USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1120 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 38 ASN : amide:sc= -0.776! K(o=0.019!,f=0.92) USER MOD Set 1.2: A 89 SER OG : rot -163:sc= 0.795 USER MOD Set 2.1: A 33 ASN : amide:sc= -1 K(o=-0.62,f=-3.8!) USER MOD Set 2.2: A 47 ASN : amide:sc= 0.386 K(o=-0.62,f=-5) USER MOD Set 3.1: A 42 THR OG1 : rot 180:sc= 0.499 USER MOD Set 3.2: A 85 GLN : amide:sc= 0.529 X(o=1,f=0.92) USER MOD Set 4.1: A 16 TYR OH : rot -114:sc= 1.2 USER MOD Set 4.2: A 28 THR OG1 : rot -149:sc= 1.16 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 170:sc= 0 (180deg=-0.115) USER MOD Single : A 17 SER OG : rot 180:sc= 0.00365 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.036) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0.0533 K(o=0.053,f=-1.1) USER MOD Single : A 30 SER OG : rot 51:sc= 0.331 USER MOD Single : A 34 MET CE :methyl -178:sc= -0.0311 (180deg=-0.0409) USER MOD Single : A 41 ASN : amide:sc= -0.011 K(o=-0.011,f=-1.3) USER MOD Single : A 43 THR OG1 : rot 176:sc= 0.928 USER MOD Single : A 51 TYR OH : rot 135:sc= 0.674 USER MOD Single : A 52 CYS SG : rot -18:sc= 0.913 USER MOD Single : A 60 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0525) USER MOD Single : A 62 CYS SG : rot 129:sc=-0.00173 USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 155:sc= -0.843 (180deg=-1.82!) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -170:sc= -0.0015 (180deg=-0.105) USER MOD Single : A 75 ASN : amide:sc= 0.103 K(o=0.1,f=-1.2) USER MOD Single : A 79 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0125) USER MOD Single : A 87 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0161) USER MOD Single : A 90 SER OG : rot -60:sc= 0.551 USER MOD Single : A 91 GLN : amide:sc= -0.478 X(o=-0.48,f=-0.1) USER MOD Single : A 94 ASN : amide:sc= -0.165 K(o=-0.17,f=-1.9) USER MOD Single : A 95 THR OG1 : rot 89:sc= 1.36 USER MOD Single : A 97 MET CE :methyl -117:sc= -2.73 (180deg=-8.4!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -46:sc= -0.126 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 62:sc= 0.0522 USER MOD Single : A 110 CYS SG : rot -20:sc= 0.496 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.388 USER MOD Single : A 118 LYS NZ :NH3+ -170:sc=-0.00186 (180deg=-0.112) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0618) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 10:sc= 1.26 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -0.148 USER MOD Single : A 131 CYS SG : rot 180:sc= -0.345 USER MOD Single : A 134 GLN : amide:sc= 0.0968 K(o=0.097,f=-3.7!) USER MOD Single : A 135 THR OG1 : rot 180:sc=-0.000554 USER MOD Single : A 138 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.874) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 7 -13.664 -9.182 8.026 1.00 0.00 N ATOM 2 CA GLU A 7 -14.717 -8.162 8.229 1.00 0.00 C ATOM 3 C GLU A 7 -15.509 -7.889 6.944 1.00 0.00 C ATOM 4 O GLU A 7 -14.947 -7.855 5.850 1.00 0.00 O ATOM 5 CB GLU A 7 -14.093 -6.846 8.730 1.00 0.00 C ATOM 6 CG GLU A 7 -13.528 -6.969 10.154 1.00 0.00 C ATOM 7 CD GLU A 7 -12.835 -5.672 10.616 1.00 0.00 C ATOM 8 OE1 GLU A 7 -12.011 -5.145 9.844 1.00 