USER MOD reduce.3.24.130724 H: found=0, std=0, add=1026, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1023 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 106 GLN : amide:sc= 1.39 K(o=2.6,f=-4.7) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -167:sc= 1.18 (180deg=0) USER MOD Set 2.1: A 86 LYS NZ :NH3+ -179:sc= 1.12 (180deg=-0.00146) USER MOD Set 2.2: A 88 SER OG : rot 180:sc= 0.97 USER MOD Set 3.1: A 36 HIS : no HE2:sc= 0.415 K(o=0.42,f=-2.2!) USER MOD Set 3.2: A 73 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 16 THR OG1 : rot 156:sc= 1.02 USER MOD Set 4.2: A 32 GLN : amide:sc= 0.96 K(o=2,f=-1.3) USER MOD Set 5.1: A 19 GLN : amide:sc= -0.0178 X(o=-0.018,f=0.027) USER MOD Set 5.2: A 21 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 12 THR OG1 : rot 171:sc= 0.543 USER MOD Set 6.2: A 59 GLN : amide:sc= 0.6 K(o=1.1,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= 0.848 (180deg=0.41) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 86:sc= 0.943 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -179:sc= 1.27 (180deg=1.22) USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.0177 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 31:sc= 0.418 USER MOD Single : A 42 HIS : no HE2:sc= 0.452 K(o=0.45,f=-2.2!) USER MOD Single : A 46 LYS NZ :NH3+ 159:sc= 0.884 (180deg=0.637) USER MOD Single : A 49 ASN : amide:sc= 1.31 K(o=1.3,f=-0.0053) USER MOD Single : A 51 HIS : no HE2:sc= 0.539 K(o=0.54,f=-3.4!) USER MOD Single : A 53 SER OG : rot 173:sc= 1.3 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0.0217 USER MOD Single : A 79 THR OG1 : rot 174:sc= 1.16 USER MOD Single : A 80 GLN : amide:sc= 0.605 K(o=0.6,f=-0.38) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 131:sc= 1.29 (180deg=0.735) USER MOD Single : A 92 LYS NZ :NH3+ -173:sc= 1.8 (180deg=1.76) USER MOD Single : A 94 LYS NZ :NH3+ 176:sc= 1.55 (180deg=1.52) USER MOD Single : A 97 GLN : amide:sc= -0.0186 K(o=-0.019,f=-0.53) USER MOD Single : A 99 SER OG : rot -69:sc= 1.19 USER MOD Single : A 103 SER OG : rot 180:sc= -0.7 USER MOD Single : A 104 THR OG1 : rot 85:sc= 1.01 USER MOD Single : A 109 ASN : amide:sc= 0.905 K(o=0.9,f=-0.075) USER MOD Single : A 110 THR OG1 : rot 120:sc= 0.768 USER MOD Single : A 112 LYS NZ :NH3+ 166:sc= 2.46 (180deg=2.33) USER MOD Single : A 114 LYS NZ :NH3+ -167:sc= 1.3 (180deg=1.1) USER MOD Single : A 121 MET CE :methyl -165:sc= 0 (180deg=-0.141) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0.615 K(o=0.62,f=-0.26) USER MOD Single : A 125 LYS NZ :NH3+ -158:sc= 1.29 (180deg=1.12) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.285 -26.557 1.240 1.00 0.00 N ATOM 2 CA MET A 1 2.139 -26.786 0.065 1.00 0.00 C ATOM 3 C MET A 1 2.507 -25.441 -0.538 1.00 0.00 C ATOM 4 O MET A 1 1.626 -24.595 -0.668 1.00 0.00 O ATOM 5 CB MET A 1 1.439 -27.661 -0.989 1.00 0.00 C ATOM 6 CG MET A 1 1.341 -29.145 -0.608 1.00 0.00 C ATOM 7 SD MET A 1 0.160 -29.551 0.708 1.00 0.00 S ATOM 8 CE MET A 1 0.334 -31.365 0.736 1.00 0.00 C ATOM 0 H1 MET A 1 0.694 -27.396 1.409 1.00 0.00 H new ATOM 0 H2 MET A 1 1.881 -26.380 2.074 1.00 0.00 H new ATOM 0 H3 MET A 1 0.675 -25.732 1.070 1.00 0.00 H new ATOM 0 HA MET A 1 3.035 -27.319 0.384 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.434 -27.273 -1.158 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.977 -27.574 -1.933 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.071 -29.712 -1.499 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.329 -29.487 -0.300 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.327 -31.782 1.495 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.068 -31.771 -0.240 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.366 -31.628 0.969 1.00 0.00 H new ATOM 20 N ALA A 2 3.786 -25.246 -0.865 1.00 0.00 N ATOM 21 CA ALA A 2 4.250 -24.068 -1.589 1.00 0.00 C ATOM 22 C ALA A 2 3.623 -23.986 -2.989 1.00 0.00 C ATOM 23 O ALA A 2 3.190 -24.996 -3.550 1.00 0.00 O ATOM 24 CB ALA A 2 5.778 -24.102 -1.686 1.00 0.00 C ATOM 0 H ALA A 2 4.529 -25.905 -0.633 1.00 0.00 H new ATOM 0 HA ALA A 2 3.939 -23.178 -1.041 1.00 0.00 H new ATOM 0 HB1 ALA A 2 6.128 -23.223 -2.227 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.206 -24.106 -0.684 1.00 0.00 H new ATOM 0 HB3 ALA A 2 6.089 -25.002 -2.217 1.00 0.00 H new ATOM 30 N ALA A 3 3.560 -22.772 -3.543 1.00 0.00 N ATOM 31 CA ALA A 3 3.198 -22.548 -4.941 1.00 0.00 C ATOM 32 C ALA A 3 4.219 -23.175 -5.905 1.00 0.00 C ATOM 33 O ALA A 3 5.336 -23.494 -5.520 1.00 0.00 O ATOM 34 CB ALA A 3 3.071 -21.037 -5.184 1.00 0.00 C ATOM 0 H ALA A 3 3.760 -21.914 -3.029 1.00 0.00 H new ATOM 0 HA ALA A 3 2.243 -23.035 -5.139 1.00 0.00 H new ATOM 0 HB1 ALA A 3 2.801 -20.857 -6.225 1.00 0.00 H new ATOM 0 HB2 ALA A 3 2.299 -20.627 -4.533 1.00 0.00 H new ATOM 0 HB3 ALA A 3 4.023 -20.552 -4.967 1.00 0.00 H new ATOM 40 N LYS A 4 3.854 -23.277 -7.191 1.00 0.00 N ATOM 41 CA LYS A 4 4.778 -23.703 -8.251 1.00 0.00 C ATOM 42 C LYS A 4 5.984 -22.766 -8.408 1.00 0.00 C ATOM 43 O LYS A 4 7.020 -23.185 -8.903 1.00 0.00 O ATOM 44 CB LYS A 4 4.017 -23.887 -9.579 1.00 0.00 C ATOM 45 CG LYS A 4 3.443 -22.583 -10.169 1.00 0.00 C ATOM 46 CD LYS A 4 2.723 -22.784 -11.514 1.00 0.00 C ATOM 47 CE LYS A 4 1.442 -23.619 -11.365 1.00 0.00 C ATOM 48 NZ LYS A 4 0.723 -23.779 -12.650 1.00 0.00 N ATOM 0 H LYS A 4 2.913 -23.067 -7.524 1.00 0.00 H new ATOM 0 HA LYS A 4 5.193 -24.666 -7.952 1.00 0.00 H new ATOM 0 HB2 LYS A 4 4.689 -24.337 -10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.200 -24.591 -9.421 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.746 -22.146 -9.454 1.00 0.00 H new ATOM 0 HG3 LYS A 4 4.253 -21.866 -10.303 1.00 0.00 H new ATOM 0 HD2 LYS A 4 2.474 -21.812 -11.940 1.00 0.00 H new ATOM 0 HD3 LYS A 4 3.397 -23.276 -12.215 1.00 0.00 H new ATOM 0 HE2 LYS A 4 1.696 -24.602 -10.968 1.00 0.00 H new ATOM 0 HE3 LYS A 4 0.783 -23.143 -10.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -0.134 -24.349 -12.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.456 -22.843 -13.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 1.341 -24.257 -13.336 1.00 0.00 H new ATOM 62 N PHE A 5 5.790 -21.480 -8.112 1.00 0.00 N ATOM 63 CA PHE A 5 6.817 -20.460 -8.204 1.00 0.00 C ATOM 64 C PHE A 5 7.862 -20.705 -7.120 1.00 0.00 C ATOM 65 O PHE A 5 7.525 -21.017 -5.981 1.00 0.00 O ATOM 66 CB PHE A 5 6.155 -19.078 -8.061 1.00 0.00 C ATOM 67 CG PHE A 5 5.086 -18.832 -9.108 1.00 0.00 C ATOM 68 CD1 PHE A 5 5.441 -18.465 -10.418 1.00 0.00 C ATOM 69 CD2 PHE A 5 3.734 -19.046 -8.784 1.00 0.00 C ATOM 70 CE1 PHE A 5 4.446 -18.359 -11.406 1.00 0.00 C ATOM 71 CE2 PHE A 5 2.745 -18.954 -9.778 1.00 0.00 C ATOM 72 CZ PHE A 5 3.103 -18.624 -11.095 1.00 0.00 C ATOM 0 H PHE A 5 4.891 -21.118 -7.795 1.00 0.00 H new ATOM 0 HA PHE A 5 7.322 -20.498 -9.169 1.00 0.00 H new ATOM 0 HB2 PHE A 5 5.713 -18.992 -7.068 1.00 0.00 H new ATOM 0 HB3 PHE A 5 6.918 -18.304 -8.138 1.00 0.00 H new ATOM 0 HD1 PHE A 5 6.473 -18.265 -10.664 1.00 0.00 H new ATOM 0 HD2 PHE A 5 3.455 -19.282 -7.768 1.00 0.00 H new ATOM 0 HE1 PHE A 5 4.717 -18.072 -12.411 1.00 0.00 H new ATOM 0 HE2 PHE A 5 1.710 -19.137 -9.529 1.00 0.00 H new ATOM 0 HZ PHE A 5 2.348 -18.574 -11.866 1.00 0.00 H new ATOM 82 N GLU A 6 9.115 -20.431 -7.464 1.00 0.00 N ATOM 83 CA GLU A 6 10.276 -20.524 -6.590 1.00 0.00 C ATOM 84 C GLU A 6 11.203 -19.358 -6.941 1.00 0.00 C ATOM 85 O GLU A 6 11.193 -18.849 -8.063 1.00 0.00 O ATOM 86 CB GLU A 6 11.008 -21.863 -6.790 1.00 0.00 C ATOM 87 CG GLU A 6 10.224 -23.076 -6.265 1.00 0.00 C ATOM 88 CD GLU A 6 11.044 -24.376 -6.344 1.00 0.00 C ATOM 89 OE1 GLU A 6 10.999 -25.038 -7.405 1.00 0.00 O ATOM 90 OE2 GLU A 6 11.724 -24.694 -5.340 1.00 0.00 O ATOM 0 H GLU A 6 9.359 -20.123 -8.405 1.00 0.00 H new ATOM 0 HA GLU A 6 9.967 -20.476 -5.546 1.00 0.00 H new ATOM 0 HB2 GLU A 6 11.209 -22.003 -7.852 1.00 0.00 H new ATOM 0 HB3 GLU A 6 11.973 -21.819 -6.286 1.00 0.00 H new ATOM 0 HG2 GLU A 6 9.929 -22.896 -5.231 1.00 0.00 H new ATOM 0 HG3 GLU A 6 9.307 -23.191 -6.842 1.00 0.00 H new ATOM 97 N VAL A 7 11.960 -18.872 -5.963 1.00 0.00 N ATOM 98 CA VAL A 7 12.885 -17.752 -6.113 1.00 0.00 C ATOM 99 C VAL A 7 13.835 -18.008 -7.283 1.00 0.00 C ATOM 100 O VAL A 7 14.456 -19.062 -7.376 1.00 0.00 O ATOM 101 CB VAL A 7 13.631 -17.507 -4.784 1.00 0.00 C ATOM 102 CG1 VAL A 7 14.425 -16.195 -4.839 1.00 0.00 C ATOM 103 CG2 VAL A 7 12.649 -17.431 -3.602 1.00 0.00 C ATOM 0 H VAL A 7 11.947 -19.256 -5.018 1.00 0.00 H new ATOM 0 HA VAL A 7 12.332 -16.842 -6.346 1.00 0.00 H new ATOM 0 HB VAL A 7 14.311 -18.346 -4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.943 -16.043 -3.892 1.00 0.00 H new ATOM 0 HG12 VAL A 7 15.155 -16.245 -5.647 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.743 -15.364 -5.017 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.203 -17.258 -2.679 1.00 0.00 H new ATOM 0 HG22 VAL A 7 11.948 -16.612 -3.763 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.099 -18.369 -3.525 1.00 0.00 H new ATOM 113 N GLY A 8 13.948 -17.018 -8.168 1.00 0.00 N ATOM 114 CA GLY A 8 14.818 -17.057 -9.330 1.00 0.00 C ATOM 115 C GLY A 8 14.107 -17.520 -10.601 1.00 0.00 C ATOM 116 O GLY A 8 14.663 -17.311 -11.681 1.00 0.00 O ATOM 0 H GLY A 8 13.422 -16.148 -8.090 1.00 0.00 H new ATOM 0 HA2 GLY A 8 15.235 -16.064 -9.496 1.00 0.00 H new ATOM 0 HA3 GLY A 8 15.655 -17.725 -9.126 1.00 0.00 H new ATOM 120 N SER A 9 12.898 -18.086 -10.499 1.00 0.00 N ATOM 121 CA SER A 9 12.077 -18.407 -11.664 1.00 0.00 C ATOM 122 C SER A 9 11.656 -17.129 -12.397 1.00 0.00 C ATOM 123 O SER A 9 11.699 -16.034 -11.825 1.00 0.00 O ATOM 124 CB SER A 9 10.840 -19.215 -11.246 1.00 0.00 C ATOM 125 OG SER A 9 11.195 -20.314 -10.435 1.00 0.00 O ATOM 0 H SER A 9 12.466 -18.332 -9.608 1.00 0.00 H new ATOM 0 HA SER A 9 12.674 -19.014 -12.345 1.00 0.00 H new ATOM 0 HB2 SER A 9 10.147 -18.570 -10.705 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.318 -19.570 -12.134 1.00 0.00 H new ATOM 0 HG SER A 9 11.244 -20.028 -9.499 1.00 0.00 H new ATOM 131 N VAL A 10 11.178 -17.268 -13.635 1.00 0.00 N ATOM 132 CA VAL A 10 10.715 -16.161 -14.463 1.00 0.00 C ATOM 133 C VAL A 10 9.442 -16.633 -15.156 1.00 0.00 C ATOM 134 O VAL A 10 9.419 -17.714 -15.741 1.00 0.00 O ATOM 135 CB VAL A 10 11.806 -15.727 -15.470 1.00 0.00 C ATOM 136 CG1 VAL A 10 11.353 -14.518 -16.304 1.00 0.00 C ATOM 137 CG2 VAL A 10 13.125 -15.338 -14.784 1.00 0.00 C ATOM 0 H VAL A 10 11.102 -18.174 -14.097 1.00 0.00 H new ATOM 0 HA VAL A 10 10.505 -15.277 -13.860 1.00 0.00 H new ATOM 0 HB VAL A 10 11.968 -16.597 -16.106 1.00 0.00 H new ATOM 0 HG11 VAL A 10 12.144 -14.240 -17.001 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.453 -14.777 -16.861 1.00 0.00 H new ATOM 0 HG13 VAL A 10 11.141 -13.678 -15.642 1.00 0.00 H new ATOM 0 HG21 VAL A 10 13.854 -15.042 -15.538 1.00 0.00 H new ATOM 0 HG22 VAL A 10 12.949 -14.505 -14.103 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.509 -16.190 -14.223 1.00 0.00 H new ATOM 147 N TYR A 11 8.382 -15.836 -15.055 1.00 0.00 N ATOM 148 CA TYR A 11 7.060 -16.116 -15.607 1.00 0.00 C ATOM 149 C TYR A 11 6.421 -14.801 -16.064 1.00 0.00 C ATOM 150 O TYR A 11 6.990 -13.731 -15.859 1.00 0.00 O ATOM 151 CB TYR A 11 6.209 -16.799 -14.529 1.00 0.00 C ATOM 152 CG TYR A 11 6.524 -18.270 -14.305 1.00 0.00 C ATOM 153 CD1 TYR A 11 5.914 -19.252 -15.110 1.00 0.00 C ATOM 154 CD2 TYR A 11 7.386 -18.659 -13.261 1.00 0.00 C ATOM 155 CE1 TYR A 11 6.154 -20.618 -14.871 1.00 0.00 C ATOM 156 CE2 TYR A 11 7.611 -20.023 -13.001 1.00 0.00 C ATOM 157 CZ TYR A 11 6.998 -21.006 -13.809 1.00 0.00 C ATOM 158 OH TYR A 11 7.205 -22.323 -13.549 1.00 0.00 O ATOM 0 H TYR A 11 8.422 -14.941 -14.567 1.00 0.00 H new ATOM 0 HA TYR A 11 7.133 -16.781 -16.467 1.00 0.00 H new ATOM 0 HB2 TYR A 11 6.343 -16.266 -13.588 1.00 0.00 H new ATOM 0 HB3 TYR A 11 5.158 -16.704 -14.802 1.00 0.00 H new ATOM 0 HD1 TYR A 11 5.258 -18.955 -15.915 1.00 0.00 H new ATOM 0 HD2 TYR A 11 7.875 -17.908 -12.659 1.00 0.00 H new ATOM 0 HE1 TYR A 11 5.694 -21.367 -15.498 1.00 0.00 H new ATOM 0 HE2 TYR A 11 8.252 -20.319 -12.184 1.00 0.00 H new ATOM 0 HH TYR A 11 7.813 -22.414 -12.786 1.00 0.00 H new ATOM 168 N THR A 12 5.242 -14.855 -16.675 1.00 0.00 N ATOM 169 CA THR A 12 4.563 -13.685 -17.221 1.00 0.00 C ATOM 170 C THR A 12 3.157 -13.616 -16.622 1.00 0.00 C ATOM 171 O THR A 12 2.546 -14.647 -16.350 1.00 0.00 O ATOM 172 CB THR A 12 4.587 -13.771 -18.759 1.00 0.00 C ATOM 173 OG1 THR A 12 5.894 -14.070 -19.236 1.00 0.00 O ATOM 174 CG2 THR A 12 4.171 -12.471 -19.444 1.00 0.00 C ATOM 0 H THR A 12 4.724 -15.724 -16.807 1.00 0.00 H new ATOM 0 HA THR A 12 5.064 -12.755 -16.955 1.00 0.00 H new ATOM 0 HB THR A 12 3.874 -14.559 -19.002 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.856 -14.262 -20.196 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.210 -12.601 -20.526 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.155 -12.212 -19.146 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.851 -11.671 -19.150 1.00 0.00 H new ATOM 182 N GLY A 13 2.656 -12.404 -16.388 1.00 0.00 N ATOM 183 CA GLY A 13 1.396 -12.164 -15.704 1.00 0.00 C ATOM 184 C GLY A 13 0.828 -10.802 -16.076 1.00 0.00 C ATOM 185 O GLY A 13 1.406 -10.092 -16.900 1.00 0.00 O ATOM 0 H GLY A 13 3.128 -11.547 -16.676 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.681 -12.944 -15.965 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.547 -12.218 -14.626 1.00 0.00 H new ATOM 189 N LYS A 14 -0.327 -10.445 -15.513 1.00 0.00 N ATOM 190 CA LYS A 14 -0.977 -9.157 -15.767 1.00 0.00 C ATOM 191 C LYS A 14 -0.904 -8.295 -14.520 1.00 0.00 C ATOM 192 O LYS A 14 -1.158 -8.803 -13.434 1.00 0.00 O ATOM 193 CB LYS A 14 -2.445 -9.359 -16.160 1.00 0.00 C ATOM 194 CG LYS A 14 -2.674 -9.445 -17.675 1.00 0.00 C ATOM 195 CD LYS A 14 -2.106 -10.717 -18.324 1.00 0.00 C ATOM 196 CE LYS A 14 -2.746 -10.903 -19.706 1.00 0.00 C ATOM 197 NZ LYS A 14 -2.316 -12.155 -20.368 1.00 0.00 N ATOM 0 H LYS A 14 -0.841 -11.043 -14.865 1.00 0.00 H new ATOM 0 HA LYS A 14 -0.459 -8.664 -16.589 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.814 -10.273 -15.694 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.036 -8.535 -15.759 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -3.745 -9.396 -17.873 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -2.222 -8.574 -18.150 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -1.023 -10.640 -18.418 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -2.310 -11.584 -17.695 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -3.831 -10.905 -19.603 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.488 -10.054 -20.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -2.763 -12.224 -21.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.282 -12.152 -20.