) USER MOD Single : A 50 THR OG1 : rot -52:sc= 0.0934 USER MOD Single : A 51 GLN : amide:sc= 0.099 X(o=0.099,f=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 MET CE :methyl 136:sc= -0.0843 (180deg=-1.4) USER MOD Single : A 58 GLN : amide:sc= -0.1 K(o=-0.1,f=-0.66) USER MOD Single : A 65 MET CE :methyl -156:sc= -0.458 (180deg=-1.45!) USER MOD Single : A 70 SER OG : rot -69:sc= 1.35 USER MOD Single : A 76 ASN : amide:sc=-0.00386 X(o=-0.0039,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.491) USER MOD Single : A 83 THR OG1 : rot -71:sc= 1.01 USER MOD Single : A 85 TYR OH : rot 79:sc= 0.297 USER MOD Single : A 94 SER OG : rot 160:sc= -0.654 USER MOD Single : A 95 TYR OH : rot 77:sc= 0.215 USER MOD Single : A 107 GLN : amide:sc= -0.0415 K(o=-0.041,f=-1.2) USER MOD Single : A 112 GLN : amide:sc=-0.00191 X(o=-0.0019,f=-0.27) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -0.542 X(o=-0.54,f=-0.35) USER MOD Single : A 120 HIS : no HE2:sc= -1.05 K(o=-1,f=-3.4!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 HIS : no HE2:sc= -4.71! K(o=-4.7!,f=-1.1) USER MOD Single : A 133 ASN : amide:sc= 0.666 K(o=0.67,f=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0895) USER MOD Single : A 143 MET CE :methyl -173:sc=-0.00206 (180deg=-0.112) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 30 3.327 -23.722 4.353 1.00 0.00 N ATOM 2 CA LEU A 30 3.190 -23.011 3.068 1.00 0.00 C ATOM 3 C LEU A 30 4.595 -22.777 2.491 1.00 0.00 C ATOM 4 O LEU A 30 5.560 -23.334 3.019 1.00 0.00 O ATOM 5 CB LEU A 30 2.390 -21.708 3.269 1.00 0.00 C ATOM 6 CG LEU A 30 1.493 -21.388 2.064 1.00 0.00 C ATOM 7 CD1 LEU A 30 0.299 -22.343 1.983 1.00 0.00 C ATOM 8 CD2 LEU A 30 0.951 -19.961 2.164 1.00 0.00 C ATOM 0 HA LEU A 30 2.628 -23.604 2.347 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.775 -21.795 4.165 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.081 -20.881 3.436 1.00 0.00 H new ATOM 0 HG LEU A 30 2.109 -21.501 1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.314 -22.087 1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.658 -23.367 1.882 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.299 -22.256 2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.318 -19.751 1.302 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.366 -19.857 3.078 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.783 -19.256 2.183 1.00 0.00 H new ATOM 20 N ARG A 31 4.769 -21.971 1.431 1.00 0.00 N ATOM 21 CA ARG A 31 6.108 -21.532 1.012 1.00 0.00 C ATOM 22 C ARG A 31 6.113 -20.165 0.349 1.00 0.00 C ATOM 23 O ARG A 31 6.999 -19.378 0.651 1.00 0.00 O ATOM 24 CB ARG A 31 6.793 -22.597 0.136 1.00 0.00 C ATOM 25 CG ARG A 31 8.268 -22.247 -0.142 1.00 0.00 C ATOM 26 CD ARG A 31 9.112 -23.457 -0.576 1.00 0.00 C ATOM 27 NE ARG A 31 9.728 -24.163 0.565 1.00 0.00 N ATOM 28 CZ ARG A 31 9.243 -25.198 1.266 1.00 0.00 C ATOM 29 NH1 ARG A 31 8.051 -25.722 1.002 1.00 0.00 N ATOM 30 NH2 ARG A 31 9.969 -25.725 2.242 1.00 0.00 N ATOM 0 H ARG A 31 4.007 -21.614 0.854 1.00 0.00 H new ATOM 0 HA ARG A 31 6.694 -21.417 1.924 1.00 0.00 H new ATOM 0 HB2 ARG A 31 6.737 -23.566 0.631 1.00 0.00 H new ATOM 0 HB3 ARG A 31 6.257 -22.690 -0.809 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.312 -21.485 -0.920 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.706 -21.812 0.756 1.00 0.00 H new ATOM 0 HD2 ARG A 31 8.483 -24.153 -1.131 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.895 -23.123 -1.256 1.00 0.00 H new ATOM 0 HE ARG A 31 10.642 -23.818 0.858 1.00 0.00 H new ATOM 0 HH11 ARG A 31 7.480 -25.337 0.250 1.00 0.00 H new ATOM 0 HH12 ARG A 31 7.707 -26.509 1.552 1.00 0.00 H new ATOM 0 HH21 ARG A 31 10.890 -25.343 2.456 1.00 0.00 H new ATOM 0 HH22 ARG A 31 9.606 -26.512 2.779 1.00 0.00 H new ATOM 44 N SER A 32 5.156 -19.880 -0.531 1.00 0.00 N ATOM 45 CA SER A 32 5.010 -18.621 -1.256 1.00 0.00 C ATOM 46 C SER A 32 6.136 -18.317 -2.250 1.00 0.00 C ATOM 47 O SER A 32 5.829 -18.258 -3.439 1.00 0.00 O ATOM 48 CB SER A 32 4.746 -17.456 -0.296 1.00 0.00 C ATOM 49 OG SER A 32 3.604 -17.724 0.502 1.00 0.00 O ATOM 0 H SER A 32 4.427 -20.553 -0.769 1.00 0.00 H new ATOM 0 HA SER A 32 4.130 -18.749 -1.886 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.615 -17.298 0.343 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.595 -16.537 -0.862 1.00 0.00 H new ATOM 0 HG SER A 32 3.447 -16.973 1.112 1.00 0.00 H new ATOM 55 N ASN A 33 7.379 -18.100 -1.798 1.00 0.00 N ATOM 56 CA ASN A 33 8.396 -17.255 -2.440 1.00 0.00 C ATOM 57 C ASN A 33 7.909 -15.803 -2.512 1.00 0.00 C ATOM 58 O ASN A 33 6.760 -15.539 -2.865 1.00 0.00 O ATOM 59 CB ASN A 33 8.846 -17.780 -3.818 1.00 0.00 C ATOM 60 CG ASN A 33 9.650 -16.742 -4.584 1.00 0.00 C ATOM 61 OD1 ASN A 33 9.094 -16.008 -5.392 1.00 0.00 O ATOM 62 ND2 ASN A 33 10.953 -16.657 -4.384 1.00 0.00 N ATOM 0 H ASN A 33 7.718 -18.528 -0.936 1.00 0.00 H new ATOM 0 HA ASN A 33 9.287 -17.294 -1.814 1.00 0.00 H new ATOM 0 HB2 ASN A 33 9.447 -18.680 -3.685 1.00 0.00 H new ATOM 0 HB3 ASN A 33 7.971 -18.065 -4.402 1.00 0.00 H new ATOM 0 HD21 ASN A 33 11.505 -15.976 -4.905 1.00 0.00 H new ATOM 0 HD22 ASN A 33 11.407 -17.273 -3.709 1.00 0.00 H new ATOM 69 N ILE A 34 8.789 -14.857 -2.171 1.00 0.00 N ATOM 70 CA ILE A 34 8.518 -13.433 -2.006 1.00 0.00 C ATOM 71 C ILE A 34 7.477 -13.210 -0.882 1.00 0.00 C ATOM 72 O ILE A 34 6.864 -14.147 -0.360 1.00 0.00 O ATOM 73 CB ILE A 34 8.252 -12.788 -3.398 1.00 0.00 C ATOM 74 CG1 ILE A 34 9.483 -12.922 -4.333 1.00 0.00 C ATOM 75 CG2 ILE A 34 7.938 -11.295 -3.284 1.00 0.00 C ATOM 76 CD1 ILE A 34 9.142 -12.770 -5.823 1.00 0.00 C ATOM 0 H ILE A 34 9.768 -15.083 -1.993 1.00 0.00 H new ATOM 0 HA ILE A 34 9.383 -12.883 -1.636 1.00 0.00 H new ATOM 0 HB ILE A 34 7.397 -13.324 -3.810 1.00 0.00 H new ATOM 0 HG12 ILE A 34 10.221 -12.168 -4.059 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.947 -13.895 -4.172 1.00 0.00 H new ATOM 0 HG21 ILE A 34 7.759 -10.884 -4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.049 -11.156 -2.668 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.782 -10.780 -2.825 1.00 0.00 H new ATOM 0 HD11 ILE A 34 10.050 -12.875 -6.417 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.428 -13.540 -6.113 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.706 -11.786 -5.998 1.00 0.00 H new ATOM 88 N ASP A 35 7.343 -11.969 -0.415 1.00 0.00 N ATOM 89 CA ASP A 35 6.367 -11.547 0.592 1.00 0.00 C ATOM 90 C ASP A 35 4.947 -11.556 -0.008 1.00 0.00 C ATOM 91 O ASP A 35 4.785 -11.798 -1.206 1.00 0.00 O ATOM 92 CB ASP A 35 6.783 -10.169 1.128 1.00 0.00 C ATOM 93 CG ASP A 35 5.809 -9.648 2.181 1.00 0.00 C ATOM 94 OD1 ASP A 35 5.386 -10.443 3.049 1.00 0.00 O ATOM 95 OD2 ASP A 35 5.425 -8.461 2.090 1.00 0.00 O ATOM 0 H ASP A 35 7.932 -11.202 -0.739 1.00 0.00 H new ATOM 0 HA ASP A 35 6.348 -12.242 1.431 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.782 -10.234 1.559 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.838 -9.460 0.302 1.00 0.00 H new ATOM 100 N LEU A 36 3.904 -11.335 0.792 1.00 0.00 N ATOM 101 CA LEU A 36 2.509 -11.243 0.383 1.00 0.00 C ATOM 102 C LEU A 36 2.225 -9.951 -0.397 1.00 0.00 C ATOM 103 O LEU A 36 3.142 -9.185 -0.718 1.00 0.00 O ATOM 104 CB LEU A 36 1.630 -11.406 1.639 1.00 0.00 C ATOM 105 CG LEU A 36 1.872 -10.413 2.785 1.00 0.00 C ATOM 106 CD1 LEU A 36 1.432 -8.998 2.413 1.00 0.00 C ATOM 107 CD2 LEU A 36 1.177 -10.914 4.057 1.00 0.00 C ATOM 0 H LEU A 36 4.020 -11.209 1.798 1.00 0.00 H new ATOM 0 HA LEU A 36 2.268 -12.043 -0.316 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.586 -11.328 1.336 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.774 -12.414 2.027 1.00 0.00 H new ATOM 0 HG LEU A 36 2.944 -10.357 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.620 -8.326 3.251 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.994 -8.659 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.367 -8.998 2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.350 -10.207 4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.106 -11.003 3.876 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.580 -11.889 4.332 1.00 0.00 H new ATOM 119 N PHE A 37 0.953 -9.739 -0.740 1.00 0.00 N ATOM 120 CA PHE A 37 0.336 -8.562 -1.357 1.00 0.00 C ATOM 121 C PHE A 37 -1.182 -8.778 -1.322 1.00 0.00 C ATOM 122 O PHE A 37 -1.608 -9.928 -1.211 1.00 0.00 O ATOM 123 CB PHE A 37 0.800 -8.425 -2.808 1.00 0.00 C ATOM 124 CG PHE A 37 0.465 -7.121 -3.496 1.00 0.00 C ATOM 125 CD1 PHE A 37 1.404 -6.074 -3.469 1.00 0.00 C ATOM 126 CD2 PHE A 37 -0.709 -6.992 -4.262 1.00 0.00 C ATOM 127 CE1 PHE A 37 1.204 -4.936 -4.261 1.00 0.00 C ATOM 128 CE2 PHE A 37 -0.919 -5.837 -5.035 1.00 0.00 C ATOM 129 CZ PHE A 37 0.064 -4.839 -5.074 1.00 0.00 C ATOM 0 H PHE A 37 0.256 -10.465 -0.575 1.00 0.00 H new ATOM 0 HA PHE A 37 0.617 -7.655 -0.821 1.00 0.00 H new ATOM 0 HB2 PHE A 37 1.881 -8.559 -2.836 1.00 0.00 H new ATOM 0 HB3 PHE A 37 0.363 -9.239 -3.386 1.00 0.00 H new ATOM 0 HD1 PHE A 37 2.278 -6.147 -2.839 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.448 -7.780 -4.256 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.927 -4.134 -4.246 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.834 -5.719 -5.596 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.056 -3.991 -5.733 1.00 0.00 H new ATOM 139 N TYR A 38 -1.984 -7.715 -1.407 1.00 0.00 N ATOM 140 CA TYR A 38 -3.447 -7.726 -1.449 1.00 0.00 C ATOM 141 C TYR A 38 -3.963 -6.559 -2.304 1.00 0.00 C ATOM 142 O TYR A 38 -3.180 -5.739 -2.793 1.00 0.00 O ATOM 143 CB TYR A 38 -4.013 -7.565 -0.032 1.00 0.00 C ATOM 144 CG TYR A 38 -3.654 -8.651 0.949 1.00 0.00 C ATOM 145 CD1 TYR A 38 -2.445 -8.588 1.661 1.00 0.00 C ATOM 146 CD2 TYR A 38 -4.538 -9.721 1.151 1.00 0.00 C ATOM 147 CE1 TYR A 38 -2.105 -9.604 2.566 1.00 0.00 C ATOM 148 CE2 TYR A 38 -4.217 -10.735 2.062 1.00 0.00 C ATOM 149 CZ TYR A 38 -3.002 -10.674 2.785 1.00 0.00 C ATOM 150 OH TYR A 38 -2.713 -11.634 3.703 1.00 0.00 O ATOM 0 H TYR A 38 -1.607 -6.768 -1.451 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.768 -8.675 -1.879 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -3.669 -6.612 0.369 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -5.099 -7.509 -0.100 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.775 -7.754 1.511 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.468 -9.763 0.603 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -1.163 -9.569 3.093 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -4.895 -11.562 2.212 1.00 0.00 H new ATOM 0 HH TYR A 38 -3.438 -12.293 3.726 1.00 0.00 H new ATOM 160 N THR A 39 -5.284 -6.424 -2.418 1.00 0.00 N ATOM 161 CA THR A 39 -5.959 -5.356 -3.145 1.00 0.00 C ATOM 162 C THR A 39 -7.126 -4.762 -2.331 1.00 0.00 C ATOM 163 O THR A 39 -7.575 -5.377 -1.350 1.00 0.00 O ATOM 164 CB THR A 39 -6.438 -5.927 -4.494 1.00 0.00 C ATOM 165 OG1 THR A 39 -7.169 -7.109 -4.249 1.00 0.00 O ATOM 166 CG2 THR A 39 -5.290 -6.257 -5.455 1.00 0.00 C ATOM 0 H THR A 39 -5.935 -7.082 -1.989 1.00 0.00 H new ATOM 0 HA THR A 39 -5.266 -4.533 -3.319 1.00 0.00 H new ATOM 0 HB THR A 39 -7.048 -5.159 -4.969 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.549 -7.858 -4.128 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.697 -6.655 -6.385 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.720 -5.352 -5.666 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.635 -7.000 -4.999 1.00 0.00 H new ATOM 174 N PRO A 40 -7.636 -3.567 -2.689 1.00 0.00 N ATOM 175 CA PRO A 40 -8.827 -2.963 -2.098 1.00 0.00 C ATOM 176 C PRO A 40 -10.065 -3.672 -2.661 1.00 0.00 C ATOM 177 O PRO A 40 -10.795 -3.176 -3.514 1.00 0.00 O ATOM 178 CB PRO A 40 -8.742 -1.487 -2.469 1.00 0.00 C ATOM 179 CG PRO A 40 -8.087 -1.520 -3.837 1.00 0.00 C ATOM 180 CD PRO A 40 -7.083 -2.654 -3.680 1.00 0.00 C ATOM 0 HA PRO A 40 -8.895 -3.062 -1.015 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -9.727 -1.022 -2.504 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.148 -0.923 -1.750 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.808 -1.720 -4.630 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.601 -0.575 -4.079 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.923 -3.164 -4.630 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.115 -2.272 -3.357 1.00 0.00 H new ATOM 188 N GLY A 41 -10.241 -4.902 -2.215 1.00 0.00 N ATOM 189 CA GLY A 41 -11.097 -5.896 -2.790 1.00 0.00 C ATOM 190 C GLY A 41 -10.766 -7.178 -2.067 1.00 0.00 C ATOM 191 O GLY A 41 -11.539 -7.596 -1.217 1.00 0.00 O ATOM 0 H GLY A 41 -9.753 -5.245 -1.387 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -12.147 -5.632 -2.661 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.922 -5.993 -3.861 1.00 0.00 H new ATOM 195 N GLU A 42 -9.563 -7.727 -2.237 1.00 0.00 N ATOM 196 CA GLU A 42 -9.190 -8.948 -1.528 1.00 0.00 C ATOM 197 C GLU A 42 -9.255 -8.771 -0.008 1.00 0.00 C ATOM 198 O GLU A 42 -9.607 -9.709 0.700 1.00 0.00 O ATOM 199 CB GLU A 42 -7.784 -9.383 -1.934 1.00 0.00 C ATOM 200 CG GLU A 42 -7.773 -10.062 -3.309 1.00 0.00 C ATOM 201 CD GLU A 42 -6.334 -10.332 -3.736 1.00 0.00 C ATOM 202 OE1 GLU A 42 -5.583 -9.343 -3.921 1.00 0.00 O ATOM 203 OE2 GLU A 42 -5.931 -11.518 -3.771 1.00 0.00 O ATOM 0 H GLU A 42 -8.840 -7.351 -2.851 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.910 -9.718 -1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.126 -8.514 -1.952 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.386 -10.069 -1.187 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.332 -10.997 -3.268 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.268 -9.426 -4.043 1.00 0.00 H new ATOM 210 N ILE A 43 -8.949 -7.576 0.507 1.00 0.00 N ATOM 211 CA ILE A 43 -9.004 -7.252 1.937 1.00 0.00 C ATOM 212 C ILE A 43 -10.451 -7.204 2.476 1.00 0.00 C ATOM 213 O ILE A 43 -10.640 -7.182 3.688 1.00 0.00 O ATOM 214 CB ILE A 43 -8.182 -5.952 2.172 1.00 0.00 C ATOM 215 CG1 ILE A 43 -6.687 -6.252 1.858 1.00 0.00 C ATOM 216 CG2 ILE A 43 -8.376 -5.317 3.567 1.00 0.00 C ATOM 217 CD1 ILE A 43 -5.639 -5.495 2.684 1.00 0.00 C ATOM 0 H ILE A 43 -8.650 -6.790 -0.070 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.546 -8.049 2.523 1.00 0.00 H new ATOM 0 HB ILE A 43 -8.561 -5.189 1.492 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.519 -7.320 1.994 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.511 -6.034 0.805 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -7.767 -4.416 3.645 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.426 -5.058 3.706 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -8.072 -6.028 4.336 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.640 -5.795 2.367 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.761 -4.423 2.532 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.770 -5.729 3.740 1.00 0.00 H new ATOM 229 N LEU A 44 -11.479 -7.211 1.622 1.00 0.00 N ATOM 230 CA LEU A 44 -12.886 -7.058 2.020 1.00 0.00 C ATOM 231 C LEU A 44 -13.740 -8.235 1.540 1.00 0.00 C ATOM 232 O LEU A 44 -14.715 -8.576 2.202 1.00 0.00 O ATOM 233 CB LEU A 44 -13.512 -5.712 1.565 1.00 0.00 C ATOM 234 CG LEU A 44 -12.668 -4.767 0.690 1.00 0.00 C ATOM 235 CD1 LEU A 44 -13.543 -3.746 -0.029 1.00 0.00 C ATOM 236 CD2 LEU A 44 -11.628 -3.982 1.491 1.00 0.00 C ATOM 0 H LEU A 44 -11.357 -7.325 0.616 1.00 0.00 H new ATOM 0 HA LEU A 44 -12.881 -7.051 3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -14.427 -5.940 1.019 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -13.803 -5.163 2.460 1.00 0.00 H new ATOM 0 HG LEU A 44 -12.161 -5.419 -0.021 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -12.916 -3.094 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -14.257 -4.265 -0.669 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -14.082 -3.148 0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -11.065 -3.334 0.819 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -12.131 -3.375 2.244 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.946 -4.677 1.981 1.00 0.00 H new ATOM 248 N TYR A 45 -13.398 -8.837 0.405 1.00 0.00 N ATOM 249 CA TYR A 45 -14.089 -9.953 -0.228 1.00 0.00 C ATOM 250 C TYR A 45 -13.429 -11.302 0.093 1.00 0.00 C ATOM 251 O TYR A 45 -14.052 -12.343 -0.116 1.00 0.00 O ATOM 252 CB TYR A 45 -14.057 -9.751 -1.753 1.00 0.00 C ATOM 253 CG TYR A 45 -14.920 -8.633 -2.317 1.00 0.00 C ATOM 254 CD1 TYR A 45 -14.680 -7.279 -2.008 1.00 0.00 C ATOM 255 CD2 TYR A 45 -15.941 -8.964 -3.228 1.00 0.00 C ATOM 256 CE1 TYR A 45 -15.458 -6.268 -2.598 1.00 0.00 C ATOM 257 CE2 TYR A 45 -16.726 -7.962 -3.819 1.00 0.00 C ATOM 258 CZ TYR A 45 -16.485 -6.609 -3.507 1.00 0.00 C ATOM 259 OH TYR A 45 -17.295 -5.667 -4.057 1.00 0.00 O ATOM 0 H TYR A 45 -12.581 -8.540 -0.129 1.00 0.00 H new ATOM 0 HA TYR A 45 -15.109 -9.974 0.156 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -13.025 -9.565 -2.049 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -14.361 -10.685 -2.225 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -13.895 -7.017 -1.315 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -16.122 -10.000 -3.475 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -15.271 -5.232 -2.357 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -17.512 -8.227 -4.511 1.00 0.00 H new ATOM 0 HH TYR A 45 -16.820 -4.811 -4.100 1.00 0.00 H new ATOM 269 N GLY A 46 -12.170 -11.303 0.542 1.00 0.00 N ATOM 270 CA GLY A 46 -11.337 -12.491 0.685 1.00 0.00 C ATOM 271 C GLY A 46 -10.298 -12.551 -0.434 1.00 0.00 C ATOM 272 O GLY A 46 -10.541 -12.066 -1.541 1.00 0.00 O ATOM 0 H GLY A 46 -11.692 -10.447 0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.837 -12.478 1.654 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -11.960 -13.385 0.660 1.00 0.00 H new ATOM 276 N LYS A 47 -9.111 -13.103 -0.156 1.00 0.00 N ATOM 277 CA LYS A 47 -8.016 -13.187 -1.124 1.00 0.00 C ATOM 278 C LYS A 47 -8.435 -14.045 -2.311 1.00 0.00 C ATOM 279 O LYS A 47 -8.879 -15.162 -2.048 1.00 0.00 O ATOM 280 CB LYS A 47 -6.833 -13.863 -0.446 1.00 0.00 C ATOM 281 CG LYS A 47 -5.542 -13.754 -1.256 1.00 0.00 C ATOM 282 CD LYS A 47 -4.905 -12.405 -0.950 1.00 0.00 C ATOM 283 CE LYS A 47 -3.469 -12.359 -1.447 1.00 0.00 C ATOM 284 NZ LYS A 47 -3.394 -12.264 -2.921 1.00 0.00 N ATOM 0 H LYS A 47 -8.884 -13.506 0.753 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.757 -12.186 -1.469 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.679 -13.415 0.536 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.066 -14.915 -0.284 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.861 -14.564 -0.997 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.753 -13.843 -2.322 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.483 -11.610 -1.421 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.928 -12.222 0.124 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.959 -11.504 -1.003 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.942 -13.253 -1.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.691 -11.545 -3.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.114 -13.185 -3.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -4.325 -11.995 -3.299 1.00 0.00 H new ATOM 298 N ARG A 48 -8.089 -13.672 -3.556 1.00 0.00 N ATOM 299 CA ARG A 48 -8.822 -14.003 -4.787 1.00 0.00 C ATOM 300 C ARG A 48 -9.787 -15.169 -4.637 1.00 0.00 C ATOM 301 O ARG A 48 -10.981 -14.910 -4.546 1.00 0.00 O ATOM 302 CB ARG A 48 -7.830 -14.312 -5.916 1.00 0.00 C ATOM 303 CG ARG A 48 -7.357 -13.074 -6.668 1.00 0.00 C ATOM 304 CD ARG A 48 -6.295 -13.504 -7.685 1.00 0.00 C ATOM 305 NE ARG A 48 -4.938 -13.270 -7.169 1.00 0.00 N ATOM 306 CZ ARG A 48 -4.157 -12.229 -7.484 1.00 0.00 C ATOM 307 NH1 ARG A 48 -4.539 -11.332 -8.388 1.00 0.00 N ATOM 308 NH2 ARG A 48 -2.988 -12.076 -6.876 1.00 0.00 N ATOM 0 H ARG A 48 -7.258 -13.109 -3.737 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.425 -13.126 -5.023 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -6.964 -14.825 -5.497 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.298 -14.999 -6.621 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.195 -12.594 -7.174 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.943 -12.343 -5.973 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.420 -14.561 -7.920 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -6.433 -12.952 -8.615 1.00 0.00 H new ATOM 0 HE ARG A 48 -4.560 -13.958 -6.517 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.441 -11.430 -8.855 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.930 -10.546 -8.615 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -2.687 -12.750 -6.172 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -2.390 -11.285 -7.113 1.00 0.00 H new ATOM 322 N GLU A 49 -9.298 -16.410 -4.625 1.00 0.00 N ATOM 323 CA GLU A 49 -10.144 -17.550 -4.327 1.00 0.00 C ATOM 324 C GLU A 49 -10.601 -17.460 -2.870 1.00 0.00 C ATOM 325 O GLU A 49 -11.660 -16.918 -2.578 1.00 0.00 O ATOM 326 CB GLU A 49 -9.407 -18.867 -4.603 1.00 0.00 C ATOM 327 CG GLU A 49 -9.403 -19.286 -6.074 1.00 0.00 C ATOM 328 CD GLU A 49 -9.710 -20.778 -6.165 1.00 0.00 C ATOM 329 OE1 GLU A 49 -8.850 -21.602 -5.775 1.00 0.00 O ATOM 330 OE2 GLU A 49 -10.849 -21.141 -6.545 1.00 0.00 O ATOM 0 H GLU A 49 -8.324 -16.643 -4.818 1.00 0.00 H new ATOM 0 HA GLU A 49 -11.019 -17.534 -4.976 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -8.376 -18.772 -4.261 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.868 -19.659 -4.012 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -10.145 -18.714 -6.631 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.433 -19.073 -6.524 1.00 0.00 H new ATOM 337 N THR A 50 -9.802 -17.995 -1.942 1.00 0.00 N ATOM 338 CA THR A 50 -10.175 -18.188 -0.543 1.00 0.00 C ATOM 339 C THR A 50 -8.945 -18.695 0.225 1.00 0.00 C ATOM 340 O THR A 50 -9.006 -19.627 1.033 1.00 0.00 O ATOM 341 CB THR A 50 -11.404 -19.131 -0.478 1.00 0.00 C ATOM 342 OG1 THR A 50 -11.908 -19.212 0.829 1.00 0.00 O ATOM 343 CG2 THR A 50 -11.124 -20.555 -0.971 1.00 0.00 C ATOM 0 H THR A 50 -8.855 -18.313 -2.151 1.00 0.00 H new ATOM 0 HA THR A 50 -10.479 -17.258 -0.063 1.00 0.00 H new ATOM 0 HB THR A 50 -12.134 -18.682 -1.151 1.00 0.00 H new ATOM 0 HG1 THR A 50 -11.180 -19.431 1.447 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.033 -21.152 -0.894 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.798 -20.523 -2.011 1.00 0.00 H new ATOM 0 HG23 THR A 50 -10.341 -21.004 -0.360 1.00 0.00 H new ATOM 351 N GLN A 51 -7.748 -18.200 -0.121 1.00 0.00 N ATOM 352 CA GLN A 51 -6.543 -18.828 0.378 1.00 0.00 C ATOM 353 C GLN A 51 -6.325 -18.424 1.837 1.00 0.00 C ATOM 354 O GLN A 51 -6.003 -19.312 2.630 1.00 0.00 O ATOM 355 CB GLN A 51 -5.374 -18.633 -0.595 1.00 0.00 C ATOM 356 CG GLN A 51 -5.081 -17.197 -1.035 1.00 0.00 C ATOM 357 CD GLN A 51 -5.285 -16.972 -2.537 1.00 0.00 C ATOM 358 OE1 GLN A 51 -4.351 -17.084 -3.322 1.00 0.00 O ATOM 359 NE2 GLN A 51 -6.475 -16.616 -2.998 1.00 0.00 N ATOM 0 H GLN A 51 -7.602 -17.392 -0.726 1.00 0.00 H new ATOM 0 HA GLN A 51 -6.638 -19.913 0.411 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.474 -19.038 -0.132 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -5.570 -19.229 -1.486 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.727 -16.515 -0.481 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -4.053 -16.946 -0.773 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -7.262 -16.519 -2.357 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -6.604 -16.439 -3.994 1.00 0.00 H new ATOM 368 N GLN A 52 -6.546 -17.147 2.199 1.00 0.00 N ATOM 369 CA GLN A 52 -6.756 -16.626 3.555 1.00 0.00 C ATOM 370 C GLN A 52 -7.114 -15.122 3.534 1.00 0.00 C ATOM 371 O GLN A 52 -7.336 -14.578 2.452 1.00 0.00 O ATOM 372 CB GLN A 52 -5.649 -17.039 4.556 1.00 0.00 C ATOM 373 CG GLN A 52 -4.225 -17.438 4.116 1.00 0.00 C ATOM 374 CD GLN A 52 -3.147 -16.387 4.211 1.00 0.00 C ATOM 375 OE1 GLN A 52 -2.701 -16.035 5.301 1.00 0.00 O ATOM 376 NE2 GLN A 52 -2.609 -15.972 3.079 1.00 0.00 N ATOM 0 H GLN A 52 -6.584 -16.404 1.501 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.637 -17.120 3.964 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -5.536 -16.208 5.253 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.044 -17.881 5.125 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.915 -18.293 4.716 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.275 -17.776 3.081 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -2.998 -16.279 2.187 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -1.805 -15.345 3.096 1.00 0.00 H new ATOM 385 N MET A 53 -7.207 -14.452 4.691 1.00 0.00 N ATOM 386 CA MET A 53 -7.310 -12.984 4.835 1.00 0.00 C ATOM 387 C MET A 53 -6.215 -12.470 5.793 1.00 0.00 C ATOM 388 O MET A 53 -5.563 -13.302 6.442 1.00 0.00 O ATOM 389 CB MET A 53 -8.715 -12.559 5.298 1.00 0.00 C ATOM 390 CG MET A 53 -9.787 -12.929 4.273 1.00 0.00 C ATOM 391 SD MET A 53 -11.293 -11.924 4.360 1.00 0.00 S ATOM 392 CE MET A 53 -10.755 -10.379 3.588 1.00 0.00 C ATOM 0 H MET A 53 -7.213 -14.932 5.591 1.00 0.00 H new ATOM 0 HA MET A 53 -7.152 -12.529 3.857 1.00 0.00 H new ATOM 0 HB2 MET A 53 -8.943 -13.036 6.251 1.00 0.00 H new ATOM 0 HB3 MET A 53 -8.731 -11.483 5.468 1.00 0.00 H new ATOM 0 HG2 MET A 53 -9.362 -12.838 3.273 1.00 0.00 H new ATOM 0 HG3 MET A 53 -10.056 -13.976 4.410 1.00 0.00 H new ATOM 0 HE1 MET A 53 -11.523 -10.031 2.898 1.00 0.00 H new ATOM 0 HE2 MET A 53 -10.590 -9.625 4.358 1.00 0.00 H new ATOM 0 HE3 MET A 53 -9.827 -10.549 3.042 1.00 0.00 H new ATOM 402 N PRO A 54 -5.887 -11.159 5.812 1.00 0.00 N ATOM 403 CA PRO A 54 -4.857 -10.613 6.695 1.00 0.00 C ATOM 404 C PRO A 54 -5.412 -10.283 8.087 1.00 0.00 C ATOM 405 O PRO A 54 -6.597 -9.988 8.249 1.00 0.00 O ATOM 406 CB PRO A 54 -4.353 -9.342 6.002 1.00 0.00 C ATOM 407 CG PRO A 54 -5.563 -8.850 5.213 1.00 0.00 C ATOM 408 CD PRO A 54 -6.329 -10.132 4.873 1.00 0.00 C ATOM 0 HA PRO A 54 -4.060 -11.339 6.856 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.018 -8.598 6.725 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -3.508 -9.552 5.347 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -6.173 -8.165 5.803 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -5.262 -8.314 4.313 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.404 -9.972 4.956 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -6.130 -10.438 3.846 1.00 0.00 H new ATOM 416 N GLU A 55 -4.525 -10.263 9.080 1.00 0.00 N ATOM 417 CA GLU A 55 -4.811 -9.876 10.456 1.00 0.00 C ATOM 418 C GLU A 55 -4.803 -8.352 10.625 1.00 0.00 C ATOM 419 O GLU A 55 -3.949 -7.667 10.065 1.00 0.00 O ATOM 420 CB GLU A 55 -3.711 -10.474 11.343 1.00 0.00 C ATOM 421 CG GLU A 55 -3.982 -11.932 11.735 1.00 0.00 C ATOM 422 CD GLU A 55 -2.711 -12.773 11.646 1.00 0.00 C ATOM 423 OE1 GLU A 55 -1.732 -12.460 12.365 1.00 0.00 O ATOM 424 OE2 GLU A 55 -2.653 -13.685 10.784 1.00 0.00 O ATOM 0 H GLU A 55 -3.550 -10.527 8.940 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.800 -10.241 10.731 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.757 -10.416 10.818 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.614 -9.873 12.247 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.377 -11.971 12.750 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.745 -12.352 11.080 1.00 0.00 H new ATOM 431 N VAL A 56 -5.685 -7.841 11.485 1.00 0.00 N ATOM 432 CA VAL A 56 -5.737 -6.447 11.947 1.00 0.00 C ATOM 433 C VAL A 56 -4.487 -6.029 12.735 1.00 0.00 C ATOM 434 O VAL A 56 -4.179 -4.843 12.838 1.00 0.00 O ATOM 435 CB VAL A 56 -7.055 -6.229 12.717 1.00 0.00 C ATOM 436 CG1 VAL A 56 -7.276 -7.267 13.821 1.00 0.00 C ATOM 437 CG2 VAL A 56 -7.176 -4.829 13.312 1.00 0.00 C ATOM 0 H VAL A 56 -6.420 -8.413 11.901 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.730 -5.784 11.082 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.833 -6.350 11.963 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.219 -7.063 14.329 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.308 -8.264 13.382 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -6.458 -7.214 14.540 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.125 -4.739 13.841 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -6.355 -4.657 14.008 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.135 -4.089 12.513 1.00 0.00 H new ATOM 447 N GLY A 57 -3.739 -6.984 13.274 1.00 0.00 N ATOM 448 CA GLY A 57 -2.429 -6.752 13.840 1.00 0.00 C ATOM 449 C GLY A 57 -1.409 -7.464 12.979 1.00 0.00 C ATOM 450 O GLY A 57 -0.747 -8.372 13.489 1.00 0.00 O ATOM 0 H GLY A 57 -4.038 -7.958 13.328 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.215 -5.684 13.878 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.387 -7.122 14.864 1.00 0.00 H new ATOM 454 N GLN A 58 -1.302 -7.129 11.685 1.00 0.00 N ATOM 455 CA GLN A 58 -0.054 -7.424 10.991 1.00 0.00 C ATOM 456 C GLN A 58 0.302 -6.355 9.955 1.00 0.00 C ATOM 457 O GLN A 58 -0.484 -5.449 9.660 1.00 0.00 O ATOM 458 CB GLN A 58 -0.093 -8.836 10.389 1.00 0.00 C ATOM 459 CG GLN A 58 -0.949 -8.927 9.124 1.00 0.00 C ATOM 460 CD GLN A 58 -0.620 -10.105 8.228 1.00 0.00 C ATOM 461 OE1 GLN A 58 0.177 -10.986 8.545 1.00 0.00 O ATOM 462 NE2 GLN A 58 -1.229 -10.121 7.062 1.00 0.00 N ATOM 0 H GLN A 58 -2.027 -6.677 11.127 1.00 0.00 H new ATOM 0 HA GLN A 58 0.750 -7.401 11.726 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.923 -9.153 10.156 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.481 -9.531 11.134 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.998 -8.988 9.414 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.829 -8.007 8.552 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.887 -9.380 6.820 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.044 -10.875 6.400 1.00 0.00 H new ATOM 471 N ARG A 59 1.473 -6.532 9.334 1.00 0.00 N ATOM 472 CA ARG A 59 1.876 -5.784 8.151 1.00 0.00 C ATOM 473 C ARG A 59 1.293 -6.418 6.897 1.00 0.00 C ATOM 474 O ARG A 59 1.128 -7.639 6.841 1.00 0.00 O ATOM 475 CB ARG A 59 3.404 -5.652 8.022 1.00 0.00 C ATOM 476 CG ARG A 59 4.161 -6.988 8.046 1.00 0.00 C ATOM 477 CD ARG A 59 4.549 -7.334 9.483 1.00 0.00 C ATOM 478 NE ARG A 59 5.959 -7.021 9.735 1.00 0.00 N ATOM 479 CZ ARG A 59 6.614 -7.206 10.881 1.00 0.00 C ATOM 480 NH1 ARG A 59 5.947 -7.429 12.007 1.00 0.00 N ATOM 481 NH2 ARG A 59 7.939 -7.189 10.871 1.00 0.00 N ATOM 0 H ARG A 59 2.171 -7.207 9.646 1.00 0.00 H new ATOM 0 HA ARG A 59 1.479 -4.776 8.266 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.634 -5.135 7.091 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.772 -5.025 8.834 1.00 0.00 H new ATOM 0 HG2 ARG A 59 3.538 -7.778 7.627 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.054 -6.923 7.424 1.00 0.00 H new ATOM 0 HD2 ARG A 59 3.919 -6.778 10.178 1.00 0.00 H new ATOM 0 HD3 ARG A 59 4.369 -8.393 9.667 1.00 0.00 H new ATOM 0 HE ARG A 59 6.489 -6.624 8.959 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.927 -7.460 11.998 1.00 0.00 H new ATOM 0 HH12 ARG A 59 6.454 -7.570 12.881 1.00 0.00 H new ATOM 0 HH21 ARG A 59 8.440 -7.036 9.996 1.00 0.00 H new ATOM 0 HH22 ARG A 59 8.457 -7.329 11.738 1.00 0.00 H new ATOM 495 N LEU A 60 1.027 -5.608 5.873 1.00 0.00 N ATOM 496 CA LEU A 60 0.738 -6.038 4.528 1.00 0.00 C ATOM 497 C LEU A 60 0.940 -4.938 3.486 1.00 0.00 C ATOM 498 O LEU A 60 1.012 -3.748 3.796 1.00 0.00 O ATOM 499 CB LEU A 60 -0.649 -6.699 4.403 1.00 0.00 C ATOM 500 CG LEU A 60 -1.926 -6.091 5.014 1.00 0.00 C ATOM 501 CD1 LEU A 60 -1.889 -6.036 6.527 1.00 0.00 C ATOM 502 CD2 LEU A 60 -2.347 -4.710 4.532 1.00 0.00 C ATOM 0 H LEU A 60 1.009 -4.593 5.975 1.00 0.00 H new ATOM 0 HA LEU A 60 1.478 -6.807 4.306 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.841 -6.815 3.336 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.553 -7.701 4.821 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.669 -6.798 4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.816 -5.598 6.898 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.779 -7.045 6.925 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.045 -5.425 6.848 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.260 -4.408 5.046 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.555 -3.992 4.747 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.528 -4.739 3.458 1.00 0.00 H new ATOM 514 N ARG A 61 1.014 -5.373 2.222 1.00 0.00 N ATOM 515 CA ARG A 61 1.037 -4.547 1.018 1.00 0.00 C ATOM 516 C ARG A 61 -0.343 -4.555 0.381 1.00 0.00 C ATOM 517 O ARG A 61 -0.957 -5.619 0.300 1.00 0.00 O ATOM 518 CB ARG A 61 2.058 -5.116 0.013 1.00 0.00 C ATOM 519 CG ARG A 61 3.481 -4.694 0.368 1.00 0.00 C ATOM 520 CD ARG A 61 4.520 -5.017 -0.711 1.00 0.00 C ATOM 521 NE ARG A 61 4.747 -6.460 -0.865 1.00 0.00 N ATOM 522 CZ ARG A 61 5.617 -7.017 -1.715 1.00 0.00 C ATOM 523 NH1 ARG A 61 6.445 -6.278 -2.456 1.00 0.00 N ATOM 524 NH2 ARG A 61 5.638 -8.337 -1.818 1.00 0.00 N ATOM 0 H ARG A 61 1.062 -6.368 2.005 1.00 0.00 H new ATOM 0 HA ARG A 61 1.320 -3.529 1.285 1.00 0.00 H new ATOM 0 HB2 ARG A 61 1.992 -6.204 0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.814 -4.770 -0.992 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.493 -3.621 0.558 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.773 -5.185 1.296 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.190 -4.602 -1.663 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.462 -4.530 -0.460 1.00 0.00 H new ATOM 0 HE ARG A 61 4.198 -7.087 -0.277 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.425 -5.261 -2.383 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.098 -6.730 -3.096 1.00 0.00 H new ATOM 0 HH21 ARG A 61 5.001 -8.903 -1.257 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.291 -8.788 -2.458 1.00 0.00 H new ATOM 538 N VAL A 62 -0.790 -3.414 -0.136 1.00 0.00 N ATOM 539 CA VAL A 62 -1.989 -3.277 -0.951 1.00 0.00 C ATOM 540 C VAL A 62 -1.608 -2.569 -2.245 1.00 0.00 C ATOM 541 O VAL A 62 -0.867 -1.589 -2.200 1.00 0.00 O ATOM 542 CB VAL A 62 -3.055 -2.476 -0.182 1.00 0.00 C ATOM 543 CG1 VAL A 62 -4.293 -2.185 -1.045 1.00 0.00 C ATOM 544 CG2 VAL A 62 -3.479 -3.255 1.064 1.00 0.00 C ATOM 0 H VAL A 62 -0.307 -2.527 0.008 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.408 -4.257 -1.182 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.611 -1.521 0.098 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.018 -1.618 -0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.999 -1.605 -1.920 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.741 -3.125 -1.367 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.234 -2.688 1.608 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.893 -4.219 0.767 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.612 -3.415 1.706 1.00 0.00 H new ATOM 554 N GLY A 63 -2.160 -2.993 -3.386 1.00 0.00 N ATOM 555 CA GLY A 63 -2.159 -2.196 -4.607 1.00 0.00 C ATOM 556 C GLY A 63 -3.587 -1.939 -5.046 1.00 0.00 C ATOM 557 O GLY A 63 -4.412 -2.846 -5.017 1.00 0.00 O ATOM 0 H GLY A 63 -2.619 -3.899 -3.485 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.644 -1.250 -4.436 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -1.614 -2.718 -5.394 1.00 0.00 H new ATOM 561 N GLY A 64 -3.869 -0.710 -5.463 1.00 0.00 N ATOM 562 CA GLY A 64 -5.186 -0.219 -5.855 1.00 0.00 C ATOM 563 C GLY A 64 -5.023 0.979 -6.784 1.00 0.00 C ATOM 564 O GLY A 64 -3.920 1.178 -7.308 1.00 0.00 O ATOM 0 H GLY A 64 -3.149 0.008 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.746 -1.008 -6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.758 0.067 -4.972 1.00 0.00 H new ATOM 568 N MET A 65 -6.091 1.762 -6.968 1.00 0.00 N ATOM 569 CA MET A 65 -6.139 2.999 -7.744 1.00 0.00 C ATOM 570 C MET A 65 -6.711 4.122 -6.880 1.00 0.00 C ATOM 571 O MET A 65 -7.737 3.925 -6.242 1.00 0.00 O ATOM 572 CB MET A 65 -6.981 2.791 -9.001 1.00 0.00 C ATOM 573 CG MET A 65 -6.799 3.995 -9.935 1.00 0.00 C ATOM 574 SD MET A 65 -7.163 3.739 -11.687 1.00 0.00 S ATOM 575 CE MET A 65 -6.352 2.147 -11.974 1.00 0.00 C ATOM 0 H MET A 65 -6.995 1.534 -6.555 1.00 0.00 H new ATOM 0 HA MET A 65 -5.132 3.279 -8.053 1.00 0.00 H new ATOM 0 HB2 MET A 65 -6.680 1.874 -9.507 1.00 0.00 H new ATOM 0 HB3 MET A 65 -8.032 2.678 -8.735 1.00 0.00 H new ATOM 0 HG2 MET A 65 -7.433 4.804 -9.572 1.00 0.00 H new ATOM 0 HG3 MET A 65 -5.767 4.336 -9.850 1.00 0.00 H new ATOM 0 HE1 MET A 65 -6.109 2.048 -13.032 1.00 0.00 H new ATOM 0 HE2 MET A 65 -5.437 2.093 -11.384 1.00 0.00 H new ATOM 0 HE3 MET A 65 -7.022 1.339 -11.679 1.00 0.00 H new ATOM 585 N VAL A 66 -6.032 5.268 -6.767 1.00 0.00 N ATOM 586 CA VAL A 66 -6.432 6.370 -5.899 1.00 0.00 C ATOM 587 C VAL A 66 -7.749 6.927 -6.425 1.00 0.00 C ATOM 588 O VAL A 66 -7.825 7.248 -7.611 1.00 0.00 O ATOM 589 CB VAL A 66 -5.353 7.471 -5.914 1.00 0.00 C ATOM 590 CG1 VAL A 66 -5.641 8.553 -4.877 1.00 0.00 C ATOM 591 CG2 VAL A 66 -3.940 6.939 -5.670 1.00 0.00 C ATOM 0 H VAL A 66 -5.175 5.455 -7.287 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.550 6.020 -4.874 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.395 7.889 -6.920 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.860 9.312 -4.917 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.606 9.014 -5.090 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.664 8.107 -3.883 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.231 7.766 -5.694 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.898 6.452 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.683 6.219 -6.447 1.00 0.00 H new ATOM 601 N MET A 67 -8.754 7.094 -5.565 1.00 0.00 N ATOM 602 CA MET A 67 -9.961 7.809 -5.954 1.00 0.00 C ATOM 603 C MET A 67 -9.603 9.267 -6.235 1.00 0.00 C ATOM 604 O MET A 67 -9.057 9.937 -5.344 1.00 0.00 O ATOM 605 CB MET A 67 -11.011 7.781 -4.850 1.00 0.00 C ATOM 606 CG MET A 67 -11.696 6.436 -4.733 1.00 0.00 C ATOM 607 SD MET A 67 -12.994 6.513 -3.492 1.00 0.00 S ATOM 608 CE MET A 67 -13.335 4.755 -3.388 1.00 0.00 C ATOM 0 H MET A 67 -8.754 6.747 -4.606 1.00 0.00 H new ATOM 0 HA MET A 67 -10.371 7.322 -6.839 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.540 8.029 -3.899 1.00 0.00 H new ATOM 0 HB3 MET A 67 -11.759 8.550 -5.045 1.00 0.00 H new ATOM 0 HG2 MET A 67 -12.119 6.149 -5.696 1.00 0.00 H new ATOM 0 HG3 MET A 67 -10.969 5.670 -4.463 1.00 0.00 H new ATOM 0 HE1 MET A 67 -14.126 4.580 -2.659 1.00 0.00 H new ATOM 0 HE2 MET A 67 -13.653 4.388 -4.364 1.00 0.00 H new ATOM 0 HE3 MET A 67 -12.433 4.227 -3.078 1.00 0.00 H new ATOM 618 N PRO A 68 -9.928 9.771 -7.433 1.00 0.00 N ATOM 619 CA PRO A 68 -9.817 11.174 -7.773 1.00 0.00 C ATOM 620 C PRO A 68 -10.862 11.911 -6.937 1.00 0.00 C ATOM 621 O PRO A 68 -12.058 11.799 -7.196 1.00 0.00 O ATOM 622 CB PRO A 68 -10.073 11.242 -9.282 1.00 0.00 C ATOM 623 CG PRO A 68 -10.997 10.050 -9.547 1.00 0.00 C ATOM 624 CD PRO A 68 -10.627 9.045 -8.481 1.00 0.00 C ATOM 0 HA PRO A 68 -8.852 11.634 -7.562 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.542 12.184 -9.567 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.146 11.164 -9.849 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.046 10.337 -9.476 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -10.845 9.643 -10.547 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -11.518 8.559 -8.084 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -9.993 8.260 -8.895 1.00 0.00 H new ATOM 632 N GLY A 69 -10.422 12.589 -5.883 1.00 0.00 N ATOM 633 CA GLY A 69 -11.275 13.314 -4.957 1.00 0.00 C ATOM 634 C GLY A 69 -11.078 12.876 -3.515 1.00 0.00 C ATOM 635 O GLY A 69 -11.708 13.461 -2.639 1.00 0.00 O ATOM 0 H GLY A 69 -9.432 12.649 -5.645 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.070 14.381 -5.040 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.318 13.167 -5.238 1.00 0.00 H new ATOM 639 N SER A 70 -10.270 11.844 -3.245 1.00 0.00 N ATOM 640 CA SER A 70 -10.058 11.381 -1.880 1.00 0.00 C ATOM 641 C SER A 70 -8.900 12.111 -1.203 1.00 0.00 C ATOM 642 O SER A 70 -9.015 12.460 -0.029 1.00 0.00 O ATOM 643 CB SER A 70 -9.850 9.868 -1.853 1.00 0.00 C ATOM 644 OG SER A 70 -8.719 9.465 -2.616 1.00 0.00 O ATOM 0 H SER A 70 -9.757 11.320 -3.954 1.00 0.00 H new ATOM 0 HA SER A 70 -10.957 11.615 -1.309 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.726 9.539 -0.821 