0.00 O ATOM 9 OE2 GLU A 7 -13.129 -5.276 11.763 1.00 0.00 O ATOM 0 HA GLU A 7 -15.407 -8.556 8.975 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.296 -6.544 8.051 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.846 -6.059 8.708 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -14.335 -7.214 10.844 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.816 -7.793 10.191 1.00 0.00 H new ATOM 16 N TYR A 8 -16.805 -7.685 7.129 1.00 0.00 N ATOM 17 CA TYR A 8 -17.737 -7.363 6.037 1.00 0.00 C ATOM 18 C TYR A 8 -17.629 -5.929 5.487 1.00 0.00 C ATOM 19 O TYR A 8 -18.111 -4.968 6.089 1.00 0.00 O ATOM 20 CB TYR A 8 -19.177 -7.725 6.414 1.00 0.00 C ATOM 21 CG TYR A 8 -19.496 -9.169 6.028 1.00 0.00 C ATOM 22 CD1 TYR A 8 -19.971 -9.439 4.729 1.00 0.00 C ATOM 23 CD2 TYR A 8 -19.257 -10.221 6.916 1.00 0.00 C ATOM 24 CE1 TYR A 8 -20.179 -10.766 4.322 1.00 0.00 C ATOM 25 CE2 TYR A 8 -19.479 -11.547 6.507 1.00 0.00 C ATOM 26 CZ TYR A 8 -19.918 -11.822 5.206 1.00 0.00 C ATOM 27 OH TYR A 8 -20.072 -13.095 4.777 1.00 0.00 O ATOM 0 H TYR A 8 -17.251 -7.737 8.045 1.00 0.00 H new ATOM 0 HA TYR A 8 -17.425 -7.992 5.203 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -19.321 -7.591 7.486 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -19.869 -7.049 5.912 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -20.175 -8.626 4.048 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -18.902 -10.015 7.915 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -20.541 -10.974 3.326 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -19.310 -12.358 7.200 1.00 0.00 H new ATOM 0 HH TYR A 8 -19.852 -13.714 5.504 1.00 0.00 H new ATOM 37 N VAL A 9 -16.764 -5.831 4.489 1.00 0.00 N ATOM 38 CA VAL A 9 -16.643 -4.652 3.612 1.00 0.00 C ATOM 39 C VAL A 9 -17.501 -4.885 2.345 1.00 0.00 C ATOM 40 O VAL A 9 -17.924 -6.012 2.085 1.00 0.00 O ATOM 41 CB VAL A 9 -15.144 -4.388 3.332 1.00 0.00 C ATOM 42 CG1 VAL A 9 -14.469 -5.435 2.449 1.00 0.00 C ATOM 43 CG2 VAL A 9 -14.893 -2.961 2.827 1.00 0.00 C ATOM 0 H VAL A 9 -16.109 -6.577 4.253 1.00 0.00 H new ATOM 0 HA VAL A 9 -17.029 -3.747 4.082 1.00 0.00 H new ATOM 0 HB VAL A 9 -14.659 -4.487 4.303 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -13.422 -5.170 2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -14.534 -6.412 2.929 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -14.969 -5.472 1.481 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -13.827 -2.822 2.644 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -15.444 -2.801 1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -15.229 -2.245 3.577 1.00 0.00 H new ATOM 53 N GLU A 10 -17.805 -3.803 1.618 1.00 0.00 N ATOM 54 CA GLU A 10 -18.602 -3.821 0.362 1.00 0.00 C ATOM 55 C GLU A 10 -17.973 -4.562 -0.845 1.00 0.00 C ATOM 56 O GLU A 10 -18.161 -4.213 -2.015 1.00 0.00 O ATOM 57 CB GLU A 10 -19.030 -2.389 0.000 1.00 0.00 C ATOM 58 CG GLU A 10 -17.871 -1.427 -0.272 1.00 0.00 C ATOM 59 CD GLU A 10 -18.370 -0.047 -0.722 1.00 0.00 C ATOM 60 OE1 GLU A 10 -18.590 0.792 0.174 1.00 0.00 O ATOM 61 OE2 GLU A 10 -18.512 0.125 -1.952 1.00 0.00 O ATOM 0 H GLU A 10 -17.503 -2.866 1.883 1.00 0.00 H new ATOM 0 HA GLU A 10 -19.475 -4.433 0.586 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -19.668 -2.427 -0.883 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -19.635 -1.988 0.813 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -17.269 -1.319 0.630 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -17.222 -1.847 -1.040 1.00 0.00 H new ATOM 68 N MET A 11 -17.414 -5.729 -0.556 1.00 0.00 N ATOM 69 CA MET A 11 -16.680 -6.572 -1.515 1.00 0.00 C ATOM 70 C MET A 11 -17.619 -7.657 -2.078 1.00 0.00 C ATOM 71 O MET A 11 -17.465 -8.864 -1.859 1.00 0.00 O ATOM 72 CB MET A 11 -15.473 -7.142 -0.752 1.00 0.00 C ATOM 73 CG MET A 11 -14.439 -7.851 -1.631 1.00 0.00 C ATOM 74 SD MET A 11 -12.990 -8.460 -0.700 1.00 0.00 S ATOM 75 CE MET A 11 -13.710 -9.775 0.251 1.00 0.00 C ATOM 0 H MET A 11 -17.455 -6.136 0.379 1.00 0.00 H new ATOM 0 HA MET A 11 -16.323 -6.016 -2.382 1.00 0.00 H new ATOM 0 HB2 MET A 11 -14.980 -6.329 -0.219 1.00 0.00 H new ATOM 0 HB3 MET A 11 -15.834 -7.844 -0.000 1.00 0.00 H new ATOM 0 HG2 MET A 11 -14.917 -8.691 -2.135 1.00 0.00 H new ATOM 0 HG3 MET A 11 -14.101 -7.164 -2.407 1.00 0.00 H new ATOM 0 HE1 MET A 11 -12.920 -10.352 0.731 1.00 0.00 H new ATOM 0 HE2 MET A 11 -14.367 -9.355 1.013 1.00 0.00 H new ATOM 0 HE3 MET A 11 -14.286 -10.426 -0.406 1.00 0.00 H new ATOM 85 N LEU A 12 -18.572 -7.190 -2.885 1.00 0.00 N ATOM 86 CA LEU A 12 -19.590 -8.033 -3.532 1.00 0.00 C ATOM 87 C LEU A 12 -19.077 -8.991 -4.637 1.00 0.00 C ATOM 88 O LEU A 12 -19.848 -9.764 -5.196 1.00 0.00 O ATOM 89 CB LEU A 12 -20.812 -7.228 -4.016 1.00 0.00 C ATOM 90 CG LEU A 12 -20.502 -6.043 -4.943 1.00 0.00 C ATOM 91 CD1 LEU A 12 -21.587 -5.944 -6.018 1.00 0.00 C ATOM 92 CD2 LEU A 12 -20.519 -4.736 -4.141 1.00 0.00 C ATOM 0 H LEU A 12 -18.664 -6.200 -3.114 1.00 0.00 H new ATOM 0 HA LEU A 12 -19.907 -8.690 -2.722 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -21.488 -7.906 -4.537 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -21.346 -6.853 -3.143 1.00 0.00 H new ATOM 0 HG LEU A 12 -19.522 -6.198 -5.394 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.370 -5.104 -6.678 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -21.608 -6.866 -6.599 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -22.556 -5.792 -5.544 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -20.298 -3.899 -4.804 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -21.504 -4.596 -3.695 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -19.767 -4.783 -3.353 1.00 0.00 H new ATOM 104 N ASP A 13 -17.811 -8.809 -5.015 1.00 0.00 N ATOM 105 CA ASP A 13 -17.022 -9.649 -5.951 1.00 0.00 C ATOM 106 C ASP A 13 -17.460 -9.633 -7.438 1.00 0.00 C ATOM 107 O ASP A 13 -16.677 -10.028 -8.307 1.00 0.00 O ATOM 108 CB ASP A 13 -16.873 -11.085 -5.425 1.00 0.00 C ATOM 109 CG ASP A 13 -15.667 -11.834 -6.011 1.00 0.00 C ATOM 110 OD1 ASP A 13 -14.652 -11.167 -6.291 1.00 0.00 O ATOM 111 OD2 ASP A 13 -15.762 -13.073 -6.109 1.00 0.00 O ATOM 0 H ASP A 13 -17.264 -8.025 -4.660 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.047 -9.162 -5.969 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.780 -11.057 -4.339 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -17.782 -11.642 -5.653 1.00 0.00 H new ATOM 116 N ARG A 14 -18.708 -9.267 -7.693 1.00 0.00 N ATOM 117 CA ARG A 14 -19.275 -8.992 -9.028 1.00 0.00 C ATOM 118 C ARG A 14 -18.314 -8.099 -9.831 1.00 0.00 C ATOM 119 O ARG A 14 -18.012 -6.985 -9.411 1.00 0.00 O ATOM 120 CB ARG A 14 -20.609 -8.269 -8.834 1.00 0.00 C ATOM 121 CG ARG A 14 -21.419 -8.095 -10.126 1.00 0.00 C ATOM 122 CD ARG A 14 -22.293 -9.318 -10.439 1.00 0.00 C ATOM 123 NE ARG A 14 -23.413 -9.363 -9.476 1.00 0.00 N ATOM 124 CZ ARG A 14 -24.385 -10.269 -9.419 1.00 0.00 C ATOM 125 NH1 ARG A 14 -24.482 -11.280 -10.275 1.00 0.00 N ATOM 126 NH2 ARG A 14 -25.317 -10.167 -8.480 1.00 0.00 N ATOM 0 H ARG A 14 -19.394 -9.145 -6.948 1.00 0.00 H new ATOM 0 HA ARG A 14 -19.422 -9.923 -9.575 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -21.209 -8.824 -8.113 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -20.419 -7.287 -8.402 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -22.052 -7.212 -10.038 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -20.737 -7.917 -10.958 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -22.674 -9.258 -11.458 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -21.702 -10.231 -10.373 1.00 0.00 H new ATOM 0 HE ARG A 14 -23.444 -8.618 -8.779 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -23.792 -11.387 -11.018 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -25.247 -11.949 -10.189 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -25.284 -9.399 -7.810 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -26.066 -10.857 -8.428 1.00 0.00 H new ATOM 140 N LEU A 15 -17.762 -8.688 -10.896 1.00 0.00 N ATOM 141 CA LEU A 15 -16.786 -8.050 -11.804 1.00 0.00 C ATOM 142 C LEU A 15 -15.410 -7.734 -11.188 1.00 0.00 C ATOM 143 O LEU A 15 -14.709 -6.807 -11.602 1.00 0.00 O ATOM 144 CB LEU A 15 -17.416 -6.795 -12.444 1.00 0.00 C ATOM 145 CG LEU A 15 -18.033 -6.948 -13.840 1.00 0.00 C ATOM 146 CD1 LEU A 15 -16.923 -7.133 -14.878 1.00 0.00 C ATOM 147 CD2 LEU A 15 -19.083 -8.067 -13.919 1.00 0.00 C ATOM 0 H LEU A 15 -17.983 -9.647 -11.163 1.00 0.00 H new ATOM 0 HA LEU A 15 -16.563 -8.796 -12.567 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -18.191 -6.427 -11.772 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -16.648 -6.023 -12.498 1.00 0.00 H new ATOM 0 HG LEU A 15 -18.577 -6.030 -14.061 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -17.365 -7.241 -15.868 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -16.266 -6.263 -14.867 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -16.346 -8.026 -14.639 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -19.480 -8.122 -14.933 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -18.621 -9.019 -13.658 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -19.894 -7.855 -13.223 1.00 0.00 H new ATOM 159 N TYR A 16 -15.028 -8.532 -10.184 1.00 0.00 N ATOM 160 CA TYR A 16 -13.691 -8.464 -9.560 1.00 0.00 C ATOM 161 C TYR A 16 -12.845 -9.661 -10.048 1.00 0.00 C ATOM 162 O TYR A 16 -11.970 -9.524 -10.902 1.00 0.00 O ATOM 163 CB TYR A 16 -13.767 -8.486 -8.025 1.00 0.00 C ATOM 164 CG TYR A 16 -14.534 -7.398 -7.257 1.00 0.00 C ATOM 165 CD1 TYR A 16 -15.541 -6.630 -7.850 