USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 753 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 90 LYS NZ :NH3+ -177:sc= 0.103 (180deg=0) USER MOD Set 1.2: A 91 SER OG : rot -150:sc= 0.1 USER MOD Set 2.1: A 85 THR OG1 : rot 111:sc= 0.0587 USER MOD Set 2.2: A 87 SER OG : rot 180:sc= 0.0597 USER MOD Set 3.1: A 44 HIS : no HD1:sc= -0.542 X(o=-1.3,f=-1) USER MOD Set 3.2: A 50 TYR OH : rot -25:sc= -0.79 USER MOD Set 4.1: A 38 CYS SG : rot 47:sc= -0.375 USER MOD Set 4.2: A 51 CYS SG : rot 90:sc= -1.79 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -2.17! K(o=-2.2!,f=-1.4) USER MOD Single : A 17 SER OG : rot -118:sc= 0.0174 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.6) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.21 K(o=-0.21,f=-2.4!) USER MOD Single : A 35 CYS SG : rot -33:sc= 0.0422 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 51:sc= 1.23 USER MOD Single : A 39 LYS NZ :NH3+ 160:sc= -0.0991 (180deg=-0.552) USER MOD Single : A 40 MET CE :methyl -115:sc= -4.06! (180deg=-5.86!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 105:sc= 0.337 USER MOD Single : A 47 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.14) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HE2:sc= 0.367 K(o=0.37,f=-2.7!) USER MOD Single : A 68 MET CE :methyl -143:sc= -4.62! (180deg=-5.87!) USER MOD Single : A 69 ASN : amide:sc= -0.939! X(o=-0.94!,f=-0.45) USER MOD Single : A 72 LYS NZ :NH3+ -118:sc= -1.41! (180deg=-1.89) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 144:sc= -0.261 (180deg=-1.73!) USER MOD Single : A 81 ASN : amide:sc= -0.692 K(o=-0.69,f=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 18:sc= 0.545! USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -37.082 -7.223 12.116 1.00 0.00 N ATOM 2 CA GLY A -6 -35.816 -7.769 11.664 1.00 0.00 C ATOM 3 C GLY A -6 -34.762 -6.697 11.459 1.00 0.00 C ATOM 4 O GLY A -6 -34.184 -6.194 12.423 1.00 0.00 O ATOM 0 H1 GLY A -6 -37.768 -7.995 12.241 1.00 0.00 H new ATOM 0 H2 GLY A -6 -36.944 -6.732 13.022 1.00 0.00 H new ATOM 0 H3 GLY A -6 -37.442 -6.551 11.409 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -35.455 -8.494 12.394 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -35.969 -8.307 10.729 1.00 0.00 H new ATOM 8 N SER A -5 -34.512 -6.348 10.201 1.00 0.00 N ATOM 9 CA SER A -5 -33.517 -5.334 9.874 1.00 0.00 C ATOM 10 C SER A -5 -33.762 -4.765 8.479 1.00 0.00 C ATOM 11 O SER A -5 -34.275 -5.453 7.597 1.00 0.00 O ATOM 12 CB SER A -5 -32.109 -5.926 9.956 1.00 0.00 C ATOM 13 OG SER A -5 -31.133 -4.974 9.566 1.00 0.00 O ATOM 0 H SER A -5 -34.984 -6.752 9.392 1.00 0.00 H new ATOM 0 HA SER A -5 -33.605 -4.525 10.599 1.00 0.00 H new ATOM 0 HB2 SER A -5 -31.910 -6.260 10.974 1.00 0.00 H new ATOM 0 HB3 SER A -5 -32.042 -6.804 9.314 1.00 0.00 H new ATOM 0 HG SER A -5 -30.241 -5.375 9.628 1.00 0.00 H new ATOM 19 N SER A -4 -33.390 -3.503 8.289 1.00 0.00 N ATOM 20 CA SER A -4 -33.572 -2.839 7.003 1.00 0.00 C ATOM 21 C SER A -4 -32.525 -1.746 6.803 1.00 0.00 C ATOM 22 O SER A -4 -32.217 -0.990 7.723 1.00 0.00 O ATOM 23 CB SER A -4 -34.976 -2.238 6.910 1.00 0.00 C ATOM 24 OG SER A -4 -35.418 -2.182 5.564 1.00 0.00 O ATOM 0 H SER A -4 -32.961 -2.920 9.008 1.00 0.00 H new ATOM 0 HA SER A -4 -33.450 -3.584 6.217 1.00 0.00 H new ATOM 0 HB2 SER A -4 -35.671 -2.836 7.500 1.00 0.00 H new ATOM 0 HB3 SER A -4 -34.975 -1.236 7.338 1.00 0.00 H new ATOM 0 HG SER A -4 -36.318 -1.796 5.531 1.00 0.00 H new ATOM 30 N GLY A -3 -31.980 -1.673 5.593 1.00 0.00 N ATOM 31 CA GLY A -3 -30.973 -0.671 5.292 1.00 0.00 C ATOM 32 C GLY A -3 -29.796 -1.244 4.530 1.00 0.00 C ATOM 33 O GLY A -3 -29.727 -1.134 3.305 1.00 0.00 O ATOM 0 H GLY A -3 -32.217 -2.289 4.816 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -31.425 0.130 4.707 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -30.618 -0.226 6.222 1.00 0.00 H new ATOM 37 N SER A -2 -28.864 -1.856 5.254 1.00 0.00 N ATOM 38 CA SER A -2 -27.679 -2.443 4.639 1.00 0.00 C ATOM 39 C SER A -2 -28.059 -3.278 3.419 1.00 0.00 C ATOM 40 O SER A -2 -28.655 -4.348 3.546 1.00 0.00 O ATOM 41 CB SER A -2 -26.929 -3.310 5.652 1.00 0.00 C ATOM 42 OG SER A -2 -25.747 -3.847 5.085 1.00 0.00 O ATOM 0 H SER A -2 -28.907 -1.958 6.268 1.00 0.00 H new ATOM 0 HA SER A -2 -27.027 -1.632 4.314 1.00 0.00 H new ATOM 0 HB2 SER A -2 -26.677 -2.715 6.530 1.00 0.00 H new ATOM 0 HB3 SER A -2 -27.575 -4.120 5.991 1.00 0.00 H new ATOM 0 HG SER A -2 -25.284 -4.396 5.752 1.00 0.00 H new ATOM 48 N SER A -1 -27.710 -2.781 2.238 1.00 0.00 N ATOM 49 CA SER A -1 -28.015 -3.478 0.994 1.00 0.00 C ATOM 50 C SER A -1 -26.805 -4.262 0.498 1.00 0.00 C ATOM 51 O SER A -1 -26.922 -5.420 0.100 1.00 0.00 O ATOM 52 CB SER A -1 -28.465 -2.482 -0.077 1.00 0.00 C ATOM 53 OG SER A -1 -29.832 -2.146 0.081 1.00 0.00 O ATOM 0 H SER A -1 -27.215 -1.897 2.116 1.00 0.00 H new ATOM 0 HA SER A -1 -28.825 -4.180 1.191 1.00 0.00 H new ATOM 0 HB2 SER A -1 -27.856 -1.580 -0.018 1.00 0.00 H new ATOM 0 HB3 SER A -1 -28.305 -2.910 -1.066 1.00 0.00 H new ATOM 0 HG SER A -1 -30.094 -1.507 -0.614 1.00 0.00 H new ATOM 59 N GLY A 0 -25.640 -3.620 0.526 1.00 0.00 N ATOM 60 CA GLY A 0 -24.423 -4.273 0.078 1.00 0.00 C ATOM 61 C GLY A 0 -24.483 -4.670 -1.384 1.00 0.00 C ATOM 62 O GLY A 0 -25.004 -5.731 -1.725 1.00 0.00 O ATOM 0 H GLY A 0 -25.518 -2.661 0.850 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -23.576 -3.605 0.235 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -24.246 -5.161 0.685 1.00 0.00 H new ATOM 66 N MET A 1 -23.951 -3.814 -2.250 1.00 0.00 N ATOM 67 CA MET A 1 -23.947 -4.082 -3.684 1.00 0.00 C ATOM 68 C MET A 1 -22.521 -4.145 -4.222 1.00 0.00 C ATOM 69 O MET A 1 -21.938 -3.122 -4.580 1.00 0.00 O ATOM 70 CB MET A 1 -24.739 -3.005 -4.428 1.00 0.00 C ATOM 71 CG MET A 1 -26.217 -2.984 -4.075 1.00 0.00 C ATOM 72 SD MET A 1 -27.013 -1.426 -4.513 1.00 0.00 S ATOM 73 CE MET A 1 -26.952 -1.505 -6.300 1.00 0.00 C ATOM 0 H MET A 1 -23.517 -2.930 -1.985 1.00 0.00 H new ATOM 0 HA MET A 1 -24.421 -5.050 -3.849 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.307 -2.029 -4.206 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.632 -3.164 -5.501 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.721 -3.802 -4.589 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.334 -3.159 -3.006 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.408 -0.608 -6.720 1.00 0.00 H new ATOM 0 HE2 MET A 1 -25.914 -1.571 -6.626 1.00 0.00 H new ATOM 0 HE3 MET A 1 -27.497 -2.384 -6.644 1.00 0.00 H new ATOM 83 N MET A 2 -21.965 -5.351 -4.274 1.00 0.00 N ATOM 84 CA MET A 2 -20.608 -5.546 -4.769 1.00 0.00 C ATOM 85 C MET A 2 -20.598 -5.694 -6.287 1.00 0.00 C ATOM 86 O MET A 2 -21.143 -6.654 -6.830 1.00 0.00 O ATOM 87 CB MET A 2 -19.978 -6.780 -4.121 1.00 0.00 C ATOM 88 CG MET A 2 -20.672 -8.081 -4.490 1.00 0.00 C ATOM 89 SD MET A 2 -20.120 -9.472 -3.484 1.00 0.00 S ATOM 90 CE MET A 2 -21.468 -10.626 -3.733 1.00 0.00 C ATOM 0 H MET A 2 -22.434 -6.208 -3.979 1.00 0.00 H new ATOM 0 HA MET A 2 -20.022 -4.666 -4.504 1.00 0.00 H new ATOM 0 HB2 MET A 2 -18.930 -6.840 -4.416 1.00 0.00 H new ATOM 0 HB3 MET A 2 -19.998 -6.662 -3.038 1.00 0.00 H new ATOM 0 HG2 MET A 2 -21.749 -7.959 -4.375 1.00 0.00 H new ATOM 0 HG3 MET A 2 -20.487 -8.302 -5.541 1.00 0.00 H new ATOM 0 HE1 MET A 2 -21.273 -11.540 -3.172 1.00 0.00 H new ATOM 0 HE2 MET A 2 -22.399 -10.179 -3.385 1.00 0.00 H new ATOM 0 HE3 MET A 2 -21.554 -10.862 -4.794 1.00 0.00 H new ATOM 100 N GLU A 3 -19.976 -4.735 -6.967 1.00 0.00 N ATOM 101 CA GLU A 3 -19.897 -4.760 -8.422 1.00 0.00 C ATOM 102 C GLU A 3 -18.595 -4.131 -8.909 1.00 0.00 C ATOM 103 O GLU A 3 -17.954 -3.367 -8.185 1.00 0.00 O ATOM 104 CB GLU A 3 -21.091 -4.022 -9.032 1.00 0.00 C ATOM 105 CG GLU A 3 -22.357 -4.860 -9.096 1.00 0.00 C ATOM 106 CD GLU A 3 -23.598 -4.024 -9.338 1.00 0.00 C ATOM 107 OE1 GLU A 3 -23.805 -3.040 -8.597 1.00 0.00 O ATOM 108 OE2 GLU A 3 -24.364 -4.352 -10.269 1.00 0.00 O ATOM 0 H GLU A 3 -19.520 -3.932 -6.533 1.00 0.00 H new ATOM 0 HA GLU A 3 -19.919 -5.802 -8.743 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -21.289 -3.124 -8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -20.830 -3.696 -10.039 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -22.260 -5.598 -9.892 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -22.471 -5.411 -8.163 1.00 0.00 H new ATOM 115 N ASP A 4 -18.209 -4.457 -10.137 1.00 0.00 N ATOM 116 CA ASP A 4 -16.983 -3.924 -10.721 1.00 0.00 C ATOM 117 C ASP A 4 -17.091 -2.418 -10.931 1.00 0.00 C ATOM 118 O ASP A 4 -17.461 -1.957 -12.011 1.00 0.00 O ATOM 119 CB ASP A 4 -16.683 -4.618 -12.050 1.00 0.00 C ATOM 120 CG ASP A 4 -17.898 -4.685 -12.955 1.00 0.00 C ATOM 121 OD1 ASP A 4 -18.165 -3.692 -13.663 1.00 0.00 O ATOM 122 OD2 ASP A 4 -18.582 -5.730 -12.954 1.00 0.00 O ATOM 0 H ASP A 4 -18.727 -5.088 -10.748 1.00 0.00 H new ATOM 0 HA ASP A 4 -16.165 -4.117 -10.027 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -15.881 -4.086 -12.562 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -16.322 -5.628 -11.856 1.00 0.00 H new ATOM 127 N ASP A 5 -16.769 -1.656 -9.892 1.00 0.00 N ATOM 128 CA ASP A 5 -16.830 -0.201 -9.963 1.00 0.00 C ATOM 129 C ASP A 5 -15.429 0.401 -10.001 1.00 0.00 C ATOM 130 O ASP A 5 -15.067 1.100 -10.948 1.00 0.00 O ATOM 131 CB ASP A 5 -17.606 0.357 -8.769 1.00 0.00 C ATOM 132 CG ASP A 5 -17.634 1.874 -8.754 1.00 0.00 C ATOM 133 OD1 ASP A 5 -17.462 2.480 -9.831 1.00 0.00 O ATOM 134 OD2 ASP A 5 -17.824 2.452 -7.664 1.00 0.00 O ATOM 0 H ASP A 5 -16.463 -2.022 -8.990 1.00 0.00 H new ATOM 0 HA ASP A 5 -17.348 0.072 -10.883 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -18.628 -0.022 -8.794 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -17.155 -0.004 -7.845 1.00 0.00 H new ATOM 139 N GLY A 6 -14.643 0.125 -8.965 1.00 0.00 N ATOM 140 CA GLY A 6 -13.290 0.647 -8.899 1.00 0.00 C ATOM 141 C GLY A 6 -12.690 0.526 -7.514 1.00 0.00 C ATOM 142 O GLY A 6 -12.578 1.515 -6.790 1.00 0.00 O ATOM 0 H GLY A 6 -14.919 -0.451 -8.170 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.662 0.112 -9.612 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.293 1.695 -9.200 1.00 0.00 H new ATOM 146 N GLN A 7 -12.300 -0.690 -7.143 1.00 0.00 N ATOM 147 CA GLN A 7 -11.709 -0.937 -5.833 1.00 0.00 C ATOM 148 C GLN A 7 -10.190 -0.815 -5.890 1.00 0.00 C ATOM 149 O GLN A 7 -9.546 -1.224 -6.856 1.00 0.00 O ATOM 150 CB GLN A 7 -12.103 -2.325 -5.327 1.00 0.00 C ATOM 151 CG GLN A 7 -13.574 -2.448 -4.965 1.00 0.00 C ATOM 152 CD GLN A 7 -13.897 -3.752 -4.262 1.00 0.00 C ATOM 153 OE1 GLN A 7 -14.373 -3.757 -3.127 1.00 0.00 O ATOM 154 NE2 GLN A 7 -13.637 -4.867 -4.936 1.00 0.00 N ATOM 0 H GLN A 7 -12.383 -1.519 -7.731 1.00 0.00 H new ATOM 0 HA GLN A 7 -12.090 -0.185 -5.142 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -11.863 -3.063 -6.093 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -11.501 -2.567 -4.451 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -13.857 -1.614 -4.323 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -14.175 -2.370 -5.871 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -13.242 -4.815 -5.875 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -13.832 -5.775 -4.514 1.00 0.00 H new ATOM 163 N PRO A 8 -9.603 -0.237 -4.831 1.00 0.00 N ATOM 164 CA PRO A 8 -8.153 -0.047 -4.737 1.00 0.00 C ATOM 165 C PRO A 8 -7.406 -1.364 -4.556 1.00 0.00 C ATOM 166 O PRO A 8 -7.793 -2.202 -3.741 1.00 0.00 O ATOM 167 CB PRO A 8 -7.990 0.834 -3.497 1.00 0.00 C ATOM 168 CG PRO A 8 -9.198 0.552 -2.671 1.00 0.00 C ATOM 169 CD PRO A 8 -10.309 0.274 -3.645 1.00 0.00 C ATOM 0 HA PRO A 8 -7.740 0.391 -5.646 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -7.075 0.591 -2.956 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.931 1.889 -3.766 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -9.031 -0.302 -2.015 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -9.442 1.401 -2.033 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -11.015 -0.457 -3.251 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -10.878 1.175 -3.873 1.00 0.00 H new ATOM 177 N ARG A 9 -6.334 -1.542 -5.322 1.00 0.00 N ATOM 178 CA ARG A 9 -5.534 -2.758 -5.246 1.00 0.00 C ATOM 179 C ARG A 9 -4.057 -2.426 -5.057 1.00 0.00 C ATOM 180 O ARG A 9 -3.203 -3.315 -5.057 1.00 0.00 O ATOM 181 CB ARG A 9 -5.722 -3.597 -6.512 1.00 0.00 C ATOM 182 CG ARG A 9 -6.882 -4.575 -6.427 1.00 0.00 C ATOM 183 CD ARG A 9 -7.024 -5.384 -7.708 1.00 0.00 C ATOM 184 NE ARG A 9 -5.726 -5.721 -8.287 1.00 0.00 N ATOM 185 CZ ARG A 9 -5.064 -4.923 -9.118 1.00 0.00 C ATOM 186 NH1 ARG A 9 -5.573 -3.750 -9.464 1.00 0.00 N ATOM 187 NH2 ARG A 9 -3.888 -5.301 -9.605 1.00 0.00 N ATOM 0 H ARG A 9 -6.000 -0.859 -6.002 1.00 0.00 H new ATOM 0 HA ARG A 9 -5.872 -3.333 -4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -5.881 -2.930 -7.359 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -4.804 -4.151 -6.710 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -6.730 -5.249 -5.584 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.806 -4.029 -6.236 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -7.577 -6.300 -7.499 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -7.608 -4.817 -8.433 1.00 0.00 H new ATOM 0 HE ARG A 9 -5.305 -6.617 -8.040 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -6.476 -3.456 -9.092 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -5.062 -3.140 -10.102 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -3.493 -6.204 -9.341 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -3.380 -4.689 -10.243 1.00 0.00 H new ATOM 201 N THR A 10 -3.759 -1.140 -4.900 1.00 0.00 N ATOM 202 CA THR A 10 -2.386 -0.690 -4.712 1.00 0.00 C ATOM 203 C THR A 10 -2.205 -0.026 -3.352 1.00 0.00 C ATOM 204 O THR A 10 -3.034 0.782 -2.930 1.00 0.00 O ATOM 205 CB THR A 10 -1.963 0.300 -5.814 1.00 0.00 C ATOM 206 OG1 THR A 10 -2.351 -0.202 -7.098 1.00 0.00 O ATOM 207 CG2 THR A 10 -0.461 0.531 -5.787 1.00 0.00 C ATOM 0 H THR A 10 -4.452 -0.391 -4.899 1.00 0.00 H new ATOM 0 HA THR A 10 -1.754 -1.576 -4.767 1.00 0.00 H new ATOM 0 HB THR A 10 -2.463 1.251 -5.629 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.080 0.434 -7.793 1.00 0.00 H new ATOM 0 HG21 THR A 10 -0.187 1.233 -6.574 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.173 0.941 -4.819 1.00 0.00 H new ATOM 0 HG23 THR A 10 0.056 -0.415 -5.949 1.00 0.00 H new ATOM 215 N LEU A 11 -1.119 -0.370 -2.670 1.00 0.00 N ATOM 216 CA LEU A 11 -0.829 0.194 -1.356 1.00 0.00 C ATOM 217 C LEU A 11 0.542 0.863 -1.341 1.00 0.00 C ATOM 218 O LEU A 11 1.503 0.346 -1.913 1.00 0.00 O ATOM 219 CB LEU A 11 -0.888 -0.897 -0.286 1.00 0.00 C ATOM 220 CG LEU A 11 -1.885 -2.028 -0.537 1.00 0.00 C ATOM 221 CD1 LEU A 11 -1.588 -3.213 0.371 1.00 0.00 C ATOM 222 CD2 LEU A 11 -3.311 -1.540 -0.328 1.00 0.00 C ATOM 0 H LEU A 11 -0.424 -1.037 -3.005 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.584 0.949 -1.138 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.106 -1.332 -0.183 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.132 -0.430 0.668 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.782 -2.353 -1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.308 -4.008 0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.581 -3.579 0.173 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.663 -2.901 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.006 -2.359 -0.511 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.428 -1.187 0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.521 -0.724 -1.019 1.00 0.00 H new ATOM 234 N TYR A 12 0.626 2.014 -0.684 1.00 0.00 N ATOM 235 CA TYR A 12 1.879 2.754 -0.594 1.00 0.00 C ATOM 236 C TYR A 12 2.608 2.436 0.708 1.00 0.00 C ATOM 237 O TYR A 12 2.047 2.567 1.796 1.00 0.00 O ATOM 238 CB TYR A 12 1.616 4.257 -0.690 1.00 0.00 C ATOM 239 CG TYR A 12 2.682 5.102 -0.028 1.00 0.00 C ATOM 240 CD1 TYR A 12 2.660 5.337 1.341 1.00 0.00 C ATOM 241 CD2 TYR A 12 3.711 5.664 -0.772 1.00 0.00 C ATOM 242 CE1 TYR A 12 3.631 6.108 1.949 1.00 0.00 C ATOM 243 CE2 TYR A 12 4.688 6.436 -0.172 1.00 0.00 C ATOM 244 CZ TYR A 12 4.643 6.655 1.188 1.00 0.00 C ATOM 245 OH TYR A 12 5.614 7.423 1.791 1.00 0.00 O ATOM 0 H TYR A 12 -0.159 2.455 -0.205 1.00 0.00 H new ATOM 0 HA TYR A 12 2.512 2.449 -1.427 1.00 0.00 H new ATOM 0 HB2 TYR A 12 1.542 4.538 -1.741 1.00 0.00 H new ATOM 0 HB3 TYR A 12 0.652 4.479 -0.232 1.00 0.00 H new ATOM 0 HD1 TYR A 12 1.870 4.909 1.940 1.00 0.00 H new ATOM 0 HD2 TYR A 12 3.749 5.495 -1.838 1.00 0.00 H new ATOM 0 HE1 TYR A 12 3.598 6.282 3.014 1.00 0.00 H new ATOM 0 HE2 TYR A 12 5.482 6.865 -0.765 1.00 0.00 H new ATOM 0 HH TYR A 12 6.253 7.732 1.115 1.00 0.00 H new ATOM 255 N VAL A 13 3.863 2.015 0.588 1.00 0.00 N ATOM 256 CA VAL A 13 4.672 1.679 1.754 1.00 0.00 C ATOM 257 C VAL A 13 5.778 2.705 1.970 1.00 0.00 C ATOM 258 O VAL A 13 6.640 2.895 1.114 1.00 0.00 O ATOM 259 CB VAL A 13 5.304 0.281 1.616 1.00 0.00 C ATOM 260 CG1 VAL A 13 5.917 -0.161 2.935 1.00 0.00 C ATOM 261 CG2 VAL A 13 4.270 -0.725 1.134 1.00 0.00 C ATOM 0 H VAL A 13 4.342 1.898 -0.305 1.00 0.00 H new ATOM 0 HA VAL A 13 4.003 1.684 2.614 1.00 0.00 H new ATOM 0 HB VAL A 13 6.100 0.333 0.874 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.358 -1.151 2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 13 6.690 0.548 3.233 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.143 -0.198 3.702 1.00 0.00 H new ATOM 0 HG21 VAL A 13 4.733 -1.707 1.042 1.00 0.00 H new ATOM 0 HG22 VAL A 13 3.450 -0.776 1.851 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.884 -0.413 0.163 1.00 0.00 H new ATOM 271 N GLY A 14 5.747 3.366 3.124 1.00 0.00 N ATOM 272 CA GLY A 14 6.752 4.366 3.433 1.00 0.00 C ATOM 273 C GLY A 14 7.535 4.033 4.689 1.00 0.00 C ATOM 274 O GLY A 14 7.190 3.100 5.414 1.00 0.00 O ATOM 0 H GLY A 14 5.044 3.226 3.850 1.00 0.00 H new ATOM 0 HA2 GLY A 14 7.440 4.457 2.593 1.00 0.00 H new ATOM 0 HA3 GLY A 14 6.270 5.336 3.556 1.00 0.00 H new ATOM 278 N ASN A 15 8.593 4.795 4.944 1.00 0.00 N ATOM 279 CA ASN A 15 9.428 4.574 6.119 1.00 0.00 C ATOM 280 C ASN A 15 10.132 3.223 6.040 1.00 0.00 C ATOM 281 O ASN A 15 10.095 2.434 6.985 1.00 0.00 O ATOM 282 CB ASN A 15 8.582 4.647 7.392 1.00 0.00 C ATOM 283 CG ASN A 15 9.416 4.946 8.623 1.00 0.00 C ATOM 284 OD1 ASN A 15 9.570 6.102 9.017 1.00 0.00 O ATOM 285 ND2 ASN A 15 9.959 3.902 9.239 1.00 0.00 N ATOM 0 H ASN A 15 8.893 5.571 4.353 1.00 0.00 H new ATOM 0 HA ASN A 15 10.186 5.357 6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 15 7.821 5.419 7.276 1.00 0.00 H new ATOM 0 HB3 ASN A 15 8.058 3.701 7.532 1.00 0.00 H new ATOM 0 HD21 ASN A 15 10.529 4.042 10.073 1.00 0.00 H new ATOM 0 HD22 ASN A 15 9.806 2.960 8.878 1.00 0.00 H new ATOM 292 N LEU A 16 10.774 2.963 4.907 1.00 0.00 N ATOM 293 CA LEU A 16 11.488 1.707 4.703 1.00 0.00 C ATOM 294 C LEU A 16 12.976 1.872 4.997 1.00 0.00 C ATOM 295 O LEU A 16 13.574 2.897 4.667 1.00 0.00 O ATOM 296 CB LEU A 16 11.293 1.214 3.268 1.00 0.00 C ATOM 297 CG LEU A 16 9.844 1.049 2.807 1.00 0.00 C ATOM 298 CD1 LEU A 16 9.793 0.677 1.333 1.00 0.00 C ATOM 299 CD2 LEU A 16 9.133 0.000 3.648 1.00 0.00 C ATOM 0 H LEU A 16 10.815 3.605 4.115 1.00 0.00 H new ATOM 0 HA LEU A 16 11.079 0.969 5.394 1.00 0.00 H new ATOM 0 HB2 LEU A 16 11.791 1.912 2.594 1.00 0.00 H new ATOM 0 HB3 LEU A 16 11.798 0.254 3.163 1.00 0.00 H new ATOM 0 HG LEU A 16 9.330 2.001 2.939 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.754 0.564 1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 16 10.265 1.463 0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.323 -0.262 1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.103 -0.104 3.306 1.00 0.00 H new ATOM 0 HD22 LEU A 16 9.647 -0.956 3.548 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.138 0.307 4.694 1.00 0.00 H new ATOM 311 N SER A 17 13.568 0.857 5.618 1.00 0.00 N ATOM 312 CA SER A 17 14.985 0.890 5.958 1.00 0.00 C ATOM 313 C SER A 17 15.846 0.657 4.722 1.00 0.00 C ATOM 314 O SER A 17 15.480 -0.113 3.833 1.00 0.00 O ATOM 315 CB SER A 17 15.301 -0.163 7.021 1.00 0.00 C ATOM 316 OG SER A 17 16.395 0.237 7.827 1.00 0.00 O ATOM 0 H SER A 17 13.088 0.001 5.896 1.00 0.00 H new ATOM 0 HA SER A 17 15.214 1.878 6.357 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.424 -0.326 7.648 1.00 0.00 H new ATOM 0 HB3 SER A 17 15.529 -1.114 6.539 1.00 0.00 H new ATOM 0 HG SER A 17 17.126 -0.408 7.729 1.00 0.00 H new ATOM 322 N ARG A 18 16.993 1.327 4.671 1.00 0.00 N ATOM 323 CA ARG A 18 17.908 1.193 3.543 1.00 0.00 C ATOM 324 C ARG A 18 18.174 -0.276 3.230 1.00 0.00 C ATOM 325 O ARG A 18 18.603 -0.618 2.128 1.00 0.00 O ATOM 326 CB ARG A 18 19.226 1.910 3.840 1.00 0.00 C ATOM 327 CG ARG A 18 19.161 3.415 3.635 1.00 0.00 C ATOM 328 CD ARG A 18 20.462 4.089 4.044 1.00 0.00 C ATOM 329 NE ARG A 18 20.570 5.441 3.501 1.00 0.00 N ATOM 330 CZ ARG A 18 21.577 6.264 3.777 1.00 0.00 C ATOM 331 NH1 ARG A 18 22.555 5.874 4.582 1.00 0.00 N ATOM 332 NH2 ARG A 18 21.605 7.479 3.245 1.00 0.00 N ATOM 0 H ARG A 18 17.311 1.968 5.398 1.00 0.00 H new ATOM 0 HA ARG A 18 17.441 1.653 2.672 1.00 0.00 H new ATOM 0 HB2 ARG A 18 19.517 1.705 4.870 1.00 0.00 H new ATOM 0 HB3 ARG A 18 20.006 1.498 3.200 1.00 0.00 H new ATOM 0 HG2 ARG A 18 18.951 3.632 2.588 1.00 0.00 H new ATOM 0 HG3 ARG A 18 18.337 3.828 4.217 1.00 0.00 H new ATOM 0 HD2 ARG A 18 20.524 4.129 5.132 1.00 0.00 H new ATOM 0 HD3 ARG A 18 21.305 3.491 3.698 1.00 0.00 H new ATOM 0 HE ARG A 18 19.834 5.771 2.877 1.00 0.00 H new ATOM 0 HH11 ARG A 18 22.536 4.940 4.992 1.00 0.00 H new ATOM 0 HH12 ARG A 18 23.326 6.508 4.792 1.00 0.00 H new ATOM 0 HH21 ARG A 18 20.854 7.781 2.624 1.00 0.00 H new ATOM 0 HH22 ARG A 18 22.377 8.111 3.457 1.00 0.00 H new ATOM 346 N ASP A 19 17.917 -1.140 4.206 1.00 0.00 N ATOM 347 CA ASP A 19 18.128 -2.572 4.035 1.00 0.00 C ATOM 348 C ASP A 19 16.941 -3.216 3.329 1.00 0.00 C ATOM 349 O ASP A 19 17.096 -4.191 2.592 1.00 0.00 O ATOM 350 CB ASP A 19 18.355 -3.242 5.392 1.00 0.00 C ATOM 351 CG ASP A 19 19.242 -2.416 6.304 1.00 0.00 C ATOM 352 OD1 ASP A 19 20.407 -2.168 5.931 1.00 0.00 O ATOM 353 OD2 ASP A 19 18.770 -2.019 7.389 1.00 0.00 O ATOM 0 H ASP A 19 17.562 -0.873 5.124 1.00 0.00 H new ATOM 0 HA ASP A 19 19.015 -2.712 3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 19 17.393 -3.408 5.878 1.00 0.00 H new ATOM 0 HB3 ASP A 19 18.808 -4.222 5.239 1.00 0.00 H new ATOM 358 N VAL A 20 15.752 -2.666 3.558 1.00 0.00 N ATOM 359 CA VAL A 20 14.536 -3.187 2.943 1.00 0.00 C ATOM 360 C VAL A 20 14.650 -3.198 1.424 1.00 0.00 C ATOM 361 O VAL A 20 15.121 -2.233 0.817 1.00 0.00 O ATOM 362 CB VAL A 20 13.303 -2.358 3.350 1.00 0.00 C ATOM 363 CG1 VAL A 20 12.091 -2.767 2.528 1.00 0.00 C ATOM 364 CG2 VAL A 20 13.025 -2.511 4.838 1.00 0.00 C ATOM 0 H VAL A 20 15.605 -1.860 4.165 1.00 0.00 H new ATOM 0 HA VAL A 20 14.412 -4.209 3.301 1.00 0.00 H new ATOM 0 HB VAL A 20 13.511 -1.307 3.149 1.00 0.00 H new ATOM 0 HG11 VAL A 20 11.229 -2.171 2.829 1.00 0.00 H new ATOM 0 HG12 VAL A 20 12.296 -2.601 1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 20 11.878 -3.823 2.695 1.00 0.00 H new ATOM 0 HG21 VAL A 20 12.151 -1.919 5.108 1.00 0.00 H new ATOM 0 HG22 VAL A 20 12.837 -3.560 5.067 1.00 0.00 H new ATOM 0 HG23 VAL A 20 13.888 -2.164 5.407 1.00 0.00 H new ATOM 374 N THR A 21 14.216 -4.294 0.811 1.00 0.00 N ATOM 375 CA THR A 21 14.268 -4.430 -0.639 1.00 0.00 C ATOM 376 C THR A 21 12.911 -4.835 -1.203 1.00 0.00 C ATOM 377 O THR A 21 11.985 -5.141 -0.454 1.00 0.00 O ATOM 378 CB THR A 21 15.321 -5.471 -1.067 1.00 0.00 C ATOM 379 OG1 THR A 21 15.214 -6.641 -0.248 1.00 0.00 O ATOM 380 CG2 THR A 21 16.724 -4.897 -0.960 1.00 0.00 C ATOM 0 H THR A 21 13.824 -5.101 1.296 1.00 0.00 H new ATOM 0 HA THR A 21 14.547 -3.455 -1.038 1.00 0.00 H new ATOM 0 HB THR A 21 15.134 -5.738 -2.107 1.00 0.00 H new ATOM 0 HG1 THR A 21 15.885 -7.298 -0.527 1.00 0.00 H new ATOM 0 HG21 THR A 21 17.450 -5.650 -1.267 1.00 0.00 H new ATOM 0 HG22 THR A 21 16.810 -4.024 -1.607 1.00 0.00 H new ATOM 0 HG23 THR A 21 16.920 -4.604 0.072 1.00 0.00 H new ATOM 388 N GLU A 22 12.802 -4.834 -2.529 1.00 0.00 N ATOM 389 CA GLU A 22 11.557 -5.202 -3.192 1.00 0.00 C ATOM 390 C GLU A 22 11.175 -6.643 -2.871 1.00 0.00 C ATOM 391 O GLU A 22 10.005 -6.950 -2.641 1.00 0.00 O ATOM 392 CB GLU A 22 11.687 -5.021 -4.706 1.00 0.00 C ATOM 393 CG GLU A 22 10.492 -5.543 -5.486 1.00 0.00 C ATOM 394 CD GLU A 22 10.639 -7.003 -5.869 1.00 0.00 C ATOM 395 OE1 GLU A 22 11.379 -7.729 -5.174 1.00 0.00 O ATOM 396 OE2 GLU A 22 10.012 -7.420 -6.866 1.00 0.00 O ATOM 0 H GLU A 22 13.560 -4.583 -3.163 1.00 0.00 H new ATOM 0 HA GLU A 22 10.770 -4.545 -2.822 1.00 0.00 H new ATOM 0 HB2 GLU A 22 11.820 -3.962 -4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.586 -5.533 -5.049 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.589 -5.417 -4.888 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.363 -4.946 -6.388 1.00 0.00 H new ATOM 403 N VAL A 23 12.169 -7.524 -2.860 1.00 0.00 N ATOM 404 CA VAL A 23 11.938 -8.935 -2.568 1.00 0.00 C ATOM 405 C VAL A 23 11.476 -9.128 -1.127 1.00 0.00 C ATOM 406 O VAL A 23 10.566 -9.913 -0.856 1.00 0.00 O ATOM 407 CB VAL A 23 13.208 -9.772 -2.804 1.00 0.00 C ATOM 408 CG1 VAL A 23 12.967 -11.227 -2.431 1.00 0.00 C ATOM 409 CG2 VAL A 23 13.662 -9.653 -4.252 1.00 0.00 C ATOM 0 H VAL A 23 13.143 -7.287 -3.050 1.00 0.00 H new ATOM 0 HA VAL A 23 11.156 -9.276 -3.247 1.00 0.00 H new ATOM 0 HB VAL A 23 14.001 -9.385 -2.164 1.00 0.00 H new ATOM 0 HG11 VAL A 23 13.876 -11.803 -2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.692 -11.292 -1.378 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.160 -11.630 -3.042 1.00 0.00 H new ATOM 0 HG21 VAL A 23 14.561 -10.251 -4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 23 12.873 -10.013 -4.912 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.878 -8.609 -4.481 1.00 0.00 H new ATOM 419 N LEU A 24 12.108 -8.409 -0.207 1.00 0.00 N ATOM 420 CA LEU A 24 11.762 -8.501 1.206 1.00 0.00 C ATOM 421 C LEU A 24 10.307 -8.106 1.438 1.00 0.00 C ATOM 422 O LEU A 24 9.550 -8.834 2.080 1.00 0.00 O ATOM 423 CB LEU A 24 12.683 -7.605 2.037 1.00 0.00 C ATOM 424 CG LEU A 24 12.680 -7.854 3.545 1.00 0.00 C ATOM 425 CD1 LEU A 24 13.771 -7.040 4.223 1.00 0.00 C ATOM 426 CD2 LEU A 24 11.318 -7.522 4.138 1.00 0.00 C ATOM 0 H LEU A 24 12.863 -7.755 -0.414 1.00 0.00 H new ATOM 0 HA LEU A 24 11.893 -9.537 1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 24 13.702 -7.727 1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.403 -6.567 1.860 1.00 0.00 H new ATOM 0 HG LEU A 24 12.882 -8.911 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 24 13.753 -7.230 5.296 1.00 0.00 H new ATOM 0 HD12 LEU A 24 14.742 -7.326 3.820 1.00 0.00 H new ATOM 0 HD13 LEU A 24 13.600 -5.979 4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 24 11.334 -7.705 5.212 1.00 0.00 H new ATOM 0 HD22 LEU A 24 11.086 -6.473 3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 24 10.557 -8.149 3.675 1.00 0.00 H new ATOM 438 N ILE A 25 9.921 -6.950 0.908 1.00 0.00 N ATOM 439 CA ILE A 25 8.556 -6.461 1.053 1.00 0.00 C ATOM 440 C ILE A 25 7.551 -7.461 0.493 1.00 0.00 C ATOM 441 O ILE A 25 6.554 -7.785 1.140 1.00 0.00 O ATOM 442 CB ILE A 25 8.364 -5.107 0.346 1.00 0.00 C ATOM 443 CG1 ILE A 25 9.115 -4.004 1.095 1.00 0.00 C ATOM 444 CG2 ILE A 25 6.885 -4.769 0.239 1.00 0.00 C ATOM 445 CD1 ILE A 25 8.527 -3.686 2.451 1.00 0.00 C ATOM 0 H ILE A 25 10.535 -6.335 0.374 1.00 0.00 H new ATOM 0 HA ILE A 25 8.380 -6.332 2.121 1.00 0.00 H new ATOM 0 HB ILE A 25 8.773 -5.180 -0.662 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.155 -4.305 1.221 1.00 0.00 H new ATOM 0 HG13 ILE A 25 9.116 -3.099 0.487 1.00 0.00 H new ATOM 0 HG21 ILE A 25 6.767 -3.809 -0.263 1.00 0.00 H new ATOM 0 HG22 ILE A 25 6.375 -5.544 -0.334 1.00 0.00 H new ATOM 0 HG23 ILE A 25 6.452 -4.712 1.238 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.110 -2.896 2.924 1.00 0.00 H new ATOM 0 HD12 ILE A 25 7.496 -3.354 2.332 1.00 0.00 H new ATOM 0 HD13 ILE A 25 8.551 -4.578 3.076 1.00 0.00 H new ATOM 457 N LEU A 26 7.820 -7.949 -0.713 1.00 0.00 N ATOM 458 CA LEU A 26 6.940 -8.915 -1.361 1.00 0.00 C ATOM 459 C LEU A 26 6.825 -10.190 -0.531 1.00 0.00 C ATOM 460 O LEU A 26 5.789 -10.854 -0.537 1.00 0.00 O ATOM 461 CB LEU A 26 7.460 -9.250 -2.760 1.00 0.00 C ATOM 462 CG LEU A 26 7.142 -8.232 -3.855 1.00 0.00 C ATOM 463 CD1 LEU A 26 7.812 -8.626 -5.162 1.00 0.00 C ATOM 464 CD2 LEU A 26 5.637 -8.104 -4.044 1.00 0.00 C ATOM 0 H LEU A 26 8.640 -7.692 -1.262 1.00 0.00 H new ATOM 0 HA LEU A 26 5.950 -8.467 -1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.542 -9.368 -2.705 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.048 -10.214 -3.058 1.00 0.00 H new ATOM 0 HG LEU A 26 7.534 -7.263 -3.547 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.574 -7.889 -5.929 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.892 -8.666 -5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.451 -9.606 -5.475 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.429 -7.375 -4.827 1.00 0.00 H new ATOM 0 HD22 LEU A 26 5.223 -9.071 -4.329 1.00 0.00 H new ATOM 0 HD23 LEU A 26 5.180 -7.774 -3.111 1.00 0.00 H new ATOM 476 N GLN A 27 7.895 -10.523 0.184 1.00 0.00 N ATOM 477 CA GLN A 27 7.913 -11.717 1.020 1.00 0.00 C ATOM 478 C GLN A 27 6.958 -11.570 2.200 1.00 0.00 C ATOM 479 O GLN A 27 6.140 -12.452 2.465 1.00 0.00 O ATOM 480 CB GLN A 27 9.331 -11.990 1.528 1.00 0.00 C ATOM 481 CG GLN A 27 10.217 -12.687 0.509 1.00 0.00 C ATOM 482 CD GLN A 27 9.722 -14.077 0.160 1.00 0.00 C ATOM 483 OE1 GLN A 27 9.217 -14.803 1.017 1.00 0.00 O ATOM 484 NE2 GLN A 27 9.865 -14.457 -1.105 1.00 0.00 N ATOM 0 H GLN A 27 8.760 -9.983 0.201 1.00 0.00 H new ATOM 0 HA GLN A 27 7.584 -12.560 0.412 1.00 0.00 H new ATOM 0 HB2 GLN A 27 9.794 -11.046 1.814 1.00 0.00 H new ATOM 0 HB3 GLN A 27 9.274 -12.603 2.428 1.00 0.00 H new ATOM 0 HG2 GLN A 27 10.265 -12.084 -0.398 1.00 0.00 H new ATOM 0 HG3 GLN A 27 11.232 -12.754 0.901 1.00 0.00 H new ATOM 0 HE21 GLN A 27 10.289 -13.824 -1.783 1.00 0.00 H new ATOM 0 HE22 GLN A 27 9.551 -15.382 -1.398 1.00 0.00 H new ATOM 493 N LEU A 28 7.066 -10.449 2.906 1.00 0.00 N ATOM 494 CA LEU A 28 6.212 -10.185 4.059 1.00 0.00 C ATOM 495 C LEU A 28 4.751 -10.063 3.637 1.00 0.00 C ATOM 496 O LEU A 28 3.864 -10.651 4.256 1.00 0.00 O ATOM 497 CB LEU A 28 6.658 -8.905 4.766 1.00 0.00 C ATOM 498 CG LEU A 28 8.149 -8.801 5.088 1.00 0.00 C ATOM 499 CD1 LEU A 28 8.433 -7.556 5.912 1.00 0.00 C ATOM 500 CD2 LEU A 28 8.625 -10.047 5.821 1.00 0.00 C ATOM 0 H LEU A 28 7.737 -9.709 2.700 1.00 0.00 H new ATOM 0 HA LEU A 28 6.304 -11.024 4.748 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.381 -8.054 4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.098 -8.814 5.697 1.00 0.00 H new ATOM 0 HG LEU A 28 8.698 -8.723 4.149 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.499 -7.500 6.131 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.131 -6.672 5.351 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.873 -7.602 6.846 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.688 -9.955 6.042 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.069 -10.156 6.752 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.459 -10.923 5.195 1.00 0.00 H new ATOM 512 N PHE A 29 4.507 -9.297 2.579 1.00 0.00 N ATOM 513 CA PHE A 29 3.154 -9.099 2.073 1.00 0.00 C ATOM 514 C PHE A 29 2.610 -10.384 1.455 1.00 0.00 C ATOM 515 O PHE A 29 1.417 -10.671 1.543 1.00 0.00 O ATOM 516 CB PHE A 29 3.133 -7.973 1.038 1.00 0.00 C ATOM 517 CG PHE A 29 3.084 -6.600 1.645 1.00 0.00 C ATOM 518 CD1 PHE A 29 4.192 -6.070 2.284 1.00 0.00 C ATOM 519 CD2 PHE A 29 1.928 -5.839 1.577 1.00 0.00 C ATOM 520 CE1 PHE A 29 4.151 -4.807 2.844 1.00 0.00 C ATOM 521 CE2 PHE A 29 1.879 -4.576 2.135 1.00 0.00 C ATOM 522 CZ PHE A 29 2.992 -4.060 2.770 1.00 0.00 C ATOM 0 H PHE A 29 5.229 -8.803 2.055 1.00 0.00 H new ATOM 0 HA PHE A 29 2.516 -8.823 2.913 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.020 -8.052 0.409 1.00 0.00 H new ATOM 0 HB3 PHE A 29 2.268 -8.105 0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.100 -6.651 2.346 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.055 -6.238 1.082 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.023 -4.405 3.338 1.00 0.00 H new ATOM 0 HE2 PHE A 29 0.972 -3.993 2.075 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.956 -3.073 3.208 1.00 0.00 H new ATOM 532 N SER A 30 3.496 -11.152 0.829 1.00 0.00 N ATOM 533 CA SER A 30 3.105 -12.405 0.192 1.00 0.00 C ATOM 534 C SER A 30 2.445 -13.343 1.197 1.00 0.00 C ATOM 535 O SER A 30 1.474 -14.028 0.877 1.00 0.00 O ATOM 536 CB SER A 30 4.325 -13.085 -0.433 1.00 0.00 C ATOM 537 OG SER A 30 4.109 -14.477 -0.586 1.00 0.00 O ATOM 0 H SER A 30 4.488 -10.929 0.749 1.00 0.00 H new ATOM 0 HA SER A 30 2.383 -12.176 -0.592 1.00 0.00 H new ATOM 0 HB2 SER A 30 4.537 -12.638 -1.404 1.00 0.00 H new ATOM 0 HB3 SER A 30 5.201 -12.916 0.194 1.00 0.00 H new ATOM 0 HG SER A 30 4.902 -14.889 -0.989 1.00 0.00 H new ATOM 543 N GLN A 31 2.980 -13.368 2.414 1.00 0.00 N ATOM 544 CA GLN A 31 2.442 -14.222 3.467 1.00 0.00 C ATOM 545 C GLN A 31 0.953 -13.966 3.669 1.00 0.00 C ATOM 546 O GLN A 31 0.204 -14.868 4.047 1.00 0.00 O ATOM 547 CB GLN A 31 3.196 -13.986 4.777 1.00 0.00 C ATOM 548 CG GLN A 31 4.684 -14.276 4.685 1.00 0.00 C ATOM 549 CD GLN A 31 5.271 -14.740 6.003 1.00 0.00 C ATOM 550 OE1 GLN A 31 4.543 -15.089 6.933 1.00 0.00 O ATOM 551 NE2 GLN A 31 6.597 -14.747 6.092 1.00 0.00 N ATOM 0 H GLN A 31 3.785 -12.807 2.695 1.00 0.00 H new ATOM 0 HA GLN A 31 2.574 -15.260 3.162 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.055 -12.950 5.086 1.00 0.00 H new ATOM 0 HB3 GLN A 31 2.760 -14.613 5.555 1.00 0.00 H new ATOM 0 HG2 GLN A 31 4.855 -15.040 3.927 1.00 0.00 H new ATOM 0 HG3 GLN A 31 5.206 -13.377 4.356 1.00 0.00 H new ATOM 0 HE21 GLN A 31 7.163 -14.450 5.297 1.00 0.00 H new ATOM 0 HE22 GLN A 31 7.049 -15.050 6.955 1.00 0.00 H new ATOM 560 N ILE A 32 0.530 -12.732 3.415 1.00 0.00 N ATOM 561 CA ILE A 32 -0.871 -12.360 3.569 