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.741 9.374 -2.240 1.00 0.00 H new ATOM 0 HG SER A 70 -8.901 9.603 -3.569 1.00 0.00 H new ATOM 650 N VAL A 71 -7.774 12.291 -1.906 1.00 0.00 N ATOM 651 CA VAL A 71 -6.514 12.729 -1.340 1.00 0.00 C ATOM 652 C VAL A 71 -6.670 14.089 -0.636 1.00 0.00 C ATOM 653 O VAL A 71 -6.762 15.126 -1.300 1.00 0.00 O ATOM 654 CB VAL A 71 -5.423 12.724 -2.432 1.00 0.00 C ATOM 655 CG1 VAL A 71 -4.022 12.879 -1.829 1.00 0.00 C ATOM 656 CG2 VAL A 71 -5.400 11.424 -3.248 1.00 0.00 C ATOM 0 H VAL A 71 -7.725 12.128 -2.912 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.195 12.031 -0.566 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.675 13.566 -3.077 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.280 12.871 -2.627 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.962 13.822 -1.287 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.827 12.054 -1.144 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.613 11.480 -4.000 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.208 10.581 -2.584 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.363 11.286 -3.740 1.00 0.00 H new ATOM 666 N GLN A 72 -6.697 14.064 0.703 1.00 0.00 N ATOM 667 CA GLN A 72 -6.702 15.229 1.576 1.00 0.00 C ATOM 668 C GLN A 72 -5.373 15.977 1.456 1.00 0.00 C ATOM 669 O GLN A 72 -5.334 17.107 0.962 1.00 0.00 O ATOM 670 CB GLN A 72 -6.962 14.789 3.034 1.00 0.00 C ATOM 671 CG GLN A 72 -8.432 14.428 3.298 1.00 0.00 C ATOM 672 CD GLN A 72 -8.875 14.790 4.718 1.00 0.00 C ATOM 673 OE1 GLN A 72 -9.682 15.693 4.917 1.00 0.00 O ATOM 674 NE2 GLN A 72 -8.368 14.122 5.741 1.00 0.00 N ATOM 0 H GLN A 72 -6.717 13.187 1.224 1.00 0.00 H new ATOM 0 HA GLN A 72 -7.501 15.906 1.274 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.335 13.928 3.265 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -6.664 15.591 3.709 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -9.066 14.947 2.579 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -8.576 13.360 3.137 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -7.697 13.371 5.578 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -8.648 14.358 6.693 1.00 0.00 H new ATOM 683 N ARG A 73 -4.287 15.331 1.902 1.00 0.00 N ATOM 684 CA ARG A 73 -3.046 15.939 2.412 1.00 0.00 C ATOM 685 C ARG A 73 -3.317 16.935 3.549 1.00 0.00 C ATOM 686 O ARG A 73 -4.451 17.367 3.753 1.00 0.00 O ATOM 687 CB ARG A 73 -2.192 16.576 1.296 1.00 0.00 C ATOM 688 CG ARG A 73 -2.250 15.898 -0.082 1.00 0.00 C ATOM 689 CD ARG A 73 -1.374 16.621 -1.103 1.00 0.00 C ATOM 690 NE ARG A 73 -1.833 16.302 -2.463 1.00 0.00 N ATOM 691 CZ ARG A 73 -1.093 16.155 -3.562 1.00 0.00 C ATOM 692 NH1 ARG A 73 0.237 16.165 -3.508 1.00 0.00 N ATOM 693 NH2 ARG A 73 -1.694 16.001 -4.736 1.00 0.00 N ATOM 0 H ARG A 73 -4.247 14.312 1.918 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.459 15.120 2.827 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -2.503 17.614 1.179 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.153 16.589 1.626 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -1.925 14.862 0.008 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.281 15.879 -0.435 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.418 17.697 -0.937 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.333 16.322 -0.980 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.839 16.178 -2.580 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.710 16.287 -2.613 1.00 0.00 H new ATOM 0 HH12 ARG A 73 0.783 16.051 -4.362 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -2.713 15.996 -4.791 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -1.137 15.888 -5.583 1.00 0.00 H new ATOM 707 N ASP A 74 -2.277 17.317 4.283 1.00 0.00 N ATOM 708 CA ASP A 74 -2.313 18.400 5.255 1.00 0.00 C ATOM 709 C ASP A 74 -1.474 19.534 4.673 1.00 0.00 C ATOM 710 O ASP A 74 -0.422 19.252 4.086 1.00 0.00 O ATOM 711 CB ASP A 74 -1.708 17.943 6.584 1.00 0.00 C ATOM 712 CG ASP A 74 -2.186 18.862 7.692 1.00 0.00 C ATOM 713 OD1 ASP A 74 -1.657 19.992 7.765 1.00 0.00 O ATOM 714 OD2 ASP A 74 -3.107 18.430 8.423 1.00 0.00 O ATOM 0 H ASP A 74 -1.363 16.869 4.215 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.338 18.717 5.446 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.001 16.915 6.796 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.620 17.959 6.526 1.00 0.00 H new ATOM 719 N PRO A 75 -1.891 20.806 4.739 1.00 0.00 N ATOM 720 CA PRO A 75 -1.071 21.894 4.236 1.00 0.00 C ATOM 721 C PRO A 75 -0.042 22.384 5.253 1.00 0.00 C ATOM 722 O PRO A 75 0.846 23.149 4.870 1.00 0.00 O ATOM 723 CB PRO A 75 -2.065 22.988 3.855 1.00 0.00 C ATOM 724 CG PRO A 75 -3.163 22.816 4.901 1.00 0.00 C ATOM 725 CD PRO A 75 -3.185 21.310 5.171 1.00 0.00 C ATOM 0 HA PRO A 75 -0.467 21.573 3.387 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.614 23.979 3.899 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.445 22.856 2.842 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.943 23.381 5.807 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.126 23.169 4.531 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.350 21.106 6.229 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.994 20.827 4.623 1.00 0.00 H new ATOM 733 N ASN A 76 -0.108 21.941 6.508 1.00 0.00 N ATOM 734 CA ASN A 76 0.826 22.332 7.556 1.00 0.00 C ATOM 735 C ASN A 76 1.722 21.167 7.947 1.00 0.00 C ATOM 736 O ASN A 76 2.804 21.410 8.481 1.00 0.00 O ATOM 737 CB ASN A 76 0.063 22.874 8.772 1.00 0.00 C ATOM 738 CG ASN A 76 -0.597 24.199 8.438 1.00 0.00 C ATOM 739 OD1 ASN A 76 0.064 25.231 8.379 1.00 0.00 O ATOM 740 ND2 ASN A 76 -1.887 24.209 8.153 1.00 0.00 N ATOM 0 H ASN A 76 -0.825 21.290 6.827 1.00 0.00 H new ATOM 0 HA ASN A 76 1.466 23.126 7.171 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -0.692 22.153 9.085 1.00 0.00 H new ATOM 0 HB3 ASN A 76 0.748 23.003 9.610 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.342 25.080 7.881 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.428 23.346 8.205 1.00 0.00 H new ATOM 747 N SER A 77 1.336 19.927 7.637 1.00 0.00 N ATOM 748 CA SER A 77 2.078 18.734 8.032 1.00 0.00 C ATOM 749 C SER A 77 2.243 17.821 6.818 1.00 0.00 C ATOM 750 O SER A 77 1.729 18.111 5.740 1.00 0.00 O ATOM 751 CB SER A 77 1.346 18.058 9.201 1.00 0.00 C ATOM 752 OG SER A 77 1.230 18.945 10.301 1.00 0.00 O ATOM 0 H SER A 77 0.493 19.724 7.100 1.00 0.00 H new ATOM 0 HA SER A 77 3.080 18.986 8.379 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.355 17.738 8.879 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.887 17.162 9.506 1.00 0.00 H new ATOM 0 HG SER A 77 0.760 18.497 11.035 1.00 0.00 H new ATOM 758 N LEU A 78 2.964 16.709 6.964 1.00 0.00 N ATOM 759 CA LEU A 78 3.166 15.752 5.871 1.00 0.00 C ATOM 760 C LEU A 78 2.130 14.622 5.928 1.00 0.00 C ATOM 761 O LEU A 78 2.223 13.665 5.162 1.00 0.00 O ATOM 762 CB LEU A 78 4.610 15.215 5.880 1.00 0.00 C ATOM 763 CG LEU A 78 5.651 16.182 5.276 1.00 0.00 C ATOM 764 CD1 LEU A 78 5.851 17.470 6.083 1.00 0.00 C ATOM 765 CD2 LEU A 78 6.998 15.463 5.181 1.00 0.00 C ATOM 0 H LEU A 78 3.422 16.446 7.836 1.00 0.00 H new ATOM 0 HA LEU A 78 3.017 16.272 4.924 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.895 14.989 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.640 14.276 5.327 1.00 0.00 H new ATOM 0 HG LEU A 78 5.266 16.475 4.299 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.597 18.095 5.592 1.00 0.00 H new ATOM 0 HD12 LEU A 78 4.907 18.012 6.143 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.191 17.220 7.088 1.00 0.00 H new ATOM 0 HD21 LEU A 78 7.741 16.137 4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.316 15.154 6.177 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.897 14.585 4.543 1.00 0.00 H new ATOM 777 N LYS A 79 1.157 14.685 6.845 1.00 0.00 N ATOM 778 CA LYS A 79 0.089 13.693 6.934 1.00 0.00 C ATOM 779 C LYS A 79 -0.783 13.792 5.691 1.00 0.00 C ATOM 780 O LYS A 79 -0.999 14.880 5.158 1.00 0.00 O ATOM 781 CB LYS A 79 -0.734 13.887 8.222 1.00 0.00 C ATOM 782 CG LYS A 79 -0.674 12.644 9.128 1.00 0.00 C ATOM 783 CD LYS A 79 -1.523 11.455 8.654 1.00 0.00 C ATOM 784 CE LYS A 79 -2.879 11.326 9.363 1.00 0.00 C ATOM 785 NZ LYS A 79 -3.848 12.392 9.037 1.00 0.00 N ATOM 0 H LYS A 79 1.092 15.426 7.543 1.00 0.00 H new ATOM 0 HA LYS A 79 0.521 12.693 6.982 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -0.358 14.753 8.767 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.771 14.099 7.963 1.00 0.00 H new ATOM 0 HG2 LYS A 79 0.364 12.321 9.208 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -0.998 12.927 10.129 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.694 11.550 7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -0.957 10.536 8.806 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.319 10.362 9.105 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -2.712 11.322 10.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.812 12.057 9.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -3.648 13.232 9.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.767 12.639 8.030 1.00 0.00 H new ATOM 799 N VAL A 80 -1.288 12.655 5.231 1.00 0.00 N ATOM 800 CA VAL A 80 -2.075 12.556 4.021 1.00 0.00 C ATOM 801 C VAL A 80 -2.910 11.274 4.130 1.00 0.00 C ATOM 802 O VAL A 80 -2.410 10.224 4.523 1.00 0.00 O ATOM 803 CB VAL A 80 -1.106 12.671 2.821 1.00 0.00 C ATOM 804 CG1 VAL A 80 0.093 11.741 2.900 1.00 0.00 C ATOM 805 CG2 VAL A 80 -1.791 12.564 1.471 1.00 0.00 C ATOM 0 H VAL A 80 -1.156 11.760 5.703 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.799 13.357 3.869 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.719 13.686 2.904 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.722 11.883 2.022 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.668 11.964 3.799 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.250 10.707 2.937 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.048 12.654 0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.291 11.599 1.392 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.526 13.363 1.372 1.00 0.00 H new ATOM 815 N THR A 81 -4.205 11.366 3.844 1.00 0.00 N ATOM 816 CA THR A 81 -5.198 10.310 4.030 1.00 0.00 C ATOM 817 C THR A 81 -5.999 10.173 2.749 1.00 0.00 C ATOM 818 O THR A 81 -6.665 11.139 2.360 1.00 0.00 O ATOM 819 CB THR A 81 -6.091 10.637 5.236 1.00 0.00 C ATOM 820 OG1 THR A 81 -6.612 11.947 5.092 1.00 0.00 O ATOM 821 CG2 THR A 81 -5.304 10.568 6.541 1.00 0.00 C ATOM 0 H THR A 81 -4.611 12.218 3.458 1.00 0.00 H new ATOM 0 HA THR A 81 -4.713 9.357 4.240 1.00 0.00 H new ATOM 0 HB THR A 81 -6.896 9.902 5.271 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.802 12.121 4.147 1.00 0.00 H new ATOM 0 HG21 THR A 81 -5.963 10.804 7.376 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.901 9.564 6.670 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.485 11.287 6.510 1.00 0.00 H new ATOM 829 N PHE A 82 -5.820 9.083 2.003 1.00 0.00 N ATOM 830 CA PHE A 82 -6.463 8.911 0.705 1.00 0.00 C ATOM 831 C PHE A 82 -7.286 7.634 0.694 1.00 0.00 C ATOM 832 O PHE A 82 -7.085 6.779 1.552 1.00 0.00 O ATOM 833 CB PHE A 82 -5.443 8.973 -0.443 1.00 0.00 C ATOM 834 CG PHE A 82 -4.335 7.927 -0.547 1.00 0.00 C ATOM 835 CD1 PHE A 82 -3.084 8.145 0.075 1.00 0.00 C ATOM 836 CD2 PHE A 82 -4.515 6.761 -1.327 1.00 0.00 C ATOM 837 CE1 PHE A 82 -2.001 7.287 -0.202 1.00 0.00 C ATOM 838 CE2 PHE A 82 -3.454 5.859 -1.519 1.00 0.00 C ATOM 839 CZ PHE A 82 -2.188 6.133 -0.979 1.00 0.00 C ATOM 0 H PHE A 82 -5.228 8.300 2.281 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.149 9.742 0.540 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -6.005 8.941 -1.376 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.961 9.950 -0.394 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -2.959 8.969 0.762 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.476 6.562 -1.779 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -1.020 7.519 0.186 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.614 4.952 -2.084 1.00 0.00 H new ATOM 0 HZ PHE A 82 -1.363 5.460 -1.160 1.00 0.00 H new ATOM 849 N THR A 83 -8.155 7.474 -0.299 1.00 0.00 N ATOM 850 CA THR A 83 -8.899 6.247 -0.509 1.00 0.00 C ATOM 851 C THR A 83 -8.407 5.670 -1.834 1.00 0.00 C ATOM 852 O THR A 83 -8.086 6.398 -2.783 1.00 0.00 O ATOM 853 CB THR A 83 -10.415 6.521 -0.475 1.00 0.00 C ATOM 854 OG1 THR A 83 -10.764 7.337 0.635 1.00 0.00 O ATOM 855 CG2 THR A 83 -11.254 5.243 -0.407 1.00 0.00 C ATOM 0 H THR A 83 -8.361 8.201 -0.984 1.00 0.00 H new ATOM 0 HA THR A 83 -8.731 5.517 0.283 1.00 0.00 H new ATOM 0 HB THR A 83 -10.637 7.033 -1.412 1.00 0.00 H new ATOM 0 HG1 THR A 83 -10.677 6.819 1.462 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.312 5.503 -0.386 1.00 0.00 H new ATOM 0 HG22 THR A 83 -11.050 4.627 -1.282 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.999 4.688 0.496 1.00 0.00 H new ATOM 863 N ILE A 84 -8.317 4.350 -1.894 1.00 0.00 N ATOM 864 CA ILE A 84 -7.907 3.588 -3.054 1.00 0.00 C ATOM 865 C ILE A 84 -8.991 2.554 -3.294 1.00 0.00 C ATOM 866 O ILE A 84 -9.593 2.056 -2.345 1.00 0.00 O ATOM 867 CB ILE A 84 -6.524 2.922 -2.854 1.00 0.00 C ATOM 868 CG1 ILE A 84 -6.016 2.849 -1.420 1.00 0.00 C ATOM 869 CG2 ILE A 84 -5.454 3.607 -3.710 1.00 0.00 C ATOM 870 CD1 ILE A 84 -4.890 1.812 -1.310 1.00 0.00 C ATOM 0 H ILE A 84 -8.539 3.757 -1.095 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.790 