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -2.600 -12.970 -19.788 1.00 0.00 H new ATOM 211 N VAL A 15 -0.570 -7.019 -14.663 1.00 0.00 N ATOM 212 CA VAL A 15 -0.540 -6.074 -13.559 1.00 0.00 C ATOM 213 C VAL A 15 -1.977 -5.828 -13.097 1.00 0.00 C ATOM 214 O VAL A 15 -2.832 -5.458 -13.909 1.00 0.00 O ATOM 215 CB VAL A 15 0.147 -4.764 -13.986 1.00 0.00 C ATOM 216 CG1 VAL A 15 0.486 -3.915 -12.750 1.00 0.00 C ATOM 217 CG2 VAL A 15 1.439 -4.986 -14.780 1.00 0.00 C ATOM 0 H VAL A 15 -0.310 -6.608 -15.560 1.00 0.00 H new ATOM 0 HA VAL A 15 0.039 -6.482 -12.731 1.00 0.00 H new ATOM 0 HB VAL A 15 -0.564 -4.253 -14.635 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.971 -2.991 -13.065 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -0.430 -3.677 -12.209 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.157 -4.474 -12.098 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.871 -4.022 -15.049 1.00 0.00 H new ATOM 0 HG22 VAL A 15 2.149 -5.545 -14.170 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.217 -5.550 -15.686 1.00 0.00 H new ATOM 227 N THR A 16 -2.211 -5.977 -11.797 1.00 0.00 N ATOM 228 CA THR A 16 -3.528 -5.965 -11.178 1.00 0.00 C ATOM 229 C THR A 16 -3.687 -4.826 -10.173 1.00 0.00 C ATOM 230 O THR A 16 -4.808 -4.570 -9.747 1.00 0.00 O ATOM 231 CB THR A 16 -3.819 -7.345 -10.552 1.00 0.00 C ATOM 232 OG1 THR A 16 -2.651 -7.926 -9.988 1.00 0.00 O ATOM 233 CG2 THR A 16 -4.344 -8.294 -11.631 1.00 0.00 C ATOM 0 H THR A 16 -1.459 -6.114 -11.122 1.00 0.00 H new ATOM 0 HA THR A 16 -4.271 -5.775 -11.953 1.00 0.00 H new ATOM 0 HB THR A 16 -4.556 -7.196 -9.763 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.908 -8.570 -9.295 1.00 0.00 H new ATOM 0 HG21 THR A 16 -4.550 -9.269 -11.189 1.00 0.00 H new ATOM 0 HG22 THR A 16 -5.261 -7.888 -12.058 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.596 -8.402 -12.416 1.00 0.00 H new ATOM 241 N GLY A 17 -2.633 -4.076 -9.845 1.00 0.00 N ATOM 242 CA GLY A 17 -2.768 -2.843 -9.088 1.00 0.00 C ATOM 243 C GLY A 17 -1.426 -2.146 -8.951 1.00 0.00 C ATOM 244 O GLY A 17 -0.384 -2.768 -9.158 1.00 0.00 O ATOM 0 H GLY A 17 -1.672 -4.309 -10.097 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -3.478 -2.181 -9.585 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.173 -3.060 -8.100 1.00 0.00 H new ATOM 248 N LEU A 18 -1.454 -0.870 -8.565 1.00 0.00 N ATOM 249 CA LEU A 18 -0.287 -0.099 -8.149 1.00 0.00 C ATOM 250 C LEU A 18 -0.541 0.446 -6.748 1.00 0.00 C ATOM 251 O LEU A 18 -1.674 0.773 -6.396 1.00 0.00 O ATOM 252 CB LEU A 18 -0.038 1.079 -9.107 1.00 0.00 C ATOM 253 CG LEU A 18 0.371 0.700 -10.542 1.00 0.00 C ATOM 254 CD1 LEU A 18 0.564 1.958 -11.393 1.00 0.00 C ATOM 255 CD2 LEU A 18 1.631 -0.151 -10.614 1.00 0.00 C ATOM 0 H LEU A 18 -2.318 -0.329 -8.533 1.00 0.00 H new ATOM 0 HA LEU A 18 0.589 -0.747 -8.161 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.945 1.682 -9.155 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.742 1.710 -8.682 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.447 0.095 -10.933 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.853 1.672 -12.404 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.369 2.521 -11.427 1.00 0.00 H new ATOM 0 HD13 LEU A 18 1.346 2.578 -10.954 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.857 -0.379 -11.656 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.465 0.395 -10.173 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.475 -1.080 -10.065 1.00 0.00 H new ATOM 267 N GLN A 19 0.540 0.599 -5.985 1.00 0.00 N ATOM 268 CA GLN A 19 0.589 1.136 -4.633 1.00 0.00 C ATOM 269 C GLN A 19 1.886 1.938 -4.504 1.00 0.00 C ATOM 270 O GLN A 19 2.840 1.704 -5.248 1.00 0.00 O ATOM 271 CB GLN A 19 0.624 0.006 -3.591 1.00 0.00 C ATOM 272 CG GLN A 19 -0.537 -0.993 -3.676 1.00 0.00 C ATOM 273 CD GLN A 19 -0.496 -1.967 -2.504 1.00 0.00 C ATOM 274 OE1 GLN A 19 -1.281 -1.868 -1.573 1.00 0.00 O ATOM 275 NE2 GLN A 19 0.427 -2.919 -2.523 1.00 0.00 N ATOM 0 H GLN A 19 1.465 0.332 -6.321 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.295 1.749 -4.457 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.561 -0.540 -3.701 1.00 0.00 H new ATOM 0 HB3 GLN A 19 0.628 0.450 -2.596 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.486 -0.456 -3.676 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.482 -1.544 -4.615 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.074 -2.986 -3.309 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.490 -3.584 -1.752 1.00 0.00 H new ATOM 284 N ALA A 20 1.971 2.826 -3.509 1.00 0.00 N ATOM 285 CA ALA A 20 3.141 3.676 -3.268 1.00 0.00 C ATOM 286 C ALA A 20 4.432 2.900 -2.944 1.00 0.00 C ATOM 287 O ALA A 20 5.483 3.510 -2.787 1.00 0.00 O ATOM 288 CB ALA A 20 2.812 4.668 -2.147 1.00 0.00 C ATOM 0 H ALA A 20 1.218 2.977 -2.838 1.00 0.00 H new ATOM 0 HA ALA A 20 3.351 4.199 -4.201 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.676 5.305 -1.960 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.964 5.285 -2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 20 2.562 4.120 -1.238 1.00 0.00 H new ATOM 294 N TYR A 21 4.376 1.568 -2.841 1.00 0.00 N ATOM 295 CA TYR A 21 5.513 0.697 -2.559 1.00 0.00 C ATOM 296 C TYR A 21 5.605 -0.517 -3.491 1.00 0.00 C ATOM 297 O TYR A 21 6.528 -1.318 -3.333 1.00 0.00 O ATOM 298 CB TYR A 21 5.471 0.289 -1.081 1.00 0.00 C ATOM 299 CG TYR A 21 4.285 -0.571 -0.668 1.00 0.00 C ATOM 300 CD1 TYR A 21 3.063 0.031 -0.304 1.00 0.00 C ATOM 301 CD2 TYR A 21 4.410 -1.974 -0.622 1.00 0.00 C ATOM 302 CE1 TYR A 21 1.975 -0.761 0.107 1.00 0.00 C ATOM 303 CE2 TYR A 21 3.333 -2.771 -0.196 1.00 0.00 C ATOM 304 CZ TYR A 21 2.113 -2.166 0.173 1.00 0.00 C ATOM 305 OH TYR A 21 1.073 -2.945 0.574 1.00 0.00 O ATOM 0 H TYR A 21 3.504 1.052 -2.957 1.00 0.00 H new ATOM 0 HA TYR A 21 6.425 1.260 -2.758 1.00 0.00 H new ATOM 0 HB2 TYR A 21 6.388 -0.252 -0.846 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.470 1.194 -0.473 1.00 0.00 H new ATOM 0 HD1 TYR A 21 2.962 1.106 -0.341 1.00 0.00 H new ATOM 0 HD2 TYR A 21 5.339 -2.440 -0.916 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.037 -0.296 0.371 1.00 0.00 H new ATOM 0 HE2 TYR A 21 3.439 -3.845 -0.151 1.00 0.00 H new ATOM 0 HH TYR A 21 1.345 -3.887 0.559 1.00 0.00 H new ATOM 315 N GLY A 22 4.723 -0.665 -4.489 1.00 0.00 N ATOM 316 CA GLY A 22 4.865 -1.745 -5.457 1.00 0.00 C ATOM 317 C GLY A 22 3.673 -1.911 -6.397 1.00 0.00 C ATOM 318 O GLY A 22 2.668 -1.218 -6.255 1.00 0.00 O ATOM 0 H GLY A 22 3.918 -0.058 -4.641 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.760 -1.567 -6.053 1.00 0.00 H new ATOM 0 HA3 GLY A 22 5.021 -2.680 -4.919 1.00 0.00 H new ATOM 322 N ALA A 23 3.799 -2.835 -7.349 1.00 0.00 N ATOM 323 CA ALA A 23 2.821 -3.159 -8.378 1.00 0.00 C ATOM 324 C ALA A 23 2.441 -4.628 -8.238 1.00 0.00 C ATOM 325 O ALA A 23 3.313 -5.497 -8.270 1.00 0.00 O ATOM 326 CB ALA A 23 3.431 -2.901 -9.759 1.00 0.00 C ATOM 0 H ALA A 23 4.638 -3.410 -7.424 1.00 0.00 H new ATOM 0 HA ALA A 23 1.932 -2.538 -8.266 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.700 -3.143 -10.531 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.712 -1.851 -9.842 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.315 -3.525 -9.888 1.00 0.00 H new ATOM 332 N PHE A 24 1.165 -4.914 -7.999 1.00 0.00 N ATOM 333 CA PHE A 24 0.689 -6.285 -7.983 1.00 0.00 C ATOM 334 C PHE A 24 0.658 -6.824 -9.405 1.00 0.00 C ATOM 335 O PHE A 24 0.223 -6.114 -10.312 1.00 0.00 O ATOM 336 CB PHE A 24 -0.708 -6.362 -7.363 1.00 0.00 C ATOM 337 CG PHE A 24 -0.734 -6.245 -5.855 1.00 0.00 C ATOM 338 CD1 PHE A 24 -0.048 -7.189 -5.067 1.00 0.00 C ATOM 339 CD2 PHE A 24 -1.487 -5.230 -5.238 1.00 0.00 C ATOM 340 CE1 PHE A 24 -0.122 -7.122 -3.666 1.00 0.00 C ATOM 341 CE2 PHE A 24 -1.563 -5.169 -3.837 1.00 0.00 C ATOM 342 CZ PHE A 24 -0.881 -6.112 -3.050 1.00 0.00 C ATOM 0 H PHE A 24 0.447 -4.214 -7.815 1.00 0.00 H new ATOM 0 HA PHE A 24 1.366 -6.889 -7.378 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -1.324 -5.569 -7.787 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.167 -7.309 -7.649 1.00 0.00 H new ATOM 0 HD1 PHE A 24 0.535 -7.965 -5.540 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -2.006 -4.499 -5.840 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.404 -7.846 -3.062 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.148 -4.395 -3.363 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.940 -6.061 -1.973 1.00 0.00 H new ATOM 352 N VAL A 25 1.051 -8.085 -9.582 1.00 0.00 N ATOM 353 CA VAL A 25 0.968 -8.801 -10.845 1.00 0.00 C ATOM 354 C VAL A 25 0.377 -10.172 -10.543 1.00 0.00 C ATOM 355 O VAL A 25 0.969 -10.966 -9.802 1.00 0.00 O ATOM 356 CB VAL A 25 2.348 -8.880 -11.525 1.00 0.00 C ATOM 357 CG1 VAL A 25 2.227 -9.507 -12.919 1.00 0.00 C ATOM 358 CG2 VAL A 25 2.995 -7.495 -11.679 1.00 0.00 C ATOM 0 H VAL A 25 1.446 -8.648 -8.828 1.00 0.00 H new ATOM 0 HA VAL A 25 0.326 -8.280 -11.555 1.00 0.00 H new ATOM 0 HB VAL A 25 2.976 -9.496 -10.881 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.212 -9.554 -13.383 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.819 -10.514 -12.831 1.00 0.00 H new ATOM 0 HG13 VAL A 25 1.564 -8.899 -13.535 1.00 0.00 H new ATOM 0 HG21 VAL A 25 3.966 -7.599 -12.163 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.352 -6.859 -12.288 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.126 -7.043 -10.696 1.00 0.00 H new ATOM 368 N ALA A 26 -0.834 -10.408 -11.039 1.00 0.00 N ATOM 369 CA ALA A 26 -1.474 -11.705 -11.000 1.00 0.00 C ATOM 370 C ALA A 26 -0.809 -12.651 -11.999 1.00 0.00 C ATOM 371 O ALA A 26 -0.368 -12.252 -13.080 1.00 0.00 O ATOM 372 CB ALA A 26 -2.968 -11.551 -11.269 1.00 0.00 C ATOM 0 H ALA A 26 -1.402 -9.687 -11.485 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.356 -12.143 -10.009 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.446 -12.530 -11.239 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.410 -10.908 -10.508 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.117 -11.105 -12.252 1.00 0.00 H new ATOM 378 N LEU A 27 -0.791 -13.927 -11.625 1.00 0.00 N ATOM 379 CA LEU A 27 -0.031 -14.989 -12.277 1.00 0.00 C ATOM 380 C LEU A 27 -0.934 -16.178 -12.595 1.00 0.00 C ATOM 381 O LEU A 27 -0.671 -16.914 -13.540 1.00 0.00 O ATOM 382 CB LEU A 27 1.095 -15.447 -11.333 1.00 0.00 C ATOM 383 CG LEU A 27 2.274 -14.461 -11.240 1.00 0.00 C ATOM 384 CD1 LEU A 27 3.154 -14.814 -10.038 1.00 0.00 C ATOM 385 CD2 LEU A 27 3.124 -14.482 -12.512 1.00 0.00 C ATOM 0 H LEU A 27 -1.328 -14.263 -10.826 1.00 0.00 H new ATOM 0 HA LEU A 27 0.386 -14.607 -13.209 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.681 -15.597 -10.336 1.00 0.00 H new ATOM 0 HB3 LEU A 27 1.469 -16.413 -11.672 1.00 0.00 H new ATOM 0 HG LEU A 27 1.861 -13.459 -11.119 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.986 -14.113 -9.978 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.563 -14.755 -9.124 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.540 -15.826 -10.155 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.947 -13.774 -12.411 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.524 -15.484 -12.666 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.507 -14.202 -13.366 1.00 0.00 H new ATOM 397 N ASP A 28 -1.991 -16.358 -11.808 1.00 0.00 N ATOM 398 CA ASP A 28 -3.032 -17.366 -11.964 1.00 0.00 C ATOM 399 C ASP A 28 -4.295 -16.789 -11.318 1.00 0.00 C ATOM 400 O ASP A 28 -4.198 -15.839 -10.532 1.00 0.00 O ATOM 401 CB ASP A 28 -2.595 -18.663 -11.272 1.00 0.00 C ATOM 402 CG ASP A 28 -3.681 -19.737 -11.305 1.00 0.00 C ATOM 403 OD1 ASP A 28 -3.835 -20.349 -12.383 1.00 0.00 O ATOM 404 OD2 ASP A 28 -4.296 -19.938 -10.243 1.00 0.00 O ATOM 0 H ASP A 28 -2.152 -15.766 -10.993 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.218 -17.604 -13.011 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.696 -19.045 -11.756 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -2.332 -18.448 -10.236 1.00 0.00 H new ATOM 409 N GLU A 29 -5.474 -17.320 -11.642 1.00 0.00 N ATOM 410 CA GLU A 29 -6.731 -16.955 -10.982 1.00 0.00 C ATOM 411 C GLU A 29 -6.716 -17.081 -9.448 1.00 0.00 C ATOM 412 O GLU A 29 -7.518 -16.415 -8.789 1.00 0.00 O ATOM 413 CB GLU A 29 -7.912 -17.695 -11.635 1.00 0.00 C ATOM 414 CG GLU A 29 -7.887 -19.223 -11.455 1.00 0.00 C ATOM 415 CD GLU A 29 -9.099 -19.899 -12.112 1.00 0.00 C ATOM 416 OE1 GLU A 29 -10.165 -19.974 -11.460 1.00 0.00 O ATOM 417 OE2 GLU A 29 -8.983 -20.289 -13.297 1.00 0.00 O ATOM 0 H GLU A 29 -5.586 -18.021 -12.375 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.863 -15.885 -11.143 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.842 -17.308 -11.218 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.922 -17.468 -12.701 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.970 -19.624 -11.887 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.870 -19.463 -10.392 1.00 0.00 H new ATOM 424 N GLU A 30 -5.751 -17.810 -8.878 1.00 0.00 N ATOM 425 CA GLU A 30 -5.538 -17.947 -7.441 1.00 0.00 C ATOM 426 C GLU A 30 -4.050 -17.777 -7.071 1.00 0.00 C ATOM 427 O GLU A 30 -3.620 -18.257 -6.021 1.00 0.00 O ATOM 428 CB GLU A 30 -6.116 -19.287 -6.939 1.00 0.00 C ATOM 429 CG GLU A 30 -7.648 -19.388 -7.031 1.00 0.00 C ATOM 430 CD GLU A 30 -8.187 -20.681 -6.389 1.00 0.00 C ATOM 431 OE1 GLU A 30 -8.226 -21.737 -7.061 1.00 0.00 O ATOM 432 OE2 GLU A 30 -8.585 -20.614 -5.201 1.00 0.00 O ATOM 0 H GLU A 30 -5.074 -18.339 -9.428 1.00 0.00 H new ATOM 0 HA GLU A 30 -6.074 -17.145 -6.934 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.674 -20.099 -7.517 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.815 -19.433 -5.902 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.097 -18.526 -6.539 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.950 -19.351 -8.078 1.00 0.00 H new ATOM 439 N THR A 31 -3.255 -17.035 -7.862 1.00 0.00 N ATOM 440 CA THR A 31 -1.907 -16.631 -7.441 1.00 0.00 C ATOM 441 C THR A 31 -1.542 -15.249 -7.994 1.00 0.00 C ATOM 442 O THR A 31 -1.805 -14.914 -9.147 1.00 0.00 O ATOM 443 CB THR A 31 -0.871 -17.692 -7.868 1.00 0.00 C ATOM 444 OG1 THR A 31 -1.276 -18.994 -7.509 1.00 0.00 O ATOM 445 CG2 THR A 31 0.490 -17.484 -7.200 1.00 0.00 C ATOM 0 H THR A 31 -3.523 -16.706 -8.790 1.00 0.00 H new ATOM 0 HA THR A 31 -1.897 -16.559 -6.353 1.00 0.00 H new ATOM 0 HB THR A 31 -0.794 -17.580 -8.950 1.00 0.00 H new ATOM 0 HG1 THR A 31 -0.596 -19.639 -7.797 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.182 -18.257 -7.535 1.00 0.00 H new ATOM 0 HG22 THR A 31 0.882 -16.504 -7.471 1.00 0.00 H new ATOM 0 HG23 THR A 31 0.377 -17.543 -6.117 1.00 0.00 H new ATOM 453 N GLN A 32 -0.870 -14.447 -7.166 1.00 0.00 N ATOM 454 CA GLN A 32 -0.428 -13.087 -7.446 1.00 0.00 C ATOM 455 C GLN A 32 0.836 -12.835 -6.622 1.00 0.00 C ATOM 456 O GLN A 32 1.043 -13.480 -5.591 1.00 0.00 O ATOM 457 CB GLN A 32 -1.581 -12.131 -7.072 1.00 0.00 C ATOM 458 CG GLN A 32 -1.258 -10.629 -7.141 1.00 0.00 C ATOM 459 CD GLN A 32 -2.508 -9.757 -7.061 1.00 0.00 C ATOM 460 OE1 GLN A 32 -3.339 -9.755 -7.961 1.00 0.00 O ATOM 461 NE2 GLN A 32 -2.646 -8.951 -6.020 1.00 0.00 N ATOM 0 H GLN A 32 -0.606 -14.751 -6.229 1.00 0.00 H new ATOM 0 HA GLN A 32 -0.186 -12.926 -8.497 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -2.423 -12.332 -7.734 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -1.908 -12.366 -6.059 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -0.584 -10.368 -6.325 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -0.730 -10.417 -8.071 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -1.950 -8.958 -5.274 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -3.448 -8.323 -5.964 1.00 0.00 H new ATOM 470 N GLY A 33 1.666 -11.889 -7.056 1.00 0.00 N ATOM 471 CA GLY A 33 2.822 -11.422 -6.305 1.00 0.00 C ATOM 472 C GLY A 33 2.983 -9.916 -6.458 1.00 0.00 C ATOM 473 O GLY A 33 2.194 -9.266 -7.147 1.00 0.00 O ATOM 0 H GLY A 33 1.550 -11.420 -7.954 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.706 -11.676 -5.251 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.721 -11.928 -6.658 1.00 0.00 H new ATOM 477 N LEU A 34 3.988 -9.346 -5.792 1.00 0.00 N ATOM 478 CA LEU A 34 4.143 -7.906 -5.634 1.00 0.00 C ATOM 479 C LEU A 34 5.533 -7.508 -6.101 1.00 0.00 C ATOM 480 O LEU A 34 6.523 -7.780 -5.416 1.00 0.00 O ATOM 481 CB LEU A 34 3.900 -7.514 -4.166 1.00 0.00 