1.00 0.00 C ATOM 562 C ILE A 32 -1.668 -12.685 2.310 1.00 0.00 C ATOM 563 O ILE A 32 -2.727 -13.308 2.378 1.00 0.00 O ATOM 564 CB ILE A 32 -1.022 -10.859 3.884 1.00 0.00 C ATOM 565 CG1 ILE A 32 -0.211 -10.493 5.127 1.00 0.00 C ATOM 566 CG2 ILE A 32 -2.489 -10.504 4.077 1.00 0.00 C ATOM 567 CD1 ILE A 32 0.062 -9.010 5.256 1.00 0.00 C ATOM 0 H ILE A 32 1.137 -11.974 3.102 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.262 -12.941 4.404 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.637 -10.285 3.041 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.746 -10.834 6.013 1.00 0.00 H new ATOM 0 HG13 ILE A 32 0.738 -11.028 5.102 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -2.580 -9.441 4.299 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -3.042 -10.733 3.166 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -2.898 -11.084 4.905 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.641 -8.824 6.160 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.624 -8.667 4.388 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -0.883 -8.470 5.313 1.00 0.00 H new ATOM 579 N GLY A 33 -1.150 -12.262 1.161 1.00 0.00 N ATOM 580 CA GLY A 33 -1.825 -12.521 -0.097 1.00 0.00 C ATOM 581 C GLY A 33 -0.904 -12.371 -1.291 1.00 0.00 C ATOM 582 O GLY A 33 0.246 -11.951 -1.166 1.00 0.00 O ATOM 0 H GLY A 33 -0.275 -11.745 1.079 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -2.236 -13.530 -0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.666 -11.836 -0.202 1.00 0.00 H new ATOM 586 N PRO A 34 -1.411 -12.723 -2.482 1.00 0.00 N ATOM 587 CA PRO A 34 -0.641 -12.635 -3.727 1.00 0.00 C ATOM 588 C PRO A 34 -0.388 -11.192 -4.151 1.00 0.00 C ATOM 589 O PRO A 34 -1.321 -10.399 -4.281 1.00 0.00 O ATOM 590 CB PRO A 34 -1.536 -13.341 -4.748 1.00 0.00 C ATOM 591 CG PRO A 34 -2.916 -13.203 -4.202 1.00 0.00 C ATOM 592 CD PRO A 34 -2.775 -13.231 -2.706 1.00 0.00 C ATOM 0 HA PRO A 34 0.349 -13.080 -3.626 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -1.452 -12.881 -5.733 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -1.258 -14.389 -4.861 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -3.375 -12.272 -4.533 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -3.556 -14.015 -4.549 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -3.522 -12.604 -2.220 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -2.899 -14.239 -2.310 1.00 0.00 H new ATOM 600 N CYS A 35 0.880 -10.858 -4.366 1.00 0.00 N ATOM 601 CA CYS A 35 1.257 -9.510 -4.775 1.00 0.00 C ATOM 602 C CYS A 35 1.457 -9.435 -6.286 1.00 0.00 C ATOM 603 O CYS A 35 2.378 -10.042 -6.832 1.00 0.00 O ATOM 604 CB CYS A 35 2.536 -9.075 -4.058 1.00 0.00 C ATOM 605 SG CYS A 35 2.419 -9.113 -2.253 1.00 0.00 S ATOM 0 H CYS A 35 1.664 -11.502 -4.264 1.00 0.00 H new ATOM 0 HA CYS A 35 0.447 -8.835 -4.500 1.00 0.00 H new ATOM 0 HB2 CYS A 35 3.354 -9.723 -4.372 1.00 0.00 H new ATOM 0 HB3 CYS A 35 2.791 -8.063 -4.374 1.00 0.00 H new ATOM 0 HG CYS A 35 1.204 -8.827 -1.891 1.00 0.00 H new ATOM 611 N LYS A 36 0.586 -8.689 -6.956 1.00 0.00 N ATOM 612 CA LYS A 36 0.664 -8.536 -8.404 1.00 0.00 C ATOM 613 C LYS A 36 2.042 -8.033 -8.824 1.00 0.00 C ATOM 614 O LYS A 36 2.681 -8.607 -9.706 1.00 0.00 O ATOM 615 CB LYS A 36 -0.414 -7.567 -8.894 1.00 0.00 C ATOM 616 CG LYS A 36 -0.774 -7.748 -10.359 1.00 0.00 C ATOM 617 CD LYS A 36 -1.745 -8.900 -10.556 1.00 0.00 C ATOM 618 CE LYS A 36 -2.322 -8.908 -11.963 1.00 0.00 C ATOM 619 NZ LYS A 36 -3.446 -7.941 -12.108 1.00 0.00 N ATOM 0 H LYS A 36 -0.183 -8.180 -6.519 1.00 0.00 H new ATOM 0 HA LYS A 36 0.499 -9.514 -8.857 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.311 -7.699 -8.289 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -0.070 -6.545 -8.737 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.216 -6.828 -10.742 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.132 -7.931 -10.937 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.235 -9.844 -10.366 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.554 -8.823 -9.830 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.537 -8.662 -12.679 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.672 -9.911 -12.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.812 -7.977 -13.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.206 -8.190 -11.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.106 -6.980 -11.901 1.00 0.00 H new ATOM 633 N SER A 37 2.496 -6.960 -8.184 1.00 0.00 N ATOM 634 CA SER A 37 3.797 -6.379 -8.493 1.00 0.00 C ATOM 635 C SER A 37 4.190 -5.338 -7.449 1.00 0.00 C ATOM 636 O SER A 37 3.335 -4.644 -6.897 1.00 0.00 O ATOM 637 CB SER A 37 3.778 -5.742 -9.883 1.00 0.00 C ATOM 638 OG SER A 37 4.083 -6.696 -10.886 1.00 0.00 O ATOM 0 H SER A 37 1.982 -6.476 -7.448 1.00 0.00 H new ATOM 0 HA SER A 37 4.537 -7.179 -8.478 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.796 -5.310 -10.075 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.499 -4.926 -9.922 1.00 0.00 H new ATOM 0 HG SER A 37 3.508 -7.482 -10.775 1.00 0.00 H new ATOM 644 N CYS A 38 5.487 -5.235 -7.184 1.00 0.00 N ATOM 645 CA CYS A 38 5.994 -4.279 -6.206 1.00 0.00 C ATOM 646 C CYS A 38 7.092 -3.411 -6.811 1.00 0.00 C ATOM 647 O CYS A 38 8.036 -3.918 -7.417 1.00 0.00 O ATOM 648 CB CYS A 38 6.527 -5.013 -4.974 1.00 0.00 C ATOM 649 SG CYS A 38 7.495 -3.971 -3.856 1.00 0.00 S ATOM 0 H CYS A 38 6.207 -5.802 -7.632 1.00 0.00 H new ATOM 0 HA CYS A 38 5.170 -3.632 -5.906 1.00 0.00 H new ATOM 0 HB2 CYS A 38 5.686 -5.435 -4.424 1.00 0.00 H new ATOM 0 HB3 CYS A 38 7.145 -5.849 -5.301 1.00 0.00 H new ATOM 0 HG CYS A 38 6.864 -2.853 -3.649 1.00 0.00 H new ATOM 655 N LYS A 39 6.960 -2.099 -6.645 1.00 0.00 N ATOM 656 CA LYS A 39 7.940 -1.159 -7.177 1.00 0.00 C ATOM 657 C LYS A 39 8.503 -0.276 -6.067 1.00 0.00 C ATOM 658 O LYS A 39 7.801 0.576 -5.522 1.00 0.00 O ATOM 659 CB LYS A 39 7.306 -0.288 -8.263 1.00 0.00 C ATOM 660 CG LYS A 39 8.308 0.566 -9.020 1.00 0.00 C ATOM 661 CD LYS A 39 7.659 1.273 -10.198 1.00 0.00 C ATOM 662 CE LYS A 39 8.698 1.941 -11.087 1.00 0.00 C ATOM 663 NZ LYS A 39 9.660 0.955 -11.651 1.00 0.00 N ATOM 0 H LYS A 39 6.184 -1.663 -6.147 1.00 0.00 H new ATOM 0 HA LYS A 39 8.758 -1.733 -7.613 1.00 0.00 H new ATOM 0 HB2 LYS A 39 6.780 -0.929 -8.970 1.00 0.00 H new ATOM 0 HB3 LYS A 39 6.560 0.362 -7.806 1.00 0.00 H new ATOM 0 HG2 LYS A 39 8.742 1.304 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.126 -0.060 -9.376 1.00 0.00 H new ATOM 0 HD2 LYS A 39 7.085 0.555 -10.784 1.00 0.00 H new ATOM 0 HD3 LYS A 39 6.956 2.021 -9.832 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.197 2.466 -11.900 1.00 0.00 H new ATOM 0 HE3 LYS A 39 9.241 2.690 -10.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 10.124 1.362 -12.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 10.379 0.723 -10.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.151 0.090 -11.924 1.00 0.00 H new ATOM 677 N MET A 40 9.774 -0.484 -5.739 1.00 0.00 N ATOM 678 CA MET A 40 10.431 0.296 -4.697 1.00 0.00 C ATOM 679 C MET A 40 11.072 1.552 -5.279 1.00 0.00 C ATOM 680 O MET A 40 11.962 1.469 -6.127 1.00 0.00 O ATOM 681 CB MET A 40 11.491 -0.550 -3.988 1.00 0.00 C ATOM 682 CG MET A 40 12.217 0.190 -2.877 1.00 0.00 C ATOM 683 SD MET A 40 13.426 -0.843 -2.028 1.00 0.00 S ATOM 684 CE MET A 40 12.465 -1.406 -0.625 1.00 0.00 C ATOM 0 H MET A 40 10.369 -1.186 -6.179 1.00 0.00 H new ATOM 0 HA MET A 40 9.674 0.598 -3.973 1.00 0.00 H new ATOM 0 HB2 MET A 40 11.016 -1.438 -3.571 1.00 0.00 H new ATOM 0 HB3 MET A 40 12.220 -0.893 -4.722 1.00 0.00 H new ATOM 0 HG2 MET A 40 12.720 1.062 -3.295 1.00 0.00 H new ATOM 0 HG3 MET A 40 11.488 0.558 -2.155 1.00 0.00 H new ATOM 0 HE1 MET A 40 12.896 -1.010 0.294 1.00 0.00 H new ATOM 0 HE2 MET A 40 11.437 -1.056 -0.724 1.00 0.00 H new ATOM 0 HE3 MET A 40 12.476 -2.495 -0.590 1.00 0.00 H new ATOM 694 N ILE A 41 10.615 2.711 -4.819 1.00 0.00 N ATOM 695 CA ILE A 41 11.145 3.983 -5.295 1.00 0.00 C ATOM 696 C ILE A 41 11.956 4.682 -4.208 1.00 0.00 C ATOM 697 O ILE A 41 11.484 4.865 -3.085 1.00 0.00 O ATOM 698 CB ILE A 41 10.018 4.923 -5.763 1.00 0.00 C ATOM 699 CG1 ILE A 41 8.917 4.125 -6.464 1.00 0.00 C ATOM 700 CG2 ILE A 41 10.573 5.996 -6.687 1.00 0.00 C ATOM 701 CD1 ILE A 41 7.924 4.990 -7.209 1.00 0.00 C ATOM 0 H ILE A 41 9.879 2.796 -4.118 1.00 0.00 H new ATOM 0 HA ILE A 41 11.794 3.757 -6.141 1.00 0.00 H new ATOM 0 HB ILE A 41 9.586 5.412 -4.890 1.00 0.00 H new ATOM 0 HG12 ILE A 41 9.375 3.427 -7.164 1.00 0.00 H new ATOM 0 HG13 ILE A 41 8.384 3.529 -5.723 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.765 6.652 -7.009 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.325 6.580 -6.156 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.028 5.526 -7.559 1.00 0.00 H new ATOM 0 HD11 ILE A 41 7.173 4.357 -7.681 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.438 5.671 -6.510 1.00 0.00 H new ATOM 0 HD13 ILE A 41 8.445 5.566 -7.973 1.00 0.00 H new ATOM 713 N THR A 42 13.180 5.073 -4.550 1.00 0.00 N ATOM 714 CA THR A 42 14.056 5.752 -3.605 1.00 0.00 C ATOM 715 C THR A 42 14.622 7.035 -4.204 1.00 0.00 C ATOM 716 O THR A 42 15.704 7.482 -3.825 1.00 0.00 O ATOM 717 CB THR A 42 15.222 4.845 -3.168 1.00 0.00 C ATOM 718 OG1 THR A 42 16.000 4.463 -4.309 1.00 0.00 O ATOM 719 CG2 THR A 42 14.705 3.601 -2.461 1.00 0.00 C ATOM 0 H THR A 42 13.586 4.931 -5.475 1.00 0.00 H new ATOM 0 HA THR A 42 13.450 5.998 -2.733 1.00 0.00 H new ATOM 0 HB THR A 42 15.848 5.405 -2.473 1.00 0.00 H new ATOM 0 HG1 THR A 42 16.740 3.888 -4.023 1.00 0.00 H new ATOM 0 HG21 THR A 42 15.547 2.976 -2.162 1.00 0.00 H new ATOM 0 HG22 THR A 42 14.138 3.894 -1.577 1.00 0.00 H new ATOM 0 HG23 THR A 42 14.059 3.040 -3.137 1.00 0.00 H new ATOM 727 N GLU A 43 13.884 7.621 -5.140 1.00 0.00 N ATOM 728 CA GLU A 43 14.313 8.853 -5.791 1.00 0.00 C ATOM 729 C GLU A 43 13.842 10.075 -5.009 1.00 0.00 C ATOM 730 O GLU A 43 13.876 11.200 -5.510 1.00 0.00 O ATOM 731 CB GLU A 43 13.778 8.913 -7.223 1.00 0.00 C ATOM 732 CG GLU A 43 13.952 7.615 -7.993 1.00 0.00 C ATOM 733 CD GLU A 43 15.409 7.247 -8.193 1.00 0.00 C ATOM 734 OE1 GLU A 43 16.204 8.141 -8.549 1.00 0.00 O ATOM 735 OE2 GLU A 43 15.753 6.062 -7.994 1.00 0.00 O ATOM 0 H GLU A 43 12.986 7.263 -5.465 1.00 0.00 H new ATOM 0 HA GLU A 43 15.403 8.858 -5.817 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.719 9.170 -7.196 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.287 9.714 -7.759 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.448 6.810 -7.459 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.467 7.706 -8.965 1.00 0.00 H new ATOM 742 N HIS A 44 13.402 9.848 -3.775 1.00 0.00 N ATOM 743 CA HIS A 44 12.923 10.929 -2.921 1.00 0.00 C ATOM 744 C HIS A 44 13.899 11.192 -1.779 1.00 0.00 C ATOM 745 O HIS A 44 14.317 10.269 -1.080 1.00 0.00 O ATOM 746 CB HIS A 44 11.542 10.591 -2.360 1.00 0.00 C ATOM 747 CG HIS A 44 10.443 10.687 -3.373 1.00 0.00 C ATOM 748 ND1 HIS A 44 9.270 11.377 -3.150 1.00 0.00 N ATOM 749 CD2 HIS A 44 10.344 10.174 -4.622 1.00 0.00 C ATOM 750 CE1 HIS A 44 8.498 11.285 -4.218 1.00 0.00 C ATOM 751 NE2 HIS A 44 9.126 10.560 -5.126 1.00 0.00 N ATOM 0 H HIS A 44 13.367 8.924 -3.344 1.00 0.00 H new ATOM 0 HA HIS A 44 12.849 11.832 -3.527 1.00 0.00 H new ATOM 0 HB2 HIS A 44 11.562 9.580 -1.953 1.00 0.00 H new ATOM 0 HB3 HIS A 44 11.321 11.264 -1.532 1.00 0.00 H new ATOM 0 