1.00 0.00 C ATOM 166 CD2 TYR A 16 -14.381 -7.379 -5.858 1.00 0.00 C ATOM 167 CE1 TYR A 16 -16.447 -5.918 -7.051 1.00 0.00 C ATOM 168 CE2 TYR A 16 -15.275 -6.637 -5.065 1.00 0.00 C ATOM 169 CZ TYR A 16 -16.317 -5.926 -5.663 1.00 0.00 C ATOM 170 OH TYR A 16 -17.254 -5.320 -4.887 1.00 0.00 O ATOM 0 H TYR A 16 -15.634 -9.245 -9.777 1.00 0.00 H new ATOM 0 HA TYR A 16 -13.231 -7.521 -9.854 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -14.201 -9.445 -7.740 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.742 -8.477 -7.654 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -15.621 -6.585 -8.926 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -13.578 -7.933 -5.394 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -17.249 -5.361 -7.513 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -15.155 -6.617 -3.992 1.00 0.00 H new ATOM 0 HH TYR A 16 -16.853 -4.551 -4.431 1.00 0.00 H new ATOM 180 N SER A 17 -13.209 -10.842 -9.552 1.00 0.00 N ATOM 181 CA SER A 17 -12.531 -12.118 -9.864 1.00 0.00 C ATOM 182 C SER A 17 -13.036 -12.748 -11.159 1.00 0.00 C ATOM 183 O SER A 17 -14.176 -12.537 -11.580 1.00 0.00 O ATOM 184 CB SER A 17 -12.738 -13.093 -8.698 1.00 0.00 C ATOM 185 OG SER A 17 -14.134 -13.300 -8.475 1.00 0.00 O ATOM 0 H SER A 17 -13.995 -10.951 -8.911 1.00 0.00 H new ATOM 0 HA SER A 17 -11.471 -11.906 -10.005 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.252 -14.043 -8.917 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.272 -12.697 -7.795 1.00 0.00 H new ATOM 0 HG SER A 17 -14.257 -13.925 -7.730 1.00 0.00 H new ATOM 191 N LYS A 18 -12.115 -13.472 -11.798 1.00 0.00 N ATOM 192 CA LYS A 18 -12.294 -14.323 -13.000 1.00 0.00 C ATOM 193 C LYS A 18 -12.582 -13.549 -14.297 1.00 0.00 C ATOM 194 O LYS A 18 -11.899 -13.761 -15.301 1.00 0.00 O ATOM 195 CB LYS A 18 -13.353 -15.429 -12.788 1.00 0.00 C ATOM 196 CG LYS A 18 -13.148 -16.284 -11.538 1.00 0.00 C ATOM 197 CD LYS A 18 -11.825 -17.054 -11.518 1.00 0.00 C ATOM 198 CE LYS A 18 -11.630 -17.756 -10.173 1.00 0.00 C ATOM 199 NZ LYS A 18 -10.349 -18.480 -10.133 1.00 0.00 N ATOM 0 H LYS A 18 -11.148 -13.487 -11.473 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.319 -14.792 -13.135 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -14.337 -14.964 -12.735 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -13.355 -16.082 -13.661 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -13.195 -15.641 -10.659 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.971 -16.994 -11.458 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.814 -17.789 -12.323 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -10.997 -16.369 -11.700 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -11.661 -17.022 -9.368 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -12.450 -18.453 -10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.243 -18.947 -9.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.331 -19.196 -10.