C ATOM 482 CG LEU A 34 4.127 -6.015 -3.883 1.00 0.00 C ATOM 483 CD1 LEU A 34 3.152 -5.130 -4.659 1.00 0.00 C ATOM 484 CD2 LEU A 34 3.948 -5.735 -2.391 1.00 0.00 C ATOM 0 H LEU A 34 4.728 -9.884 -5.341 1.00 0.00 H new ATOM 0 HA LEU A 34 3.410 -7.374 -6.241 1.00 0.00 H new ATOM 0 HB2 LEU A 34 2.878 -7.776 -3.893 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.561 -8.100 -3.528 1.00 0.00 H new ATOM 0 HG LEU A 34 5.142 -5.779 -4.203 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.349 -4.083 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.281 -5.297 -5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.130 -5.378 -4.374 1.00 0.00 H new ATOM 0 HD21 LEU A 34 4.110 -4.675 -2.198 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.937 -6.009 -2.088 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.669 -6.322 -1.822 1.00 0.00 H new ATOM 496 N VAL A 35 5.617 -6.869 -7.264 1.00 0.00 N ATOM 497 CA VAL A 35 6.820 -6.163 -7.676 1.00 0.00 C ATOM 498 C VAL A 35 7.019 -5.030 -6.679 1.00 0.00 C ATOM 499 O VAL A 35 6.166 -4.153 -6.585 1.00 0.00 O ATOM 500 CB VAL A 35 6.694 -5.635 -9.119 1.00 0.00 C ATOM 501 CG1 VAL A 35 8.022 -5.009 -9.564 1.00 0.00 C ATOM 502 CG2 VAL A 35 6.302 -6.736 -10.114 1.00 0.00 C ATOM 0 H VAL A 35 4.856 -6.827 -7.942 1.00 0.00 H new ATOM 0 HA VAL A 35 7.682 -6.830 -7.678 1.00 0.00 H new ATOM 0 HB VAL A 35 5.901 -4.888 -9.116 1.00 0.00 H new ATOM 0 HG11 VAL A 35 7.926 -4.638 -10.584 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.275 -4.183 -8.900 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.810 -5.761 -9.524 1.00 0.00 H new ATOM 0 HG21 VAL A 35 6.227 -6.312 -11.115 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.060 -7.519 -10.108 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.340 -7.161 -9.827 1.00 0.00 H new ATOM 512 N HIS A 36 8.099 -5.042 -5.906 1.00 0.00 N ATOM 513 CA HIS A 36 8.422 -3.937 -5.008 1.00 0.00 C ATOM 514 C HIS A 36 8.929 -2.750 -5.842 1.00 0.00 C ATOM 515 O HIS A 36 9.553 -2.940 -6.884 1.00 0.00 O ATOM 516 CB HIS A 36 9.424 -4.421 -3.947 1.00 0.00 C ATOM 517 CG HIS A 36 8.819 -5.391 -2.950 1.00 0.00 C ATOM 518 ND1 HIS A 36 7.981 -6.452 -3.237 1.00 0.00 N ATOM 519 CD2 HIS A 36 8.985 -5.375 -1.587 1.00 0.00 C ATOM 520 CE1 HIS A 36 7.655 -7.045 -2.084 1.00 0.00 C ATOM 521 NE2 HIS A 36 8.233 -6.426 -1.043 1.00 0.00 N ATOM 0 H HIS A 36 8.770 -5.810 -5.883 1.00 0.00 H new ATOM 0 HA HIS A 36 7.542 -3.591 -4.467 1.00 0.00 H new ATOM 0 HB2 HIS A 36 10.267 -4.901 -4.445 1.00 0.00 H new ATOM 0 HB3 HIS A 36 9.820 -3.559 -3.410 1.00 0.00 H new ATOM 0 HD1 HIS A 36 7.666 -6.733 -4.166 1.00 0.00 H new ATOM 0 HD2 HIS A 36 9.590 -4.674 -1.031 1.00 0.00 H new ATOM 0 HE1 HIS A 36 7.011 -7.908 -2.001 1.00 0.00 H new ATOM 529 N ILE A 37 8.618 -1.518 -5.423 1.00 0.00 N ATOM 530 CA ILE A 37 8.854 -0.293 -6.204 1.00 0.00 C ATOM 531 C ILE A 37 10.295 -0.149 -6.712 1.00 0.00 C ATOM 532 O ILE A 37 10.485 0.163 -7.888 1.00 0.00 O ATOM 533 CB ILE A 37 8.320 0.937 -5.429 1.00 0.00 C ATOM 534 CG1 ILE A 37 8.282 2.167 -6.347 1.00 0.00 C ATOM 535 CG2 ILE A 37 9.110 1.208 -4.135 1.00 0.00 C ATOM 536 CD1 ILE A 37 7.505 3.353 -5.758 1.00 0.00 C ATOM 0 H ILE A 37 8.188 -1.339 -4.516 1.00 0.00 H new ATOM 0 HA ILE A 37 8.281 -0.367 -7.128 1.00 0.00 H new ATOM 0 HB ILE A 37 7.301 0.713 -5.113 1.00 0.00 H new ATOM 0 HG12 ILE A 37 9.303 2.483 -6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 37 7.831 1.885 -7.299 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.694 2.080 -3.631 1.00 0.00 H new ATOM 0 HG22 ILE A 37 9.040 0.341 -3.478 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.156 1.394 -4.379 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.521 4.185 -6.462 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.473 3.055 -5.572 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.968 3.662 -4.821 1.00 0.00 H new ATOM 548 N SER A 38 11.298 -0.451 -5.888 1.00 0.00 N ATOM 549 CA SER A 38 12.712 -0.339 -6.246 1.00 0.00 C ATOM 550 C SER A 38 13.145 -1.371 -7.300 1.00 0.00 C ATOM 551 O SER A 38 14.223 -1.257 -7.898 1.00 0.00 O ATOM 552 CB SER A 38 13.548 -0.472 -4.972 1.00 0.00 C ATOM 553 OG SER A 38 13.020 0.352 -3.936 1.00 0.00 O ATOM 0 H SER A 38 11.148 -0.786 -4.936 1.00 0.00 H new ATOM 0 HA SER A 38 12.874 0.637 -6.704 1.00 0.00 H new ATOM 0 HB2 SER A 38 13.560 -1.512 -4.646 1.00 0.00 H new ATOM 0 HB3 SER A 38 14.581 -0.190 -5.177 1.00 0.00 H new ATOM 0 HG SER A 38 13.566 0.253 -3.129 1.00 0.00 H new ATOM 559 N GLU A 39 12.273 -2.333 -7.603 1.00 0.00 N ATOM 560 CA GLU A 39 12.474 -3.396 -8.566 1.00 0.00 C ATOM 561 C GLU A 39 11.542 -3.239 -9.775 1.00 0.00 C ATOM 562 O GLU A 39 11.437 -4.154 -10.585 1.00 0.00 O ATOM 563 CB GLU A 39 12.335 -4.757 -7.857 1.00 0.00 C ATOM 564 CG GLU A 39 13.585 -5.169 -7.059 1.00 0.00 C ATOM 565 CD GLU A 39 13.878 -4.320 -5.809 1.00 0.00 C ATOM 566 OE1 GLU A 39 12.990 -4.220 -4.934 1.00 0.00 O ATOM 567 OE2 GLU A 39 14.998 -3.764 -5.745 1.00 0.00 O ATOM 0 H GLU A 39 11.359 -2.387 -7.153 1.00 0.00 H new ATOM 0 HA GLU A 39 13.484 -3.339 -8.973 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.480 -4.720 -7.182 1.00 0.00 H new ATOM 0 HB3 GLU A 39 12.120 -5.524 -8.601 1.00 0.00 H new ATOM 0 HG2 GLU A 39 13.474 -6.209 -6.753 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.450 -5.122 -7.721 1.00 0.00 H new ATOM 574 N VAL A 40 10.878 -2.095 -9.956 1.00 0.00 N ATOM 575 CA VAL A 40 10.095 -1.807 -11.159 1.00 0.00 C ATOM 576 C VAL A 40 11.008 -1.480 -12.355 1.00 0.00 C ATOM 577 O VAL A 40 10.691 -1.844 -13.485 1.00 0.00 O ATOM 578 CB VAL A 40 9.074 -0.700 -10.829 1.00 0.00 C ATOM 579 CG1 VAL A 40 8.291 -0.209 -12.049 1.00 0.00 C ATOM 580 CG2 VAL A 40 8.053 -1.224 -9.805 1.00 0.00 C ATOM 0 H VAL A 40 10.869 -1.340 -9.270 1.00 0.00 H new ATOM 0 HA VAL A 40 9.535 -2.689 -11.470 1.00 0.00 H new ATOM 0 HB VAL A 40 9.655 0.135 -10.438 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.591 0.569 -11.743 1.00 0.00 H new ATOM 0 HG12 VAL A 40 8.984 0.195 -12.787 1.00 0.00 H new ATOM 0 HG13 VAL A 40 7.740 -1.041 -12.487 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.333 -0.439 -9.574 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.530 -2.085 -10.221 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.571 -1.520 -8.893 1.00 0.00 H new ATOM 590 N THR A 41 12.149 -0.825 -12.130 1.00 0.00 N ATOM 591 CA THR A 41 13.150 -0.507 -13.157 1.00 0.00 C ATOM 592 C THR A 41 14.442 -0.097 -12.433 1.00 0.00 C ATOM 593 O THR A 41 14.626 -0.430 -11.267 1.00 0.00 O ATOM 594 CB THR A 41 12.567 0.525 -14.164 1.00 0.00 C ATOM 595 OG1 THR A 41 13.483 0.845 -15.193 1.00 0.00 O ATOM 596 CG2 THR A 41 12.162 1.841 -13.504 1.00 0.00 C ATOM 0 H THR A 41 12.412 -0.491 -11.203 1.00 0.00 H new ATOM 0 HA THR A 41 13.408 -1.361 -13.783 1.00 0.00 H new ATOM 0 HB THR A 41 11.686 0.031 -14.574 1.00 0.00 H new ATOM 0 HG1 THR A 41 14.053 0.069 -15.376 1.00 0.00 H new ATOM 0 HG21 THR A 41 11.763 2.519 -14.259 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.400 1.650 -12.749 1.00 0.00 H new ATOM 0 HG23 THR A 41 13.034 2.295 -13.033 1.00 0.00 H new ATOM 604 N HIS A 42 15.355 0.592 -13.122 1.00 0.00 N ATOM 605 CA HIS A 42 16.730 0.900 -12.715 1.00 0.00 C ATOM 606 C HIS A 42 16.833 1.495 -11.303 1.00 0.00 C ATOM 607 O HIS A 42 17.830 1.243 -10.621 1.00 0.00 O ATOM 608 CB HIS A 42 17.341 1.838 -13.779 1.00 0.00 C ATOM 609 CG HIS A 42 18.845 2.002 -13.745 1.00 0.00 C ATOM 610 ND1 HIS A 42 19.619 2.137 -12.616 1.00 0.00 N ATOM 611 CD2 HIS A 42 19.693 2.113 -14.821 1.00 0.00 C ATOM 612 CE1 HIS A 42 20.892 2.317 -12.994 1.00 0.00 C ATOM 613 NE2 HIS A 42 20.989 2.311 -14.330 1.00 0.00 N ATOM 0 H HIS A 42 15.139 0.976 -14.042 1.00 0.00 H new ATOM 0 HA HIS A 42 17.293 -0.031 -12.659 1.00 0.00 H new ATOM 0 HB2 HIS A 42 17.060 1.467 -14.764 1.00 0.00 H new ATOM 0 HB3 HIS A 42 16.887 2.823 -13.668 1.00 0.00 H new ATOM 0 HD1 HIS A 42 19.281 2.105 -11.654 1.00 0.00 H new ATOM 0 HD2 HIS A 42 19.410 2.057 -15.862 1.00 0.00 H new ATOM 0 HE1 HIS A 42 21.723 2.448 -12.317 1.00 0.00 H new ATOM 621 N GLY A 43 15.850 2.273 -10.847 1.00 0.00 N ATOM 622 CA GLY A 43 15.778 2.724 -9.455 1.00 0.00 C ATOM 623 C GLY A 43 15.154 4.112 -9.308 1.00 0.00 C ATOM 624 O GLY A 43 14.760 4.499 -8.214 1.00 0.00 O ATOM 0 H GLY A 43 15.083 2.608 -11.430 1.00 0.00 H new ATOM 0 HA2 GLY A 43 15.196 2.007 -8.876 1.00 0.00 H new ATOM 0 HA3 GLY A 43 16.782 2.736 -9.030 1.00 0.00 H new ATOM 628 N PHE A 44 14.991 4.849 -10.413 1.00 0.00 N ATOM 629 CA PHE A 44 14.518 6.240 -10.449 1.00 0.00 C ATOM 630 C PHE A 44 12.992 6.362 -10.263 1.00 0.00 C ATOM 631 O PHE A 44 12.378 7.309 -10.775 1.00 0.00 O ATOM 632 CB PHE A 44 14.984 6.882 -11.770 1.00 0.00 C ATOM 633 CG PHE A 44 16.422 6.593 -12.163 1.00 0.00 C ATOM 634 CD1 PHE A 44 17.485 7.021 -11.343 1.00 0.00 C ATOM 635 CD2 PHE A 44 16.695 5.876 -13.345 1.00 0.00 C ATOM 636 CE1 PHE A 44 18.811 6.718 -11.696 1.00 0.00 C ATOM 637 CE2 PHE A 44 18.023 5.580 -13.700 1.00 0.00 C ATOM 638 CZ PHE A 44 19.081 5.995 -12.872 1.00 0.00 C ATOM 0 H PHE A 44 15.192 4.480 -11.342 1.00 0.00 H new ATOM 0 HA PHE A 44 14.951 6.775 -9.604 1.00 0.00 H new ATOM 0 HB2 PHE A 44 14.330 6.539 -12.572 1.00 0.00 H new ATOM 0 HB3 PHE A 44 14.856 7.962 -11.695 1.00 0.00 H new ATOM 0 HD1 PHE A 44 17.281 7.582 -10.443 1.00 0.00 H new ATOM 0 HD2 PHE A 44 15.883 5.553 -13.979 1.00 0.00 H new ATOM 0 HE1 PHE A 44 19.624 7.041 -11.063 1.00 0.00 H new ATOM 0 HE2 PHE A 44 18.230 5.034 -14.608 1.00 0.00 H new ATOM 0 HZ PHE A 44 20.100 5.759 -13.139 1.00 0.00 H new ATOM 648 N VAL A 45 12.392 5.400 -9.563 1.00 0.00 N ATOM 649 CA VAL A 45 10.960 5.169 -9.395 1.00 0.00 C ATOM 650 C VAL A 45 10.375 6.126 -8.344 1.00 0.00 C ATOM 651 O VAL A 45 9.794 5.726 -7.343 1.00 0.00 O ATOM 652 CB VAL A 45 10.689 3.666 -9.128 1.00 0.00 C ATOM 653 CG1 VAL A 45 9.233 3.316 -9.471 1.00 0.00 C ATOM 654 CG2 VAL A 45 11.585 2.748 -9.981 1.00 0.00 C ATOM 0 H VAL A 45 12.942 4.705 -9.057 1.00 0.00 H new ATOM 0 HA VAL A 45 10.430 5.404 -10.318 1.00 0.00 H new ATOM 0 HB VAL A 45 10.902 3.504 -8.071 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.058 2.258 -9.278 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.560 3.913 -8.855 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.046 3.529 -10.523 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.356 1.706 -9.757 1.00 0.00 H new ATOM 0 HG22 VAL A 45 11.401 2.941 -11.038 1.00 0.00 H new ATOM 0 HG23 VAL A 45 12.632 2.947 -9.752 1.00 0.00 H new ATOM 664 N LYS A 46 10.583 7.424 -8.585 1.00 0.00 N ATOM 665 CA LYS A 46 10.017 8.533 -7.819 1.00 0.00 C ATOM 666 C LYS A 46 8.495 8.439 -7.673 1.00 0.00 C ATOM 667 O LYS A 46 7.966 8.877 -6.660 1.00 0.00 O ATOM 668 CB LYS A 46 10.484 9.863 -8.439 1.00 0.00 C ATOM 669 CG LYS A 46 9.938 10.107 -9.861 1.00 0.00 C ATOM 670 CD LYS A 46 10.594 11.297 -10.578 1.00 0.00 C ATOM 671 CE LYS A 46 12.092 11.116 -10.880 1.00 0.00 C ATOM 672 NZ LYS A 46 12.372 10.016 -11.835 1.00 0.00 N ATOM 0 H LYS A 46 11.176 7.741 -9.352 1.00 0.00 H new ATOM 0 HA LYS A 46 10.390 8.479 -6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 46 10.173 10.684 -7.793 1.00 0.00 H new ATOM 0 HB3 LYS A 46 11.573 9.877 -8.470 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.088 9.207 -10.458 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.863 10.276 -9.804 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.067 11.475 -11.515 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.465 12.189 -9.965 1.00 0.00 H new ATOM 0 HE2 LYS A 46 12.489 12.047 -11.284 1.00 0.00 H new ATOM 0 HE3 LYS A 46 12.622 10.921 -9.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 13.307 10.161 -12.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 12.361 9.107 -11.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 11.645 10.008 -12.578 1.00 0.00 H new ATOM 686 N ASP A 47 7.811 7.905 -8.684 1.00 0.00 N ATOM 687 CA ASP A 47 6.411 7.496 -8.621 1.00 0.00 C ATOM 688 C ASP A 47 6.270 6.279 -9.532 1.00 0.00 C ATOM 689 O ASP A 47 6.931 6.218 -10.572 1.00 0.00 O ATOM 690 CB ASP A 47 5.477 8.625 -9.070 1.00 0.00 C ATOM 691 CG ASP A 47 4.027 8.125 -9.063 1.00 0.00 C ATOM 692 OD1 ASP A 47 3.393 8.179 -7.992 1.00 0.00 O ATOM 693 OD2 ASP A 47 3.592 7.569 -10.096 1.00 0.00 O ATOM 0 H ASP A 47 8.231 7.740 -9.599 1.00 0.00 H new ATOM 0 HA ASP A 47 6.128 7.255 -7.596 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.580 9.482 -8.405 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.751 8.962 -10.070 1.00 0.00 H new ATOM 698 N ILE A 48 5.493 5.281 -9.121 1.00 0.00 N ATOM 699 CA ILE A 48 5.400 3.998 -9.812 1.00 0.00 C ATOM 700 C ILE A 48 4.584 4.066 -11.109 1.00 0.00 C ATOM 701 O ILE A 48 4.921 3.354 -12.057 1.00 0.00 O ATOM 702 CB ILE A 48 4.902 2.948 -8.795 1.00 0.00 C ATOM 703 CG1 ILE A 48 5.147 1.538 -9.344 1.00 0.00 C ATOM 704 CG2 ILE A 48 3.437 3.188 -8.385 1.00 0.00 C ATOM 705 CD1 ILE A 48 4.914 0.451 -8.290 1.00 0.00 C ATOM 0 H ILE A 48 4.904 5.341 -8.290 1.00 0.00 H new ATOM 0 HA ILE A 48 6.385 3.695 -10.168 1.00 0.00 H new ATOM 0 HB ILE A 48 5.477 3.051 -7.875 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.488 1.363 -10.194 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.170 1.468 -9.714 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.130 2.426 -7.669 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.344 4.173 -7.928 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.799 3.135 -9.267 1.00 0.00 H new ATOM 0 HD11 ILE A 48 5.101 -0.529 -8.730 1.00 0.00 H new ATOM 0 HD12 ILE A 48 5.592 0.607 -7.451 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.883 0.500 -7.938 1.00 0.00 H new ATOM 717 N ASN A 49 3.538 4.896 -11.175 1.00 0.00 N ATOM 718 CA ASN A 49 2.727 5.037 -12.388 1.00 0.00 C ATOM 719 C ASN A 49 3.511 5.626 -13.567 1.00 0.00 C ATOM 720 O ASN A 49 3.137 5.398 -14.713 1.00 0.00 O ATOM 721 CB ASN A 49 1.439 5.827 -12.096 1.00 0.00 C ATOM 722 CG ASN A 49 1.363 7.160 -12.839 1.00 0.00 C ATOM 723 OD1 ASN A 49 0.592 7.297 -13.783 1.00 0.00 O ATOM 724 ND2 ASN A 49 2.083 8.148 -12.356 1.00 0.00 N ATOM 0 H ASN A 49 3.232 5.483 -10.399 1.00 0.00 H new ATOM 0 HA ASN A 49 2.442 4.032 -12.699 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.578 5.217 -12.370 1.00 0.00 H new ATOM 0 HB3 ASN A 49 1.371 6.013 -11.024 1.00 0.00 H new ATOM 0 HD21 ASN A 49 2.014 9.078 -12.768 1.00 0.00 H new ATOM 0 HD22 ASN A 49 2.711 7.984 -11.569 1.00 0.00 H new ATOM 731 N GLU A 50 4.631 6.292 -13.296 1.00 0.00 N ATOM 732 CA GLU A 50 5.517 6.784 -14.345 1.00 0.00 C ATOM 733 C GLU A 50 6.380 5.650 -14.933 1.00 0.00 C ATOM 734 O GLU A 50 7.113 5.872 -15.892 1.00 0.00 O ATOM 735 CB GLU A 50 6.391 7.915 -13.779 1.00 0.00 C ATOM 736 CG GLU A 50 5.600 9.133 -13.275 1.00 0.00 C ATOM 737 CD GLU A 50 4.726 9.791 -14.355 1.00 0.00 C ATOM 738 OE1 GLU A 50 5.313 10.354 -15.305 1.00 0.00 O ATOM 739 OE2 GLU A 50 3.495 9.822 -14.145 1.00 0.00 O ATOM 0 H GLU A 50 4.947 6.504 -12.350 1.00 0.00 H new ATOM 0 HA GLU A 50 4.913 7.175 -15.164 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.989 7.520 -12.958 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.087 8.242 -14.552 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.965 8.825 -12.444 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.299 9.873 -12.885 1.00 0.00 H new ATOM 746 N HIS A 51 6.334 4.429 -14.383 1.00 0.00 N ATOM 747 CA HIS A 51 7.279 3.358 -14.713 1.00 0.00 C ATOM 748 C HIS A 51 6.599 2.002 -14.947 1.00 0.00 C ATOM 749 O HIS A 51 7.190 1.140 -15.598 1.00 0.00 O ATOM 750 CB HIS A 51 8.363 3.262 -13.623 1.00 0.00 C ATOM 751 CG HIS