HD2 HIS A 44 11.085 9.573 -5.128 1.00 0.00 H new ATOM 0 HE1 HIS A 44 7.519 11.728 -4.330 1.00 0.00 H new ATOM 0 HE2 HIS A 44 8.765 10.325 -6.051 1.00 0.00 H new ATOM 759 N THR A 45 14.259 12.458 -1.594 1.00 0.00 N ATOM 760 CA THR A 45 15.186 12.843 -0.538 1.00 0.00 C ATOM 761 C THR A 45 14.462 13.024 0.791 1.00 0.00 C ATOM 762 O THR A 45 14.653 14.025 1.481 1.00 0.00 O ATOM 763 CB THR A 45 15.926 14.148 -0.889 1.00 0.00 C ATOM 764 OG1 THR A 45 14.985 15.210 -1.077 1.00 0.00 O ATOM 765 CG2 THR A 45 16.762 13.975 -2.147 1.00 0.00 C ATOM 0 H THR A 45 13.922 13.235 -2.163 1.00 0.00 H new ATOM 0 HA THR A 45 15.912 12.036 -0.445 1.00 0.00 H new ATOM 0 HB THR A 45 16.591 14.396 -0.062 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.464 16.036 -1.298 1.00 0.00 H new ATOM 0 HG21 THR A 45 17.275 14.910 -2.374 1.00 0.00 H new ATOM 0 HG22 THR A 45 17.498 13.186 -1.989 1.00 0.00 H new ATOM 0 HG23 THR A 45 16.114 13.705 -2.980 1.00 0.00 H new ATOM 773 N SER A 46 13.633 12.049 1.145 1.00 0.00 N ATOM 774 CA SER A 46 12.877 12.102 2.391 1.00 0.00 C ATOM 775 C SER A 46 13.582 11.311 3.489 1.00 0.00 C ATOM 776 O SER A 46 14.632 10.711 3.258 1.00 0.00 O ATOM 777 CB SER A 46 11.464 11.554 2.180 1.00 0.00 C ATOM 778 OG SER A 46 11.498 10.191 1.795 1.00 0.00 O ATOM 0 H SER A 46 13.467 11.212 0.587 1.00 0.00 H new ATOM 0 HA SER A 46 12.812 13.145 2.702 1.00 0.00 H new ATOM 0 HB2 SER A 46 10.888 11.661 3.099 1.00 0.00 H new ATOM 0 HB3 SER A 46 10.954 12.139 1.414 1.00 0.00 H new ATOM 0 HG SER A 46 11.233 9.630 2.553 1.00 0.00 H new ATOM 784 N ASN A 47 12.998 11.315 4.682 1.00 0.00 N ATOM 785 CA ASN A 47 13.569 10.599 5.816 1.00 0.00 C ATOM 786 C ASN A 47 13.875 9.151 5.446 1.00 0.00 C ATOM 787 O ASN A 47 14.807 8.546 5.978 1.00 0.00 O ATOM 788 CB ASN A 47 12.612 10.640 7.008 1.00 0.00 C ATOM 789 CG ASN A 47 11.210 10.196 6.639 1.00 0.00 C ATOM 790 OD1 ASN A 47 10.907 9.003 6.625 1.00 0.00 O ATOM 791 ND2 ASN A 47 10.344 11.158 6.338 1.00 0.00 N ATOM 0 H ASN A 47 12.129 11.807 4.889 1.00 0.00 H new ATOM 0 HA ASN A 47 14.502 11.091 6.091 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.996 9.999 7.801 1.00 0.00 H new ATOM 0 HB3 ASN A 47 12.576 11.654 7.407 1.00 0.00 H new ATOM 0 HD21 ASN A 47 9.386 10.920 6.083 1.00 0.00 H new ATOM 0 HD22 ASN A 47 10.638 12.135 6.362 1.00 0.00 H new ATOM 798 N ASP A 48 13.086 8.599 4.531 1.00 0.00 N ATOM 799 CA ASP A 48 13.273 7.223 4.088 1.00 0.00 C ATOM 800 C ASP A 48 12.547 6.973 2.770 1.00 0.00 C ATOM 801 O ASP A 48 11.590 7.664 2.419 1.00 0.00 O ATOM 802 CB ASP A 48 12.770 6.249 5.155 1.00 0.00 C ATOM 803 CG ASP A 48 13.806 5.983 6.230 1.00 0.00 C ATOM 804 OD1 ASP A 48 14.676 5.113 6.013 1.00 0.00 O ATOM 805 OD2 ASP A 48 13.747 6.645 7.287 1.00 0.00 O ATOM 0 H ASP A 48 12.310 9.084 4.081 1.00 0.00 H new ATOM 0 HA ASP A 48 14.339 7.059 3.931 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.868 6.653 5.615 1.00 0.00 H new ATOM 0 HB3 ASP A 48 12.492 5.307 4.681 1.00 0.00 H new ATOM 810 N PRO A 49 13.010 5.960 2.022 1.00 0.00 N ATOM 811 CA PRO A 49 12.419 5.596 0.731 1.00 0.00 C ATOM 812 C PRO A 49 11.033 4.980 0.881 1.00 0.00 C ATOM 813 O PRO A 49 10.568 4.736 1.995 1.00 0.00 O ATOM 814 CB PRO A 49 13.403 4.567 0.168 1.00 0.00 C ATOM 815 CG PRO A 49 14.069 3.984 1.367 1.00 0.00 C ATOM 816 CD PRO A 49 14.146 5.094 2.378 1.00 0.00 C ATOM 0 HA PRO A 49 12.276 6.465 0.089 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.887 3.801 -0.410 1.00 0.00 H new ATOM 0 HB3 PRO A 49 14.127 5.035 -0.499 1.00 0.00 H new ATOM 0 HG2 PRO A 49 13.501 3.139 1.757 1.00 0.00 H new ATOM 0 HG3 PRO A 49 15.063 3.612 1.119 1.00 0.00 H new ATOM 0 HD2 PRO A 49 14.059 4.716 3.397 1.00 0.00 H new ATOM 0 HD3 PRO A 49 15.094 5.629 2.316 1.00 0.00 H new ATOM 824 N TYR A 50 10.377 4.728 -0.247 1.00 0.00 N ATOM 825 CA TYR A 50 9.042 4.141 -0.240 1.00 0.00 C ATOM 826 C TYR A 50 8.869 3.169 -1.403 1.00 0.00 C ATOM 827 O TYR A 50 9.547 3.279 -2.425 1.00 0.00 O ATOM 828 CB TYR A 50 7.980 5.239 -0.315 1.00 0.00 C ATOM 829 CG TYR A 50 7.863 5.877 -1.681 1.00 0.00 C ATOM 830 CD1 TYR A 50 8.795 6.810 -2.115 1.00 0.00 C ATOM 831 CD2 TYR A 50 6.821 5.545 -2.538 1.00 0.00 C ATOM 832 CE1 TYR A 50 8.693 7.397 -3.362 1.00 0.00 C ATOM 833 CE2 TYR A 50 6.711 6.125 -3.787 1.00 0.00 C ATOM 834 CZ TYR A 50 7.649 7.050 -4.195 1.00 0.00 C ATOM 835 OH TYR A 50 7.543 7.630 -5.438 1.00 0.00 O ATOM 0 H TYR A 50 10.748 4.921 -1.177 1.00 0.00 H new ATOM 0 HA TYR A 50 8.919 3.589 0.692 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.014 4.818 -0.036 1.00 0.00 H new ATOM 0 HB3 TYR A 50 8.215 6.011 0.418 1.00 0.00 H new ATOM 0 HD1 TYR A 50 9.615 7.082 -1.466 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.084 4.821 -2.222 1.00 0.00 H new ATOM 0 HE1 TYR A 50 9.426 8.123 -3.683 1.00 0.00 H new ATOM 0 HE2 TYR A 50 5.895 5.855 -4.441 1.00 0.00 H new ATOM 0 HH TYR A 50 7.987 8.504 -5.430 1.00 0.00 H new ATOM 845 N CYS A 51 7.955 2.219 -1.239 1.00 0.00 N ATOM 846 CA CYS A 51 7.690 1.226 -2.274 1.00 0.00 C ATOM 847 C CYS A 51 6.191 1.012 -2.453 1.00 0.00 C ATOM 848 O CYS A 51 5.402 1.300 -1.553 1.00 0.00 O ATOM 849 CB CYS A 51 8.370 -0.100 -1.924 1.00 0.00 C ATOM 850 SG CYS A 51 7.401 -1.155 -0.821 1.00 0.00 S ATOM 0 H CYS A 51 7.385 2.115 -0.399 1.00 0.00 H new ATOM 0 HA CYS A 51 8.099 1.599 -3.213 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.574 -0.646 -2.845 1.00 0.00 H new ATOM 0 HB3 CYS A 51 9.332 0.109 -1.457 1.00 0.00 H new ATOM 0 HG CYS A 51 6.637 -1.935 -1.527 1.00 0.00 H new ATOM 856 N PHE A 52 5.806 0.506 -3.619 1.00 0.00 N ATOM 857 CA PHE A 52 4.399 0.255 -3.917 1.00 0.00 C ATOM 858 C PHE A 52 4.106 -1.242 -3.937 1.00 0.00 C ATOM 859 O PHE A 52 4.936 -2.043 -4.367 1.00 0.00 O ATOM 860 CB PHE A 52 4.023 0.879 -5.262 1.00 0.00 C ATOM 861 CG PHE A 52 3.917 2.377 -5.220 1.00 0.00 C ATOM 862 CD1 PHE A 52 3.006 2.997 -4.381 1.00 0.00 C ATOM 863 CD2 PHE A 52 4.729 3.164 -6.020 1.00 0.00 C ATOM 864 CE1 PHE A 52 2.906 4.375 -4.341 1.00 0.00 C ATOM 865 CE2 PHE A 52 4.634 4.543 -5.984 1.00 0.00 C ATOM 866 CZ PHE A 52 3.722 5.149 -5.143 1.00 0.00 C ATOM 0 H PHE A 52 6.447 0.261 -4.374 1.00 0.00 H new ATOM 0 HA PHE A 52 3.799 0.713 -3.131 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.768 0.596 -6.005 1.00 0.00 H new ATOM 0 HB3 PHE A 52 3.070 0.465 -5.592 1.00 0.00 H new ATOM 0 HD1 PHE A 52 2.366 2.397 -3.751 1.00 0.00 H new ATOM 0 HD2 PHE A 52 5.444 2.695 -6.679 1.00 0.00 H new ATOM 0 HE1 PHE A 52 2.191 4.846 -3.683 1.00 0.00 H new ATOM 0 HE2 PHE A 52 5.273 5.145 -6.613 1.00 0.00 H new ATOM 0 HZ PHE A 52 3.647 6.226 -5.112 1.00 0.00 H new ATOM 876 N VAL A 53 2.919 -1.612 -3.468 1.00 0.00 N ATOM 877 CA VAL A 53 2.515 -3.013 -3.432 1.00 0.00 C ATOM 878 C VAL A 53 1.105 -3.191 -3.983 1.00 0.00 C ATOM 879 O VAL A 53 0.138 -2.678 -3.419 1.00 0.00 O ATOM 880 CB VAL A 53 2.569 -3.577 -1.999 1.00 0.00 C ATOM 881 CG1 VAL A 53 2.111 -5.026 -1.978 1.00 0.00 C ATOM 882 CG2 VAL A 53 3.974 -3.444 -1.428 1.00 0.00 C ATOM 0 H VAL A 53 2.220 -0.962 -3.108 1.00 0.00 H new ATOM 0 HA VAL A 53 3.219 -3.562 -4.057 1.00 0.00 H new ATOM 0 HB VAL A 53 1.890 -2.998 -1.373 1.00 0.00 H new ATOM 0 HG11 VAL A 53 2.156 -5.407 -0.958 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.086 -5.089 -2.344 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.762 -5.623 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 53 3.995 -3.847 -0.415 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.675 -3.997 -2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.260 -2.392 -1.406 1.00 0.00 H new ATOM 892 N GLU A 54 0.994 -3.923 -5.087 1.00 0.00 N ATOM 893 CA GLU A 54 -0.299 -4.169 -5.714 1.00 0.00 C ATOM 894 C GLU A 54 -0.736 -5.617 -5.512 1.00 0.00 C ATOM 895 O GLU A 54 0.064 -6.543 -5.650 1.00 0.00 O ATOM 896 CB GLU A 54 -0.235 -3.849 -7.209 1.00 0.00 C ATOM 897 CG GLU A 54 -1.600 -3.772 -7.874 1.00 0.00 C ATOM 898 CD GLU A 54 -1.507 -3.554 -9.371 1.00 0.00 C ATOM 899 OE1 GLU A 54 -0.443 -3.856 -9.950 1.00 0.00 O ATOM 900 OE2 GLU A 54 -2.498 -3.079 -9.964 1.00 0.00 O ATOM 0 H GLU A 54 1.784 -4.356 -5.566 1.00 0.00 H new ATOM 0 HA GLU A 54 -1.033 -3.517 -5.240 1.00 0.00 H new ATOM 0 HB2 GLU A 54 0.281 -2.899 -7.347 1.00 0.00 H new ATOM 0 HB3 GLU A 54 0.361 -4.611 -7.710 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -2.148 -4.694 -7.678 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -2.173 -2.959 -7.427 1.00 0.00 H new ATOM 907 N PHE A 55 -2.009 -5.804 -5.181 1.00 0.00 N ATOM 908 CA PHE A 55 -2.552 -7.139 -4.956 1.00 0.00 C ATOM 909 C PHE A 55 -3.531 -7.521 -6.064 1.00 0.00 C ATOM 910 O PHE A 55 -4.034 -6.660 -6.785 1.00 0.00 O ATOM 911 CB PHE A 55 -3.251 -7.206 -3.597 1.00 0.00 C ATOM 912 CG PHE A 55 -2.311 -7.447 -2.451 1.00 0.00 C ATOM 913 CD1 PHE A 55 -1.678 -6.387 -1.822 1.00 0.00 C ATOM 914 CD2 PHE A 55 -2.062 -8.734 -2.001 1.00 0.00 C ATOM 915 CE1 PHE A 55 -0.812 -6.606 -0.768 1.00 0.00 C ATOM 916 CE2 PHE A 55 -1.196 -8.958 -0.947 1.00 0.00 C ATOM 917 CZ PHE A 55 -0.571 -7.893 -0.329 1.00 0.00 C ATOM 0 H PHE A 55 -2.684 -5.049 -5.063 1.00 0.00 H new ATOM 0 HA PHE A 55 -1.724 -7.848 -4.966 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -3.787 -6.272 -3.427 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -3.996 -8.002 -3.619 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -1.864 -5.378 -2.160 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -2.550 -9.571 -2.479 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -0.324 -5.771 -0.288 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -1.008 -9.966 -0.607 1.00 0.00 H new ATOM 0 HZ PHE A 55 0.105 -8.066 0.496 1.00 0.00 H new ATOM 927 N TYR A 56 -3.793 -8.816 -6.191 1.00 0.00 N ATOM 928 CA TYR A 56 -4.709 -9.313 -7.212 1.00 0.00 C ATOM 929 C TYR A 56 -6.144 -8.901 -6.904 1.00 0.00 C ATOM 930 O TYR A 56 -6.883 -8.478 -7.793 1.00 0.00 O ATOM 931 CB TYR A 56 -4.614 -10.838 -7.313 1.00 0.00 C ATOM 932 CG TYR A 56 -3.449 -11.318 -8.146 1.00 0.00 C ATOM 933 CD1 TYR A 56 -2.163 -11.356 -7.621 1.00 0.00 C ATOM 934 CD2 TYR A 56 -3.633 -11.736 -9.458 1.00 0.00 C ATOM 935 CE1 TYR A 56 -1.094 -11.794 -8.380 1.00 0.00 C ATOM 936 CE2 TYR A 56 -2.571 -12.178 -10.223 1.00 0.00 C ATOM 937 CZ TYR A 56 -1.304 -12.204 -9.680 1.00 0.00 C ATOM 938 OH TYR A 56 -0.242 -12.643 -10.437 1.00 0.00 O ATOM 0 H TYR A 56 -3.385 -9.541 -5.601 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.422 -8.873 -8.167 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -4.529 -11.255 -6.310 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.539 -11.224 -7.741 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -1.996 -11.038 -6.603 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -4.624 -11.715 -9.887 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.100 -11.815 -7.958 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -2.732 -12.501 -11.241 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.559 -12.896 -11.329 1.00 0.00 H new ATOM 948 N GLU A 57 -6.531 -9.025 -5.639 1.00 0.00 N ATOM 949 CA GLU A 57 -7.878 -8.666 -5.213 1.00 0.00 C ATOM 950 C GLU A 57 -7.842 -7.530 -4.194 1.00 0.00 C ATOM 951 O GLU A 57 -6.806 -7.259 -3.586 1.00 0.00 O ATOM 952 CB GLU A 57 -8.590 -9.880 -4.613 1.00 0.00 C ATOM 953 CG GLU A 57 -8.529 -11.117 -5.493 1.00 0.00 C ATOM 954 CD GLU A 57 -9.684 -11.192 -6.474 1.00 0.00 C ATOM 955 OE1 GLU A 57 -10.745 -10.602 -6.188 