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.567 -17.809 -10.274 1.00 0.00 H new ATOM 213 N LEU A 19 -13.568 -12.659 -14.253 1.00 0.00 N ATOM 214 CA LEU A 19 -13.912 -11.746 -15.361 1.00 0.00 C ATOM 215 C LEU A 19 -13.957 -10.246 -14.955 1.00 0.00 C ATOM 216 O LEU A 19 -15.035 -9.687 -14.774 1.00 0.00 O ATOM 217 CB LEU A 19 -15.173 -12.177 -16.157 1.00 0.00 C ATOM 218 CG LEU A 19 -16.418 -12.793 -15.485 1.00 0.00 C ATOM 219 CD1 LEU A 19 -16.199 -14.270 -15.112 1.00 0.00 C ATOM 220 CD2 LEU A 19 -16.960 -12.013 -14.287 1.00 0.00 C ATOM 0 H LEU A 19 -14.167 -12.542 -13.436 1.00 0.00 H new ATOM 0 HA LEU A 19 -13.072 -11.841 -16.050 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -15.517 -11.294 -16.695 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -14.837 -12.895 -16.905 1.00 0.00 H new ATOM 0 HG LEU A 19 -17.190 -12.728 -16.252 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -17.100 -14.664 -14.642 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.979 -14.844 -16.012 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.363 -14.350 -14.417 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -17.834 -12.525 -13.884 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -16.191 -11.948 -13.517 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -17.242 -11.009 -14.604 1.00 0.00 H new ATOM 232 N PRO A 20 -12.795 -9.575 -14.883 1.00 0.00 N ATOM 233 CA PRO A 20 -12.729 -8.110 -14.659 1.00 0.00 C ATOM 234 C PRO A 20 -13.074 -7.258 -15.895 1.00 0.00 C ATOM 235 O PRO A 20 -12.574 -6.153 -16.088 1.00 0.00 O ATOM 236 CB PRO A 20 -11.303 -7.883 -14.147 1.00 0.00 C ATOM 237 CG PRO A 20 -10.500 -8.965 -14.867 1.00 0.00 C ATOM 238 CD PRO A 20 -11.441 -10.157 -14.870 1.00 0.00 C ATOM 0 HA PRO A 20 -13.488 -7.782 -13.949 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.942 -6.884 -14.390 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -11.242 -7.989 -13.064 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.233 -8.661 -15.879 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.569 -9.189 -14.346 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.275 -10.789 -15.743 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.289 -10.782 -13.990 1.00 0.00 H new ATOM 246 N GLU A 21 -14.013 -7.780 -16.695 1.00 0.00 N ATOM 247 CA GLU A 21 -14.512 -7.221 -17.969 1.00 0.00 C ATOM 248 C GLU A 21 -15.689 -8.064 -18.477 1.00 0.00 C ATOM 249 O GLU A 21 -15.522 -9.236 -18.807 1.00 0.00 O ATOM 250 CB GLU A 21 -13.410 -7.063 -19.046 1.00 0.00 C ATOM 251 CG GLU A 21 -12.735 -8.330 -19.602 1.00 0.00 C ATOM 252 CD GLU A 21 -11.996 -9.152 -18.548 1.00 0.00 C ATOM 253 OE1 GLU A 21 -10.820 -8.824 -18.293 1.00 0.00 O ATOM 254 OE2 GLU A 21 -12.626 -10.088 -18.001 1.00 0.00 O ATOM 0 H GLU A 21 -14.476 -8.658 -16.460 1.00 0.00 H new ATOM 0 HA GLU A 21 -14.858 -6.207 -17.767 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.845 -6.523 -19.887 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.629 -6.428 -18.629 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -13.493 -8.957 -20.072 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -12.031 -8.042 -20.383 1.00 0.00 H new ATOM 261 N LYS A 22 -16.879 -7.511 -18.277 1.00 0.00 N ATOM 262 CA LYS A 22 -18.180 -8.167 -18.593 1.00 0.00 C ATOM 263 C LYS A 22 -19.346 -7.183 -18.387 1.00 0.00 C ATOM 264 O LYS A 22 -20.091 -6.894 -19.320 1.00 0.00 O ATOM 265 CB LYS A 22 -18.389 -9.425 -17.721 