A 51 9.148 4.537 -13.413 1.00 0.00 C ATOM 752 ND1 HIS A 51 8.860 5.514 -12.490 1.00 0.00 N ATOM 753 CD2 HIS A 51 10.257 4.960 -14.105 1.00 0.00 C ATOM 754 CE1 HIS A 51 9.741 6.506 -12.653 1.00 0.00 C ATOM 755 NE2 HIS A 51 10.662 6.198 -13.582 1.00 0.00 N ATOM 0 H HIS A 51 5.635 4.157 -13.692 1.00 0.00 H new ATOM 0 HA HIS A 51 7.746 3.620 -15.662 1.00 0.00 H new ATOM 0 HB2 HIS A 51 7.891 2.980 -12.682 1.00 0.00 H new ATOM 0 HB3 HIS A 51 9.055 2.462 -13.885 1.00 0.00 H new ATOM 0 HD1 HIS A 51 8.107 5.487 -11.802 1.00 0.00 H new ATOM 0 HD2 HIS A 51 10.736 4.430 -14.915 1.00 0.00 H new ATOM 0 HE1 HIS A 51 9.716 7.437 -12.107 1.00 0.00 H new ATOM 763 N LEU A 52 5.366 1.794 -14.470 1.00 0.00 N ATOM 764 CA LEU A 52 4.532 0.628 -14.787 1.00 0.00 C ATOM 765 C LEU A 52 3.054 1.039 -14.843 1.00 0.00 C ATOM 766 O LEU A 52 2.724 2.177 -14.528 1.00 0.00 O ATOM 767 CB LEU A 52 4.748 -0.477 -13.738 1.00 0.00 C ATOM 768 CG LEU A 52 4.648 -1.892 -14.342 1.00 0.00 C ATOM 769 CD1 LEU A 52 5.941 -2.261 -15.074 1.00 0.00 C ATOM 770 CD2 LEU A 52 4.376 -2.924 -13.248 1.00 0.00 C ATOM 0 H LEU A 52 4.908 2.449 -13.836 1.00 0.00 H new ATOM 0 HA LEU A 52 4.820 0.238 -15.763 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.728 -0.350 -13.278 1.00 0.00 H new ATOM 0 HB3 LEU A 52 4.008 -0.371 -12.945 1.00 0.00 H new ATOM 0 HG LEU A 52 3.822 -1.894 -15.053 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.849 -3.263 -15.492 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.120 -1.547 -15.878 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.776 -2.236 -14.373 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.309 -3.917 -13.693 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.188 -2.906 -12.521 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.437 -2.686 -12.748 1.00 0.00 H new ATOM 782 N SER A 53 2.167 0.103 -15.196 1.00 0.00 N ATOM 783 CA SER A 53 0.769 0.365 -15.536 1.00 0.00 C ATOM 784 C SER A 53 -0.092 -0.825 -15.120 1.00 0.00 C ATOM 785 O SER A 53 0.280 -1.965 -15.381 1.00 0.00 O ATOM 786 CB SER A 53 0.630 0.509 -17.056 1.00 0.00 C ATOM 787 OG SER A 53 1.354 1.621 -17.529 1.00 0.00 O ATOM 0 H SER A 53 2.411 -0.886 -15.254 1.00 0.00 H new ATOM 0 HA SER A 53 0.452 1.274 -15.025 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.989 -0.397 -17.544 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.422 0.618 -17.319 1.00 0.00 H new ATOM 0 HG SER A 53 1.339 1.629 -18.509 1.00 0.00 H new ATOM 793 N VAL A 54 -1.241 -0.595 -14.478 1.00 0.00 N ATOM 794 CA VAL A 54 -2.260 -1.630 -14.306 1.00 0.00 C ATOM 795 C VAL A 54 -2.851 -1.967 -15.678 1.00 0.00 C ATOM 796 O VAL A 54 -2.927 -1.104 -16.556 1.00 0.00 O ATOM 797 CB VAL A 54 -3.350 -1.180 -13.306 1.00 0.00 C ATOM 798 CG1 VAL A 54 -4.270 -2.340 -12.905 1.00 0.00 C ATOM 799 CG2 VAL A 54 -2.741 -0.621 -12.016 1.00 0.00 C ATOM 0 H VAL A 54 -1.488 0.305 -14.067 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.806 -2.527 -13.884 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.919 -0.407 -13.823 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.022 -1.982 -12.202 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.763 -2.737 -13.792 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.680 -3.127 -12.436 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.539 -0.316 -11.339 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.134 -1.389 -11.538 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.116 0.240 -12.252 1.00 0.00 H new ATOM 809 N GLY A 55 -3.316 -3.207 -15.847 1.00 0.00 N ATOM 810 CA GLY A 55 -3.900 -3.647 -17.102 1.00 0.00 C ATOM 811 C GLY A 55 -2.843 -3.690 -18.200 1.00 0.00 C ATOM 812 O GLY A 55 -3.125 -3.297 -19.338 1.00 0.00 O ATOM 0 H GLY A 55 -3.296 -3.923 -15.121 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.342 -4.635 -16.977 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.705 -2.972 -17.391 1.00 0.00 H new ATOM 816 N ASP A 56 -1.635 -4.134 -17.858 1.00 0.00 N ATOM 817 CA ASP A 56 -0.585 -4.470 -18.819 1.00 0.00 C ATOM 818 C ASP A 56 -0.126 -5.896 -18.544 1.00 0.00 C ATOM 819 O ASP A 56 -0.332 -6.396 -17.434 1.00 0.00 O ATOM 820 CB ASP A 56 0.570 -3.469 -18.696 1.00 0.00 C ATOM 821 CG ASP A 56 1.654 -3.649 -19.769 1.00 0.00 C ATOM 822 OD1 ASP A 56 1.292 -4.123 -20.869 1.00 0.00 O ATOM 823 OD2 ASP A 56 2.789 -3.182 -19.522 1.00 0.00 O ATOM 0 H ASP A 56 -1.353 -4.273 -16.888 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.960 -4.410 -19.841 1.00 0.00 H new ATOM 0 HB2 ASP A 56 0.171 -2.457 -18.760 1.00 0.00 H new ATOM 0 HB3 ASP A 56 1.025 -3.571 -17.711 1.00 0.00 H new ATOM 828 N GLU A 57 0.406 -6.587 -19.545 1.00 0.00 N ATOM 829 CA GLU A 57 1.087 -7.863 -19.370 1.00 0.00 C ATOM 830 C GLU A 57 2.589 -7.605 -19.195 1.00 0.00 C ATOM 831 O GLU A 57 3.205 -6.870 -19.958 1.00 0.00 O ATOM 832 CB GLU A 57 0.787 -8.753 -20.584 1.00 0.00 C ATOM 833 CG GLU A 57 1.492 -10.116 -20.504 1.00 0.00 C ATOM 834 CD GLU A 57 1.084 -11.056 -21.643 1.00 0.00 C ATOM 835 OE1 GLU A 57 1.645 -10.925 -22.749 1.00 0.00 O ATOM 836 OE2 GLU A 57 0.164 -11.878 -21.379 1.00 0.00 O ATOM 0 H GLU A 57 0.376 -6.272 -20.515 1.00 0.00 H new ATOM 0 HA GLU A 57 0.733 -8.382 -18.479 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -0.289 -8.908 -20.659 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.099 -8.239 -21.493 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.571 -9.965 -20.531 1.00 0.00 H new ATOM 0 HG3 GLU A 57 1.259 -10.586 -19.548 1.00 0.00 H new ATOM 843 N VAL A 58 3.204 -8.244 -18.203 1.00 0.00 N ATOM 844 CA VAL A 58 4.597 -8.030 -17.842 1.00 0.00 C ATOM 845 C VAL A 58 5.219 -9.377 -17.503 1.00 0.00 C ATOM 846 O VAL A 58 4.577 -10.259 -16.921 1.00 0.00 O ATOM 847 CB VAL A 58 4.701 -7.015 -16.681 1.00 0.00 C ATOM 848 CG1 VAL A 58 4.192 -5.620 -17.071 1.00 0.00 C ATOM 849 CG2 VAL A 58 3.953 -7.456 -15.414 1.00 0.00 C ATOM 0 H VAL A 58 2.737 -8.937 -17.619 1.00 0.00 H new ATOM 0 HA VAL A 58 5.150 -7.598 -18.676 1.00 0.00 H new ATOM 0 HB VAL A 58 5.768 -6.973 -16.464 1.00 0.00 H new ATOM 0 HG11 VAL A 58 4.288 -4.947 -16.219 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.782 -5.237 -17.904 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.145 -5.684 -17.367 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.068 -6.697 -14.640 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.895 -7.584 -15.642 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.364 -8.401 -15.059 1.00 0.00 H new ATOM 859 N GLN A 59 6.482 -9.546 -17.889 1.00 0.00 N ATOM 860 CA GLN A 59 7.289 -10.685 -17.489 1.00 0.00 C ATOM 861 C GLN A 59 8.014 -10.313 -16.200 1.00 0.00 C ATOM 862 O GLN A 59 8.585 -9.229 -16.116 1.00 0.00 O ATOM 863 CB GLN A 59 8.236 -11.044 -18.640 1.00 0.00 C ATOM 864 CG GLN A 59 8.940 -12.389 -18.419 1.00 0.00 C ATOM 865 CD GLN A 59 9.426 -12.989 -19.734 1.00 0.00 C ATOM 866 OE1 GLN A 59 10.578 -12.851 -20.113 1.00 0.00 O ATOM 867 NE2 GLN A 59 8.547 -13.654 -20.469 1.00 0.00 N ATOM 0 H GLN A 59 6.974 -8.888 -18.493 1.00 0.00 H new ATOM 0 HA GLN A 59 6.689 -11.572 -17.287 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.673 -11.080 -19.573 1.00 0.00 H new ATOM 0 HB3 GLN A 59 8.984 -10.259 -18.750 1.00 0.00 H new ATOM 0 HG2 GLN A 59 9.786 -12.251 -17.746 1.00 0.00 H new ATOM 0 HG3 GLN A 59 8.255 -13.083 -17.932 1.00 0.00 H new ATOM 0 HE21 GLN A 59 7.587 -13.763 -20.142 1.00 0.00 H new ATOM 0 HE22 GLN A 59 8.830 -14.057 -21.362 1.00 0.00 H new ATOM 876 N VAL A 60 8.000 -11.199 -15.213 1.00 0.00 N ATOM 877 CA VAL A 60 8.433 -10.976 -13.842 1.00 0.00 C ATOM 878 C VAL A 60 9.422 -12.067 -13.452 1.00 0.00 C ATOM 879 O VAL A 60 9.238 -13.241 -13.787 1.00 0.00 O ATOM 880 CB VAL A 60 7.224 -10.979 -12.873 1.00 0.00 C ATOM 881 CG1 VAL A 60 6.460 -9.656 -12.916 1.00 0.00 C ATOM 882 CG2 VAL A 60 6.215 -12.108 -13.115 1.00 0.00 C ATOM 0 H VAL A 60 7.665 -12.151 -15.359 1.00 0.00 H new ATOM 0 HA VAL A 60 8.913 -10.000 -13.774 1.00 0.00 H new ATOM 0 HB VAL A 60 7.679 -11.137 -11.895 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.620 -9.698 -12.223 1.00 0.00 H new ATOM 0 HG12 VAL A 60 7.126 -8.842 -12.630 1.00 0.00 H new ATOM 0 HG13 VAL A 60 6.089 -9.483 -13.926 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.403 -12.032 -12.391 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.811 -12.025 -14.124 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.713 -13.071 -13.002 1.00 0.00 H new ATOM 892 N LYS A 61 10.458 -11.690 -12.702 1.00 0.00 N ATOM 893 CA LYS A 61 11.303 -12.650 -12.005 1.00 0.00 C ATOM 894 C LYS A 61 10.755 -12.817 -10.589 1.00 0.00 C ATOM 895 O LYS A 61 10.486 -11.816 -9.924 1.00 0.00 O ATOM 896 CB LYS A 61 12.749 -12.139 -12.025 1.00 0.00 C ATOM 897 CG LYS A 61 13.723 -13.144 -11.394 1.00 0.00 C ATOM 898 CD LYS A 61 15.181 -12.694 -11.557 1.00 0.00 C ATOM 899 CE LYS A 61 16.127 -13.722 -10.924 1.00 0.00 C ATOM 900 NZ LYS A 61 17.551 -13.335 -11.072 1.00 0.00 N ATOM 0 H LYS A 61 10.731 -10.717 -12.563 1.00 0.00 H new ATOM 0 HA LYS A 61 11.299 -13.628 -12.487 1.00 0.00 H new ATOM 0 HB2 LYS A 61 13.049 -11.940 -13.054 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.806 -11.192 -11.488 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.493 -13.259 -10.335 1.00 0.00 H new ATOM 0 HG3 LYS A 61 13.589 -14.122 -11.857 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.416 -12.575 -12.615 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.323 -11.721 -11.088 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.889 -13.829 -9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 61 15.966 -14.695 -11.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 18.155 -14.057 -10.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 17.786 -13.257 -12.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.712 -12.418 -10.608 1.00 0.00 H new ATOM 914 N VAL A 62 10.591 -14.052 -10.125 1.00 0.00 N ATOM 915 CA VAL A 62 10.258 -14.347 -8.739 1.00 0.00 C ATOM 916 C VAL A 62 11.425 -13.899 -7.853 1.00 0.00 C ATOM 917 O VAL A 62 12.529 -14.440 -7.957 1.00 0.00 O ATOM 918 CB VAL A 62 9.917 -15.839 -8.580 1.00 0.00 C ATOM 919 CG1 VAL A 62 9.424 -16.115 -7.154 1.00 0.00 C ATOM 920 CG2 VAL A 62 8.816 -16.282 -9.560 1.00 0.00 C ATOM 0 H VAL A 62 10.687 -14.883 -10.708 1.00 0.00 H new ATOM 0 HA VAL A 62 9.369 -13.799 -8.426 1.00 0.00 H new ATOM 0 HB VAL A 62 10.827 -16.400 -8.792 1.00 0.00 H new ATOM 0 HG11 VAL A 62 9.185 -17.173 -7.050 1.00 0.00 H new ATOM 0 HG12 VAL A 62 10.204 -15.848 -6.441 1.00 0.00 H new ATOM 0 HG13 VAL A 62 8.532 -15.520 -6.956 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.605 -17.342 -9.415 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.911 -15.703 -9.376 1.00 0.00 H new ATOM 0 HG23 VAL A 62 9.151 -16.115 -10.584 1.00 0.00 H new ATOM 930 N LEU A 63 11.167 -12.904 -7.003 1.00 0.00 N ATOM 931 CA LEU A 63 12.162 -12.275 -6.143 1.00 0.00 C ATOM 932 C LEU A 63 12.154 -12.889 -4.746 1.00 0.00 C ATOM 933 O LEU A 63 13.210 -12.985 -4.133 1.00 0.00 O ATOM 934 CB LEU A 63 11.860 -10.771 -6.094 1.00 0.00 C ATOM 935 CG LEU A 63 12.856 -9.926 -5.276 1.00 0.00 C ATOM 936 CD1 LEU A 63 14.252 -9.919 -5.909 1.00 0.00 C ATOM 937 CD2 LEU A 63 12.327 -8.492 -5.192 1.00 0.00 C ATOM 0 H LEU A 63 10.235 -12.505 -6.893 1.00 0.00 H new ATOM 0 HA LEU A 63 13.161 -12.440 -6.547 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.836 -10.388 -7.114 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.862 -10.631 -5.678 1.00 0.00 H new ATOM 0 HG LEU A 63 12.947 -10.365 -4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 63 14.924 -9.312 -5.302 1.00 0.00 H new ATOM 0 HD12 LEU A 63 14.632 -10.939 -5.962 1.00 0.00 H new ATOM 0 HD13 LEU A 63 14.194 -9.501 -6.914 1.00 0.00 H new ATOM 0 HD21 LEU A 63 13.022 -7.881 -4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 63 12.230 -8.081 -6.197 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.352 -8.492 -4.704 1.00 0.00 H new ATOM 949 N ALA A 64 10.994 -13.330 -4.252 1.00 0.00 N ATOM 950 CA ALA A 64 10.851 -14.080 -3.007 1.00 0.00 C ATOM 951 C ALA A 64 9.540 -14.863 -3.042 1.00 0.00 C ATOM 952 O ALA A 64 8.624 -14.497 -3.779 1.00 0.00 O ATOM 953 CB ALA A 64 10.847 -13.126 -1.808 1.00 0.00 C ATOM 0 H ALA A 64 10.104 -13.169 -4.723 1.00 0.00 H new ATOM 0 HA ALA A 64 11.691 -14.767 -2.905 1.00 0.00 H new ATOM 0 HB1 ALA A 64 10.740 -13.699 -0.887 1.00 0.00 H new ATOM 0 HB2 ALA A 64 11.784 -12.570 -1.782 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.014 -12.429 -1.900 1.00 0.00 H new ATOM 959 N VAL A 65 9.421 -15.877 -2.189 1.00 0.00 N ATOM 960 CA VAL A 65 8.180 -16.594 -1.908 1.00 0.00 C ATOM 961 C VAL A 65 8.112 -16.755 -0.384 1.00 0.00 C ATOM 962 O VAL A 65 9.147 -16.963 0.250 1.00 0.00 O ATOM 963 CB VAL A 65 8.182 -17.945 -2.659 1.00 0.00 C ATOM 964 CG1 VAL A 65 6.888 -18.741 -2.419 1.00 0.00 C ATOM 965 CG2 VAL A 65 8.342 -17.771 -4.180 1.00 0.00 C ATOM 0 H VAL A 65 10.214 -16.235 -1.656 1.00 0.00 H new ATOM 0 HA VAL A 65 7.296 -16.059 -2.254 1.00 0.00 H new ATOM 0 HB VAL A 65 9.037 -18.489 -2.258 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.933 -19.683 -2.966 1.00 0.00 H new ATOM 0 HG12 VAL A 65 6.778 -18.945 -1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.034 -18.160 -2.767 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.337 -18.749 -4.661 1.00 0.00 H new ATOM 0 HG22 VAL A 65 7.517 -17.173 -4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 65 9.285 -17.268 -4.391 1.00 0.00 H new ATOM 975 N ASP A 66 6.909 -16.662 0.185 1.00 0.00 N ATOM 976 CA ASP A 66 6.661 -16.661 1.628 1.00 0.00 C ATOM 977 C ASP A 66 5.413 -17.494 1.901 1.00 0.00 C ATOM 978 O ASP A 66 4.298 -16.981 2.050 1.00 0.00 O ATOM 979 CB ASP A 66 6.562 -15.228 2.170 1.00 0.00 C ATOM 980 CG ASP A 66 6.311 -15.182 3.687 1.00 0.00 C ATOM 981 OD1 ASP A 66 6.668 -16.169 4.364 1.00 0.00 O ATOM 982 OD2 ASP A 66 5.762 -14.148 4.143 1.00 0.00 O ATOM 0 H ASP A 66 6.053 -16.583 -0.363 1.00 0.00 H new ATOM 0 HA ASP A 66 7.498 -17.114 2.160 1.00 0.00 H new ATOM 0 HB2 ASP A 66 7.484 -14.693 1.942 1.00 0.00 H new ATOM 0 HB3 ASP A 66 5.755 -14.705 1.657 1.00 0.00 H new ATOM 987 N GLU A 67 5.589 -18.810 1.771 1.00 0.00 N ATOM 988 CA GLU A 67 4.541 -19.818 1.910 1.00 0.00 C ATOM 989 C GLU A 67 3.832 -19.794 3.270 1.00 0.00 C ATOM 990 O GLU A 67 2.687 -20.241 3.338 1.00 0.00 O ATOM 991 CB GLU A 67 5.107 -21.211 1.576 1.00 0.00 C ATOM 992 CG GLU A 67 6.129 -21.727 2.606 1.00 0.00 C ATOM 993 CD GLU A 67 6.693 -23.108 2.236 1.00 0.00 C ATOM 994 OE1 GLU A 67 5.964 -24.114 2.424 1.00 0.00 O ATOM 995 OE2 GLU A 67 7.821 -23.155 1.693 1.00 0.00 O ATOM 0 H GLU A 67 6.500 -19.216 1.558 1.00 0.00 H new ATOM 0 HA GLU A 67 3.761 -19.569 1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.283 -21.921 1.508 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.580 -21.176 0.595 1.00 0.00 H new ATOM 0 HG2 GLU A 67 6.949 -21.014 2.688 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.656 -21.782 3.586 1.00 0.00 H new ATOM 1002 N GLU A 68 4.447 -19.202 4.298 1.00 0.00 N ATOM 1003 CA GLU A 68 3.834 -19.035 5.616 1.00 0.00 C ATOM 1004 C GLU A 68 2.621 -18.093 5.544 1.00 0.00 C ATOM 1005 O GLU A 68 1.709 -18.157 6.372 1.00 0.00 O ATOM 1006 CB GLU A 68 4.858 -18.457 6.602 1.00 0.00 C ATOM 1007 CG GLU A 68 6.104 -19.331 6.818 1.00 0.00 C ATOM 1008 CD GLU A 68 5.791 -20.673 7.497 1.00 0.00 C ATOM 1009 OE1 GLU A 68 5.553 -20.665 8.729 1.00 0.00 O ATOM 1010 OE2 GLU A 68 5.808 -21.701 6.789 1.00 0.00 O ATOM 0 H GLU A 68 5.392 -18.823 4.237 1.00 0.00 H new ATOM 0 HA GLU A 68 3.501 -20.015 5.958 1.00 0.00 H new ATOM 0 HB2 GLU A 68 5.175 -17.478 6.243 1.00 0.00 H new ATOM 0 HB3 GLU A 68 4.369 -18.301 7.563 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.579 -19.520 5.855 1.00 0.00 H new ATOM 0 HG3 GLU A 68 6.824 -18.783 7.426 1.00 0.00 H new ATOM 1017 N LYS A 69 2.593 -17.202 4.546 1.00 0.00 N ATOM 1018 CA LYS A 69 1.527 -16.219 4.333 1.00 0.00 C ATOM 1019 C LYS A 69 0.887 -16.375 2.954 1.00 0.00 C ATOM 1020 O LYS A 69 -0.085 -15.673 2.679 1.00 0.00 O ATOM 1021 CB LYS A 69 2.104 -14.804 4.509 1.00 0.00 C ATOM 1022 CG LYS A 69 2.652 -14.491 5.914 1.00 0.00 C ATOM 1023 CD LYS A 69 1.627 -14.580 7.058 1.00 0.00 C ATOM 1024 CE LYS A 69 0.459 -13.601 6.871 1.00 0.00 C ATOM 1025 NZ LYS A 69 -0.493 -13.636 8.006 1.00 0.00 N ATOM 0 H LYS A 69 3.332 -17.144 3.846 1.00 0.00 H new ATOM 0 HA LYS A 69 0.742 -16.388 5.071 1.00 0.00 H new ATOM 0 HB2 LYS A 69 2.905 -14.663 3.784 1.00 0.00 H new ATOM 0 HB3 LYS A 69 1.326 -14.079 4.270 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.470 -15.179 6.128 1.00 0.00 H new ATOM 0 HG3 LYS A 69 3.074 -13.486 5.905 1.00 0.00 H new ATOM 0 HD2 LYS A 69 1.240 -15.597 7.118 1.00 0.00 H new ATOM 0 HD3 LYS A 69 2.124 -14.372 8.005 1.00 0.00 H new ATOM 0 HE2 LYS A 69 0.850 -12.590 6.759 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -0.070 -13.842 5.