1.00 0.00 O ATOM 956 OE2 GLU A 57 -9.524 -11.842 -7.528 1.00 0.00 O ATOM 0 H GLU A 57 -5.930 -9.372 -4.891 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.429 -8.328 -6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -8.144 -10.110 -3.645 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -9.634 -9.625 -4.431 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.588 -11.121 -6.044 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -8.533 -12.007 -4.864 1.00 0.00 H new ATOM 963 N HIS A 58 -8.981 -6.867 -4.015 1.00 0.00 N ATOM 964 CA HIS A 58 -9.079 -5.760 -3.071 1.00 0.00 C ATOM 965 C HIS A 58 -9.060 -6.268 -1.633 1.00 0.00 C ATOM 966 O HIS A 58 -8.514 -5.619 -0.741 1.00 0.00 O ATOM 967 CB HIS A 58 -10.357 -4.960 -3.324 1.00 0.00 C ATOM 968 CG HIS A 58 -10.706 -4.020 -2.210 1.00 0.00 C ATOM 969 ND1 HIS A 58 -10.015 -2.851 -1.967 1.00 0.00 N ATOM 970 CD2 HIS A 58 -11.680 -4.081 -1.273 1.00 0.00 C ATOM 971 CE1 HIS A 58 -10.549 -2.235 -0.928 1.00 0.00 C ATOM 972 NE2 HIS A 58 -11.561 -2.960 -0.488 1.00 0.00 N ATOM 0 H HIS A 58 -9.847 -7.077 -4.511 1.00 0.00 H new ATOM 0 HA HIS A 58 -8.216 -5.111 -3.219 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -10.243 -4.391 -4.246 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -11.185 -5.652 -3.477 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -9.217 -2.515 -2.506 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -12.414 -4.865 -1.163 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -10.215 -1.297 -0.509 1.00 0.00 H new ATOM 980 N ARG A 59 -9.662 -7.435 -1.415 1.00 0.00 N ATOM 981 CA ARG A 59 -9.715 -8.029 -0.085 1.00 0.00 C ATOM 982 C ARG A 59 -8.311 -8.268 0.461 1.00 0.00 C ATOM 983 O ARG A 59 -8.040 -8.018 1.635 1.00 0.00 O ATOM 984 CB ARG A 59 -10.490 -9.348 -0.124 1.00 0.00 C ATOM 985 CG ARG A 59 -9.891 -10.378 -1.066 1.00 0.00 C ATOM 986 CD ARG A 59 -10.667 -11.686 -1.027 1.00 0.00 C ATOM 987 NE ARG A 59 -10.473 -12.399 0.232 1.00 0.00 N ATOM 988 CZ ARG A 59 -11.225 -13.426 0.618 1.00 0.00 C ATOM 989 NH1 ARG A 59 -12.213 -13.855 -0.154 1.00 0.00 N ATOM 990 NH2 ARG A 59 -10.986 -14.024 1.778 1.00 0.00 N ATOM 0 H ARG A 59 -10.119 -7.986 -2.142 1.00 0.00 H new ATOM 0 HA ARG A 59 -10.229 -7.332 0.577 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -10.529 -9.767 0.882 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -11.518 -9.147 -0.425 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -9.889 -9.985 -2.083 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.852 -10.562 -0.793 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -11.728 -11.482 -1.169 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -10.351 -12.320 -1.855 1.00 0.00 H new ATOM 0 HE ARG A 59 -9.720 -12.093 0.849 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -12.398 -13.397 -1.047 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -12.788 -14.643 0.144 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.226 -13.696 2.374 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -11.563 -14.812 2.074 1.00 0.00 H new ATOM 1004 N ASP A 60 -7.423 -8.754 -0.398 1.00 0.00 N ATOM 1005 CA ASP A 60 -6.046 -9.026 -0.004 1.00 0.00 C ATOM 1006 C ASP A 60 -5.300 -7.731 0.302 1.00 0.00 C ATOM 1007 O ASP A 60 -4.573 -7.639 1.289 1.00 0.00 O ATOM 1008 CB ASP A 60 -5.319 -9.799 -1.106 1.00 0.00 C ATOM 1009 CG ASP A 60 -6.059 -11.058 -1.514 1.00 0.00 C ATOM 1010 OD1 ASP A 60 -6.853 -11.570 -0.698 1.00 0.00 O ATOM 1011 OD2 ASP A 60 -5.843 -11.531 -2.650 1.00 0.00 O ATOM 0 H ASP A 60 -7.632 -8.968 -1.373 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.069 -9.633 0.901 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.196 -9.155 -1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.319 -10.064 -0.761 1.00 0.00 H new ATOM 1016 N ALA A 61 -5.488 -6.732 -0.554 1.00 0.00 N ATOM 1017 CA ALA A 61 -4.835 -5.441 -0.376 1.00 0.00 C ATOM 1018 C ALA A 61 -5.195 -4.824 0.972 1.00 0.00 C ATOM 1019 O ALA A 61 -4.333 -4.304 1.678 1.00 0.00 O ATOM 1020 CB ALA A 61 -5.213 -4.497 -1.508 1.00 0.00 C ATOM 0 H ALA A 61 -6.087 -6.792 -1.377 1.00 0.00 H new ATOM 0 HA ALA A 61 -3.757 -5.602 -0.396 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -4.718 -3.537 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.899 -4.926 -2.460 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -6.293 -4.351 -1.515 1.00 0.00 H new ATOM 1026 N ALA A 62 -6.476 -4.887 1.322 1.00 0.00 N ATOM 1027 CA ALA A 62 -6.950 -4.336 2.585 1.00 0.00 C ATOM 1028 C ALA A 62 -6.425 -5.143 3.768 1.00 0.00 C ATOM 1029 O ALA A 62 -6.039 -4.581 4.792 1.00 0.00 O ATOM 1030 CB ALA A 62 -8.471 -4.295 2.605 1.00 0.00 C ATOM 0 H ALA A 62 -7.203 -5.314 0.748 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.569 -3.319 2.675 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.811 -3.881 3.554 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.829 -3.669 1.787 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.864 -5.305 2.488 1.00 0.00 H new ATOM 1036 N ALA A 63 -6.415 -6.464 3.618 1.00 0.00 N ATOM 1037 CA ALA A 63 -5.935 -7.348 4.673 1.00 0.00 C ATOM 1038 C ALA A 63 -4.447 -7.139 4.931 1.00 0.00 C ATOM 1039 O ALA A 63 -4.017 -7.030 6.078 1.00 0.00 O ATOM 1040 CB ALA A 63 -6.212 -8.800 4.311 1.00 0.00 C ATOM 0 H ALA A 63 -6.734 -6.945 2.777 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.472 -7.104 5.589 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.848 -9.449 5.107 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.285 -8.945 4.186 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.701 -9.047 3.380 1.00 0.00 H new ATOM 1046 N ALA A 64 -3.667 -7.086 3.857 1.00 0.00 N ATOM 1047 CA ALA A 64 -2.227 -6.889 3.967 1.00 0.00 C ATOM 1048 C ALA A 64 -1.899 -5.457 4.374 1.00 0.00 C ATOM 1049 O ALA A 64 -0.944 -5.215 5.115 1.00 0.00 O ATOM 1050 CB ALA A 64 -1.545 -7.236 2.652 1.00 0.00 C ATOM 0 H ALA A 64 -4.008 -7.177 2.900 1.00 0.00 H new ATOM 0 HA ALA A 64 -1.852 -7.555 4.744 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.470 -7.084 2.749 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.743 -8.279 2.403 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.932 -6.594 1.861 1.00 0.00 H new ATOM 1056 N LEU A 65 -2.694 -4.511 3.888 1.00 0.00 N ATOM 1057 CA LEU A 65 -2.487 -3.101 4.201 1.00 0.00 C ATOM 1058 C LEU A 65 -2.550 -2.863 5.706 1.00 0.00 C ATOM 1059 O LEU A 65 -1.654 -2.249 6.285 1.00 0.00 O ATOM 1060 CB LEU A 65 -3.536 -2.242 3.492 1.00 0.00 C ATOM 1061 CG LEU A 65 -3.786 -0.858 4.093 1.00 0.00 C ATOM 1062 CD1 LEU A 65 -2.685 0.108 3.686 1.00 0.00 C ATOM 1063 CD2 LEU A 65 -5.148 -0.330 3.666 1.00 0.00 C ATOM 0 H LEU A 65 -3.489 -4.694 3.275 1.00 0.00 H new ATOM 0 HA LEU A 65 -1.495 -2.817 3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.232 -2.116 2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.479 -2.788 3.484 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.778 -0.947 5.179 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -2.880 1.087 4.123 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.725 -0.264 4.043 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.660 0.194 2.600 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.309 0.656 4.103 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -5.185 -0.256 2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -5.926 -1.011 4.010 1.00 0.00 H new ATOM 1075 N ALA A 66 -3.612 -3.355 6.334 1.00 0.00 N ATOM 1076 CA ALA A 66 -3.789 -3.199 7.772 1.00 0.00 C ATOM 1077 C ALA A 66 -2.752 -4.008 8.544 1.00 0.00 C ATOM 1078 O ALA A 66 -2.214 -3.546 9.549 1.00 0.00 O ATOM 1079 CB ALA A 66 -5.195 -3.616 8.178 1.00 0.00 C ATOM 0 H ALA A 66 -4.363 -3.865 5.869 1.00 0.00 H new ATOM 0 HA ALA A 66 -3.648 -2.147 8.019 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -5.314 -3.495 9.255 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -5.923 -2.992 7.660 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -5.356 -4.660 7.911 1.00 0.00 H new ATOM 1085 N ALA A 67 -2.477 -5.217 8.067 1.00 0.00 N ATOM 1086 CA ALA A 67 -1.503 -6.089 8.711 1.00 0.00 C ATOM 1087 C ALA A 67 -0.089 -5.536 8.566 1.00 0.00 C ATOM 1088 O ALA A 67 0.783 -5.811 9.391 1.00 0.00 O ATOM 1089 CB ALA A 67 -1.584 -7.492 8.129 1.00 0.00 C ATOM 0 H ALA A 67 -2.915 -5.615 7.236 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.741 -6.134 9.774 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.851 -8.132 8.620 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.584 -7.896 8.290 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.376 -7.455 7.060 1.00 0.00 H new ATOM 1095 N MET A 68 0.130 -4.755 7.513 1.00 0.00 N ATOM 1096 CA MET A 68 1.438 -4.162 7.262 1.00 0.00 C ATOM 1097 C MET A 68 1.463 -2.697 7.685 1.00 0.00 C ATOM 1098 O MET A 68 2.529 -2.111 7.862 1.00 0.00 O ATOM 1099 CB MET A 68 1.800 -4.283 5.779 1.00 0.00 C ATOM 1100 CG MET A 68 1.926 -5.720 5.299 1.00 0.00 C ATOM 1101 SD MET A 68 3.211 -6.633 6.173 1.00 0.00 S ATOM 1102 CE MET A 68 4.532 -5.424 6.193 1.00 0.00 C ATOM 0 H MET A 68 -0.581 -4.518 6.821 1.00 0.00 H new ATOM 0 HA MET A 68 2.174 -4.705 7.855 1.00 0.00 H new ATOM 0 HB2 MET A 68 1.040 -3.776 5.185 1.00 0.00 H new ATOM 0 HB3 MET A 68 2.742 -3.765 5.600 1.00 0.00 H new ATOM 0 HG2 MET A 68 0.971 -6.228 5.431 1.00 0.00 H new ATOM 0 HG3 MET A 68 2.145 -5.725 4.231 1.00 0.00 H new ATOM 0 HE1 MET A 68 5.489 -5.929 6.062 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.384 -4.710 5.383 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.528 -4.896 7.147 1.00 0.00 H new ATOM 1112 N ASN A 69 0.280 -2.113 7.844 1.00 0.00 N ATOM 1113 CA ASN A 69 0.166 -0.716 8.247 1.00 0.00 C ATOM 1114 C ASN A 69 0.902 -0.465 9.560 1.00 0.00 C ATOM 1115 O ASN A 69 0.444 -0.869 10.628 1.00 0.00 O ATOM 1116 CB ASN A 69 -1.306 -0.324 8.392 1.00 0.00 C ATOM 1117 CG ASN A 69 -1.479 1.082 8.938 1.00 0.00 C ATOM 1118 OD1 ASN A 69 -1.887 1.993 8.219 1.00 0.00 O ATOM 1119 ND2 ASN A 69 -1.168 1.261 10.216 1.00 0.00 N ATOM 0 H ASN A 69 -0.613 -2.585 7.700 1.00 0.00 H new ATOM 0 HA ASN A 69 0.625 -0.102 7.472 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -1.796 -0.397 7.421 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -1.804 -1.032 9.054 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -1.264 2.184 10.640 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -0.833 0.476 10.774 1.00 0.00 H new ATOM 1126 N GLY A 70 2.048 0.204 9.471 1.00 0.00 N ATOM 1127 CA GLY A 70 2.829 0.497 10.659 1.00 0.00 C ATOM 1128 C GLY A 70 3.440 -0.747 11.272 1.00 0.00 C ATOM 1129 O GLY A 70 3.574 -0.845 12.492 1.00 0.00 O ATOM 0 H GLY A 70 2.449 0.548 8.598 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.622 1.200 10.404 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.193 0.987 11.396 1.00 0.00 H new ATOM 1133 N ARG A 71 3.811 -1.702 10.425 1.00 0.00 N ATOM 1134 CA ARG A 71 4.409 -2.947 10.890 1.00 0.00 C ATOM 1135 C ARG A 71 5.893 -2.758 11.192 1.00 0.00 C ATOM 1136 O ARG A 71 6.526 -1.828 10.692 1.00 0.00 O ATOM 1137 CB ARG A 71 4.225 -4.048 9.844 1.00 0.00 C ATOM 1138 CG ARG A 71 4.393 -5.452 10.403 1.00 0.00 C ATOM 1139 CD ARG A 71 4.065 -6.509 9.359 1.00 0.00 C ATOM 1140 NE ARG A 71 3.629 -7.762 9.969 1.00 0.00 N ATOM 1141 CZ ARG A 71 4.428 -8.554 10.675 1.00 0.00 C ATOM 1142 NH1 ARG A 71 5.698 -8.222 10.860 1.00 0.00 N ATOM 1143 NH2 ARG A 71 3.957 -9.678 11.198 1.00 0.00 N ATOM 0 H ARG