1.00 0.00 C ATOM 266 CG LYS A 22 -19.484 -10.360 -18.234 1.00 0.00 C ATOM 267 CD LYS A 22 -19.073 -11.064 -19.541 1.00 0.00 C ATOM 268 CE LYS A 22 -20.170 -11.988 -20.076 1.00 0.00 C ATOM 269 NZ LYS A 22 -21.353 -11.238 -20.532 1.00 0.00 N ATOM 0 H LYS A 22 -16.989 -6.576 -17.884 1.00 0.00 H new ATOM 0 HA LYS A 22 -18.157 -8.471 -19.639 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -17.451 -9.977 -17.666 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -18.636 -9.114 -16.706 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -19.708 -11.108 -17.474 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -20.399 -9.791 -18.400 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -18.834 -10.314 -20.295 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -18.166 -11.643 -19.369 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -19.775 -12.578 -20.903 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -20.465 -12.690 -19.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -22.027 -11.892 -20.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -21.806 -10.776 -19.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -21.062 -10.516 -21.222 1.00 0.00 H new ATOM 283 N GLY A 23 -19.497 -6.733 -17.140 1.00 0.00 N ATOM 284 CA GLY A 23 -20.468 -5.703 -16.725 1.00 0.00 C ATOM 285 C GLY A 23 -19.756 -4.518 -16.063 1.00 0.00 C ATOM 286 O GLY A 23 -18.682 -4.111 -16.506 1.00 0.00 O ATOM 0 H GLY A 23 -18.934 -7.081 -16.364 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -21.030 -5.357 -17.592 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -21.188 -6.135 -16.030 1.00 0.00 H new ATOM 290 N ARG A 24 -20.263 -4.135 -14.899 1.00 0.00 N ATOM 291 CA ARG A 24 -19.779 -2.972 -14.137 1.00 0.00 C ATOM 292 C ARG A 24 -19.072 -3.396 -12.841 1.00 0.00 C ATOM 293 O ARG A 24 -19.497 -4.356 -12.196 1.00 0.00 O ATOM 294 CB ARG A 24 -20.953 -2.037 -13.830 1.00 0.00 C ATOM 295 CG ARG A 24 -20.669 -0.594 -14.259 1.00 0.00 C ATOM 296 CD ARG A 24 -20.645 -0.454 -15.784 1.00 0.00 C ATOM 297 NE ARG A 24 -20.285 0.919 -16.199 1.00 0.00 N ATOM 298 CZ ARG A 24 -21.032 2.021 -16.087 1.00 0.00 C ATOM 299 NH1 ARG A 24 -22.297 2.000 -15.683 1.00 0.00 N ATOM 300 NH2 ARG A 24 -20.541 3.187 -16.490 1.00 0.00 N ATOM 0 H ARG A 24 -21.033 -4.625 -14.444 1.00 0.00 H new ATOM 0 HA ARG A 24 -19.045 -2.445 -14.746 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -21.846 -2.397 -14.341 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -21.165 -2.062 -12.761 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -21.431 0.066 -13.844 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -19.712 -0.273 -13.848 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -19.929 -1.161 -16.204 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -21.623 -0.712 -16.189 1.00 0.00 H new ATOM 0 HE ARG A 24 -19.363 1.038 -16.618 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -22.741 1.114 -15.441 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -22.825 2.870 -15.614 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.600 3.236 -16.881 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -21.104 4.033 -16.408 1.00 0.00 H new ATOM 314 N LYS A 