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.263 -12.959 7.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -0.888 -14.594 8.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 0.003 -13.380 8.883 1.00 0.00 H new ATOM 1039 N GLY A 70 1.416 -17.263 2.107 1.00 0.00 N ATOM 1040 CA GLY A 70 0.972 -17.415 0.730 1.00 0.00 C ATOM 1041 C GLY A 70 1.253 -16.161 -0.098 1.00 0.00 C ATOM 1042 O GLY A 70 0.418 -15.758 -0.901 1.00 0.00 O ATOM 0 H GLY A 70 2.170 -17.899 2.366 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.475 -18.270 0.278 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.097 -17.629 0.714 1.00 0.00 H new ATOM 1046 N LYS A 71 2.408 -15.520 0.108 1.00 0.00 N ATOM 1047 CA LYS A 71 2.798 -14.295 -0.595 1.00 0.00 C ATOM 1048 C LYS A 71 3.994 -14.569 -1.503 1.00 0.00 C ATOM 1049 O LYS A 71 4.743 -15.524 -1.298 1.00 0.00 O ATOM 1050 CB LYS A 71 3.113 -13.188 0.425 1.00 0.00 C ATOM 1051 CG LYS A 71 1.860 -12.725 1.185 1.00 0.00 C ATOM 1052 CD LYS A 71 2.159 -11.658 2.252 1.00 0.00 C ATOM 1053 CE LYS A 71 2.627 -10.333 1.631 1.00 0.00 C ATOM 1054 NZ LYS A 71 2.857 -9.282 2.652 1.00 0.00 N ATOM 0 H LYS A 71 3.107 -15.842 0.777 1.00 0.00 H new ATOM 0 HA LYS A 71 1.973 -13.957 -1.222 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.854 -13.552 1.137 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.558 -12.337 -0.091 1.00 0.00 H new ATOM 0 HG2 LYS A 71 1.138 -12.325 0.473 1.00 0.00 H new ATOM 0 HG3 LYS A 71 1.393 -13.587 1.663 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.264 -11.482 2.848 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.926 -12.030 2.931 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.548 -10.501 1.073 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.880 -9.985 0.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.171 -8.407 2.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.973 -9.100 3.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.589 -9.600 3.319 1.00 0.00 H new ATOM 1068 N ILE A 72 4.178 -13.707 -2.501 1.00 0.00 N ATOM 1069 CA ILE A 72 5.249 -13.771 -3.486 1.00 0.00 C ATOM 1070 C ILE A 72 5.678 -12.324 -3.718 1.00 0.00 C ATOM 1071 O ILE A 72 4.828 -11.436 -3.814 1.00 0.00 O ATOM 1072 CB ILE A 72 4.749 -14.462 -4.787 1.00 0.00 C ATOM 1073 CG1 ILE A 72 4.303 -15.915 -4.515 1.00 0.00 C ATOM 1074 CG2 ILE A 72 5.838 -14.443 -5.876 1.00 0.00 C ATOM 1075 CD1 ILE A 72 3.809 -16.687 -5.748 1.00 0.00 C ATOM 0 H ILE A 72 3.557 -12.912 -2.649 1.00 0.00 H new ATOM 0 HA ILE A 72 6.095 -14.368 -3.146 1.00 0.00 H new ATOM 0 HB ILE A 72 3.887 -13.897 -5.143 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.139 -16.459 -4.076 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.506 -15.901 -3.771 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.462 -14.932 -6.775 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.102 -13.411 -6.108 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.721 -14.972 -5.517 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.519 -17.696 -5.454 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.949 -16.173 -6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.608 -16.740 -6.488 1.00 0.00 H new ATOM 1087 N SER A 73 6.982 -12.091 -3.812 1.00 0.00 N ATOM 1088 CA SER A 73 7.550 -10.823 -4.244 1.00 0.00 C ATOM 1089 C SER A 73 8.168 -11.029 -5.622 1.00 0.00 C ATOM 1090 O SER A 73 8.644 -12.123 -5.934 1.00 0.00 O ATOM 1091 CB SER A 73 8.594 -10.336 -3.235 1.00 0.00 C ATOM 1092 OG SER A 73 8.066 -10.361 -1.918 1.00 0.00 O ATOM 0 H SER A 73 7.686 -12.793 -3.585 1.00 0.00 H new ATOM 0 HA SER A 73 6.776 -10.058 -4.301 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.481 -10.967 -3.289 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.907 -9.323 -3.488 1.00 0.00 H new ATOM 0 HG SER A 73 8.747 -10.048 -1.287 1.00 0.00 H new ATOM 1098 N LEU A 74 8.181 -9.994 -6.449 1.00 0.00 N ATOM 1099 CA LEU A 74 8.536 -10.076 -7.861 1.00 0.00 C ATOM 1100 C LEU A 74 9.509 -8.947 -8.209 1.00 0.00 C ATOM 1101 O LEU A 74 9.694 -8.008 -7.435 1.00 0.00 O ATOM 1102 CB LEU A 74 7.253 -9.972 -8.707 1.00 0.00 C ATOM 1103 CG LEU A 74 6.197 -11.073 -8.477 1.00 0.00 C ATOM 1104 CD1 LEU A 74 4.926 -10.755 -9.266 1.00 0.00 C ATOM 1105 CD2 LEU A 74 6.707 -12.455 -8.884 1.00 0.00 C ATOM 0 H LEU A 74 7.939 -9.049 -6.150 1.00 0.00 H new ATOM 0 HA LEU A 74 9.023 -11.028 -8.073 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.789 -9.005 -8.510 1.00 0.00 H new ATOM 0 HB3 LEU A 74 7.535 -9.981 -9.760 1.00 0.00 H new ATOM 0 HG LEU A 74 5.982 -11.093 -7.409 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.187 -11.538 -9.097 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.522 -9.798 -8.935 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.161 -10.702 -10.329 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.929 -13.197 -8.704 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.966 -12.450 -9.943 1.00 0.00 H new ATOM 0 HD23 LEU A 74 7.590 -12.705 -8.296 1.00 0.00 H new ATOM 1117 N SER A 75 10.096 -9.013 -9.400 1.00 0.00 N ATOM 1118 CA SER A 75 10.966 -7.988 -9.946 1.00 0.00 C ATOM 1119 C SER A 75 10.647 -7.811 -11.426 1.00 0.00 C ATOM 1120 O SER A 75 10.288 -8.768 -12.115 1.00 0.00 O ATOM 1121 CB SER A 75 12.426 -8.403 -9.714 1.00 0.00 C ATOM 1122 OG SER A 75 13.334 -7.495 -10.318 1.00 0.00 O ATOM 0 H SER A 75 9.973 -9.808 -10.028 1.00 0.00 H new ATOM 0 HA SER A 75 10.808 -7.029 -9.452 1.00 0.00 H new ATOM 0 HB2 SER A 75 12.623 -8.456 -8.643 1.00 0.00 H new ATOM 0 HB3 SER A 75 12.588 -9.402 -10.118 1.00 0.00 H new ATOM 0 HG SER A 75 14.253 -7.790 -10.148 1.00 0.00 H new ATOM 1128 N ILE A 76 10.832 -6.579 -11.893 1.00 0.00 N ATOM 1129 CA ILE A 76 10.731 -6.138 -13.277 1.00 0.00 C ATOM 1130 C ILE A 76 12.060 -5.494 -13.699 1.00 0.00 C ATOM 1131 O ILE A 76 12.433 -5.592 -14.861 1.00 0.00 O ATOM 1132 CB ILE A 76 9.523 -5.182 -13.415 1.00 0.00 C ATOM 1133 CG1 ILE A 76 8.160 -5.840 -13.162 1.00 0.00 C ATOM 1134 CG2 ILE A 76 9.471 -4.491 -14.778 1.00 0.00 C ATOM 1135 CD1 ILE A 76 7.728 -6.841 -14.231 1.00 0.00 C ATOM 0 H ILE A 76 11.073 -5.810 -11.268 1.00 0.00 H new ATOM 0 HA ILE A 76 10.555 -6.979 -13.948 1.00 0.00 H new ATOM 0 HB ILE A 76 9.697 -4.448 -12.628 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.190 -6.348 -12.198 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.403 -5.059 -13.087 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.604 -3.832 -14.819 1.00 0.00 H new ATOM 0 HG22 ILE A 76 10.379 -3.905 -14.924 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.394 -5.242 -15.564 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.754 -7.255 -13.969 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.661 -6.337 -15.195 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.460 -7.646 -14.293 1.00 0.00 H new ATOM 1147 N ARG A 77 12.874 -4.937 -12.795 1.00 0.00 N ATOM 1148 CA ARG A 77 14.244 -4.546 -13.130 1.00 0.00 C ATOM 1149 C ARG A 77 15.041 -5.736 -13.665 1.00 0.00 C ATOM 1150 O ARG A 77 15.961 -5.531 -14.445 1.00 0.00 O ATOM 1151 CB ARG A 77 14.926 -3.825 -11.952 1.00 0.00 C ATOM 1152 CG ARG A 77 15.406 -4.731 -10.802 1.00 0.00 C ATOM 1153 CD ARG A 77 16.135 -3.970 -9.681 1.00 0.00 C ATOM 1154 NE ARG A 77 17.336 -3.273 -10.169 1.00 0.00 N ATOM 1155 CZ ARG A 77 17.613 -1.977 -9.972 1.00 0.00 C ATOM 1156 NH1 ARG A 77 16.823 -1.168 -9.279 1.00 0.00 N ATOM 1157 NH2 ARG A 77 18.733 -1.482 -10.493 1.00 0.00 N ATOM 0 H ARG A 77 12.607 -4.748 -11.829 1.00 0.00 H new ATOM 0 HA ARG A 77 14.209 -3.819 -13.941 1.00 0.00 H new ATOM 0 HB2 ARG A 77 15.783 -3.271 -12.336 1.00 0.00 H new ATOM 0 HB3 ARG A 77 14.229 -3.092 -11.546 1.00 0.00 H new ATOM 0 HG2 ARG A 77 14.547 -5.251 -10.378 1.00 0.00 H new ATOM 0 HG3 ARG A 77 16.073 -5.493 -11.205 1.00 0.00 H new ATOM 0 HD2 ARG A 77 15.454 -3.246 -9.234 1.00 0.00 H new ATOM 0 HD3 ARG A 77 16.418 -4.669 -8.894 1.00 0.00 H new ATOM 0 HE ARG A 77 18.012 -3.821 -10.700 1.00 0.00 H new ATOM 0 HH11 ARG A 77 15.961 -1.526 -8.868 1.00 0.00 H new ATOM 0 HH12 ARG A 77 17.078 -0.188 -9.157 1.00 0.00 H new ATOM 0 HH21 ARG A 77 19.357 -2.086 -11.028 1.00 0.00 H new ATOM 0 HH22 ARG A 77 18.967 -0.499 -10.358 1.00 0.00 H new ATOM 1171 N ALA A 78 14.706 -6.956 -13.232 1.00 0.00 N ATOM 1172 CA ALA A 78 15.266 -8.181 -13.776 1.00 0.00 C ATOM 1173 C ALA A 78 14.909 -8.416 -15.251 1.00 0.00 C ATOM 1174 O ALA A 78 15.685 -9.078 -15.932 1.00 0.00 O ATOM 1175 CB ALA A 78 14.767 -9.355 -12.930 1.00 0.00 C ATOM 0 H ALA A 78 14.030 -7.114 -12.485 1.00 0.00 H new ATOM 0 HA ALA A 78 16.352 -8.093 -13.738 1.00 0.00 H new ATOM 0 HB1 ALA A 78 15.176 -10.286 -13.322 1.00 0.00 H new ATOM 0 HB2 ALA A 78 15.090 -9.223 -11.898 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.678 -9.393 -12.967 1.00 0.00 H new ATOM 1181 N THR A 79 13.765 -7.925 -15.732 1.00 0.00 N ATOM 1182 CA THR A 79 13.211 -8.261 -17.048 1.00 0.00 C ATOM 1183 C THR A 79 13.272 -7.074 -18.028 1.00 0.00 C ATOM 1184 O THR A 79 13.323 -7.291 -19.240 1.00 0.00 O ATOM 1185 CB THR A 79 11.791 -8.836 -16.862 1.00 0.00 C ATOM 1186 OG1 THR A 79 10.965 -7.918 -16.178 1.00 0.00 O ATOM 1187 CG2 THR A 79 11.800 -10.122 -16.018 1.00 0.00 C ATOM 0 H THR A 79 13.185 -7.269 -15.208 1.00 0.00 H new ATOM 0 HA THR A 79 13.827 -9.029 -17.515 1.00 0.00 H new ATOM 0 HB THR A 79 11.416 -9.041 -17.865 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.047 -8.261 -16.151 1.00 0.00 H new ATOM 0 HG21 THR A 79 10.781 -10.494 -15.911 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.412 -10.877 -16.512 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.213 -9.908 -15.032 1.00 0.00 H new ATOM 1195 N GLN A 80 13.401 -5.840 -17.525 1.00 0.00 N ATOM 1196 CA GLN A 80 13.746 -4.631 -18.272 1.00 0.00 C ATOM 1197 C GLN A 80 14.987 -3.988 -17.639 1.00 0.00 C ATOM 1198 O GLN A 80 14.974 -2.868 -17.124 1.00 0.00 O ATOM 1199 CB GLN A 80 12.535 -3.693 -18.461 1.00 0.00 C ATOM 1200 CG GLN A 80 11.766 -3.291 -17.186 1.00 0.00 C ATOM 1201 CD GLN A 80 10.616 -2.287 -17.419 1.00 0.00 C ATOM 1202 OE1 GLN A 80 10.157 -2.088 -18.535 1.00 0.00 O ATOM 1203 NE2 GLN A 80 10.101 -1.630 -16.383 1.00 0.00 N ATOM 0 H GLN A 80 13.259 -5.652 -16.533 1.00 0.00 H new ATOM 0 HA GLN A 80 14.017 -4.887 -19.296 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.882 -2.783 -18.950 1.00 0.00 H new ATOM 0 HB3 GLN A 80 11.835 -4.174 -19.143 1.00 0.00 H new ATOM 0 HG2 GLN A 80 11.358 -4.190 -16.725 1.00 0.00 H new ATOM 0 HG3 GLN A 80 12.469 -2.859 -16.474 1.00 0.00 H new ATOM 0 HE21 GLN A 80 10.472 -1.784 -15.446 1.00 0.00 H new ATOM 0 HE22 GLN A 80 9.335 -0.972 -16.526 1.00 0.00 H new ATOM 1212 N ALA A 81 16.075 -4.763 -17.653 1.00 0.00 N ATOM 1213 CA ALA A 81 17.398 -4.415 -17.137 1.00 0.00 C ATOM 1214 C ALA A 81 18.118 -3.373 -18.012 1.00 0.00 C ATOM 1215 O ALA A 81 19.198 -3.643 -18.537 1.00 0.00 O ATOM 1216 CB ALA A 81 18.217 -5.703 -16.971 1.00 0.00 C ATOM 0 H ALA A 81 16.053 -5.703 -18.048 1.00 0.00 H new ATOM 0 HA ALA A 81 17.283 -3.937 -16.164 1.00 0.00 H new ATOM 0 HB1 ALA A 81 19.207 -5.458 -16.586 1.00 0.00 H new ATOM 0 HB2 ALA A 81 17.711 -6.368 -16.272 1.00 0.00 H new ATOM 0 HB3 ALA A 81 18.316 -6.199 -17.937 1.00 0.00 H new ATOM 1222 N ALA A 82 17.483 -2.213 -18.193 1.00 0.00 N ATOM 1223 CA ALA A 82 17.883 -1.137 -19.096 1.00 0.00 C ATOM 1224 C ALA A 82 18.376 -1.644 -20.475 1.00 0.00 C ATOM 1225 O ALA A 82 19.504 -1.358 -20.872 1.00 0.00 O ATOM 1226 CB ALA A 82 18.874 -0.207 -18.379 1.00 0.00 C ATOM 0 H ALA A 82 16.628 -1.989 -17.684 1.00 0.00 H new ATOM 0 HA ALA A 82 17.000 -0.549 -19.346 1.00 0.00 H new ATOM 0 HB1 ALA A 82 19.172 0.596 -19.053 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.399 0.219 -17.495 1.00 0.00 H new ATOM 0 HB3 ALA A 82 19.755 -0.775 -18.079 1.00 0.00 H new ATOM 1232 N PRO A 83 17.539 -2.376 -21.242 1.00 0.00 N ATOM 1233 CA PRO A 83 17.843 -2.722 -22.632 1.00 0.00 C ATOM 1234 C PRO A 83 17.813 -1.494 -23.561 1.00 0.00 C ATOM 1235 O PRO A 83 18.318 -1.544 -24.683 1.00 0.00 O ATOM 1236 CB PRO A 83 16.765 -3.732 -23.036 1.00 0.00 C ATOM 1237 CG PRO A 83 15.558 -3.319 -22.189 1.00 0.00 C ATOM 1238 CD PRO A 83 16.192 -2.802 -20.895 1.00 0.00 C ATOM 0 HA PRO A 83 18.851 -3.127 -22.721 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.545 -3.680 -24.102 1.00 0.00 H new ATOM 0 HB3 PRO A 83 17.074 -4.756 -22.824 1.00 0.00 H new ATOM 0 HG2 PRO A 83 14.966 -2.548 -22.682 1.00 0.00 H new ATOM 0 HG3 PRO A 83 14.892 -4.161 -22.001 1.00 0.00 H new ATOM 0 HD2 PRO A 83 15.616 -1.973 -20.484 1.00 0.00 H new ATOM 0 HD3 PRO A 83 16.215 -3.582 -20.134 1.00 0.00 H new ATOM 1246 N GLU A 84 17.207 -0.407 -23.082 1.00 0.00 N ATOM 1247 CA GLU A 84 17.088 0.897 -23.711 1.00 0.00 C ATOM 1248 C GLU A 84 17.392 1.948 -22.624 1.00 0.00 C ATOM 1249 O GLU A 84 17.813 1.617 -21.513 1.00 0.00 O ATOM 1250 CB GLU A 84 15.665 1.076 -24.273 1.00 0.00 C ATOM 1251 CG GLU A 84 15.272 0.051 -25.347 1.00 0.00 C ATOM 1252 CD GLU A 84 13.867 0.321 -25.903 1.00 0.00 C ATOM 1253 OE1 GLU A 84 12.874 0.026 -25.190 1.00 0.00 O ATOM 1254 OE2 GLU A 84 13.771 0.779 -27.062 1.00 0.00 O ATOM 0 H GLU A 84 16.752 -0.424 -22.169 1.00 0.00 H new ATOM 0 HA GLU A 84 17.783 1.005 -24.544 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.952 1.013 -23.451 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.578 2.077 -24.695 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.997 0.080 -26.160 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.309 -0.952 -24.923 1.00 0.00 H new ATOM 1261 N LYS A 85 17.218 3.245 -22.917 1.00 0.00 N ATOM 1262 CA LYS A 85 17.193 4.281 -21.874 1.00 0.00 C ATOM 1263 C LYS A 85 16.163 3.925 -20.784 1.00 0.00 C ATOM 1264 O LYS A 85 15.232 3.175 -21.025 1.00 0.00 O ATOM 1265 CB LYS A 85 16.887 5.658 -22.492 1.00 0.00 C ATOM 1266 CG LYS A 85 18.091 6.339 -23.171 1.00 0.00 C ATOM 1267 CD LYS A 85 18.597 5.619 -24.432 1.00 0.00 C ATOM 1268 CE LYS A 85 19.619 6.452 -25.224 1.00 0.00 C ATOM 1269 NZ LYS A 85 20.901 6.632 -24.503 1.00 0.00 N ATOM 0 H LYS A 85 17.093 3.601 -23.865 1.00 0.00 H new ATOM 0 HA LYS A 85 18.177 4.329 -21.407 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.090 5.543 -23.226 1.00 0.00 H new ATOM 0 HB3 LYS A 85 16.508 6.316 -21.710 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.814 7.360 -23.436 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.908 6.406 -22.453 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.052 4.671 -24.146 1.00 0.00 H new ATOM 0 HD3 LYS A 85 17.749 5.384 -25.076 1.00 0.00 H new ATOM 0 HE2 LYS A 85 19.812 5.967 -26.181 1.00 0.00 H new ATOM 0 HE3 LYS A 85 19.191 7.430 -25.