A 71 3.708 -1.637 9.412 1.00 0.00 H new ATOM 0 HA ARG A 71 3.904 -3.242 11.810 1.00 0.00 H new ATOM 0 HB2 ARG A 71 3.232 -3.957 9.404 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.945 -3.898 9.040 1.00 0.00 H new ATOM 0 HG2 ARG A 71 5.418 -5.587 10.750 1.00 0.00 H new ATOM 0 HG3 ARG A 71 3.744 -5.580 11.269 1.00 0.00 H new ATOM 0 HD2 ARG A 71 3.283 -6.136 8.698 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.944 -6.693 8.741 1.00 0.00 H new ATOM 0 HE ARG A 71 2.657 -8.045 9.846 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.063 -7.357 10.460 1.00 0.00 H new ATOM 0 HH12 ARG A 71 6.311 -8.831 11.402 1.00 0.00 H new ATOM 0 HH21 ARG A 71 2.980 -9.935 11.058 1.00 0.00 H new ATOM 0 HH22 ARG A 71 4.572 -10.285 11.740 1.00 0.00 H new ATOM 1157 N LYS A 72 6.443 -3.647 12.012 1.00 0.00 N ATOM 1158 CA LYS A 72 7.852 -3.580 12.380 1.00 0.00 C ATOM 1159 C LYS A 72 8.695 -4.463 11.466 1.00 0.00 C ATOM 1160 O LYS A 72 8.544 -5.685 11.457 1.00 0.00 O ATOM 1161 CB LYS A 72 8.040 -4.009 13.837 1.00 0.00 C ATOM 1162 CG LYS A 72 7.948 -2.860 14.826 1.00 0.00 C ATOM 1163 CD LYS A 72 9.308 -2.230 15.078 1.00 0.00 C ATOM 1164 CE LYS A 72 9.700 -1.283 13.955 1.00 0.00 C ATOM 1165 NZ LYS A 72 10.580 -0.184 14.438 1.00 0.00 N ATOM 0 H LYS A 72 5.934 -4.423 12.435 1.00 0.00 H new ATOM 0 HA LYS A 72 8.184 -2.548 12.266 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.285 -4.754 14.088 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.012 -4.491 13.942 1.00 0.00 H new ATOM 0 HG2 LYS A 72 7.261 -2.104 14.444 1.00 0.00 H new ATOM 0 HG3 LYS A 72 7.533 -3.221 15.767 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.289 -1.687 16.023 1.00 0.00 H new ATOM 0 HD3 LYS A 72 10.060 -3.013 15.175 1.00 0.00 H new ATOM 0 HE2 LYS A 72 10.213 -1.841 13.172 1.00 0.00 H new ATOM 0 HE3 LYS A 72 8.801 -0.859 13.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 10.107 0.730 14.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 10.773 -0.314 15.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 11.476 -0.199 13.910 1.00 0.00 H new ATOM 1179 N ILE A 73 9.583 -3.838 10.701 1.00 0.00 N ATOM 1180 CA ILE A 73 10.452 -4.568 9.786 1.00 0.00 C ATOM 1181 C ILE A 73 11.890 -4.069 9.878 1.00 0.00 C ATOM 1182 O ILE A 73 12.168 -2.894 9.632 1.00 0.00 O ATOM 1183 CB ILE A 73 9.968 -4.442 8.330 1.00 0.00 C ATOM 1184 CG1 ILE A 73 8.498 -4.849 8.220 1.00 0.00 C ATOM 1185 CG2 ILE A 73 10.830 -5.294 7.410 1.00 0.00 C ATOM 1186 CD1 ILE A 73 7.833 -4.379 6.946 1.00 0.00 C ATOM 0 H ILE A 73 9.720 -2.827 10.696 1.00 0.00 H new ATOM 0 HA ILE A 73 10.415 -5.616 10.083 1.00 0.00 H new ATOM 0 HB ILE A 73 10.060 -3.401 8.021 1.00 0.00 H new ATOM 0 HG12 ILE A 73 8.425 -5.935 8.279 1.00 0.00 H new ATOM 0 HG13 ILE A 73 7.953 -4.446 9.074 1.00 0.00 H new ATOM 0 HG21 ILE A 73 10.476 -5.195 6.384 1.00 0.00 H new ATOM 0 HG22 ILE A 73 11.866 -4.960 7.470 1.00 0.00 H new ATOM 0 HG23 ILE A 73 10.767 -6.338 7.716 1.00 0.00 H new ATOM 0 HD11 ILE A 73 6.793 -4.704 6.937 1.00 0.00 H new ATOM 0 HD12 ILE A 73 7.874 -3.291 6.894 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.353 -4.803 6.087 1.00 0.00 H new ATOM 1198 N LEU A 74 12.801 -4.969 10.231 1.00 0.00 N ATOM 1199 CA LEU A 74 14.213 -4.621 10.353 1.00 0.00 C ATOM 1200 C LEU A 74 14.417 -3.537 11.406 1.00 0.00 C ATOM 1201 O LEU A 74 15.235 -2.635 11.231 1.00 0.00 O ATOM 1202 CB LEU A 74 14.761 -4.150 9.005 1.00 0.00 C ATOM 1203 CG LEU A 74 14.682 -5.158 7.858 1.00 0.00 C ATOM 1204 CD1 LEU A 74 15.097 -4.509 6.548 1.00 0.00 C ATOM 1205 CD2 LEU A 74 15.550 -6.372 8.155 1.00 0.00 C ATOM 0 H LEU A 74 12.588 -5.945 10.438 1.00 0.00 H new ATOM 0 HA LEU A 74 14.756 -5.512 10.667 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.220 -3.251 8.710 1.00 0.00 H new ATOM 0 HB3 LEU A 74 15.804 -3.864 9.140 1.00 0.00 H new ATOM 0 HG LEU A 74 13.649 -5.491 7.762 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.035 -5.241 5.743 1.00 0.00 H new ATOM 0 HD12 LEU A 74 14.433 -3.673 6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.122 -4.147 6.630 1.00 0.00 H new ATOM 0 HD21 LEU A 74 15.482 -7.079 7.328 1.00 0.00 H new ATOM 0 HD22 LEU A 74 16.586 -6.057 8.279 1.00 0.00 H new ATOM 0 HD23 LEU A 74 15.205 -6.851 9.071 1.00 0.00 H new ATOM 1217 N GLY A 75 13.668 -3.633 12.500 1.00 0.00 N ATOM 1218 CA GLY A 75 13.784 -2.654 13.566 1.00 0.00 C ATOM 1219 C GLY A 75 13.180 -1.315 13.192 1.00 0.00 C ATOM 1220 O GLY A 75 13.138 -0.394 14.008 1.00 0.00 O ATOM 0 H GLY A 75 12.983 -4.370 12.668 1.00 0.00 H new ATOM 0 HA2 GLY A 75 13.290 -3.035 14.460 1.00 0.00 H new ATOM 0 HA3 GLY A 75 14.836 -2.517 13.817 1.00 0.00 H new ATOM 1224 N LYS A 76 12.712 -1.204 11.953 1.00 0.00 N ATOM 1225 CA LYS A 76 12.107 0.031 11.471 1.00 0.00 C ATOM 1226 C LYS A 76 10.631 -0.175 11.145 1.00 0.00 C ATOM 1227 O LYS A 76 10.278 -1.058 10.364 1.00 0.00 O ATOM 1228 CB LYS A 76 12.848 0.536 10.231 1.00 0.00 C ATOM 1229 CG LYS A 76 12.758 2.041 10.039 1.00 0.00 C ATOM 1230 CD LYS A 76 13.902 2.563 9.185 1.00 0.00 C ATOM 1231 CE LYS A 76 14.245 4.002 9.534 1.00 0.00 C ATOM 1232 NZ LYS A 76 15.646 4.343 9.164 1.00 0.00 N ATOM 0 H LYS A 76 12.741 -1.956 11.264 1.00 0.00 H new ATOM 0 HA LYS A 76 12.185 0.776 12.263 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.897 0.250 10.303 1.00 0.00 H new ATOM 0 HB3 LYS A 76 12.442 0.041 9.349 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.807 2.293 9.569 1.00 0.00 H new ATOM 0 HG3 LYS A 76 12.773 2.534 11.011 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.780 1.934 9.327 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.630 2.498 8.131 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.559 4.674 9.018 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.103 4.160 10.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 15.841 5.332 9.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 16.302 3.719 9.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 15.775 4.217 8.140 1.00 0.00 H new ATOM 1246 N GLU A 77 9.776 0.644 11.749 1.00 0.00 N ATOM 1247 CA GLU A 77 8.338 0.550 11.520 1.00 0.00 C ATOM 1248 C GLU A 77 7.959 1.166 10.176 1.00 0.00 C ATOM 1249 O GLU A 77 8.192 2.350 9.936 1.00 0.00 O ATOM 1250 CB GLU A 77 7.574 1.247 12.648 1.00 0.00 C ATOM 1251 CG GLU A 77 6.209 0.640 12.925 1.00 0.00 C ATOM 1252 CD GLU A 77 5.246 1.629 13.551 1.00 0.00 C ATOM 1253 OE1 GLU A 77 4.570 2.358 12.794 1.00 0.00 O ATOM 1254 OE2 GLU A 77 5.168 1.674 14.796 1.00 0.00 O ATOM 0 H GLU A 77 10.053 1.379 12.400 1.00 0.00 H new ATOM 0 HA GLU A 77 8.066 -0.505 11.505 1.00 0.00 H new ATOM 0 HB2 GLU A 77 8.172 1.207 13.559 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.449 2.300 12.394 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.786 0.267 11.992 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.325 -0.218 13.588 1.00 0.00 H new ATOM 1261 N VAL A 78 7.373 0.351 9.304 1.00 0.00 N ATOM 1262 CA VAL A 78 6.960 0.815 7.985 1.00 0.00 C ATOM 1263 C VAL A 78 5.482 1.188 7.971 1.00 0.00 C ATOM 1264 O VAL A 78 4.653 0.509 8.575 1.00 0.00 O ATOM 1265 CB VAL A 78 7.218 -0.255 6.908 1.00 0.00 C ATOM 1266 CG1 VAL A 78 8.545 -0.956 7.158 1.00 0.00 C ATOM 1267 CG2 VAL A 78 6.075 -1.258 6.869 1.00 0.00 C ATOM 0 H VAL A 78 7.174 -0.632 9.487 1.00 0.00 H new ATOM 0 HA VAL A 78 7.557 1.699 7.759 1.00 0.00 H new ATOM 0 HB VAL A 78 7.272 0.238 5.937 1.00 0.00 H new ATOM 0 HG11 VAL A 78 8.710 -1.709 6.387 1.00 0.00 H new ATOM 0 HG12 VAL A 78 9.353 -0.225 7.131 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.524 -1.437 8.136 1.00 0.00 H new ATOM 0 HG21 VAL A 78 6.274 -2.007 6.102 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.987 -1.747 7.839 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.144 -0.740 6.637 1.00 0.00 H new ATOM 1277 N LYS A 79 5.159 2.273 7.276 1.00 0.00 N ATOM 1278 CA LYS A 79 3.779 2.739 7.181 1.00 0.00 C ATOM 1279 C LYS A 79 3.151 2.309 5.858 1.00 0.00 C ATOM 1280 O LYS A 79 3.776 2.408 4.802 1.00 0.00 O ATOM 1281 CB LYS A 79 3.722 4.261 7.314 1.00 0.00 C ATOM 1282 CG LYS A 79 4.377 4.999 6.158 1.00 0.00 C ATOM 1283 CD LYS A 79 4.249 6.505 6.313 1.00 0.00 C ATOM 1284 CE LYS A 79 2.937 7.014 5.734 1.00 0.00 C ATOM 1285 NZ LYS A 79 1.812 6.872 6.700 1.00 0.00 N ATOM 0 H LYS A 79 5.833 2.847 6.770 1.00 0.00 H new ATOM 0 HA LYS A 79 3.212 2.289 7.996 1.00 0.00 H new ATOM 0 HB2 LYS A 79 2.680 4.572 7.388 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.209 4.554 8.244 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.431 4.727 6.102 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.917 4.689 5.220 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.310 6.770 7.369 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.084 6.996 5.813 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.046 8.062 5.455 1.00 0.00 H new ATOM 0 HE3 LYS A 79 2.705 6.464 4.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.166 7.681 6.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 1.296 5.990 6.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 2.188 6.846 7.669 1.00 0.00 H new ATOM 1299 N VAL A 80 1.912 1.834 5.924 1.00 0.00 N ATOM 1300 CA VAL A 80 1.197 1.393 4.732 1.00 0.00 C ATOM 1301 C VAL A 80 -0.184 2.032 4.651 1.00 0.00 C ATOM 1302 O VAL A 80 -0.957 1.986 5.607 1.00 0.00 O ATOM 1303 CB VAL A 80 1.045 -0.140 4.704 1.00 0.00 C ATOM 1304 CG1 VAL A 80 0.524 -0.600 3.351 1.00 0.00 C ATOM 1305 CG2 VAL A 80 2.370 -0.812 5.031 1.00 0.00 C ATOM 0 H VAL A 80 1.382 1.744 6.791 1.00 0.00 H new ATOM 0 HA VAL A 80 1.790 1.708 3.873 1.00 0.00 H new ATOM 0 HB VAL A 80 0.319 -0.430 5.464 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.423 -1.685 3.350 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.448 -0.145 3.162 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.223 -0.300 2.571 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.245 -1.895 5.007 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.119 -0.517 4.296 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.697 -0.507 6.025 1.00 0.00 H new ATOM 1315 N ASN A 81 -0.489 2.626 3.501 1.00 0.00 N ATOM 1316 CA ASN A 81 -1.779 3.274 3.295 1.00 0.00 C ATOM 1317 C ASN A 81 -2.284 3.040 1.874 1.00 0.00 C ATOM 1318 O ASN A 81 -1.527 2.629 0.995 1.00 0.00 O ATOM 1319 CB ASN A 81 -1.668 4.776 3.567 1.00 0.00 C ATOM 1320 CG ASN A 81 -1.949 5.123 5.016 1.00 0.00 C ATOM 1321 OD1 ASN A 81 -2.998 5.678 5.341 1.00 0.00 O ATOM 1322 ND2 ASN A 81 -1.008 4.795 5.896 1.00 0.00 N ATOM 0 H ASN A 81 0.139 2.672 2.699 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.493 2.837 3.993 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -0.667 5.118 3.302 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.368 5.311 2.926 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.141 5.003 6.886 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.153 4.336 5.581 1.00 0.00 H new ATOM 1329 N TRP A 82 -3.567 3.304 1.658 1.00 0.00 N ATOM 1330 CA TRP A 82 -4.174 3.123 0.344 1.00 0.00 C ATOM 1331 C TRP A 82 -3.630 4.141 -0.652 1.00 0.00 C ATOM 1332 O TRP A 82 -3.718 5.349 -0.429 1.00 0.00 O ATOM 1333 CB TRP A 82 -5.695 3.247 0.440 1.00 0.00 C ATOM 1334 CG TRP A 82 -6.340 2.101 1.160 1.00 0.00 C ATOM 1335 CD1 TRP A 82 -6.813 2.099 2.442 1.00 0.00 C ATOM 1336 CD2 TRP A 82 -6.582 0.789 0.639 1.00 0.00 C ATOM 1337 NE1 TRP A 82 -7.333 0.865 2.749 1.00 0.00 N ATOM 1338 CE2 TRP A 82 -7.204 0.045 1.660 1.00 0.00 C ATOM 1339 CE3 TRP A 82 -6.335 0.172 -0.590 1.00 0.00 C ATOM 1340 CZ2 TRP A 82 -7.581 -1.284 1.488 1.00 0.00 C ATOM 1341 CZ3 TRP A 82 -6.709 -1.147 -0.760 1.00 0.00 C ATOM 1342 CH2 TRP A 82 -7.327 -1.864 0.274 1.00 0.00 C ATOM 0 H TRP A 82 -4.207 3.644 2.375 1.00 0.00 H new ATOM 0 HA TRP A 82 -3.920 2.124 -0.011 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -5.945 4.176 0.953 1.00 0.00 H new ATOM 0 HB3 TRP A 82 -6.111 3.316 -0.565 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -6.783 2.943 3.115 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -7.748 0.602 3.643 1.00 0.00 H new ATOM 0 HE3 TRP A 82 -5.860 0.717 -1.393 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -8.057 -1.838 2.