4.242 -3.918 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.696 1.893 -3.169 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.652 3.827 -1.105 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.833 2.582 -0.750 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.493 3.119 -3.550 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.728 3.533 -4.762 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.379 4.657 -3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.535 1.769 -0.280 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -5.267 0.833 -1.605 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.067 2.097 -1.966 1.00 0.00 H new ATOM 882 N TYR A 85 -9.236 2.238 -4.557 1.00 0.00 N ATOM 883 CA TYR A 85 -10.290 1.346 -4.982 1.00 0.00 C ATOM 884 C TYR A 85 -9.761 0.406 -6.056 1.00 0.00 C ATOM 885 O TYR A 85 -8.638 0.545 -6.553 1.00 0.00 O ATOM 886 CB TYR A 85 -11.492 2.167 -5.470 1.00 0.00 C ATOM 887 CG TYR A 85 -11.284 2.817 -6.817 1.00 0.00 C ATOM 888 CD1 TYR A 85 -10.558 4.013 -6.920 1.00 0.00 C ATOM 889 CD2 TYR A 85 -11.758 2.186 -7.976 1.00 0.00 C ATOM 890 CE1 TYR A 85 -10.256 4.565 -8.173 1.00 0.00 C ATOM 891 CE2 TYR A 85 -11.462 2.725 -9.235 1.00 0.00 C ATOM 892 CZ TYR A 85 -10.701 3.915 -9.350 1.00 0.00 C ATOM 893 OH TYR A 85 -10.409 4.411 -10.587 1.00 0.00 O ATOM 0 H TYR A 85 -8.687 2.609 -5.333 1.00 0.00 H new ATOM 0 HA TYR A 85 -10.627 0.733 -4.146 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.366 1.517 -5.522 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.713 2.941 -4.735 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.227 4.515 -6.023 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.350 1.286 -7.898 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.687 5.481 -8.240 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.817 2.229 -10.126 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.490 4.169 -10.828 1.00 0.00 H new ATOM 903 N ASP A 86 -10.601 -0.543 -6.424 1.00 0.00 N ATOM 904 CA ASP A 86 -10.469 -1.359 -7.627 1.00 0.00 C ATOM 905 C ASP A 86 -11.872 -1.827 -8.021 1.00 0.00 C ATOM 906 O ASP A 86 -12.863 -1.357 -7.454 1.00 0.00 O ATOM 907 CB ASP A 86 -9.487 -2.541 -7.422 1.00 0.00 C ATOM 908 CG ASP A 86 -8.991 -3.125 -8.754 1.00 0.00 C ATOM 909 OD1 ASP A 86 -9.110 -2.431 -9.790 1.00 0.00 O ATOM 910 OD2 ASP A 86 -8.458 -4.253 -8.794 1.00 0.00 O ATOM 0 H ASP A 86 -11.428 -0.780 -5.875 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.037 -0.770 -8.436 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.633 -2.203 -6.835 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -9.980 -3.324 -6.846 1.00 0.00 H new ATOM 915 N ALA A 87 -11.978 -2.758 -8.971 1.00 0.00 N ATOM 916 CA ALA A 87 -13.229 -3.263 -9.527 1.00 0.00 C ATOM 917 C ALA A 87 -14.134 -3.956 -8.500 1.00 0.00 C ATOM 918 O ALA A 87 -15.283 -4.271 -8.822 1.00 0.00 O ATOM 919 CB ALA A 87 -12.881 -4.245 -10.649 1.00 0.00 C ATOM 0 H ALA A 87 -11.158 -3.197 -9.390 1.00 0.00 H new ATOM 0 HA ALA A 87 -13.796 -2.406 -9.891 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.799 -4.640 -11.085 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.307 -3.729 -11.419 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.289 -5.066 -10.244 1.00 0.00 H new ATOM 925 N GLU A 88 -13.634 -4.193 -7.289 1.00 0.00 N ATOM 926 CA GLU A 88 -14.287 -4.919 -6.216 1.00 0.00 C ATOM 927 C GLU A 88 -14.792 -3.886 -5.224 1.00 0.00 C ATOM 928 O GLU A 88 -15.997 -3.677 -5.111 1.00 0.00 O ATOM 929 CB GLU A 88 -13.357 -5.952 -5.538 1.00 0.00 C ATOM 930 CG GLU A 88 -12.028 -6.203 -6.244 1.00 0.00 C ATOM 931 CD GLU A 88 -12.131 -6.860 -7.615 1.00 0.00 C ATOM 932 OE1 GLU A 88 -13.204 -7.370 -8.010 1.00 0.00 O ATOM 933 OE2 GLU A 88 -11.076 -6.956 -8.273 1.00 0.00 O ATOM 0 H GLU A 88 -12.707 -3.861 -7.021 1.00 0.00 H new ATOM 0 HA GLU A 88 -15.111 -5.507 -6.620 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.151 -5.617 -4.522 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.891 -6.899 -5.459 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.509 -5.251 -6.354 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.409 -6.832 -5.604 1.00 0.00 H new ATOM 940 N GLY A 89 -13.877 -3.252 -4.490 1.00 0.00 N ATOM 941 CA GLY A 89 -14.233 -2.375 -3.392 1.00 0.00 C ATOM 942 C GLY A 89 -13.227 -1.248 -3.244 1.00 0.00 C ATOM 943 O GLY A 89 -12.633 -0.804 -4.230 1.00 0.00 O ATOM 0 H GLY A 89 -12.872 -3.337 -4.645 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.226 -1.960 -3.562 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -14.281 -2.948 -2.466 1.00 0.00 H new ATOM 947 N SER A 90 -13.078 -0.739 -2.023 1.00 0.00 N ATOM 948 CA SER A 90 -12.170 0.349 -1.726 1.00 0.00 C ATOM 949 C SER A 90 -11.738 0.334 -0.256 1.00 0.00 C ATOM 950 O SER A 90 -12.349 -0.360 0.558 1.00 0.00 O ATOM 951 CB SER A 90 -12.819 1.647 -2.183 1.00 0.00 C ATOM 952 OG SER A 90 -14.137 1.824 -1.687 1.00 0.00 O ATOM 0 H SER A 90 -13.592 -1.078 -1.210 1.00 0.00 H new ATOM 0 HA SER A 90 -11.235 0.238 -2.276 1.00 0.00 H new ATOM 0 HB2 SER A 90 -12.202 2.486 -1.861 1.00 0.00 H new ATOM 0 HB3 SER A 90 -12.843 1.669 -3.273 1.00 0.00 H new ATOM 0 HG SER A 90 -14.610 2.479 -2.242 1.00 0.00 H new ATOM 958 N VAL A 91 -10.673 1.067 0.084 1.00 0.00 N ATOM 959 CA VAL A 91 -10.109 1.188 1.428 1.00 0.00 C ATOM 960 C VAL A 91 -9.525 2.575 1.610 1.00 0.00 C ATOM 961 O VAL A 91 -9.094 3.196 0.632 1.00 0.00 O ATOM 962 CB VAL A 91 -9.001 0.137 1.668 1.00 0.00 C ATOM 963 CG1 VAL A 91 -9.516 -1.292 1.506 1.00 0.00 C ATOM 964 CG2 VAL A 91 -7.770 0.341 0.772 1.00 0.00 C ATOM 0 H VAL A 91 -10.158 1.617 -0.604 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.910 1.018 2.148 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.692 0.287 2.702 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.702 -1.995 1.684 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -10.316 -1.474 2.224 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -9.898 -1.429 0.494 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -7.030 -0.429 0.990 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.067 0.273 -0.275 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.339 1.323 0.964 1.00 0.00 H new ATOM 974 N ASP A 92 -9.449 3.027 2.861 1.00 0.00 N ATOM 975 CA ASP A 92 -8.681 4.213 3.194 1.00 0.00 C ATOM 976 C ASP A 92 -7.233 3.846 3.456 1.00 0.00 C ATOM 977 O ASP A 92 -6.889 2.690 3.733 1.00 0.00 O ATOM 978 CB ASP A 92 -9.220 4.932 4.433 1.00 0.00 C ATOM 979 CG ASP A 92 -10.583 5.544 4.158 1.00 0.00 C ATOM 980 OD1 ASP A 92 -10.704 6.404 3.257 1.00 0.00 O ATOM 981 OD2 ASP A 92 -11.530 5.151 4.884 1.00 0.00 O ATOM 0 H ASP A 92 -9.912 2.586 3.656 1.00 0.00 H new ATOM 0 HA ASP A 92 -8.765 4.883 2.338 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -9.294 4.229 5.262 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.522 5.712 4.738 1.00 0.00 H new ATOM 986 N VAL A 93 -6.391 4.870 3.445 1.00 0.00 N ATOM 987 CA VAL A 93 -5.016 4.818 3.878 1.00 0.00 C ATOM 988 C VAL A 93 -4.763 6.023 4.798 1.00 0.00 C ATOM 989 O VAL A 93 -5.380 7.080 4.615 1.00 0.00 O ATOM 990 CB VAL A 93 -4.092 4.771 2.641 1.00 0.00 C ATOM 991 CG1 VAL A 93 -4.632 3.948 1.442 1.00 0.00 C ATOM 992 CG2 VAL A 93 -3.648 6.124 2.183 1.00 0.00 C ATOM 0 H VAL A 93 -6.667 5.796 3.119 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.799 3.917 4.451 1.00 0.00 H new ATOM 0 HB VAL A 93 -3.222 4.230 3.014 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.910 3.978 0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.788 2.914 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.578 4.373 1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.002 6.019 1.311 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.520 6.723 1.919 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.098 6.617 2.985 1.00 0.00 H new ATOM 1002 N SER A 94 -3.760 5.918 5.666 1.00 0.00 N ATOM 1003 CA SER A 94 -3.070 7.044 6.280 1.00 0.00 C ATOM 1004 C SER A 94 -1.614 6.891 5.872 1.00 0.00 C ATOM 1005 O SER A 94 -1.090 5.786 5.936 1.00 0.00 O ATOM 1006 CB SER A 94 -3.231 7.001 7.800 1.00 0.00 C ATOM 1007 OG SER A 94 -2.861 8.211 8.437 1.00 0.00 O ATOM 0 H SER A 94 -3.395 5.015 5.970 1.00 0.00 H new ATOM 0 HA SER A 94 -3.473 8.004 5.957 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.269 6.774 8.042 1.00 0.00 H new ATOM 0 HB3 SER A 94 -2.625 6.188 8.200 1.00 0.00 H new ATOM 0 HG SER A 94 -3.271 8.251 9.326 1.00 0.00 H new ATOM 1013 N TYR A 95 -0.969 7.964 5.446 1.00 0.00 N ATOM 1014 CA TYR A 95 0.457 8.072 5.235 1.00 0.00 C ATOM 1015 C TYR A 95 0.921 9.360 5.906 1.00 0.00 C ATOM 1016 O TYR A 95 0.129 10.271 6.168 1.00 0.00 O ATOM 1017 CB TYR A 95 0.767 8.067 3.726 1.00 0.00 C ATOM 1018 CG TYR A 95 2.233 8.233 3.363 1.00 0.00 C ATOM 1019 CD1 TYR A 95 3.150 7.333 3.916 1.00 0.00 C ATOM 1020 CD2 TYR A 95 2.694 9.247 2.495 1.00 0.00 C ATOM 1021 CE1 TYR A 95 4.513 7.425 3.611 1.00 0.00 C ATOM 1022 CE2 TYR A 95 4.052 9.308 2.115 1.00 0.00 C ATOM 1023 CZ TYR A 95 4.969 8.406 2.706 1.00 0.00 C ATOM 1024 OH TYR A 95 6.299 8.526 2.448 1.00 0.00 O ATOM 0 H TYR A 95 -1.459 8.831 5.227 1.00 0.00 H new ATOM 0 HA TYR A 95 0.988 7.225 5.670 1.00 0.00 H new ATOM 0 HB2 TYR A 95 0.409 7.129 3.302 1.00 0.00 H new ATOM 0 HB3 TYR A 95 0.200 8.868 3.253 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.803 6.559 4.585 1.00 0.00 H new ATOM 0 HD2 TYR A 95 2.000 9.984 2.118 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.216 6.745 4.069 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.386 10.031 1.385 1.00 0.00 H new ATOM 0 HH TYR A 95 6.582 7.806 1.847 1.00 0.00 H new ATOM 1034 N GLU A 96 2.224 9.466 6.137 1.00 0.00 N ATOM 1035 CA GLU A 96 2.853 10.701 6.538 1.00 0.00 C ATOM 1036 C GLU A 96 4.185 10.774 5.818 1.00 0.00 C ATOM 1037 O GLU A 96 5.140 10.073 6.168 1.00 0.00 O ATOM 1038 CB GLU A 96 2.985 10.807 8.055 1.00 0.00 C ATOM 1039 CG GLU A 96 3.404 12.232 8.445 1.00 0.00 C ATOM 1040 CD GLU A 96 3.998 12.271 9.845 1.00 0.00 C ATOM 1041 OE1 GLU A 96 3.215 12.347 10.827 1.00 0.00 O ATOM 1042 OE2 GLU A 96 5.244 12.222 9.942 1.00 0.00 O ATOM 0 H GLU A 96 2.873 8.684 6.048 1.00 0.00 H new ATOM 0 HA GLU A 96 2.239 11.557 6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 96 2.037 10.555 8.530 1.00 0.00 H new ATOM 0 HB3 GLU A 96 3.723 10.090 8.416 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.134 12.608 7.728 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.539 12.894 8.396 1.00 0.00 H new ATOM 1049 N GLY A 97 4.226 11.597 4.783 1.00 0.00 N ATOM 1050 CA GLY A 97 5.374 11.826 3.944 1.00 0.00 C ATOM 1051 C GLY A 97 4.942 12.673 2.756 1.00 0.00 C ATOM 1052 O GLY A 97 3.753 12.824 2.465 1.00 0.00 O ATOM 0 H GLY A 97 3.416 12.147 4.497 1.00 0.00 H new ATOM 0 HA2 GLY A 97 6.159 12.333 4.506 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.789 10.878 3.602 1.00 0.00 H new ATOM 1056 N ILE A 98 5.928 13.243 2.079 1.00 0.00 N ATOM 1057 CA ILE A 98 5.709 14.334 1.137 1.00 0.00 C ATOM 1058 C ILE A 98 5.107 13.863 -0.189 1.00 0.00 C ATOM 1059 O ILE A 98 4.454 14.644 -0.879 1.00 0.00 O ATOM 1060 CB ILE A 98 7.022 15.130 0.974 1.00 0.00 C ATOM 1061 CG1 ILE A 98 6.747 16.457 0.242 1.00 0.00 C ATOM 1062 CG2 ILE A 98 8.127 14.301 0.284 1.00 0.00 C ATOM 1063 CD1 ILE A 98 7.920 17.434 0.320 1.00 0.00 C ATOM 0 H ILE A 98 6.905 12.962 2.167 1.00 0.00 H new ATOM 0 HA ILE A 98 4.953 15.007 1.542 1.00 0.00 H new ATOM 0 HB ILE A 98 7.403 15.362 1.968 1.00 0.00 H new ATOM 0 HG12 ILE A 98 6.523 16.249 -0.804 1.00 0.00 H new ATOM 0 HG13 ILE A 98 5.861 16.926 0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 98 9.030 14.904 0.192 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.342 13.414 0.880 1.00 0.00 H new ATOM 0 HG23 ILE A 98 7.790 13.999 -0.708 1.00 0.00 H new ATOM 0 HD11 ILE A 98 7.667 18.350 -0.214 1.00 0.00 H new ATOM 0 HD12 ILE A 98 8.130 17.668 1.364 1.00 0.00 H new ATOM 0 HD13 ILE A 98 8.801 16.981 -0.134 1.00 0.00 H new ATOM 1075 N LEU A 99 5.294 12.575 -0.480 1.00 0.00 N ATOM 1076 CA LEU A 99 4.781 11.750 -1.561 1.00 0.00 C ATOM 1077 C LEU A 99 5.671 11.760 -2.793 1.00 0.00 C ATOM 1078 O LEU A 99 6.328 12.760 -3.083 1.00 0.00 O ATOM 1079 CB LEU A 99 3.318 12.034 -1.951 1.00 0.00 C ATOM 1080 CG LEU A 99 2.345 11.455 -0.926 1.00 0.00 C ATOM 1081 CD1 LEU A 99 0.952 11.995 -1.242 1.00 0.00 C ATOM 1082 CD2 LEU A 99 2.338 9.919 -1.000 1.00 0.00 C ATOM 0 H LEU A 99 5.894 12.015 0.126 1.00 0.00 H new ATOM 0 HA LEU A 99 4.796 10.746 -1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.164 13.110 -2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.112 11.607 -2.932 1.00 0.00 H new ATOM 0 HG LEU A 99 2.649 11.744 0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.236 11.596 -0.524 1.00 0.00 H new ATOM 0 HD12 LEU A 99 0.961 13.083 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 99 0.664 11.691 -2.248 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.640 9.522 -0.263 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.031 9.604 -1.997 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.339 9.540 -0.792 1.00 0.00 H new ATOM 1094 N PRO A 100 5.668 10.643 -3.544 1.00 0.00 N ATOM 1095 CA PRO A 100 6.409 10.555 -4.780 1.00 0.00 C ATOM 1096 C PRO A 100 5.855 11.573 -5.785 1.00 0.00 C ATOM 1097 O PRO A 100 4.645 11.834 -5.851 1.00 0.00 O ATOM 1098 CB PRO A 100 6.253 9.107 -5.277 1.00 0.00 C ATOM 1099 CG PRO A 100 5.415 8.367 -4.229 1.00 