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 21.549 7.200 -25.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 20.727 7.120 -23.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 21.328 5.702 -24.317 1.00 0.00 H new ATOM 1283 N LYS A 86 16.312 4.521 -19.591 1.00 0.00 N ATOM 1284 CA LYS A 86 15.358 4.346 -18.492 1.00 0.00 C ATOM 1285 C LYS A 86 13.928 4.634 -18.951 1.00 0.00 C ATOM 1286 O LYS A 86 13.723 5.460 -19.844 1.00 0.00 O ATOM 1287 CB LYS A 86 15.794 5.149 -17.249 1.00 0.00 C ATOM 1288 CG LYS A 86 15.763 6.685 -17.390 1.00 0.00 C ATOM 1289 CD LYS A 86 14.407 7.309 -17.015 1.00 0.00 C ATOM 1290 CE LYS A 86 14.413 8.842 -17.106 1.00 0.00 C ATOM 1291 NZ LYS A 86 14.527 9.324 -18.498 1.00 0.00 N ATOM 0 H LYS A 86 17.095 5.135 -19.364 1.00 0.00 H new ATOM 0 HA LYS A 86 15.360 3.300 -18.184 1.00 0.00 H new ATOM 0 HB2 LYS A 86 15.151 4.868 -16.415 1.00 0.00 H new ATOM 0 HB3 LYS A 86 16.808 4.849 -16.985 1.00 0.00 H new ATOM 0 HG2 LYS A 86 16.539 7.116 -16.758 1.00 0.00 H new ATOM 0 HG3 LYS A 86 16.005 6.952 -18.419 1.00 0.00 H new ATOM 0 HD2 LYS A 86 13.635 6.913 -17.675 1.00 0.00 H new ATOM 0 HD3 LYS A 86 14.143 7.011 -16.000 1.00 0.00 H new ATOM 0 HE2 LYS A 86 13.497 9.233 -16.663 1.00 0.00 H new ATOM 0 HE3 LYS A 86 15.244 9.235 -16.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 14.544 10.364 -18.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 15.405 8.961 -18.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 13.712 8.987 -19.050 1.00 0.00 H new ATOM 1305 N GLU A 87 12.963 4.037 -18.260 1.00 0.00 N ATOM 1306 CA GLU A 87 11.559 4.065 -18.650 1.00 0.00 C ATOM 1307 C GLU A 87 10.955 5.420 -18.271 1.00 0.00 C ATOM 1308 O GLU A 87 10.393 5.576 -17.195 1.00 0.00 O ATOM 1309 CB GLU A 87 10.795 2.888 -18.017 1.00 0.00 C ATOM 1310 CG GLU A 87 11.414 1.503 -18.281 1.00 0.00 C ATOM 1311 CD GLU A 87 11.687 1.181 -19.759 1.00 0.00 C ATOM 1312 OE1 GLU A 87 10.862 1.565 -20.621 1.00 0.00 O ATOM 1313 OE2 GLU A 87 12.700 0.502 -20.023 1.00 0.00 O ATOM 0 H GLU A 87 13.137 3.513 -17.402 1.00 0.00 H new ATOM 0 HA GLU A 87 11.474 3.947 -19.730 1.00 0.00 H new ATOM 0 HB2 GLU A 87 10.738 3.046 -16.940 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.772 2.892 -18.394 1.00 0.00 H new ATOM 0 HG2 GLU A 87 12.352 1.431 -17.730 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.747 0.741 -17.877 1.00 0.00 H new ATOM 1320 N SER A 88 11.157 6.442 -19.105 1.00 0.00 N ATOM 1321 CA SER A 88 10.605 7.786 -18.915 1.00 0.00 C ATOM 1322 C SER A 88 9.076 7.788 -18.761 1.00 0.00 C ATOM 1323 O SER A 88 8.552 8.662 -18.078 1.00 0.00 O ATOM 1324 CB SER A 88 11.027 8.664 -20.097 1.00 0.00 C ATOM 1325 OG SER A 88 12.443 8.631 -20.289 1.00 0.00 O ATOM 0 H SER A 88 11.721 6.357 -19.950 1.00 0.00 H new ATOM 0 HA SER A 88 11.004 8.185 -17.982 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.527 8.322 -21.003 1.00 0.00 H new ATOM 0 HB3 SER A 88 10.705 9.691 -19.923 1.00 0.00 H new ATOM 0 HG SER A 88 12.683 9.199 -21.051 1.00 0.00 H new ATOM 1331 N LYS A 89 8.397 6.829 -19.394 1.00 0.00 N ATOM 1332 CA LYS A 89 7.005 6.457 -19.158 1.00 0.00 C ATOM 1333 C LYS A 89 6.876 4.930 -19.268 1.00 0.00 C ATOM 1334 O LYS A 89 7.796 4.310 -19.809 1.00 0.00 O ATOM 1335 CB LYS A 89 6.099 7.241 -20.120 1.00 0.00 C ATOM 1336 CG LYS A 89 6.374 7.030 -21.620 1.00 0.00 C ATOM 1337 CD LYS A 89 5.356 7.842 -22.434 1.00 0.00 C ATOM 1338 CE LYS A 89 5.661 7.803 -23.936 1.00 0.00 C ATOM 1339 NZ LYS A 89 4.600 8.473 -24.718 1.00 0.00 N ATOM 0 H LYS A 89 8.829 6.262 -20.124 1.00 0.00 H new ATOM 0 HA LYS A 89 6.678 6.725 -18.153 1.00 0.00 H new ATOM 0 HB2 LYS A 89 5.063 6.968 -19.918 1.00 0.00 H new ATOM 0 HB3 LYS A 89 6.198 8.303 -19.898 1.00 0.00 H new ATOM 0 HG2 LYS A 89 7.389 7.345 -21.865 1.00 0.00 H new ATOM 0 HG3 LYS A 89 6.299 5.972 -21.871 1.00 0.00 H new ATOM 0 HD2 LYS A 89 4.355 7.450 -22.257 1.00 0.00 H new ATOM 0 HD3 LYS A 89 5.359 8.876 -22.090 1.00 0.00 H new ATOM 0 HE2 LYS A 89 6.618 8.288 -24.127 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.758 6.768 -24.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 5.032 9.141 -25.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.053 7.761 -25.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.967 8.989 -24.074 1.00 0.00 H new ATOM 1353 N PRO A 90 5.775 4.308 -18.809 1.00 0.00 N ATOM 1354 CA PRO A 90 5.607 2.861 -18.853 1.00 0.00 C ATOM 1355 C PRO A 90 5.703 2.282 -20.272 1.00 0.00 C ATOM 1356 O PRO A 90 5.475 2.979 -21.264 1.00 0.00 O ATOM 1357 CB PRO A 90 4.225 2.587 -18.250 1.00 0.00 C ATOM 1358 CG PRO A 90 3.945 3.811 -17.380 1.00 0.00 C ATOM 1359 CD PRO A 90 4.647 4.935 -18.139 1.00 0.00 C ATOM 0 HA PRO A 90 6.410 2.376 -18.298 1.00 0.00 H new ATOM 0 HB2 PRO A 90 3.469 2.469 -19.026 1.00 0.00 H new ATOM 0 HB3 PRO A 90 4.223 1.670 -17.660 1.00 0.00 H new ATOM 0 HG2 PRO A 90 2.876 3.998 -17.278 1.00 0.00 H new ATOM 0 HG3 PRO A 90 4.345 3.692 -16.373 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.974 5.402 -18.858 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.981 5.719 -17.459 1.00 0.00 H new ATOM 1367 N ARG A 91 5.898 0.960 -20.365 1.00 0.00 N ATOM 1368 CA ARG A 91 5.841 0.237 -21.643 1.00 0.00 C ATOM 1369 C ARG A 91 4.449 0.271 -22.296 1.00 0.00 C ATOM 1370 O ARG A 91 4.342 0.166 -23.517 1.00 0.00 O ATOM 1371 CB ARG A 91 6.294 -1.221 -21.459 1.00 0.00 C ATOM 1372 CG ARG A 91 7.663 -1.416 -20.779 1.00 0.00 C ATOM 1373 CD ARG A 91 8.829 -0.650 -21.426 1.00 0.00 C ATOM 1374 NE ARG A 91 9.139 -1.118 -22.790 1.00 0.00 N ATOM 1375 CZ ARG A 91 10.223 -0.734 -23.484 1.00 0.00 C ATOM 1376 NH1 ARG A 91 11.077 0.159 -23.009 1.00 0.00 N ATOM 1377 NH2 ARG A 91 10.461 -1.254 -24.686 1.00 0.00 N ATOM 0 H ARG A 91 6.099 0.364 -19.562 1.00 0.00 H new ATOM 0 HA ARG A 91 6.523 0.755 -22.317 1.00 0.00 H new ATOM 0 HB2 ARG A 91 5.540 -1.745 -20.872 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.324 -1.699 -22.438 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.580 -1.108 -19.737 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.903 -2.479 -20.779 1.00 0.00 H new ATOM 0 HD2 ARG A 91 8.585 0.412 -21.459 1.00 0.00 H new ATOM 0 HD3 ARG A 91 9.716 -0.754 -20.801 1.00 0.00 H new ATOM 0 HE ARG A 91 8.492 -1.771 -23.232 1.00 0.00 H new ATOM 0 HH11 ARG A 91 10.921 0.576 -22.091 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.891 0.430 -23.561 1.00 0.00 H new ATOM 0 HH21 ARG A 91 9.820 -1.943 -25.079 1.00 0.00 H new ATOM 0 HH22 ARG A 91 11.284 -0.963 -25.214 1.00 0.00 H new ATOM 1391 N LYS A 92 3.394 0.490 -21.506 1.00 0.00 N ATOM 1392 CA LYS A 92 2.021 0.677 -21.966 1.00 0.00 C ATOM 1393 C LYS A 92 1.472 1.884 -21.210 1.00 0.00 C ATOM 1394 O LYS A 92 0.862 1.701 -20.160 1.00 0.00 O ATOM 1395 CB LYS A 92 1.233 -0.622 -21.721 1.00 0.00 C ATOM 1396 CG LYS A 92 -0.231 -0.572 -22.200 1.00 0.00 C ATOM 1397 CD LYS A 92 -0.885 -1.951 -22.019 1.00 0.00 C ATOM 1398 CE LYS A 92 -2.357 -2.016 -22.449 1.00 0.00 C ATOM 1399 NZ LYS A 92 -3.267 -1.384 -21.467 1.00 0.00 N ATOM 0 H LYS A 92 3.479 0.543 -20.491 1.00 0.00 H new ATOM 0 HA LYS A 92 1.945 0.877 -23.035 1.00 0.00 H new ATOM 0 HB2 LYS A 92 1.741 -1.443 -22.227 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.247 -0.847 -20.655 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.783 0.179 -21.635 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.270 -0.275 -23.248 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.319 -2.686 -22.591 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.812 -2.239 -20.970 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.471 -1.523 -23.414 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.645 -3.058 -22.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -4.254 -1.559 -21.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -3.096 -1.789 -20.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -3.091 -0.359 -21.440 1.00 0.00 H new ATOM 1413 N PRO A 93 1.725 3.120 -21.688 1.00 0.00 N ATOM 1414 CA PRO A 93 1.282 4.346 -21.019 1.00 0.00 C ATOM 1415 C PRO A 93 -0.239 4.390 -20.801 1.00 0.00 C ATOM 1416 O PRO A 93 -0.715 4.833 -19.760 1.00 0.00 O ATOM 1417 CB PRO A 93 1.750 5.505 -21.908 1.00 0.00 C ATOM 1418 CG PRO A 93 2.927 4.917 -22.686 1.00 0.00 C ATOM 1419 CD PRO A 93 2.537 3.447 -22.853 1.00 0.00 C ATOM 0 HA PRO A 93 1.710 4.405 -20.018 1.00 0.00 H new ATOM 0 HB2 PRO A 93 0.957 5.842 -22.576 1.00 0.00 H new ATOM 0 HB3 PRO A 93 2.054 6.367 -21.314 1.00 0.00 H new ATOM 0 HG2 PRO A 93 3.060 5.410 -23.649 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.864 5.025 -22.141 1.00 0.00 H new ATOM 0 HD2 PRO A 93 1.978 3.293 -23.776 1.00 0.00 H new ATOM 0 HD3 PRO A 93 3.421 2.811 -22.905 1.00 0.00 H new ATOM 1427 N LYS A 94 -0.998 3.879 -21.784 1.00 0.00 N ATOM 1428 CA LYS A 94 -2.443 3.678 -21.695 1.00 0.00 C ATOM 1429 C LYS A 94 -2.814 2.422 -22.480 1.00 0.00 C ATOM 1430 O LYS A 94 -3.225 1.413 -21.903 1.00 0.00 O ATOM 1431 CB LYS A 94 -3.133 4.957 -22.206 1.00 0.00 C ATOM 1432 CG LYS A 94 -4.667 4.865 -22.169 1.00 0.00 C ATOM 1433 CD LYS A 94 -5.359 6.205 -22.472 1.00 0.00 C ATOM 1434 CE LYS A 94 -5.104 7.200 -21.338 1.00 0.00 C ATOM 1435 NZ LYS A 94 -5.891 8.443 -21.468 1.00 0.00 N ATOM 0 H LYS A 94 -0.609 3.589 -22.681 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.779 3.514 -20.671 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.810 5.804 -21.601 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.810 5.154 -23.228 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.998 4.120 -22.893 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.981 4.515 -21.185 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.986 6.611 -23.412 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.431 6.049 -22.595 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.341 6.725 -20.386 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.043 7.450 -21.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.726 9.047 -20.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -5.599 8.950 -22.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -6.902 8.209 -21.531 1.00 0.00 H new ATOM 1449 N ALA A 95 -2.583 2.440 -23.788 1.00 0.00 N ATOM 1450 CA ALA A 95 -2.729 1.302 -24.689 1.00 0.00 C ATOM 1451 C ALA A 95 -1.762 1.487 -25.853 1.00 0.00 C ATOM 1452 O ALA A 95 -1.153 2.542 -25.958 1.00 0.00 O ATOM 1453 CB ALA A 95 -4.179 1.214 -25.173 1.00 0.00 C ATOM 0 H ALA A 95 -2.276 3.284 -24.270 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.494 0.368 -24.178 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.287 0.363 -25.846 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.841 1.086 -24.317 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.443 2.130 -25.701 1.00 0.00 H new ATOM 1459 N ALA A 96 -1.576 0.439 -26.663 1.00 0.00 N ATOM 1460 CA ALA A 96 -0.675 0.449 -27.817 1.00 0.00 C ATOM 1461 C ALA A 96 -1.197 1.299 -28.985 1.00 0.00 C ATOM 1462 O ALA A 96 -0.486 1.477 -29.969 1.00 0.00 O ATOM 1463 CB ALA A 96 -0.437 -0.996 -28.275 1.00 0.00 C ATOM 0 H ALA A 96 -2.055 -0.452 -26.532 1.00 0.00 H new ATOM 0 HA ALA A 96 0.260 0.911 -27.501 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.233 -1.000 -29.135 1.00 0.00 H new ATOM 0 HB2 ALA A 96 0.013 -1.566 -27.462 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.388 -1.450 -28.554 1.00 0.00 H new ATOM 1469 N GLN A 97 -2.436 1.778 -28.905 1.00 0.00 N ATOM 1470 CA GLN A 97 -3.046 2.737 -29.818 1.00 0.00 C ATOM 1471 C GLN A 97 -3.731 3.807 -28.961 1.00 0.00 C ATOM 1472 O GLN A 97 -4.060 3.535 -27.803 1.00 0.00 O ATOM 1473 CB GLN A 97 -4.067 2.022 -30.718 1.00 0.00 C ATOM 1474 CG GLN A 97 -3.448 0.977 -31.667 1.00 0.00 C ATOM 1475 CD GLN A 97 -2.484 1.553 -32.710 1.00 0.00 C ATOM 1476 OE1 GLN A 97 -2.529 2.730 -33.045 1.00 0.00 O ATOM 1477 NE2 GLN A 97 -1.609 0.725 -33.263 1.00 0.00 N ATOM 0 H GLN A 97 -3.074 1.492 -28.162 1.00 0.00 H new ATOM 0 HA GLN A 97 -2.299 3.195 -30.466 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -4.809 1.531 -30.088 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.596 2.767 -31.312 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -2.917 0.235 -31.072 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -4.252 0.454 -32.185 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -1.581 -0.253 -32.976 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.964 1.066 -33.976 1.00 0.00 H new ATOM 1486 N VAL A 98 -3.949 5.000 -29.535 1.00 0.00 N ATOM 1487 CA VAL A 98 -4.433 6.209 -28.834 1.00 0.00 C ATOM 1488 C VAL A 98 -3.719 6.421 -27.487 1.00 0.00 C ATOM 1489 O VAL A 98 -4.314 6.830 -26.491 1.00 0.00 O ATOM 1490 CB VAL A 98 -5.986 6.287 -28.804 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -6.554 6.374 -30.236 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -6.696 5.129 -28.091 1.00 0.00 C ATOM 0 H VAL A 98 -3.790 5.160 -30.530 1.00 0.00 H new ATOM 0 HA VAL A 98 -4.145 7.083 -29.418 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.188 7.187 -28.224 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -7.642 6.428 -30.193 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -6.166 7.266 -30.728 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -6.256 5.490 -30.800 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -7.774 5.284 -28.129 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -6.447 4.190 -28.585 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -6.372 5.089 -27.051 1.00 0.00 H new ATOM 1502 N SER A 99 -2.422 6.105 -27.473 1.00 0.00 N ATOM 1503 CA SER A 99 -1.543 6.224 -26.327 1.00 0.00 C ATOM 1504 C SER A 99 -1.518 7.674 -25.837 1.00 0.00 C ATOM 1505 O SER A 99 -1.549 8.608 -26.635 1.00 0.00 O ATOM 1506 CB SER A 99 -0.139 5.741 -26.724 1.00 0.00 C ATOM 1507 OG SER A 99 -0.201 4.603 -27.571 1.00 0.00 O ATOM 0 H SER A 99 -1.944 5.745 -28.299 1.00 0.00 H new ATOM 0 HA SER A 99 -1.907 5.605 -25.507 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.394 6.545 -27.232 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.431 5.498 -25.827 1.00 0.00 H new ATOM 0 HG SER A 99 -0.530 3.833 -27.061 1.00 0.00 H new ATOM 1513 N GLU A 100 -1.387 7.863 -24.525 1.00 0.00 N ATOM 1514 CA GLU A 100 -1.433 9.171 -23.883 1.00 0.00 C ATOM 1515 C GLU A 100 -0.659 9.089 -22.566 1.00 0.00 C ATOM 1516 O GLU A 100 -0.505 7.999 -22.012 1.00 0.00 O ATOM 1517 CB GLU A 100 -2.907 9.552 -23.666 1.00 0.00 C ATOM 1518 CG GLU A 100 -3.093 10.972 -23.114 1.00 0.00 C ATOM 1519 CD GLU A 100 -4.548 11.458 -23.142 1.00 0.00 C ATOM 1520 OE1 GLU A 100 -5.460 10.607 -23.002 1.00 0.00 O ATOM 1521 OE2 GLU A 100 -4.738 12.696 -23.078 1.00 0.00 O ATOM 0 H GLU A 100 -1.243 7.096 -23.868 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.971 9.942 -24.499 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -3.440 9.465 -24.613 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.361 8.840 -22.977 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -2.728 11.004 -22.087 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -2.478 11.661 -23.693 1.00 0.00 H new ATOM 1528 N GLU A 101 -0.173 10.232 -22.080 1.00 0.00 N ATOM 1529 CA GLU A 101 0.737 10.325 -20.937 1.00 0.00 C ATOM 1530 C GLU A 101 0.039 10.020 -19.602 1.00 0.00 C ATOM 1531 O GLU A 101 0.706 9.701 -18.628 1.00 0.00 O ATOM 1532 CB GLU A 101 1.336 11.741 -20.879 