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -6.522 -1.634 -1.706 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -7.608 -2.894 0.110 1.00 0.00 H new ATOM 1353 N ALA A 83 -3.069 3.647 -1.751 1.00 0.00 N ATOM 1354 CA ALA A 83 -2.514 4.515 -2.781 1.00 0.00 C ATOM 1355 C ALA A 83 -3.602 5.004 -3.732 1.00 0.00 C ATOM 1356 O ALA A 83 -3.784 4.455 -4.818 1.00 0.00 O ATOM 1357 CB ALA A 83 -1.424 3.787 -3.553 1.00 0.00 C ATOM 0 H ALA A 83 -2.987 2.650 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 83 -2.078 5.386 -2.291 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.018 4.447 -4.319 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.628 3.493 -2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.844 2.899 -4.025 1.00 0.00 H new ATOM 1363 N THR A 84 -4.323 6.041 -3.315 1.00 0.00 N ATOM 1364 CA THR A 84 -5.394 6.602 -4.129 1.00 0.00 C ATOM 1365 C THR A 84 -5.949 7.877 -3.503 1.00 0.00 C ATOM 1366 O THR A 84 -5.646 8.201 -2.353 1.00 0.00 O ATOM 1367 CB THR A 84 -6.543 5.596 -4.319 1.00 0.00 C ATOM 1368 OG1 THR A 84 -7.468 6.085 -5.296 1.00 0.00 O ATOM 1369 CG2 THR A 84 -7.270 5.350 -3.005 1.00 0.00 C ATOM 0 H THR A 84 -4.184 6.509 -2.419 1.00 0.00 H new ATOM 0 HA THR A 84 -4.962 6.835 -5.102 1.00 0.00 H new ATOM 0 HB THR A 84 -6.117 4.654 -4.663 1.00 0.00 H new ATOM 0 HG1 THR A 84 -8.195 5.438 -5.411 1.00 0.00 H new ATOM 0 HG21 THR A 84 -8.078 4.636 -3.164 1.00 0.00 H new ATOM 0 HG22 THR A 84 -6.570 4.949 -2.272 1.00 0.00 H new ATOM 0 HG23 THR A 84 -7.683 6.289 -2.637 1.00 0.00 H new ATOM 1377 N THR A 85 -6.764 8.600 -4.265 1.00 0.00 N ATOM 1378 CA THR A 85 -7.361 9.839 -3.786 1.00 0.00 C ATOM 1379 C THR A 85 -8.677 9.572 -3.064 1.00 0.00 C ATOM 1380 O THR A 85 -9.404 8.629 -3.375 1.00 0.00 O ATOM 1381 CB THR A 85 -7.613 10.825 -4.942 1.00 0.00 C ATOM 1382 OG1 THR A 85 -8.439 10.211 -5.938 1.00 0.00 O ATOM 1383 CG2 THR A 85 -6.302 11.272 -5.568 1.00 0.00 C ATOM 0 H THR A 85 -7.026 8.347 -5.218 1.00 0.00 H new ATOM 0 HA THR A 85 -6.651 10.283 -3.088 1.00 0.00 H new ATOM 0 HB THR A 85 -8.121 11.701 -4.539 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.318 10.644 -5.947 1.00 0.00 H new ATOM 0 HG21 THR A 85 -6.506 11.968 -6.382 1.00 0.00 H new ATOM 0 HG22 THR A 85 -5.688 11.765 -4.814 1.00 0.00 H new ATOM 0 HG23 THR A 85 -5.770 10.404 -5.958 1.00 0.00 H new ATOM 1391 N PRO A 86 -8.994 10.423 -2.075 1.00 0.00 N ATOM 1392 CA PRO A 86 -10.225 10.299 -1.290 1.00 0.00 C ATOM 1393 C PRO A 86 -11.469 10.630 -2.106 1.00 0.00 C ATOM 1394 O PRO A 86 -12.561 10.139 -1.819 1.00 0.00 O ATOM 1395 CB PRO A 86 -10.033 11.322 -0.168 1.00 0.00 C ATOM 1396 CG PRO A 86 -9.090 12.329 -0.731 1.00 0.00 C ATOM 1397 CD PRO A 86 -8.175 11.570 -1.650 1.00 0.00 C ATOM 0 HA PRO A 86 -10.382 9.280 -0.935 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.980 11.781 0.115 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -9.625 10.855 0.728 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -9.628 13.108 -1.272 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -8.526 12.822 0.061 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -7.864 12.178 -2.499 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.268 11.249 -1.138 1.00 0.00 H new ATOM 1405 N SER A 87 -11.298 11.465 -3.126 1.00 0.00 N ATOM 1406 CA SER A 87 -12.408 11.864 -3.982 1.00 0.00 C ATOM 1407 C SER A 87 -13.328 10.681 -4.266 1.00 0.00 C ATOM 1408 O SER A 87 -12.866 9.568 -4.518 1.00 0.00 O ATOM 1409 CB SER A 87 -11.884 12.444 -5.297 1.00 0.00 C ATOM 1410 OG SER A 87 -11.439 11.417 -6.165 1.00 0.00 O ATOM 0 H SER A 87 -10.401 11.878 -3.379 1.00 0.00 H new ATOM 0 HA SER A 87 -12.980 12.630 -3.458 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.671 13.020 -5.783 1.00 0.00 H new ATOM 0 HB3 SER A 87 -11.064 13.133 -5.093 1.00 0.00 H new ATOM 0 HG SER A 87 -11.110 11.813 -6.999 1.00 0.00 H new ATOM 1416 N SER A 88 -14.633 10.929 -4.225 1.00 0.00 N ATOM 1417 CA SER A 88 -15.619 9.885 -4.473 1.00 0.00 C ATOM 1418 C SER A 88 -16.905 10.476 -5.042 1.00 0.00 C ATOM 1419 O SER A 88 -17.201 11.653 -4.841 1.00 0.00 O ATOM 1420 CB SER A 88 -15.921 9.122 -3.182 1.00 0.00 C ATOM 1421 OG SER A 88 -16.688 7.959 -3.445 1.00 0.00 O ATOM 0 H SER A 88 -15.032 11.845 -4.022 1.00 0.00 H new ATOM 0 HA SER A 88 -15.203 9.193 -5.206 1.00 0.00 H new ATOM 0 HB2 SER A 88 -14.987 8.843 -2.694 1.00 0.00 H new ATOM 0 HB3 SER A 88 -16.461 9.769 -2.491 1.00 0.00 H new ATOM 0 HG SER A 88 -16.866 7.488 -2.604 1.00 0.00 H new ATOM 1427 N GLN A 89 -17.666 9.649 -5.752 1.00 0.00 N ATOM 1428 CA GLN A 89 -18.921 10.090 -6.351 1.00 0.00 C ATOM 1429 C GLN A 89 -20.075 9.941 -5.366 1.00 0.00 C ATOM 1430 O GLN A 89 -20.525 8.830 -5.082 1.00 0.00 O ATOM 1431 CB GLN A 89 -19.212 9.290 -7.622 1.00 0.00 C ATOM 1432 CG GLN A 89 -20.361 9.852 -8.443 1.00 0.00 C ATOM 1433 CD GLN A 89 -19.926 10.976 -9.363 1.00 0.00 C ATOM 1434 OE1 GLN A 89 -20.063 12.153 -9.032 1.00 0.00 O ATOM 1435 NE2 GLN A 89 -19.396 10.616 -10.527 1.00 0.00 N ATOM 0 H GLN A 89 -17.436 8.671 -5.927 1.00 0.00 H new ATOM 0 HA GLN A 89 -18.822 11.144 -6.609 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -18.314 9.264 -8.239 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -19.441 8.260 -7.349 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -20.803 9.052 -9.037 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -21.138 10.217 -7.771 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -19.301 9.628 -10.760 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -19.084 11.328 -11.187 1.00 0.00 H new ATOM 1444 N LYS A 90 -20.552 11.066 -4.846 1.00 0.00 N ATOM 1445 CA LYS A 90 -21.656 11.064 -3.893 1.00 0.00 C ATOM 1446 C LYS A 90 -22.498 12.327 -4.032 1.00 0.00 C ATOM 1447 O LYS A 90 -21.989 13.388 -4.395 1.00 0.00 O ATOM 1448 CB LYS A 90 -21.121 10.948 -2.463 1.00 0.00 C ATOM 1449 CG LYS A 90 -20.187 12.079 -2.070 1.00 0.00 C ATOM 1450 CD LYS A 90 -20.947 13.247 -1.465 1.00 0.00 C ATOM 1451 CE LYS A 90 -21.336 12.971 -0.021 1.00 0.00 C ATOM 1452 NZ LYS A 90 -22.081 14.111 0.581 1.00 0.00 N ATOM 0 H LYS A 90 -20.191 11.993 -5.069 1.00 0.00 H new ATOM 0 HA LYS A 90 -22.288 10.203 -4.109 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -21.962 10.925 -1.770 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -20.594 10.000 -2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -19.452 11.712 -1.354 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -19.636 12.418 -2.947 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -20.332 14.146 -1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -21.843 13.443 -2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -21.950 12.072 0.024 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -20.439 12.774 0.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -22.283 13.905 1.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -21.506 14.975 0.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -22.975 14.251 0.068 1.00 0.00 H new ATOM 1466 N SER A 91 -23.789 12.208 -3.738 1.00 0.00 N ATOM 1467 CA SER A 91 -24.703 13.340 -3.833 1.00 0.00 C ATOM 1468 C SER A 91 -24.669 13.950 -5.230 1.00 0.00 C ATOM 1469 O SER A 91 -24.635 15.170 -5.387 1.00 0.00 O ATOM 1470 CB SER A 91 -24.343 14.401 -2.791 1.00 0.00 C ATOM 1471 OG SER A 91 -24.540 13.912 -1.476 1.00 0.00 O ATOM 0 H SER A 91 -24.226 11.338 -3.432 1.00 0.00 H new ATOM 0 HA SER A 91 -25.713 12.978 -3.639 1.00 0.00 H new ATOM 0 HB2 SER A 91 -23.303 14.702 -2.918 1.00 0.00 H new ATOM 0 HB3 SER A 91 -24.954 15.290 -2.947 1.00 0.00 H new ATOM 0 HG SER A 91 -24.774 14.656 -0.882 1.00 0.00 H new ATOM 1477 N GLY A 92 -24.679 13.092 -6.245 1.00 0.00 N ATOM 1478 CA GLY A 92 -24.648 13.563 -7.617 1.00 0.00 C ATOM 1479 C GLY A 92 -26.018 13.547 -8.266 1.00 0.00 C ATOM 1480 O GLY A 92 -26.750 14.537 -8.247 1.00 0.00 O ATOM 0 H GLY A 92 -24.708 12.078 -6.141 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -24.250 14.577 -7.641 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -23.967 12.940 -8.197 1.00 0.00 H new ATOM 1484 N PRO A 93 -26.382 12.400 -8.860 1.00 0.00 N ATOM 1485 CA PRO A 93 -27.675 12.232 -9.531 1.00 0.00 C ATOM 1486 C PRO A 93 -28.839 12.207 -8.546 1.00 0.00 C ATOM 1487 O PRO A 93 -28.642 12.061 -7.340 1.00 0.00 O ATOM 1488 CB PRO A 93 -27.537 10.878 -10.232 1.00 0.00 C ATOM 1489 CG PRO A 93 -26.518 10.140 -9.433 1.00 0.00 C ATOM 1490 CD PRO A 93 -25.561 11.180 -8.922 1.00 0.00 C ATOM 0 HA PRO A 93 -27.894 13.057 -10.209 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -28.487 10.344 -10.252 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -27.217 10.999 -11.267 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -26.984 9.600 -8.609 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -26.001 9.402 -10.046 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -25.163 10.913 -7.943 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -24.708 11.303 -9.589 1.00 0.00 H new ATOM 1498 N SER A 94 -30.053 12.349 -9.069 1.00 0.00 N ATOM 1499 CA SER A 94 -31.250 12.345 -8.236 1.00 0.00 C ATOM 1500 C SER A 94 -32.509 12.290 -9.094 1.00 0.00 C ATOM 1501 O SER A 94 -32.727 13.144 -9.954 1.00 0.00 O ATOM 1502 CB SER A 94 -31.280 13.590 -7.345 1.00 0.00 C ATOM 1503 OG SER A 94 -31.591 14.748 -8.099 1.00 0.00 O ATOM 0 H SER A 94 -30.233 12.468 -10.066 1.00 0.00 H new ATOM 0 HA SER A 94 -31.222 11.456 -7.606 1.00 0.00 H new ATOM 0 HB2 SER A 94 -32.019 13.458 -6.554 1.00 0.00 H new ATOM 0 HB3 SER A 94 -30.312 13.717 -6.859 1.00 0.00 H new ATOM 0 HG SER A 94 -31.998 14.484 -8.951 1.00 0.00 H new ATOM 1509 N SER A 95 -33.337 11.277 -8.854 1.00 0.00 N ATOM 1510 CA SER A 95 -34.574 11.106 -9.607 1.00 0.00 C ATOM 1511 C SER A 95 -35.734 11.816 -8.915 1.00 0.00 C ATOM 1512 O SER A 95 -35.683 12.091 -7.716 1.00 0.00 O ATOM 1513 CB SER A 95 -34.896 9.620 -9.769 1.00 0.00 C ATOM 1514 OG SER A 95 -34.115 9.039 -10.799 1.00 0.00 O ATOM 0 H SER A 95 -33.173 10.563 -8.144 1.00 0.00 H new ATOM 0 HA SER A 95 -34.434 11.550 -10.593 1.00 0.00 H new ATOM 0 HB2 SER A 95 -34.710 9.100 -8.829 1.00 0.00 H new ATOM 0 HB3 SER A 95 -35.955 9.497 -9.997 1.00 0.00 H new ATOM 0 HG SER A 95 -34.338 8.088 -10.882 1.00 0.00 H new ATOM 1520 N GLY A 96 -36.780 12.112 -9.681 1.00 0.00 N ATOM 1521 CA GLY A 96 -37.939 12.788 -9.124 1.00 0.00 C ATOM 1522 C GLY A 96 -38.450 12.119 -7.864 1.00 0.00 C ATOM 1523 O GLY A 96 -39.655 11.927 -7.701 1.00 0.00 O ATOM 0 H GLY A 96 -36.846 11.896 -10.676 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -37.680 13.823 -8.903 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -38.735 12.811 -9.868 1.00 0.00 H new TER 1527 GLY A 96