0.00 C ATOM 1100 CD PRO A 100 4.869 9.446 -3.319 1.00 0.00 C ATOM 0 HA PRO A 100 7.465 10.789 -4.648 1.00 0.00 H new ATOM 0 HB2 PRO A 100 5.763 9.083 -6.251 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.227 8.633 -5.398 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.609 7.802 -4.697 1.00 0.00 H new ATOM 0 HG3 PRO A 100 6.022 7.653 -3.672 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.818 9.638 -3.537 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.927 9.135 -2.276 1.00 0.00 H new ATOM 1108 N ASP A 101 6.733 12.044 -6.667 1.00 0.00 N ATOM 1109 CA ASP A 101 6.382 12.747 -7.905 1.00 0.00 C ATOM 1110 C ASP A 101 5.492 11.849 -8.777 1.00 0.00 C ATOM 1111 O ASP A 101 4.633 12.303 -9.541 1.00 0.00 O ATOM 1112 CB ASP A 101 7.669 13.122 -8.655 1.00 0.00 C ATOM 1113 CG ASP A 101 7.598 14.520 -9.257 1.00 0.00 C ATOM 1114 OD1 ASP A 101 6.619 14.845 -9.960 1.00 0.00 O ATOM 1115 OD2 ASP A 101 8.552 15.299 -8.993 1.00 0.00 O ATOM 0 H ASP A 101 7.740 11.946 -6.539 1.00 0.00 H new ATOM 0 HA ASP A 101 5.830 13.657 -7.670 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.516 13.065 -7.971 1.00 0.00 H new ATOM 0 HB3 ASP A 101 7.850 12.396 -9.447 1.00 0.00 H new ATOM 1120 N LEU A 102 5.699 10.538 -8.616 1.00 0.00 N ATOM 1121 CA LEU A 102 5.017 9.443 -9.262 1.00 0.00 C ATOM 1122 C LEU A 102 3.643 9.117 -8.659 1.00 0.00 C ATOM 1123 O LEU A 102 2.918 8.368 -9.298 1.00 0.00 O ATOM 1124 CB LEU A 102 5.946 8.207 -9.216 1.00 0.00 C ATOM 1125 CG LEU A 102 6.148 7.477 -10.560 1.00 0.00 C ATOM 1126 CD1 LEU A 102 4.868 7.079 -11.289 1.00 0.00 C ATOM 1127 CD2 LEU A 102 7.001 8.279 -11.534 1.00 0.00 C ATOM 0 H LEU A 102 6.413 10.201 -7.971 1.00 0.00 H new ATOM 0 HA LEU A 102 4.806 9.741 -10.289 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.921 8.521 -8.843 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.542 7.497 -8.494 1.00 0.00 H new ATOM 0 HG LEU A 102 6.655 6.562 -10.255 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.122 6.573 -12.221 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.284 6.408 -10.659 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.282 7.971 -11.509 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.113 7.721 -12.464 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.518 9.234 -11.740 1.00 0.00 H new ATOM 0 HD23 LEU A 102 7.984 8.456 -11.097 1.00 0.00 H new ATOM 1139 N PHE A 103 3.236 9.591 -7.470 1.00 0.00 N ATOM 1140 CA PHE A 103 1.896 9.312 -6.952 1.00 0.00 C ATOM 1141 C PHE A 103 0.971 10.364 -7.534 1.00 0.00 C ATOM 1142 O PHE A 103 1.253 11.552 -7.354 1.00 0.00 O ATOM 1143 CB PHE A 103 1.876 9.408 -5.418 1.00 0.00 C ATOM 1144 CG PHE A 103 0.509 9.224 -4.771 1.00 0.00 C ATOM 1145 CD1 PHE A 103 -0.454 10.249 -4.807 1.00 0.00 C ATOM 1146 CD2 PHE A 103 0.180 8.022 -4.128 1.00 0.00 C ATOM 1147 CE1 PHE A 103 -1.716 10.082 -4.197 1.00 0.00 C ATOM 1148 CE2 PHE A 103 -1.069 7.850 -3.538 1.00 0.00 C ATOM 1149 CZ PHE A 103 -2.019 8.878 -3.543 1.00 0.00 C ATOM 0 H PHE A 103 3.815 10.165 -6.857 1.00 0.00 H new ATOM 0 HA PHE A 103 1.584 8.305 -7.229 1.00 0.00 H new ATOM 0 HB2 PHE A 103 2.554 8.656 -5.015 1.00 0.00 H new ATOM 0 HB3 PHE A 103 2.269 10.382 -5.126 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.224 11.177 -5.309 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.903 7.221 -4.090 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -2.445 10.878 -4.233 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.309 6.908 -3.068 1.00 0.00 H new ATOM 0 HZ PHE A 103 -2.971 8.746 -3.051 1.00 0.00 H new ATOM 1159 N ARG A 104 -0.147 9.980 -8.165 1.00 0.00 N ATOM 1160 CA ARG A 104 -1.174 10.923 -8.573 1.00 0.00 C ATOM 1161 C ARG A 104 -2.559 10.414 -8.214 1.00 0.00 C ATOM 1162 O ARG A 104 -2.784 9.224 -7.988 1.00 0.00 O ATOM 1163 CB ARG A 104 -1.062 11.215 -10.077 1.00 0.00 C ATOM 1164 CG ARG A 104 0.345 11.654 -10.503 1.00 0.00 C ATOM 1165 CD ARG A 104 0.657 13.081 -10.033 1.00 0.00 C ATOM 1166 NE ARG A 104 2.066 13.466 -10.230 1.00 0.00 N ATOM 1167 CZ ARG A 104 2.492 14.634 -10.726 1.00 0.00 C ATOM 1168 NH1 ARG A 104 1.671 15.441 -11.392 1.00 0.00 N ATOM 1169 NH2 ARG A 104 3.752 15.005 -10.561 1.00 0.00 N ATOM 0 H ARG A 104 -0.356 9.010 -8.402 1.00 0.00 H new ATOM 0 HA ARG A 104 -1.019 11.856 -8.031 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -1.342 10.322 -10.636 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -1.775 11.995 -10.344 1.00 0.00 H new ATOM 0 HG2 ARG A 104 1.082 10.965 -10.091 1.00 0.00 H new ATOM 0 HG3 ARG A 104 0.431 11.601 -11.588 1.00 0.00 H new ATOM 0 HD2 ARG A 104 0.018 13.781 -10.571 1.00 0.00 H new ATOM 0 HD3 ARG A 104 0.408 13.170 -8.976 1.00 0.00 H new ATOM 0 HE ARG A 104 2.777 12.784 -9.966 1.00 0.00 H new ATOM 0 HH11 ARG A 104 0.697 15.174 -11.533 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.016 16.327 -11.762 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.400 14.401 -10.055 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.075 15.895 -10.940 1.00 0.00 H new ATOM 1183 N GLU A 105 -3.495 11.346 -8.220 1.00 0.00 N ATOM 1184 CA GLU A 105 -4.916 11.130 -8.040 1.00 0.00 C ATOM 1185 C GLU A 105 -5.467 10.486 -9.310 1.00 0.00 C ATOM 1186 O GLU A 105 -5.555 11.142 -10.350 1.00 0.00 O ATOM 1187 CB GLU A 105 -5.573 12.486 -7.750 1.00 0.00 C ATOM 1188 CG GLU A 105 -5.305 12.907 -6.300 1.00 0.00 C ATOM 1189 CD GLU A 105 -5.185 14.420 -6.100 1.00 0.00 C ATOM 1190 OE1 GLU A 105 -6.149 15.143 -6.450 1.00 0.00 O ATOM 1191 OE2 GLU A 105 -4.159 14.864 -5.530 1.00 0.00 O ATOM 0 H GLU A 105 -3.268 12.331 -8.359 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.125 10.463 -7.203 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.183 13.240 -8.433 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.647 12.422 -7.925 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.110 12.531 -5.669 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -4.385 12.432 -5.959 1.00 0.00 H new ATOM 1198 N GLY A 106 -5.826 9.205 -9.239 1.00 0.00 N ATOM 1199 CA GLY A 106 -6.396 8.454 -10.349 1.00 0.00 C ATOM 1200 C GLY A 106 -5.337 7.639 -11.082 1.00 0.00 C ATOM 1201 O GLY A 106 -5.351 7.600 -12.312 1.00 0.00 O ATOM 0 H GLY A 106 -5.725 8.651 -8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -7.174 7.788 -9.976 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.873 9.142 -11.047 1.00 0.00 H new ATOM 1205 N GLN A 107 -4.371 7.059 -10.363 1.00 0.00 N ATOM 1206 CA GLN A 107 -3.481 6.033 -10.905 1.00 0.00 C ATOM 1207 C GLN A 107 -3.223 4.921 -9.894 1.00 0.00 C ATOM 1208 O GLN A 107 -3.554 5.055 -8.707 1.00 0.00 O ATOM 1209 CB GLN A 107 -2.139 6.631 -11.360 1.00 0.00 C ATOM 1210 CG GLN A 107 -1.510 7.502 -10.295 1.00 0.00 C ATOM 1211 CD GLN A 107 -0.053 7.727 -10.636 1.00 0.00 C ATOM 1212 OE1 GLN A 107 0.308 8.610 -11.400 1.00 0.00 O ATOM 1213 NE2 GLN A 107 0.807 6.919 -10.062 1.00 0.00 N ATOM 0 H GLN A 107 -4.186 7.290 -9.387 1.00 0.00 H new ATOM 0 HA GLN A 107 -3.989 5.609 -11.771 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.453 5.824 -11.619 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -2.294 7.220 -12.264 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -2.033 8.456 -10.232 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -1.598 7.025 -9.319 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.478 6.191 -9.428 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.805 7.019 -10.249 1.00 0.00 H new ATOM 1222 N GLY A 108 -2.583 3.851 -10.366 1.00 0.00 N ATOM 1223 CA GLY A 108 -2.115 2.757 -9.543 1.00 0.00 C ATOM 1224 C GLY A 108 -1.038 3.221 -8.563 1.00 0.00 C ATOM 1225 O GLY A 108 -0.129 3.975 -8.927 1.00 0.00 O ATOM 0 H GLY A 108 -2.375 3.727 -11.357 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.952 2.330 -8.991 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.716 1.966 -10.178 1.00 0.00 H new ATOM 1229 N VAL A 109 -1.130 2.761 -7.318 1.00 0.00 N ATOM 1230 CA VAL A 109 -0.115 2.900 -6.273 1.00 0.00 C ATOM 1231 C VAL A 109 0.018 1.531 -5.585 1.00 0.00 C ATOM 1232 O VAL A 109 -0.851 0.671 -5.765 1.00 0.00 O ATOM 1233 CB VAL A 109 -0.418 4.070 -5.319 1.00 0.00 C ATOM 1234 CG1 VAL A 109 -0.818 5.357 -6.072 1.00 0.00 C ATOM 1235 CG2 VAL A 109 -1.291 3.698 -4.118 1.00 0.00 C ATOM 0 H VAL A 109 -1.954 2.256 -6.993 1.00 0.00 H new ATOM 0 HA VAL A 109 0.852 3.171 -6.697 1.00 0.00 H new ATOM 0 HB VAL A 109 0.527 4.323 -4.837 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -1.021 6.151 -5.353 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.004 5.662 -6.729 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.712 5.168 -6.666 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.454 4.581 -3.500 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.251 3.318 -4.469 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.791 2.930 -3.529 1.00 0.00 H new ATOM 1245 N VAL A 110 1.045 1.331 -4.761 1.00 0.00 N ATOM 1246 CA VAL A 110 1.190 0.213 -3.846 1.00 0.00 C ATOM 1247 C VAL A 110 1.492 0.803 -2.481 1.00 0.00 C ATOM 1248 O VAL A 110 2.555 1.413 -2.306 1.00 0.00 O ATOM 1249 CB VAL A 110 2.280 -0.748 -4.352 1.00 0.00 C ATOM 1250 CG1 VAL A 110 2.822 -1.676 -3.257 1.00 0.00 C ATOM 1251 CG2 VAL A 110 1.662 -1.591 -5.466 1.00 0.00 C ATOM 0 H VAL A 110 1.833 1.977 -4.715 1.00 0.00 H new ATOM 0 HA VAL A 110 0.283 -0.387 -3.779 1.00 0.00 H new ATOM 0 HB VAL A 110 3.126 -0.156 -4.701 1.00 0.00 H new ATOM 0 HG11 VAL A 110 3.587 -2.328 -3.679 1.00 0.00 H new ATOM 0 HG12 VAL A 110 3.256 -1.078 -2.456 1.00 0.00 H new ATOM 0 HG13 VAL A 110 2.008 -2.282 -2.858 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.407 -2.287 -5.851 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.813 -2.150 -5.071 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.324 -0.939 -6.271 1.00 0.00 H new ATOM 1261 N VAL A 111 0.550 0.768 -1.547 1.00 0.00 N ATOM 1262 CA VAL A 111 0.817 1.030 -0.147 1.00 0.00 C ATOM 1263 C VAL A 111 1.421 -0.248 0.451 1.00 0.00 C ATOM 1264 O VAL A 111 1.249 -1.363 -0.060 1.00 0.00 O ATOM 1265 CB VAL A 111 -0.492 1.480 0.524 1.00 0.00 C ATOM 1266 CG1 VAL A 111 -0.585 1.156 2.011 1.00 0.00 C ATOM 1267 CG2 VAL A 111 -0.723 2.973 0.361 1.00 0.00 C ATOM 0 H VAL A 111 -0.427 0.555 -1.746 1.00 0.00 H new ATOM 0 HA VAL A 111 1.534 1.836 0.010 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.259 0.906 0.005 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.540 1.509 2.401 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.511 0.078 2.154 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.229 1.649 2.542 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.657 3.252 0.848 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.102 3.521 0.817 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.779 3.219 -0.699 1.00 0.00 H new ATOM 1277 N GLN A 112 2.128 -0.058 1.550 1.00 0.00 N ATOM 1278 CA GLN A 112 2.744 -1.053 2.393 1.00 0.00 C ATOM 1279 C GLN A 112 2.751 -0.462 3.774 1.00 0.00 C ATOM 1280 O GLN A 112 3.034 0.726 3.906 1.00 0.00 O ATOM 1281 CB GLN A 112 4.180 -1.288 1.891 1.00 0.00 C ATOM 1282 CG GLN A 112 4.993 -2.198 2.804 1.00 0.00 C ATOM 1283 CD GLN A 112 5.974 -3.090 2.047 1.00 0.00 C ATOM 1284 OE1 GLN A 112 6.563 -2.759 1.019 1.00 0.00 O ATOM 1285 NE2 GLN A 112 6.075 -4.317 2.507 1.00 0.00 N ATOM 0 H GLN A 112 2.298 0.884 1.902 1.00 0.00 H new ATOM 0 HA GLN A 112 2.220 -2.009 2.384 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.142 -1.725 0.893 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.688 -0.328 1.800 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.545 -1.586 3.518 1.00 0.00 H new ATOM 0 HG3 GLN A 112 4.313 -2.825 3.380 1.00 0.00 H new ATOM 0 HE21 GLN A 112 5.584 -4.584 3.360 1.00 0.00 H new ATOM 0 HE22 GLN A 112 6.645 -5.002 2.011 1.00 0.00 H new ATOM 1294 N GLY A 113 2.454 -1.280 4.771 1.00 0.00 N ATOM 1295 CA GLY A 113 2.570 -0.935 6.165 1.00 0.00 C ATOM 1296 C GLY A 113 1.679 -1.925 6.870 1.00 0.00 C ATOM 1297 O GLY A 113 1.947 -3.116 6.730 1.00 0.00 O ATOM 0 H GLY A 113 2.116 -2.230 4.620 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.601 -1.013 6.509 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.249 0.090 6.349 1.00 0.00 H new ATOM 1301 N GLU A 114 0.632 -1.491 7.565 1.00 0.00 N ATOM 1302 CA GLU A 114 -0.069 -2.306 8.546 1.00 0.00 C ATOM 1303 C GLU A 114 -1.576 -2.077 8.487 1.00 0.00 C ATOM 1304 O GLU A 114 -2.035 -1.050 7.997 1.00 0.00 O ATOM 1305 CB GLU A 114 0.510 -1.960 9.921 1.00 0.00 C ATOM 1306 CG GLU A 114 1.825 -2.713 10.193 1.00 0.00 C ATOM 1307 CD GLU A 114 2.723 -1.999 11.197 1.00 0.00 C ATOM 1308 OE1 GLU A 114 2.324 -1.825 12.374 1.00 0.00 O ATOM 1309 OE2 GLU A 114 3.844 -1.580 10.824 1.00 0.00 O ATOM 0 H GLU A 114 0.244 -0.554 7.460 1.00 0.00 H new ATOM 0 HA GLU A 114 0.076 -3.366 8.336 1.00 0.00 H new ATOM 0 HB2 GLU A 114 0.687 -0.886 9.981 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -0.217 -2.207 10.694 1.00 0.00 H new ATOM 0 HG2 GLU A 114 1.595 -3.711 10.565 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.366 -2.839 9.255 1.00 0.00 H new ATOM 1316 N LEU A 115 -2.356 -3.049 8.959 1.00 0.00 N ATOM 1317 CA LEU A 115 -3.815 -2.977 8.995 1.00 0.00 C ATOM 1318 C LEU A 115 -4.252 -2.171 10.230 1.00 0.00 C ATOM 1319 O LEU A 115 -3.603 -2.275 11.269 1.00 0.00 O ATOM 1320 CB LEU A 115 -4.353 -4.416 8.999 1.00 0.00 C ATOM 1321 CG LEU A 115 -5.613 -4.647 8.117 1.00 0.00 C ATOM 1322 CD1 LEU A 115 -6.271 -6.003 8.383 1.00 0.00 C ATOM 1323 CD2 