1.00 0.00 C ATOM 1533 CG GLU A 101 2.118 12.180 -22.133 1.00 0.00 C ATOM 1534 CD GLU A 101 3.380 11.334 -22.417 1.00 0.00 C ATOM 1535 OE1 GLU A 101 4.403 11.519 -21.731 1.00 0.00 O ATOM 1536 OE2 GLU A 101 3.339 10.467 -23.336 1.00 0.00 O ATOM 0 H GLU A 101 -0.407 11.141 -22.480 1.00 0.00 H new ATOM 0 HA GLU A 101 1.517 9.577 -21.080 1.00 0.00 H new ATOM 0 HB2 GLU A 101 0.528 12.452 -20.708 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.001 11.801 -20.017 1.00 0.00 H new ATOM 0 HG2 GLU A 101 1.456 12.128 -22.998 1.00 0.00 H new ATOM 0 HG3 GLU A 101 2.411 13.224 -22.019 1.00 0.00 H new ATOM 1543 N ALA A 102 -1.295 10.141 -19.535 1.00 0.00 N ATOM 1544 CA ALA A 102 -2.055 10.013 -18.297 1.00 0.00 C ATOM 1545 C ALA A 102 -3.468 9.489 -18.567 1.00 0.00 C ATOM 1546 O ALA A 102 -4.006 9.597 -19.677 1.00 0.00 O ATOM 1547 CB ALA A 102 -2.125 11.383 -17.603 1.00 0.00 C ATOM 0 H ALA A 102 -1.876 10.332 -20.351 1.00 0.00 H new ATOM 0 HA ALA A 102 -1.551 9.295 -17.650 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -2.692 11.293 -16.677 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -1.116 11.729 -17.379 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -2.616 12.100 -18.261 1.00 0.00 H new ATOM 1553 N SER A 103 -4.111 9.019 -17.501 1.00 0.00 N ATOM 1554 CA SER A 103 -5.414 8.356 -17.515 1.00 0.00 C ATOM 1555 C SER A 103 -6.291 8.936 -16.407 1.00 0.00 C ATOM 1556 O SER A 103 -5.826 9.778 -15.644 1.00 0.00 O ATOM 1557 CB SER A 103 -5.214 6.843 -17.344 1.00 0.00 C ATOM 1558 OG SER A 103 -4.356 6.343 -18.354 1.00 0.00 O ATOM 0 H SER A 103 -3.721 9.093 -16.561 1.00 0.00 H new ATOM 0 HA SER A 103 -5.917 8.527 -18.467 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.791 6.634 -16.362 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.177 6.334 -17.391 1.00 0.00 H new ATOM 0 HG SER A 103 -4.235 5.378 -18.233 1.00 0.00 H new ATOM 1564 N THR A 104 -7.560 8.542 -16.354 1.00 0.00 N ATOM 1565 CA THR A 104 -8.542 8.974 -15.355 1.00 0.00 C ATOM 1566 C THR A 104 -8.026 8.732 -13.918 1.00 0.00 C ATOM 1567 O THR A 104 -7.198 7.833 -13.715 1.00 0.00 O ATOM 1568 CB THR A 104 -9.875 8.267 -15.676 1.00 0.00 C ATOM 1569 OG1 THR A 104 -9.666 6.883 -15.862 1.00 0.00 O ATOM 1570 CG2 THR A 104 -10.419 8.721 -17.032 1.00 0.00 C ATOM 0 H THR A 104 -7.951 7.887 -17.031 1.00 0.00 H new ATOM 0 HA THR A 104 -8.707 10.050 -15.402 1.00 0.00 H new ATOM 0 HB THR A 104 -10.546 8.497 -14.848 1.00 0.00 H new ATOM 0 HG1 THR A 104 -9.684 6.430 -14.993 1.00 0.00 H new ATOM 0 HG21 THR A 104 -11.359 8.209 -17.237 1.00 0.00 H new ATOM 0 HG22 THR A 104 -10.588 9.798 -17.014 1.00 0.00 H new ATOM 0 HG23 THR A 104 -9.697 8.480 -17.813 1.00 0.00 H new ATOM 1578 N PRO A 105 -8.461 9.503 -12.897 1.00 0.00 N ATOM 1579 CA PRO A 105 -7.888 9.465 -11.545 1.00 0.00 C ATOM 1580 C PRO A 105 -8.306 8.214 -10.759 1.00 0.00 C ATOM 1581 O PRO A 105 -7.709 7.849 -9.737 1.00 0.00 O ATOM 1582 CB PRO A 105 -8.378 10.736 -10.851 1.00 0.00 C ATOM 1583 CG PRO A 105 -9.732 10.995 -11.514 1.00 0.00 C ATOM 1584 CD PRO A 105 -9.557 10.458 -12.940 1.00 0.00 C ATOM 0 HA PRO A 105 -6.800 9.418 -11.595 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -8.477 10.595 -9.775 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -7.690 11.568 -11.001 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -10.538 10.481 -10.990 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -9.979 12.057 -11.515 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -10.473 9.980 -13.288 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -9.336 11.269 -13.634 1.00 0.00 H new ATOM 1592 N GLN A 106 -9.292 7.494 -11.279 1.00 0.00 N ATOM 1593 CA GLN A 106 -9.703 6.162 -10.879 1.00 0.00 C ATOM 1594 C GLN A 106 -9.835 5.309 -12.148 1.00 0.00 C ATOM 1595 O GLN A 106 -9.767 5.825 -13.252 1.00 0.00 O ATOM 1596 CB GLN A 106 -11.062 6.236 -10.172 1.00 0.00 C ATOM 1597 CG GLN A 106 -11.064 6.936 -8.805 1.00 0.00 C ATOM 1598 CD GLN A 106 -12.455 6.912 -8.164 1.00 0.00 C ATOM 1599 OE1 GLN A 106 -13.407 6.372 -8.739 1.00 0.00 O ATOM 1600 NE2 GLN A 106 -12.619 7.527 -7.005 1.00 0.00 N ATOM 0 H GLN A 106 -9.863 7.854 -12.044 1.00 0.00 H new ATOM 0 HA GLN A 106 -8.972 5.726 -10.198 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -11.763 6.754 -10.826 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -11.438 5.222 -10.041 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -10.349 6.447 -8.144 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -10.734 7.968 -8.923 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -11.823 7.967 -6.544 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -13.542 7.561 -6.572 1.00 0.00 H new ATOM 1609 N GLY A 107 -10.066 4.014 -11.993 1.00 0.00 N ATOM 1610 CA GLY A 107 -10.492 3.093 -13.033 1.00 0.00 C ATOM 1611 C GLY A 107 -11.380 2.035 -12.385 1.00 0.00 C ATOM 1612 O GLY A 107 -11.619 2.079 -11.177 1.00 0.00 O ATOM 0 H GLY A 107 -9.955 3.554 -11.089 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.038 3.624 -13.813 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.628 2.628 -13.508 1.00 0.00 H new ATOM 1616 N PHE A 108 -11.872 1.078 -13.168 1.00 0.00 N ATOM 1617 CA PHE A 108 -12.669 -0.051 -12.680 1.00 0.00 C ATOM 1618 C PHE A 108 -11.774 -1.119 -12.025 1.00 0.00 C ATOM 1619 O PHE A 108 -11.813 -2.292 -12.383 1.00 0.00 O ATOM 1620 CB PHE A 108 -13.580 -0.555 -13.815 1.00 0.00 C ATOM 1621 CG PHE A 108 -14.492 0.534 -14.350 1.00 0.00 C ATOM 1622 CD1 PHE A 108 -15.644 0.896 -13.627 1.00 0.00 C ATOM 1623 CD2 PHE A 108 -14.166 1.224 -15.535 1.00 0.00 C ATOM 1624 CE1 PHE A 108 -16.462 1.946 -14.080 1.00 0.00 C ATOM 1625 CE2 PHE A 108 -14.982 2.278 -15.984 1.00 0.00 C ATOM 1626 CZ PHE A 108 -16.129 2.640 -15.257 1.00 0.00 C ATOM 0 H PHE A 108 -11.727 1.063 -14.178 1.00 0.00 H new ATOM 0 HA PHE A 108 -13.335 0.262 -11.876 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.964 -0.941 -14.627 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -14.185 -1.385 -13.451 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -15.900 0.366 -12.722 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -13.289 0.943 -16.099 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -17.346 2.220 -13.524 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -14.727 2.810 -16.889 1.00 0.00 H new ATOM 0 HZ PHE A 108 -16.754 3.450 -15.602 1.00 0.00 H new ATOM 1636 N ASN A 109 -10.905 -0.666 -11.116 1.00 0.00 N ATOM 1637 CA ASN A 109 -9.866 -1.428 -10.426 1.00 0.00 C ATOM 1638 C ASN A 109 -9.450 -0.742 -9.118 1.00 0.00 C ATOM 1639 O ASN A 109 -9.180 -1.415 -8.131 1.00 0.00 O ATOM 1640 CB ASN A 109 -8.631 -1.521 -11.336 1.00 0.00 C ATOM 1641 CG ASN A 109 -7.423 -2.102 -10.604 1.00 0.00 C ATOM 1642 OD1 ASN A 109 -6.588 -1.356 -10.102 1.00 0.00 O ATOM 1643 ND2 ASN A 109 -7.304 -3.419 -10.584 1.00 0.00 N ATOM 0 H ASN A 109 -10.912 0.311 -10.824 1.00 0.00 H new ATOM 0 HA ASN A 109 -10.262 -2.417 -10.195 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.864 -2.142 -12.201 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.383 -0.529 -11.714 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.494 -3.851 -10.139 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -8.022 -4.003 -11.013 1.00 0.00 H new ATOM 1650 N THR A 110 -9.354 0.587 -9.118 1.00 0.00 N ATOM 1651 CA THR A 110 -8.938 1.365 -7.957 1.00 0.00 C ATOM 1652 C THR A 110 -9.994 1.354 -6.842 1.00 0.00 C ATOM 1653 O THR A 110 -11.160 1.020 -7.060 1.00 0.00 O ATOM 1654 CB THR A 110 -8.620 2.802 -8.410 1.00 0.00 C ATOM 1655 OG1 THR A 110 -9.635 3.319 -9.241 1.00 0.00 O ATOM 1656 CG2 THR A 110 -7.343 2.875 -9.254 1.00 0.00 C ATOM 0 H THR A 110 -9.566 1.159 -9.936 1.00 0.00 H new ATOM 0 HA THR A 110 -8.045 0.907 -7.532 1.00 0.00 H new ATOM 0 HB THR A 110 -8.518 3.369 -7.485 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.018 4.121 -8.829 1.00 0.00 H new ATOM 0 HG21 THR A 110 -7.161 3.908 -9.550 1.00 0.00 H new ATOM 0 HG22 THR A 110 -6.499 2.511 -8.669 1.00 0.00 H new ATOM 0 HG23 THR A 110 -7.460 2.258 -10.145 1.00 0.00 H new ATOM 1664 N LEU A 111 -9.593 1.801 -5.646 1.00 0.00 N ATOM 1665 CA LEU A 111 -10.479 2.081 -4.520 1.00 0.00 C ATOM 1666 C LEU A 111 -9.937 3.326 -3.827 1.00 0.00 C ATOM 1667 O LEU A 111 -8.788 3.327 -3.394 1.00 0.00 O ATOM 1668 CB LEU A 111 -10.521 0.870 -3.573 1.00 0.00 C ATOM 1669 CG LEU A 111 -11.340 1.100 -2.285 1.00 0.00 C ATOM 1670 CD1 LEU A 111 -12.813 1.415 -2.578 1.00 0.00 C ATOM 1671 CD2 LEU A 111 -11.277 -0.147 -1.399 1.00 0.00 C ATOM 0 H LEU A 111 -8.612 1.982 -5.433 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.503 2.259 -4.848 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -10.940 0.019 -4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.501 0.603 -3.298 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.900 1.959 -1.779 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -13.346 1.568 -1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.878 2.318 -3.184 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -13.263 0.582 -3.119 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.857 0.022 -0.492 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.689 -0.999 -1.940 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.240 -0.353 -1.134 1.00 0.00 H new ATOM 1683 N LYS A 112 -10.732 4.394 -3.795 1.00 0.00 N ATOM 1684 CA LYS A 112 -10.406 5.672 -3.162 1.00 0.00 C ATOM 1685 C LYS A 112 -11.681 6.196 -2.505 1.00 0.00 C ATOM 1686 O LYS A 112 -12.767 5.935 -3.030 1.00 0.00 O ATOM 1687 CB LYS A 112 -9.903 6.679 -4.213 1.00 0.00 C ATOM 1688 CG LYS A 112 -8.534 6.308 -4.805 1.00 0.00 C ATOM 1689 CD LYS A 112 -8.027 7.360 -5.804 1.00 0.00 C ATOM 1690 CE LYS A 112 -6.668 6.916 -6.354 1.00 0.00 C ATOM 1691 NZ LYS A 112 -6.153 7.843 -7.385 1.00 0.00 N ATOM 0 H LYS A 112 -11.657 4.393 -4.226 1.00 0.00 H new ATOM 0 HA LYS A 112 -9.616 5.539 -2.422 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -10.633 6.747 -5.019 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -9.838 7.667 -3.757 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.810 6.197 -3.998 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -8.606 5.341 -5.304 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.741 7.480 -6.619 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.936 8.330 -5.315 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.951 6.850 -5.536 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.759 5.916 -6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -5.146 7.646 -7.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.687 7.712 -8.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.263 8.824 -7.056 1.00 0.00 H new ATOM 1705 N ASP A 113 -11.552 6.945 -1.413 1.00 0.00 N ATOM 1706 CA ASP A 113 -12.689 7.563 -0.715 1.00 0.00 C ATOM 1707 C ASP A 113 -13.316 8.687 -1.545 1.00 0.00 C ATOM 1708 O ASP A 113 -14.495 9.003 -1.408 1.00 0.00 O ATOM 1709 CB ASP A 113 -12.227 8.139 0.631 1.00 0.00 C ATOM 1710 CG ASP A 113 -13.381 8.792 1.412 1.00 0.00 C ATOM 1711 OD1 ASP A 113 -14.243 8.035 1.906 1.00 0.00 O ATOM 1712 OD2 ASP A 113 -13.373 10.047 1.566 1.00 0.00 O ATOM 0 H ASP A 113 -10.651 7.145 -0.980 1.00 0.00 H new ATOM 0 HA ASP A 113 -13.438 6.787 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -11.788 7.343 1.233 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -11.444 8.877 0.458 1.00 0.00 H new ATOM 1717 N LYS A 114 -12.534 9.309 -2.432 1.00 0.00 N ATOM 1718 CA LYS A 114 -12.931 10.460 -3.243 1.00 0.00 C ATOM 1719 C LYS A 114 -12.404 10.268 -4.666 1.00 0.00 C ATOM 1720 O LYS A 114 -11.682 9.311 -4.956 1.00 0.00 O ATOM 1721 CB LYS A 114 -12.395 11.765 -2.619 1.00 0.00 C ATOM 1722 CG LYS A 114 -12.644 11.883 -1.106 1.00 0.00 C ATOM 1723 CD LYS A 114 -12.311 13.284 -0.573 1.00 0.00 C ATOM 1724 CE LYS A 114 -12.193 13.326 0.959 1.00 0.00 C ATOM 1725 NZ LYS A 114 -13.381 12.775 1.653 1.00 0.00 N ATOM 0 H LYS A 114 -11.574 9.014 -2.610 1.00 0.00 H new ATOM 0 HA LYS A 114 -14.018 10.535 -3.275 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -11.323 11.832 -2.807 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -12.860 12.613 -3.121 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -13.688 11.653 -0.892 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -12.040 11.143 -0.581 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -11.374 13.622 -1.014 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.084 13.983 -0.893 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -11.310 12.765 1.264 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -12.041 14.357 1.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -13.342 13.028 2.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.245 13.171 1.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.391 11.740 1.556 1.00 0.00 H new ATOM 1739 N LEU A 115 -12.764 11.183 -5.574 1.00 0.00 N ATOM 1740 CA LEU A 115 -12.360 11.128 -6.982 1.00 0.00 C ATOM 1741 C LEU A 115 -10.843 11.055 -7.140 1.00 0.00 C ATOM 1742 O LEU A 115 -10.370 10.311 -7.998 1.00 0.00 O ATOM 1743 CB LEU A 115 -12.949 12.326 -7.743 1.00 0.00 C ATOM 1744 CG LEU A 115 -12.596 12.350 -9.247 1.00 0.00 C ATOM 1745 CD1 LEU A 115 -13.125 11.109 -9.986 1.00 0.00 C ATOM 1746 CD2 LEU A 115 -13.202 13.600 -9.888 1.00 0.00 C ATOM 0 H LEU A 115 -13.348 11.988 -5.349 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.759 10.210 -7.414 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -14.034 12.314 -7.635 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -12.593 13.247 -7.282 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.509 12.356 -9.330 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -12.853 11.170 -11.040 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.687 10.211 -9.549 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -14.210 11.065 -9.893 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -12.955 13.621 -10.949 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -14.285 13.582 -9.768 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -12.798 14.489 -9.404 1.00 0.00 H new ATOM 1758 N GLU A 116 -10.103 11.733 -6.267 1.00 0.00 N ATOM 1759 CA GLU A 116 -8.661 11.603 -6.132 1.00 0.00 C ATOM 1760 C GLU A 116 -8.334 11.687 -4.637 1.00 0.00 C ATOM 1761 O GLU A 116 -9.077 12.302 -3.868 1.00 0.00 O ATOM 1762 CB GLU A 116 -7.983 12.703 -6.967 1.00 0.00 C ATOM 1763 CG GLU A 116 -6.444 12.717 -6.912 1.00 0.00 C ATOM 1764 CD GLU A 116 -5.796 11.388 -7.353 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -5.819 10.416 -6.555 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -5.294 11.267 -8.490 1.00 0.00 O ATOM 0 H GLU A 116 -10.505 12.407 -5.616 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.287 10.651 -6.509 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -8.292 12.590 -8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -8.351 13.672 -6.629 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -6.074 13.520 -7.549 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.128 12.945 -5.894 1.00 0.00 H new ATOM 1773 N GLU A 117 -7.236 11.051 -4.237 1.00 0.00 N ATOM 1774 CA GLU A 117 -6.828 10.842 -2.846 1.00 0.00 C ATOM 1775 C GLU A 117 -5.330 11.141 -2.655 1.00 0.00 C ATOM 1776 O GLU A 117 -4.860 11.279 -1.526 1.00 0.00 O ATOM 1777 CB GLU A 117 -7.199 9.396 -2.463 1.00 0.00 C ATOM 1778 CG GLU A 117 -7.194 9.124 -0.949 1.00 0.00 C ATOM 1779 CD GLU A 117 -7.667 7.701 -0.612 1.00 0.00 C ATOM 1780 OE1 GLU A 117 -8.897 7.469 -0.677 1.00 0.00 O ATOM 1781 OE2 GLU A 117 -6.797 6.837 -0.367 1.00 0.00 O ATOM 0 H GLU A 117 -6.575 10.648 -4.902 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.349 11.533 -2.183 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.189 9.170 -2.858 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -6.500 8.713 -2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -6.187 9.272 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.839 9.847 -0.450 1.00 0.00 H new ATOM 1788 N TRP A 118 -4.566 11.319 -3.741 1.00 0.00 N ATOM 1789 CA TRP A 118 -3.160 11.705 -3.689 1.00 0.00 C ATOM 1790 C TRP A 118 -2.855 12.700 -4.808 1.00 0.00 C ATOM 1791 O TRP A 118 -3.330 12.547 -5.929 1.00 0.00 O ATOM 1792 CB TRP A 118 -2.285 10.452 -3.828 1.00 0.00 C ATOM 1793 CG TRP A 118 -0.811 10.700 -3.843 1.00 0.00 C ATOM 1794 CD1 TRP A 118 -0.018 10.664 -2.754 1.00 0.00 C ATOM 1795 CD2 TRP A 118 0.059 11.038 -4.967 1.00 0.00 C ATOM 1796 NE1 TRP A 118 1.286 10.943 -3.117 1.00 0.00 N ATOM 1797 CE2 TRP A 118 1.389 11.190 -4.472 1.00 0.00 C ATOM 1798 CE3 TRP A 118 -0.141 11.245 -6.351 1.00 0.00 C ATOM 1799 CZ2 TRP A 118 2.463 11.521 -5.309 1.00 0.00 C ATOM 1800 CZ3 TRP A 118 0.926 11.593 -7.196 1.00 0.00 C ATOM 1801 CH2 TRP A 118 2.229 11.724 -6.682 1.00 0.00 C ATOM 0 H TRP A 118 -4.917 11.196 -4.691 1.00 0.00 H new ATOM 0 HA TRP A 118 -2.944 12.183 -2.734 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -2.515 9.776 -3.005 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -2.560 9.938 -4.749 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -0.351 10.450 -1.749 1.00 0.00 H new ATOM 0 HE1 TRP A 118 2.072 10.964 -2.467 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -1.132 11.134 -6.