LEU A 115 -6.678 -3.559 8.100 1.00 0.00 C ATOM 0 H LEU A 115 -1.985 -3.922 9.333 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.221 -2.462 8.124 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -3.562 -5.085 8.659 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -4.589 -4.697 10.025 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.176 -4.616 7.119 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.146 -6.115 7.742 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.560 -6.801 8.169 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.577 -6.060 9.428 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.494 -3.859 7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.061 -3.409 9.109 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -6.242 -2.629 7.735 1.00 0.00 H new ATOM 1335 N GLU A 116 -5.313 -1.361 10.138 1.00 0.00 N ATOM 1336 CA GLU A 116 -5.769 -0.477 11.208 1.00 0.00 C ATOM 1337 C GLU A 116 -6.837 -1.193 12.037 1.00 0.00 C ATOM 1338 O GLU A 116 -6.572 -1.600 13.165 1.00 0.00 O ATOM 1339 CB GLU A 116 -6.273 0.837 10.586 1.00 0.00 C ATOM 1340 CG GLU A 116 -6.332 2.014 11.563 1.00 0.00 C ATOM 1341 CD GLU A 116 -7.376 1.894 12.666 1.00 0.00 C ATOM 1342 OE1 GLU A 116 -8.559 1.663 12.336 1.00 0.00 O ATOM 1343 OE2 GLU A 116 -7.010 2.121 13.841 1.00 0.00 O ATOM 0 H GLU A 116 -5.889 -1.303 9.298 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.954 -0.227 11.887 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.623 1.104 9.753 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -7.268 0.672 10.174 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -5.352 2.131 12.025 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.528 2.925 10.997 1.00 0.00 H new ATOM 1350 N LYS A 117 -8.040 -1.361 11.478 1.00 0.00 N ATOM 1351 CA LYS A 117 -9.120 -2.154 12.040 1.00 0.00 C ATOM 1352 C LYS A 117 -9.839 -2.877 10.921 1.00 0.00 C ATOM 1353 O LYS A 117 -9.502 -4.020 10.637 1.00 0.00 O ATOM 1354 CB LYS A 117 -10.076 -1.326 12.905 1.00 0.00 C ATOM 1355 CG LYS A 117 -9.649 -1.306 14.381 1.00 0.00 C ATOM 1356 CD LYS A 117 -10.810 -0.928 15.309 1.00 0.00 C ATOM 1357 CE LYS A 117 -11.367 0.438 14.923 1.00 0.00 C ATOM 1358 NZ LYS A 117 -12.588 0.799 15.669 1.00 0.00 N ATOM 0 H LYS A 117 -8.290 -0.929 10.588 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.690 -2.890 12.719 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.115 -0.305 12.526 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.083 -1.735 12.825 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -9.266 -2.287 14.661 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.833 -0.595 14.513 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.596 -1.681 15.246 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.468 -0.910 16.344 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -10.604 1.197 15.098 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -11.586 0.446 13.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -12.918 1.737 15.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.329 0.094 15.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -12.379 0.822 16.687 1.00 0.00 H new ATOM 1372 N GLY A 118 -10.815 -2.209 10.300 1.00 0.00 N ATOM 1373 CA GLY A 118 -11.699 -2.843 9.347 1.00 0.00 C ATOM 1374 C GLY A 118 -10.912 -3.221 8.109 1.00 0.00 C ATOM 1375 O GLY A 118 -10.692 -4.399 7.843 1.00 0.00 O ATOM 0 H GLY A 118 -11.005 -1.218 10.450 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.152 -3.730 9.789 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.512 -2.167 9.083 1.00 0.00 H new ATOM 1379 N ASN A 119 -10.495 -2.208 7.349 1.00 0.00 N ATOM 1380 CA ASN A 119 -9.869 -2.404 6.038 1.00 0.00 C ATOM 1381 C ASN A 119 -8.818 -1.341 5.716 1.00 0.00 C ATOM 1382 O ASN A 119 -8.318 -1.298 4.598 1.00 0.00 O ATOM 1383 CB ASN A 119 -10.934 -2.407 4.920 1.00 0.00 C ATOM 1384 CG ASN A 119 -12.154 -3.282 5.183 1.00 0.00 C ATOM 1385 OD1 ASN A 119 -13.211 -2.779 5.564 1.00 0.00 O ATOM 1386 ND2 ASN A 119 -12.065 -4.587 4.999 1.00 0.00 N ATOM 0 H ASN A 119 -10.581 -1.229 7.623 1.00 0.00 H new ATOM 0 HA ASN A 119 -9.367 -3.370 6.085 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -11.270 -1.383 4.759 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -10.464 -2.737 3.994 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.874 -5.183 5.173 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -11.187 -4.999 4.683 1.00 0.00 H new ATOM 1393 N HIS A 120 -8.524 -0.457 6.667 1.00 0.00 N ATOM 1394 CA HIS A 120 -7.750 0.763 6.468 1.00 0.00 C ATOM 1395 C HIS A 120 -6.296 0.396 6.697 1.00 0.00 C ATOM 1396 O HIS A 120 -5.997 -0.340 7.633 1.00 0.00 O ATOM 1397 CB HIS A 120 -8.263 1.838 7.445 1.00 0.00 C ATOM 1398 CG HIS A 120 -7.420 3.082 7.696 1.00 0.00 C ATOM 1399 ND1 HIS A 120 -7.551 3.950 8.766 1.00 0.00 N ATOM 1400 CD2 HIS A 120 -6.391 3.568 6.934 1.00 0.00 C ATOM 1401 CE1 HIS A 120 -6.588 4.886 8.663 1.00 0.00 C ATOM 1402 NE2 HIS A 120 -5.855 4.684 7.566 1.00 0.00 N ATOM 0 H HIS A 120 -8.830 -0.577 7.633 1.00 0.00 H new ATOM 0 HA HIS A 120 -7.853 1.177 5.465 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -9.237 2.170 7.085 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.427 1.354 8.408 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -8.254 3.891 9.503 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.052 3.153 5.997 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -6.431 5.688 9.369 1.00 0.00 H new ATOM 1410 N ILE A 121 -5.412 0.886 5.842 1.00 0.00 N ATOM 1411 CA ILE A 121 -3.998 0.580 5.852 1.00 0.00 C ATOM 1412 C ILE A 121 -3.225 1.808 6.346 1.00 0.00 C ATOM 1413 O ILE A 121 -3.324 2.897 5.777 1.00 0.00 O ATOM 1414 CB ILE A 121 -3.568 0.162 4.434 1.00 0.00 C ATOM 1415 CG1 ILE A 121 -4.597 -0.740 3.702 1.00 0.00 C ATOM 1416 CG2 ILE A 121 -2.183 -0.497 4.500 1.00 0.00 C ATOM 1417 CD1 ILE A 121 -4.826 -2.111 4.319 1.00 0.00 C ATOM 0 H ILE A 121 -5.674 1.531 5.096 1.00 0.00 H new ATOM 0 HA ILE A 121 -3.782 -0.247 6.528 1.00 0.00 H new ATOM 0 HB ILE A 121 -3.519 1.068 3.830 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -5.551 -0.215 3.664 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -4.266 -0.876 2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -1.874 -0.795 3.498 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -1.462 0.212 4.907 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -2.229 -1.377 5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -5.562 -2.657 3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -3.888 -2.666 4.332 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -5.192 -1.994 5.339 1.00 0.00 H new ATOM 1429 N LEU A 122 -2.381 1.616 7.352 1.00 0.00 N ATOM 1430 CA LEU A 122 -1.351 2.563 7.733 1.00 0.00 C ATOM 1431 C LEU A 122 -0.255 2.331 6.715 1.00 0.00 C ATOM 1432 O LEU A 122 0.412 1.298 6.737 1.00 0.00 O ATOM 1433 CB LEU A 122 -0.779 2.257 9.123 1.00 0.00 C ATOM 1434 CG LEU A 122 -1.665 2.605 10.320 1.00 0.00 C ATOM 1435 CD1 LEU A 122 -2.001 4.099 10.457 1.00 0.00 C ATOM 1436 CD2 LEU A 122 -2.992 1.858 10.305 1.00 0.00 C ATOM 0 H LEU A 122 -2.397 0.779 7.935 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.742 3.580 7.762 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.547 1.193 9.169 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.164 2.794 9.229 1.00 0.00 H new ATOM 0 HG LEU A 122 -1.050 2.300 11.167 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.632 4.251 11.332 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.080 4.670 10.570 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.530 4.436 9.565 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.580 2.143 11.177 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.542 2.111 9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.805 0.784 10.329 1.00 0.00 H new ATOM 1448 N ALA A 123 -0.140 3.237 5.761 1.00 0.00 N ATOM 1449 CA ALA A 123 0.947 3.260 4.817 1.00 0.00 C ATOM 1450 C ALA A 123 2.207 3.769 5.511 1.00 0.00 C ATOM 1451 O ALA A 123 2.204 4.808 6.165 1.00 0.00 O ATOM 1452 CB ALA A 123 0.600 4.156 3.642 1.00 0.00 C ATOM 0 H ALA A 123 -0.816 3.989 5.624 1.00 0.00 H new ATOM 0 HA ALA A 123 1.122 2.251 4.443 1.00 0.00 H new ATOM 0 HB1 ALA A 123 1.429 4.166 2.935 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.294 3.777 3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 123 0.416 5.169 3.999 1.00 0.00 H new ATOM 1458 N LYS A 124 3.306 3.064 5.288 1.00 0.00 N ATOM 1459 CA LYS A 124 4.622 3.350 5.840 1.00 0.00 C ATOM 1460 C LYS A 124 5.520 4.055 4.825 1.00 0.00 C ATOM 1461 O LYS A 124 6.461 4.734 5.226 1.00 0.00 O ATOM 1462 CB LYS A 124 5.185 2.044 6.429 1.00 0.00 C ATOM 1463 CG LYS A 124 5.920 1.143 5.423 1.00 0.00 C ATOM 1464 CD LYS A 124 7.428 1.403 5.506 1.00 0.00 C ATOM 1465 CE LYS A 124 8.058 0.466 6.540 1.00 0.00 C ATOM 1466 NZ LYS A 124 9.515 0.347 6.356 1.00 0.00 N ATOM 0 H LYS A 124 3.305 2.238 4.689 1.00 0.00 H new ATOM 0 HA LYS A 124 4.561 4.070 6.656 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.870 2.294 7.239 1.00 0.00 H new ATOM 0 HB3 LYS A 124 4.364 1.478 6.869 1.00 0.00 H new ATOM 0 HG2 LYS A 124 5.709 0.095 5.636 1.00 0.00 H new ATOM 0 HG3 LYS A 124 5.562 1.341 4.413 1.00 0.00 H new ATOM 0 HD2 LYS A 124 7.888 1.245 4.530 1.00 0.00 H new ATOM 0 HD3 LYS A 124 7.613 2.441 5.782 1.00 0.00 H new ATOM 0 HE2 LYS A 124 7.848 0.838 7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 124 7.600 -0.520 6.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 9.904 -0.296 7.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 9.715 -0.032 5.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 9.955 1.284 6.455 1.00 0.00 H new ATOM 1480 N GLU A 125 5.243 3.940 3.519 1.00 0.00 N ATOM 1481 CA GLU A 125 6.158 4.436 2.492 1.00 0.00 C ATOM 1482 C GLU A 125 5.483 5.022 1.250 1.00 0.00 C ATOM 1483 O GLU A 125 5.960 6.047 0.782 1.00 0.00 O ATOM 1484 CB GLU A 125 7.192 3.348 2.163 1.00 0.00 C ATOM 1485 CG GLU A 125 6.593 2.071 1.562 1.00 0.00 C ATOM 1486 CD GLU A 125 7.547 0.877 1.645 1.00 0.00 C ATOM 1487 OE1 GLU A 125 8.531 0.825 0.871 1.00 0.00 O ATOM 1488 OE2 GLU A 125 7.309 -0.020 2.478 1.00 0.00 O ATOM 0 H GLU A 125 4.394 3.509 3.153 1.00 0.00 H new ATOM 0 HA GLU A 125 6.671 5.301 2.913 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.923 3.756 1.465 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.732 3.089 3.074 1.00 0.00 H new ATOM 0 HG2 GLU A 125 5.667 1.828 2.083 1.00 0.00 H new ATOM 0 HG3 GLU A 125 6.333 2.252 0.519 1.00 0.00 H new ATOM 1495 N VAL A 126 4.377 4.454 0.756 1.00 0.00 N ATOM 1496 CA VAL A 126 3.638 4.881 -0.440 1.00 0.00 C ATOM 1497 C VAL A 126 4.503 4.883 -1.713 1.00 0.00 C ATOM 1498 O VAL A 126 5.347 5.748 -1.947 1.00 0.00 O ATOM 1499 CB VAL A 126 2.853 6.187 -0.188 1.00 0.00 C ATOM 1500 CG1 VAL A 126 2.174 6.749 -1.449 1.00 0.00 C ATOM 1501 CG2 VAL A 126 1.737 5.903 0.821 1.00 0.00 C ATOM 0 H VAL A 126 3.950 3.642 1.202 1.00 0.00 H new ATOM 0 HA VAL A 126 2.881 4.124 -0.644 1.00 0.00 H new ATOM 0 HB VAL A 126 3.580 6.918 0.167 1.00 0.00 H new ATOM 0 HG11 VAL A 126 1.641 7.666 -1.197 1.00 0.00 H new ATOM 0 HG12 VAL A 126 2.930 6.964 -2.204 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.469 6.016 -1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 126 1.174 6.818 1.008 1.00 0.00 H new ATOM 0 HG22 VAL A 126 1.069 5.141 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 126 2.173 5.547 1.755 1.00 0.00 H new ATOM 1511 N LEU A 127 4.260 3.892 -2.576 1.00 0.00 N ATOM 1512 CA LEU A 127 5.010 3.657 -3.809 1.00 0.00 C ATOM 1513 C LEU A 127 4.043 3.732 -4.975 1.00 0.00 C ATOM 1514 O LEU A 127 2.850 3.487 -4.762 1.00 0.00 O ATOM 1515 CB LEU A 127 5.601 2.230 -3.795 1.00 0.00 C ATOM 1516 CG LEU A 127 6.539 1.933 -2.613 1.00 0.00 C ATOM 1517 CD1 LEU A 127 6.669 0.426 -2.389 1.00 0.00 C ATOM 1518 CD2 LEU A 127 7.903 2.573 -2.856 1.00 0.00 C ATOM 0 H LEU A 127 3.514 3.212 -2.430 1.00 0.00 H new ATOM 0 HA LEU A 127 5.806 4.397 -3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.781 1.512 -3.779 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.148 2.069 -4.724 1.00 0.00 H new ATOM 0 HG LEU A 127 6.112 2.365 -1.708 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.337 0.239 -1.548 1.00 0.00 H new ATOM 0 HD12 LEU A 127 5.687 0.004 -2.173 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.075 -0.041 -3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.561 2.358 -2.014 1.00 0.00 H new ATOM 0 HD22 LEU A 127 8.338 2.167 -3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.786 3.652 -2.958 1.00 0.00 H new ATOM 1530 N ALA A 128 4.489 4.013 -6.204 1.00 0.00 N ATOM 1531 CA ALA A 128 3.581 4.188 -7.348 1.00 0.00 C ATOM 1532 C ALA A 128 3.800 3.132 -8.437 1.00 0.00 C ATOM 1533 O ALA A 128 3.622 3.404 -9.618 1.00 0.00 O ATOM 1534 CB ALA A 128 3.545 5.648 -7.828 1.00 0.00 C ATOM 0 H ALA A 128 5.476 4.125 -6.435 1.00 0.00 H new ATOM 0 HA ALA A 128 2.564 3.992 -7.010 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.863 5.736 -8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.201 6.289 -7.017 1.00 0.00 H new ATOM 0 HB3 ALA A 128 4.545 5.955 -8.134 1.00 0.00 H new ATOM 1540 N LYS A 129 4.193 1.917 -8.035 1.00 0.00 N ATOM 1541 CA LYS A 129 4.375 0.752 -8.915 1.00 0.00 C ATOM 1542 C LYS A 129 5.357 0.922 -10.094 1.00 0.00 C ATOM 1543 O LYS A 129 5.342 0.066 -10.978 1.00 0.00 O ATOM 1544 CB LYS A 129 2.981 0.258 -9.390 1.00 0.00 C ATOM 1545 CG LYS A 129 2.643 -1.137 -8.848 1.00 0.00 C ATOM 1546 CD LYS A 129 3.436 -2.294 -9.465 1.00 0.00 C ATOM 1547 CE LYS A 129 3.004 -2.557 -10.912 1.00 0.00 C ATOM 1548 NZ LYS A 129 3.704 -3.708 -11.517 1.00 0.00 N ATOM 0 H LYS A 129 4.400 1.709 -7.058 1.00 0.00 H new ATOM 0 HA LYS A 129 4.873 -0.003 -8.306 1.00 0.00 H new ATOM 0 HB2 LYS A 129 2.218 0.966 -9.067 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.957 0.238 -10.480 1.00 0.00 H new ATOM 0 HG2 LYS A 129 2.809 -1.139 -7.771 1.00 0.00 H new ATOM 0 HG3 LYS A 129 1.581 -1.322 -9.007 1.00 0.00 H new ATOM 0 HD2 LYS A 129 4.501 -2.063 -9.438 1.00 0.00 H new ATOM 0 HD3 LYS A 129 3.290 -3.196 -8.870 1.00 0.00 H new ATOM 0 HE2 LYS A 129 1.929 -2.736 -10.939 1.00 0.00 H new ATOM 0 HE3 LYS A 129 3.194 -1.666 -11.