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 3.460 11.619 -4.905 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 0.745 11.761 -8.247 1.00 0.00 H new ATOM 0 HH2 TRP A 118 3.047 11.980 -7.339 1.00 0.00 H new ATOM 1812 N ILE A 119 -2.008 13.686 -4.523 1.00 0.00 N ATOM 1813 CA ILE A 119 -1.412 14.594 -5.496 1.00 0.00 C ATOM 1814 C ILE A 119 -0.104 15.110 -4.895 1.00 0.00 C ATOM 1815 O ILE A 119 -0.050 15.379 -3.700 1.00 0.00 O ATOM 1816 CB ILE A 119 -2.426 15.710 -5.863 1.00 0.00 C ATOM 1817 CG1 ILE A 119 -1.787 16.722 -6.830 1.00 0.00 C ATOM 1818 CG2 ILE A 119 -3.023 16.425 -4.630 1.00 0.00 C ATOM 1819 CD1 ILE A 119 -2.807 17.622 -7.540 1.00 0.00 C ATOM 0 H ILE A 119 -1.707 13.881 -3.568 1.00 0.00 H new ATOM 0 HA ILE A 119 -1.176 14.098 -6.437 1.00 0.00 H new ATOM 0 HB ILE A 119 -3.262 15.218 -6.360 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -1.086 17.347 -6.277 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -1.209 16.181 -7.579 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -3.723 17.193 -4.958 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -3.546 15.700 -4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -2.221 16.887 -4.054 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.285 18.310 -8.205 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.493 17.006 -8.121 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.369 18.191 -6.799 1.00 0.00 H new ATOM 1831 N GLU A 120 0.928 15.233 -5.735 1.00 0.00 N ATOM 1832 CA GLU A 120 2.185 15.908 -5.399 1.00 0.00 C ATOM 1833 C GLU A 120 2.867 16.353 -6.699 1.00 0.00 C ATOM 1834 O GLU A 120 3.258 17.501 -6.866 1.00 0.00 O ATOM 1835 CB GLU A 120 3.087 14.933 -4.622 1.00 0.00 C ATOM 1836 CG GLU A 120 4.348 15.584 -4.038 1.00 0.00 C ATOM 1837 CD GLU A 120 4.043 16.580 -2.907 1.00 0.00 C ATOM 1838 OE1 GLU A 120 3.971 16.130 -1.740 1.00 0.00 O ATOM 1839 OE2 GLU A 120 3.917 17.785 -3.217 1.00 0.00 O ATOM 0 H GLU A 120 0.913 14.860 -6.684 1.00 0.00 H new ATOM 0 HA GLU A 120 1.997 16.783 -4.777 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.511 14.488 -3.811 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.383 14.120 -5.285 1.00 0.00 H new ATOM 0 HG2 GLU A 120 5.010 14.805 -3.660 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.885 16.100 -4.834 1.00 0.00 H new ATOM 1846 N MET A 121 2.933 15.453 -7.683 1.00 0.00 N ATOM 1847 CA MET A 121 3.532 15.680 -8.996 1.00 0.00 C ATOM 1848 C MET A 121 2.924 14.677 -9.976 1.00 0.00 C ATOM 1849 O MET A 121 2.439 13.638 -9.536 1.00 0.00 O ATOM 1850 CB MET A 121 5.064 15.520 -8.920 1.00 0.00 C ATOM 1851 CG MET A 121 5.511 14.133 -8.435 1.00 0.00 C ATOM 1852 SD MET A 121 7.308 13.919 -8.283 1.00 0.00 S ATOM 1853 CE MET A 121 7.341 12.231 -7.621 1.00 0.00 C ATOM 0 H MET A 121 2.556 14.511 -7.581 1.00 0.00 H new ATOM 0 HA MET A 121 3.326 16.695 -9.336 1.00 0.00 H new ATOM 0 HB2 MET A 121 5.490 15.706 -9.906 1.00 0.00 H new ATOM 0 HB3 MET A 121 5.468 16.278 -8.249 1.00 0.00 H new ATOM 0 HG2 MET A 121 5.053 13.938 -7.465 1.00 0.00 H new ATOM 0 HG3 MET A 121 5.127 13.382 -9.125 1.00 0.00 H new ATOM 0 HE1 MET A 121 8.330 12.019 -7.215 1.00 0.00 H new ATOM 0 HE2 MET A 121 6.596 12.135 -6.831 1.00 0.00 H new ATOM 0 HE3 MET A 121 7.117 11.523 -8.419 1.00 0.00 H new ATOM 1863 N SER A 122 2.957 14.999 -11.275 1.00 0.00 N ATOM 1864 CA SER A 122 2.606 14.087 -12.377 1.00 0.00 C ATOM 1865 C SER A 122 1.247 13.400 -12.160 1.00 0.00 C ATOM 1866 O SER A 122 1.074 12.227 -12.461 1.00 0.00 O ATOM 1867 CB SER A 122 3.763 13.099 -12.632 1.00 0.00 C ATOM 1868 OG SER A 122 5.013 13.787 -12.717 1.00 0.00 O ATOM 0 H SER A 122 3.236 15.925 -11.600 1.00 0.00 H new ATOM 0 HA SER A 122 2.474 14.674 -13.286 1.00 0.00 H new ATOM 0 HB2 SER A 122 3.802 12.364 -11.828 1.00 0.00 H new ATOM 0 HB3 SER A 122 3.581 12.551 -13.557 1.00 0.00 H new ATOM 0 HG SER A 122 5.732 13.141 -12.877 1.00 0.00 H new ATOM 1874 N ASN A 123 0.288 14.127 -11.570 1.00 0.00 N ATOM 1875 CA ASN A 123 -1.010 13.573 -11.206 1.00 0.00 C ATOM 1876 C ASN A 123 -1.828 13.168 -12.440 1.00 0.00 C ATOM 1877 O ASN A 123 -1.642 13.695 -13.538 1.00 0.00 O ATOM 1878 CB ASN A 123 -1.775 14.569 -10.320 1.00 0.00 C ATOM 1879 CG ASN A 123 -3.089 13.992 -9.814 1.00 0.00 C ATOM 1880 OD1 ASN A 123 -4.140 14.571 -10.026 1.00 0.00 O ATOM 1881 ND2 ASN A 123 -3.026 12.850 -9.145 1.00 0.00 N ATOM 0 H ASN A 123 0.396 15.114 -11.335 1.00 0.00 H new ATOM 0 HA ASN A 123 -0.843 12.659 -10.636 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -1.152 14.851 -9.471 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -1.973 15.479 -10.886 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -3.879 12.422 -8.785 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -2.124 12.399 -8.990 1.00 0.00 H new ATOM 1888 N ARG A 124 -2.721 12.197 -12.233 1.00 0.00 N ATOM 1889 CA ARG A 124 -3.662 11.672 -13.226 1.00 0.00 C ATOM 1890 C ARG A 124 -4.626 12.762 -13.722 1.00 0.00 C ATOM 1891 O ARG A 124 -4.663 13.871 -13.205 1.00 0.00 O ATOM 1892 CB ARG A 124 -4.379 10.460 -12.597 1.00 0.00 C ATOM 1893 CG ARG A 124 -3.402 9.282 -12.406 1.00 0.00 C ATOM 1894 CD ARG A 124 -3.918 8.174 -11.475 1.00 0.00 C ATOM 1895 NE ARG A 124 -4.977 7.363 -12.097 1.00 0.00 N ATOM 1896 CZ ARG A 124 -5.282 6.090 -11.821 1.00 0.00 C ATOM 1897 NH1 ARG A 124 -4.589 5.392 -10.920 1.00 0.00 N ATOM 1898 NH2 ARG A 124 -6.287 5.496 -12.459 1.00 0.00 N ATOM 0 H ARG A 124 -2.812 11.735 -11.328 1.00 0.00 H new ATOM 0 HA ARG A 124 -3.134 11.342 -14.121 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -4.806 10.744 -11.635 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -5.207 10.151 -13.235 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -3.181 8.847 -13.381 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -2.463 9.666 -12.008 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -3.088 7.527 -11.191 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -4.300 8.623 -10.558 1.00 0.00 H new ATOM 0 HE ARG A 124 -5.538 7.820 -12.815 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -3.810 5.828 -10.427 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -4.838 4.422 -10.724 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -6.823 6.011 -13.157 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -6.521 4.525 -12.250 1.00 0.00 H new ATOM 1912 N LYS A 125 -5.377 12.469 -14.790 1.00 0.00 N ATOM 1913 CA LYS A 125 -6.388 13.381 -15.340 1.00 0.00 C ATOM 1914 C LYS A 125 -7.416 13.751 -14.262 1.00 0.00 C ATOM 1915 O LYS A 125 -7.643 12.965 -13.352 1.00 0.00 O ATOM 1916 CB LYS A 125 -7.127 12.714 -16.512 1.00 0.00 C ATOM 1917 CG LYS A 125 -6.262 12.336 -17.725 1.00 0.00 C ATOM 1918 CD LYS A 125 -5.812 13.548 -18.555 1.00 0.00 C ATOM 1919 CE LYS A 125 -5.284 13.064 -19.912 1.00 0.00 C ATOM 1920 NZ LYS A 125 -4.956 14.177 -20.829 1.00 0.00 N ATOM 0 H LYS A 125 -5.301 11.589 -15.300 1.00 0.00 H new ATOM 0 HA LYS A 125 -5.878 14.279 -15.687 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -7.614 11.812 -16.142 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -7.916 13.387 -16.849 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -5.381 11.795 -17.379 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -6.824 11.655 -18.365 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -6.646 14.234 -18.700 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -5.035 14.099 -18.025 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -4.394 12.455 -19.754 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -6.031 12.422 -20.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -4.968 13.833 -21.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -5.659 14.936 -20.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -4.010 14.546 -20.603 1.00 0.00 H new ATOM 1934 N ASP A 126 -8.113 14.873 -14.460 1.00 0.00 N ATOM 1935 CA ASP A 126 -9.278 15.249 -13.641 1.00 0.00 C ATOM 1936 C ASP A 126 -10.555 14.530 -14.105 1.00 0.00 C ATOM 1937 O ASP A 126 -11.464 14.262 -13.324 1.00 0.00 O ATOM 1938 CB ASP A 126 -9.481 16.768 -13.710 1.00 0.00 C ATOM 1939 CG ASP A 126 -10.702 17.232 -12.900 1.00 0.00 C ATOM 1940 OD1 ASP A 126 -10.604 17.241 -11.653 1.00 0.00 O ATOM 1941 OD2 ASP A 126 -11.693 17.637 -13.551 1.00 0.00 O ATOM 0 H ASP A 126 -7.889 15.549 -15.191 1.00 0.00 H new ATOM 0 HA ASP A 126 -9.082 14.945 -12.613 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -8.588 17.269 -13.336 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -9.603 17.069 -14.751 1.00 0.00 H new ATOM 1946 N LEU A 127 -10.612 14.176 -15.394 1.00 0.00 N ATOM 1947 CA LEU A 127 -11.775 13.580 -16.051 1.00 0.00 C ATOM 1948 C LEU A 127 -12.123 12.242 -15.384 1.00 0.00 C ATOM 1949 O LEU A 127 -11.255 11.379 -15.246 1.00 0.00 O ATOM 1950 CB LEU A 127 -11.455 13.464 -17.558 1.00 0.00 C ATOM 1951 CG LEU A 127 -12.632 13.325 -18.552 1.00 0.00 C ATOM 1952 CD1 LEU A 127 -13.359 11.984 -18.472 1.00 0.00 C ATOM 1953 CD2 LEU A 127 -13.648 14.464 -18.421 1.00 0.00 C ATOM 0 H LEU A 127 -9.822 14.302 -16.027 1.00 0.00 H new ATOM 0 HA LEU A 127 -12.666 14.199 -15.946 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -10.881 14.345 -17.844 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -10.803 12.601 -17.693 1.00 0.00 H new ATOM 0 HG LEU A 127 -12.157 13.381 -19.532 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -14.170 11.966 -19.200 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -12.659 11.177 -18.689 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -13.767 11.851 -17.470 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -14.453 14.318 -19.141 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -14.060 14.470 -17.412 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -13.155 15.416 -18.617 1.00 0.00 H new ATOM 1965 N ILE A 128 -13.385 12.081 -14.975 1.00 0.00 N ATOM 1966 CA ILE A 128 -13.899 10.900 -14.273 1.00 0.00 C ATOM 1967 C ILE A 128 -13.717 9.603 -15.075 1.00 0.00 C ATOM 1968 O ILE A 128 -13.601 9.618 -16.291 1.00 0.00 O ATOM 1969 CB ILE A 128 -15.374 11.137 -13.856 1.00 0.00 C ATOM 1970 CG1 ILE A 128 -16.318 11.270 -15.069 1.00 0.00 C ATOM 1971 CG2 ILE A 128 -15.476 12.374 -12.939 1.00 0.00 C ATOM 1972 CD1 ILE A 128 -17.800 11.386 -14.680 1.00 0.00 C ATOM 0 H ILE A 128 -14.100 12.792 -15.128 1.00 0.00 H new ATOM 0 HA ILE A 128 -13.304 10.760 -13.370 1.00 0.00 H new ATOM 0 HB ILE A 128 -15.701 10.256 -13.304 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -16.032 12.148 -15.648 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -16.187 10.404 -15.718 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -16.516 12.530 -12.653 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -14.874 12.215 -12.045 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -15.110 13.252 -13.471 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -18.407 11.476 -15.581 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -18.102 10.496 -14.127 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -17.944 12.268 -14.055 1.00 0.00 H new ATOM 1984 N LYS A 129 -13.715 8.461 -14.373 1.00 0.00 N ATOM 1985 CA LYS A 129 -13.514 7.151 -14.993 1.00 0.00 C ATOM 1986 C LYS A 129 -14.625 6.704 -15.947 1.00 0.00 C ATOM 1987 O LYS A 129 -14.380 5.757 -16.681 1.00 0.00 O ATOM 1988 CB LYS A 129 -13.235 6.076 -13.925 1.00 0.00 C ATOM 1989 CG LYS A 129 -14.432 5.746 -13.012 1.00 0.00 C ATOM 1990 CD LYS A 129 -14.096 4.563 -12.089 1.00 0.00 C ATOM 1991 CE LYS A 129 -15.242 4.176 -11.142 1.00 0.00 C ATOM 1992 NZ LYS A 129 -15.538 5.221 -10.133 1.00 0.00 N ATOM 0 H LYS A 129 -13.852 8.423 -13.363 1.00 0.00 H new ATOM 0 HA LYS A 129 -12.637 7.272 -15.628 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.914 5.162 -14.425 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -12.403 6.408 -13.304 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -14.692 6.619 -12.414 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -15.304 5.505 -13.619 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -13.834 3.699 -12.700 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -13.216 4.814 -11.497 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -16.140 3.980 -11.728 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.986 3.248 -10.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -16.155 4.826 -9.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -14.650 5.549 -9.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -16.017 6.022 -10.593 1.00 0.00 H new ATOM 2006 N LYS A 130 -15.835 7.261 -15.818 1.00 0.00 N ATOM 2007 CA LYS A 130 -16.979 6.885 -16.644 1.00 0.00 C ATOM 2008 C LYS A 130 -16.641 7.023 -18.129 1.00 0.00 C ATOM 2009 O LYS A 130 -16.136 8.108 -18.483 1.00 0.00 O ATOM 2010 CB LYS A 130 -18.226 7.709 -16.287 1.00 0.00 C ATOM 2011 CG LYS A 130 -18.702 7.481 -14.844 1.00 0.00 C ATOM 2012 CD LYS A 130 -20.060 8.153 -14.594 1.00 0.00 C ATOM 2013 CE LYS A 130 -20.493 7.951 -13.137 1.00 0.00 C ATOM 2014 NZ LYS A 130 -21.809 8.570 -12.852 1.00 0.00 N ATOM 2015 OXT LYS A 130 -16.989 6.077 -18.865 1.00 0.00 O ATOM 0 H LYS A 130 -16.045 7.988 -15.134 1.00 0.00 H new ATOM 0 HA LYS A 130 -17.207 5.839 -16.439 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -18.008 8.768 -16.429 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -19.032 7.454 -16.975 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -18.781 6.411 -14.649 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -17.963 7.878 -14.148 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -19.993 9.218 -14.816 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -20.810 7.734 -15.265 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -20.541 6.884 -12.919 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -19.741 8.379 -12.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -22.060 8.408 -11.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -21.758 9.593 -13.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -22.533 8.144 -13.465 1.00 0.00 H new TER 2029 LYS A 130