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 3.374 -3.840 -12.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 4.729 -3.529 -11.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.503 -4.566 -10.965 1.00 0.00 H new ATOM 1562 N HIS A 130 6.233 1.932 -10.122 1.00 0.00 N ATOM 1563 CA HIS A 130 7.112 2.309 -11.224 1.00 0.00 C ATOM 1564 C HIS A 130 8.361 1.437 -11.189 1.00 0.00 C ATOM 1565 O HIS A 130 9.486 1.905 -11.046 1.00 0.00 O ATOM 1566 CB HIS A 130 7.430 3.815 -11.164 1.00 0.00 C ATOM 1567 CG HIS A 130 7.773 4.298 -9.775 1.00 0.00 C ATOM 1568 ND1 HIS A 130 9.009 4.606 -9.267 1.00 0.00 N ATOM 1569 CD2 HIS A 130 6.861 4.541 -8.792 1.00 0.00 C ATOM 1570 CE1 HIS A 130 8.825 4.985 -7.987 1.00 0.00 C ATOM 1571 NE2 HIS A 130 7.524 4.936 -7.641 1.00 0.00 N ATOM 0 H HIS A 130 6.351 2.548 -9.317 1.00 0.00 H new ATOM 0 HA HIS A 130 6.616 2.137 -12.180 1.00 0.00 H new ATOM 0 HB2 HIS A 130 8.264 4.030 -11.832 1.00 0.00 H new ATOM 0 HB3 HIS A 130 6.572 4.376 -11.535 1.00 0.00 H new ATOM 0 HD1 HIS A 130 9.899 4.557 -9.764 1.00 0.00 H new ATOM 0 HD2 HIS A 130 5.790 4.441 -8.894 1.00 0.00 H new ATOM 0 HE1 HIS A 130 9.620 5.290 -7.323 1.00 0.00 H new ATOM 1579 N ASP A 131 8.125 0.136 -11.311 1.00 0.00 N ATOM 1580 CA ASP A 131 9.101 -0.929 -11.510 1.00 0.00 C ATOM 1581 C ASP A 131 10.155 -1.080 -10.411 1.00 0.00 C ATOM 1582 O ASP A 131 11.110 -1.843 -10.549 1.00 0.00 O ATOM 1583 CB ASP A 131 9.675 -0.810 -12.912 1.00 0.00 C ATOM 1584 CG ASP A 131 10.174 -2.174 -13.389 1.00 0.00 C ATOM 1585 OD1 ASP A 131 9.367 -3.134 -13.365 1.00 0.00 O ATOM 1586 OD2 ASP A 131 11.336 -2.272 -13.841 1.00 0.00 O ATOM 0 H ASP A 131 7.174 -0.230 -11.270 1.00 0.00 H new ATOM 0 HA ASP A 131 8.571 -1.877 -11.419 1.00 0.00 H new ATOM 0 HB2 ASP A 131 8.914 -0.433 -13.595 1.00 0.00 H new ATOM 0 HB3 ASP A 131 10.494 -0.091 -12.919 1.00 0.00 H new ATOM 1591 N GLU A 132 9.942 -0.389 -9.289 1.00 0.00 N ATOM 1592 CA GLU A 132 10.703 -0.523 -8.060 1.00 0.00 C ATOM 1593 C GLU A 132 10.684 -1.992 -7.648 1.00 0.00 C ATOM 1594 O GLU A 132 9.611 -2.569 -7.466 1.00 0.00 O ATOM 1595 CB GLU A 132 10.159 0.445 -6.988 1.00 0.00 C ATOM 1596 CG GLU A 132 8.676 0.288 -6.572 1.00 0.00 C ATOM 1597 CD GLU A 132 8.394 -0.807 -5.530 1.00 0.00 C ATOM 1598 OE1 GLU A 132 9.253 -1.069 -4.658 1.00 0.00 O ATOM 1599 OE2 GLU A 132 7.264 -1.362 -5.531 1.00 0.00 O ATOM 0 H GLU A 132 9.201 0.308 -9.216 1.00 0.00 H new ATOM 0 HA GLU A 132 11.746 -0.238 -8.198 1.00 0.00 H new ATOM 0 HB2 GLU A 132 10.773 0.336 -6.094 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.301 1.463 -7.350 1.00 0.00 H new ATOM 0 HG2 GLU A 132 8.325 1.241 -6.176 1.00 0.00 H new ATOM 0 HG3 GLU A 132 8.087 0.077 -7.464 1.00 0.00 H new ATOM 1606 N ASN A 133 11.849 -2.634 -7.618 1.00 0.00 N ATOM 1607 CA ASN A 133 11.997 -4.018 -7.186 1.00 0.00 C ATOM 1608 C ASN A 133 13.432 -4.330 -6.747 1.00 0.00 C ATOM 1609 O ASN A 133 13.632 -5.305 -6.024 1.00 0.00 O ATOM 1610 CB ASN A 133 11.570 -4.977 -8.309 1.00 0.00 C ATOM 1611 CG ASN A 133 10.992 -6.308 -7.820 1.00 0.00 C ATOM 1612 OD1 ASN A 133 10.191 -6.908 -8.532 1.00 0.00 O ATOM 1613 ND2 ASN A 133 11.356 -6.807 -6.650 1.00 0.00 N ATOM 0 H ASN A 133 12.729 -2.200 -7.897 1.00 0.00 H new ATOM 0 HA ASN A 133 11.347 -4.161 -6.322 1.00 0.00 H new ATOM 0 HB2 ASN A 133 10.827 -4.479 -8.932 1.00 0.00 H new ATOM 0 HB3 ASN A 133 12.433 -5.181 -8.943 1.00 0.00 H new ATOM 0 HD21 ASN A 133 10.971 -7.697 -6.333 1.00 0.00 H new ATOM 0 HD22 ASN A 133 12.022 -6.302 -6.065 1.00 0.00 H new ATOM 1620 N TYR A 134 14.432 -3.561 -7.187 1.00 0.00 N ATOM 1621 CA TYR A 134 15.777 -3.495 -6.622 1.00 0.00 C ATOM 1622 C TYR A 134 16.421 -2.210 -7.138 1.00 0.00 C ATOM 1623 O TYR A 134 16.316 -1.917 -8.331 1.00 0.00 O ATOM 1624 CB TYR A 134 16.619 -4.700 -7.066 1.00 0.00 C ATOM 1625 CG TYR A 134 18.048 -4.674 -6.557 1.00 0.00 C ATOM 1626 CD1 TYR A 134 19.034 -3.932 -7.237 1.00 0.00 C ATOM 1627 CD2 TYR A 134 18.384 -5.375 -5.385 1.00 0.00 C ATOM 1628 CE1 TYR A 134 20.343 -3.868 -6.732 1.00 0.00 C ATOM 1629 CE2 TYR A 134 19.697 -5.331 -4.887 1.00 0.00 C ATOM 1630 CZ TYR A 134 20.675 -4.562 -5.551 1.00 0.00 C ATOM 1631 OH TYR A 134 21.931 -4.463 -5.044 1.00 0.00 O ATOM 0 H TYR A 134 14.317 -2.938 -7.986 1.00 0.00 H new ATOM 0 HA TYR A 134 15.724 -3.507 -5.533 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.137 -5.614 -6.720 1.00 0.00 H new ATOM 0 HB3 TYR A 134 16.633 -4.739 -8.155 1.00 0.00 H new ATOM 0 HD1 TYR A 134 18.783 -3.411 -8.149 1.00 0.00 H new ATOM 0 HD2 TYR A 134 17.630 -5.949 -4.866 1.00 0.00 H new ATOM 0 HE1 TYR A 134 21.094 -3.288 -7.248 1.00 0.00 H new ATOM 0 HE2 TYR A 134 19.957 -5.885 -3.997 1.00 0.00 H new ATOM 0 HH TYR A 134 21.997 -5.000 -4.227 1.00 0.00 H new ATOM 1641 N THR A 135 17.119 -1.468 -6.283 1.00 0.00 N ATOM 1642 CA THR A 135 17.795 -0.229 -6.649 1.00 0.00 C ATOM 1643 C THR A 135 19.209 -0.272 -6.047 1.00 0.00 C ATOM 1644 O THR A 135 19.326 -0.318 -4.815 1.00 0.00 O ATOM 1645 CB THR A 135 16.963 0.985 -6.190 1.00 0.00 C ATOM 1646 OG1 THR A 135 15.619 0.861 -6.644 1.00 0.00 O ATOM 1647 CG2 THR A 135 17.529 2.306 -6.724 1.00 0.00 C ATOM 0 H THR A 135 17.232 -1.716 -5.300 1.00 0.00 H new ATOM 0 HA THR A 135 17.891 -0.125 -7.730 1.00 0.00 H new ATOM 0 HB THR A 135 17.002 1.000 -5.101 1.00 0.00 H new ATOM 0 HG1 THR A 135 15.100 1.637 -6.345 1.00 0.00 H new ATOM 0 HG21 THR A 135 16.911 3.134 -6.376 1.00 0.00 H new ATOM 0 HG22 THR A 135 18.549 2.437 -6.363 1.00 0.00 H new ATOM 0 HG23 THR A 135 17.530 2.287 -7.814 1.00 0.00 H new ATOM 1655 N PRO A 136 20.276 -0.339 -6.869 1.00 0.00 N ATOM 1656 CA PRO A 136 21.645 -0.276 -6.375 1.00 0.00 C ATOM 1657 C PRO A 136 21.953 1.125 -5.810 1.00 0.00 C ATOM 1658 O PRO A 136 21.142 2.042 -5.941 1.00 0.00 O ATOM 1659 CB PRO A 136 22.532 -0.645 -7.574 1.00 0.00 C ATOM 1660 CG PRO A 136 21.697 -0.284 -8.799 1.00 0.00 C ATOM 1661 CD PRO A 136 20.254 -0.434 -8.324 1.00 0.00 C ATOM 0 HA PRO A 136 21.824 -0.963 -5.548 1.00 0.00 H new ATOM 0 HB2 PRO A 136 23.471 -0.091 -7.557 1.00 0.00 H new ATOM 0 HB3 PRO A 136 22.787 -1.705 -7.567 1.00 0.00 H new ATOM 0 HG2 PRO A 136 21.902 0.732 -9.136 1.00 0.00 H new ATOM 0 HG3 PRO A 136 21.912 -0.947 -9.637 1.00 0.00 H new ATOM 0 HD2 PRO A 136 19.623 0.345 -8.753 1.00 0.00 H new ATOM 0 HD3 PRO A 136 19.840 -1.391 -8.642 1.00 0.00 H new ATOM 1669 N PRO A 137 23.128 1.327 -5.196 1.00 0.00 N ATOM 1670 CA PRO A 137 23.603 2.663 -4.847 1.00 0.00 C ATOM 1671 C PRO A 137 23.914 3.513 -6.081 1.00 0.00 C ATOM 1672 O PRO A 137 23.855 4.740 -6.051 1.00 0.00 O ATOM 1673 CB PRO A 137 24.918 2.442 -4.105 1.00 0.00 C ATOM 1674 CG PRO A 137 24.950 0.962 -3.738 1.00 0.00 C ATOM 1675 CD PRO A 137 24.086 0.305 -4.807 1.00 0.00 C ATOM 0 HA PRO A 137 22.839 3.184 -4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 137 25.769 2.707 -4.732 1.00 0.00 H new ATOM 0 HB3 PRO A 137 24.973 3.066 -3.213 1.00 0.00 H new ATOM 0 HG2 PRO A 137 25.967 0.569 -3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 137 24.551 0.789 -2.739 1.00 0.00 H new ATOM 0 HD2 PRO A 137 24.687 -0.017 -5.657 1.00 0.00 H new ATOM 0 HD3 PRO A 137 23.583 -0.581 -4.419 1.00 0.00 H new ATOM 1683 N GLU A 138 24.376 2.871 -7.150 1.00 0.00 N ATOM 1684 CA GLU A 138 25.097 3.491 -8.258 1.00 0.00 C ATOM 1685 C GLU A 138 24.160 4.170 -9.271 1.00 0.00 C ATOM 1686 O GLU A 138 24.390 4.136 -10.481 1.00 0.00 O ATOM 1687 CB GLU A 138 26.024 2.423 -8.860 1.00 0.00 C ATOM 1688 CG GLU A 138 27.282 3.061 -9.462 1.00 0.00 C ATOM 1689 CD GLU A 138 28.460 2.091 -9.432 1.00 0.00 C ATOM 1690 OE1 GLU A 138 28.955 1.787 -8.320 1.00 0.00 O ATOM 1691 OE2 GLU A 138 28.906 1.659 -10.516 1.00 0.00 O ATOM 0 H GLU A 138 24.254 1.866 -7.273 1.00 0.00 H new ATOM 0 HA GLU A 138 25.708 4.320 -7.902 1.00 0.00 H new ATOM 0 HB2 GLU A 138 26.309 1.707 -8.089 1.00 0.00 H new ATOM 0 HB3 GLU A 138 25.491 1.866 -9.630 1.00 0.00 H new ATOM 0 HG2 GLU A 138 27.083 3.364 -10.490 1.00 0.00 H new ATOM 0 HG3 GLU A 138 27.537 3.964 -8.907 1.00 0.00 H new ATOM 1698 N VAL A 139 23.067 4.741 -8.767 1.00 0.00 N ATOM 1699 CA VAL A 139 21.964 5.291 -9.537 1.00 0.00 C ATOM 1700 C VAL A 139 21.316 6.461 -8.798 1.00 0.00 C ATOM 1701 O VAL A 139 21.034 7.495 -9.408 1.00 0.00 O ATOM 1702 CB VAL A 139 20.916 4.189 -9.846 1.00 0.00 C ATOM 1703 CG1 VAL A 139 21.358 3.205 -10.934 1.00 0.00 C ATOM 1704 CG2 VAL A 139 20.590 3.334 -8.616 1.00 0.00 C ATOM 0 H VAL A 139 22.924 4.835 -7.761 1.00 0.00 H new ATOM 0 HA VAL A 139 22.359 5.665 -10.481 1.00 0.00 H new ATOM 0 HB VAL A 139 20.048 4.755 -10.183 1.00 0.00 H new ATOM 0 HG11 VAL A 139 20.575 2.464 -11.095 1.00 0.00 H new ATOM 0 HG12 VAL A 139 21.541 3.747 -11.862 1.00 0.00 H new ATOM 0 HG13 VAL A 139 22.273 2.703 -10.620 1.00 0.00 H new ATOM 0 HG21 VAL A 139 19.852 2.578 -8.884 1.00 0.00 H new ATOM 0 HG22 VAL A 139 21.498 2.846 -8.261 1.00 0.00 H new ATOM 0 HG23 VAL A 139 20.188 3.970 -7.827 1.00 0.00 H new ATOM 1714 N GLU A 140 21.104 6.325 -7.483 1.00 0.00 N ATOM 1715 CA GLU A 140 20.403 7.319 -6.675 1.00 0.00 C ATOM 1716 C GLU A 140 21.096 8.681 -6.730 1.00 0.00 C ATOM 1717 O GLU A 140 20.447 9.721 -6.629 1.00 0.00 O ATOM 1718 CB GLU A 140 20.292 6.844 -5.221 1.00 0.00 C ATOM 1719 CG GLU A 140 21.611 6.392 -4.570 1.00 0.00 C ATOM 1720 CD GLU A 140 21.705 6.739 -3.086 1.00 0.00 C ATOM 1721 OE1 GLU A 140 21.628 7.936 -2.734 1.00 0.00 O ATOM 1722 OE2 GLU A 140 21.981 5.837 -2.263 1.00 0.00 O ATOM 0 H GLU A 140 21.418 5.514 -6.950 1.00 0.00 H new ATOM 0 HA GLU A 140 19.403 7.435 -7.092 1.00 0.00 H new ATOM 0 HB2 GLU A 140 19.871 7.653 -4.624 1.00 0.00 H new ATOM 0 HB3 GLU A 140 19.584 6.016 -5.180 1.00 0.00 H new ATOM 0 HG2 GLU A 140 21.716 5.314 -4.691 1.00 0.00 H new ATOM 0 HG3 GLU A 140 22.445 6.855 -5.097 1.00 0.00 H new ATOM 1729 N LYS A 141 22.416 8.665 -6.897 1.00 0.00 N ATOM 1730 CA LYS A 141 23.258 9.829 -7.111 1.00 0.00 C ATOM 1731 C LYS A 141 24.280 9.463 -8.178 1.00 0.00 C ATOM 1732 O LYS A 141 24.853 8.373 -8.110 1.00 0.00 O ATOM 1733 CB LYS A 141 23.891 10.238 -5.768 1.00 0.00 C ATOM 1734 CG LYS A 141 24.448 11.665 -5.766 1.00 0.00 C ATOM 1735 CD LYS A 141 25.911 11.784 -6.223 1.00 0.00 C ATOM 1736 CE LYS A 141 26.263 13.216 -6.644 1.00 0.00 C ATOM 1737 NZ LYS A 141 25.902 14.223 -5.623 1.00 0.00 N ATOM 0 H LYS A 141 22.949 7.795 -6.885 1.00 0.00 H new ATOM 0 HA LYS A 141 22.698 10.694 -7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 141 23.143 10.147 -4.980 1.00 0.00 H new ATOM 0 HB3 LYS A 141 24.695 9.542 -5.527 1.00 0.00 H new ATOM 0 HG2 LYS A 141 23.828 12.284 -6.414 1.00 0.00 H new ATOM 0 HG3 LYS A 141 24.362 12.073 -4.759 1.00 0.00 H new ATOM 0 HD2 LYS A 141 26.571 11.471 -5.414 1.00 0.00 H new ATOM 0 HD3 LYS A 141 26.087 11.106 -7.058 1.00 0.00 H new ATOM 0 HE2 LYS A 141 27.333 13.277 -6.845 1.00 0.00 H new ATOM 0 HE3 LYS A 141 25.750 13.451 -7.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 26.283 15.150 -5.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 24.867 14.283 -5.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 26.302 13.945 -4.704 1.00 0.00 H new ATOM 1751 N ALA A 142 24.542 10.387 -9.102 1.00 0.00 N ATOM 1752 CA ALA A 142 25.393 10.247 -10.276 1.00 0.00 C ATOM 1753 C ALA A 142 25.140 8.924 -11.011 1.00 0.00 C ATOM 1754 O ALA A 142 26.007 8.050 -11.082 1.00 0.00 O ATOM 1755 CB ALA A 142 26.864 10.492 -9.918 1.00 0.00 C ATOM 0 H ALA A 142 24.134 11.320 -9.042 1.00 0.00 H new ATOM 0 HA ALA A 142 25.124 11.023 -10.993 1.00 0.00 H new ATOM 0 HB1 ALA A 142 27.479 10.382 -10.811 1.00 0.00 H new ATOM 0 HB2 ALA A 142 26.979 11.501 -9.521 1.00 0.00 H new ATOM 0 HB3 ALA A 142 27.181 9.768 -9.167 1.00 0.00 H new ATOM 1761 N MET A 143 23.946 8.809 -11.597 1.00 0.00 N ATOM 1762 CA MET A 143 23.594 7.763 -12.552 1.00 0.00 C ATOM 1763 C MET A 143 24.330 8.077 -13.841 1.00 0.00 C ATOM 1764 O MET A 143 24.034 9.123 -14.459 1.00 0.00 O ATOM 1765 CB MET A 143 22.067 7.739 -12.755 1.00 0.00 C ATOM 1766 CG MET A 143 21.501 6.353 -13.069 1.00 0.00 C ATOM 1767 SD MET A 143 19.795 6.350 -13.677 1.00 0.00 S ATOM 1768 CE MET A 143 18.948 7.150 -12.286 1.00 0.00 C ATOM 0 H MET A 143 23.181 9.458 -11.414 1.00 0.00 H new ATOM 0 HA MET A 143 23.882 6.774 -12.196 1.00 0.00 H new ATOM 0 HB2 MET A 143 21.585 8.121 -11.855 1.00 0.00 H new ATOM 0 HB3 MET A 143 21.808 8.418 -13.568 1.00 0.00 H new ATOM 0 HG2 MET A 143 22.138 5.876 -13.814 1.00 0.00 H new ATOM 0 HG3 MET A 143 21.552 5.742 -12.168 1.00 0.00 H new ATOM 0 HE1 MET A 143 17.871 7.114 -12.447 1.00 0.00 H new ATOM 0 HE2 MET A 143 19.195 6.629 -11.361 1.00 0.00 H new ATOM 0 HE3 MET A 143 19.269 8.189 -12.213 1.00 0.00 H new TER 1778 MET A 143