25 -18.174 -2.508 -12.400 1.00 0.00 N ATOM 315 CA LYS A 25 -17.188 -2.685 -11.310 1.00 0.00 C ATOM 316 C LYS A 25 -15.964 -3.526 -11.719 1.00 0.00 C ATOM 317 O LYS A 25 -15.928 -4.071 -12.816 1.00 0.00 O ATOM 318 CB LYS A 25 -17.776 -3.219 -9.992 1.00 0.00 C ATOM 319 CG LYS A 25 -18.693 -2.183 -9.318 1.00 0.00 C ATOM 320 CD LYS A 25 -19.388 -2.724 -8.060 1.00 0.00 C ATOM 321 CE LYS A 25 -18.438 -2.956 -6.874 1.00 0.00 C ATOM 322 NZ LYS A 25 -17.902 -1.720 -6.291 1.00 0.00 N ATOM 0 H LYS A 25 -18.106 -1.581 -12.819 1.00 0.00 H new ATOM 0 HA LYS A 25 -16.854 -1.665 -11.118 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -18.340 -4.131 -10.188 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -16.966 -3.484 -9.313 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -18.105 -1.304 -9.052 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -19.449 -1.856 -10.032 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -20.167 -2.024 -7.757 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -19.883 -3.664 -8.306 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -18.968 -3.511 -6.100 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -17.608 -3.581 -7.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -17.271 -1.955 -5.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.368 -1.198 -7.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -18.686 -1.130 -5.946 1.00 0.00 H new ATOM 336 N GLU A 26 -14.869 -3.226 -11.024 1.00 0.00 N ATOM 337 CA GLU A 26 -13.574 -3.933 -11.189 1.00 0.00 C ATOM 338 C GLU A 26 -13.031 -4.598 -9.920 1.00 0.00 C ATOM 339 O GLU A 26 -12.329 -5.604 -9.992 1.00 0.00 O ATOM 340 CB GLU A 26 -12.520 -2.990 -11.771 1.00 0.00 C ATOM 341 CG GLU A 26 -12.770 -2.685 -13.257 1.00 0.00 C ATOM 342 CD GLU A 26 -11.841 -1.575 -13.784 1.00 0.00 C ATOM 343 OE1 GLU A 26 -11.760 -0.523 -13.111 1.00 0.00 O ATOM 344 OE2 GLU A 26 -11.323 -1.757 -14.901 1.00 0.00 O ATOM 0 H GLU A 26 -14.841 -2.484 -10.324 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.786 -4.748 -11.881 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.517 -2.058 -11.206 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.532 -3.436 -11.655 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.620 -3.592 -13.843 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -13.809 -2.384 -13.395 1.00 0.00 H new ATOM 351 N GLY A 27 -13.232 -3.932 -8.780 1.00 0.00 N ATOM 352 CA GLY A 27 -12.805 -4.431 -7.461 1.00 0.00 C ATOM 353 C GLY A 27 -13.126 -3.447 -6.320 1.00 0.00 C ATOM 354 O GLY A 27 -13.273 -2.250 -6.545 1.00 0.00 O ATOM 0 H GLY A 27 -13.698 -3.026 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.295 -5.384 -7.262 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.732 -4.622 -7.479 1.00 0.00 H new ATOM 358 N THR A 28 -13.272 -4.026 -5.139 1.00 0.00 N ATOM 359 CA THR A 28 -13.405 -3.287 -3.869 1.00 0.00 C ATOM 360 C THR A 28 -12.134 -3.562 -3.053 1.00 0.00 C ATOM 361 O THR A 28 -11.747 -4.708 -2.849 1.00 0.00 O ATOM 362 CB THR A 28 -14.681 -3.687 -3.107 1.00 0.00 C ATOM 363 OG1 THR A 28 -15.808 -3.319 -3.895 1.00 0.00 O ATOM 364 CG2 THR A 28 -14.802 -3.039 -1.718 1.00 0.00 C ATOM 0 H THR A 28 -13.303 -5.039 -5.021 1.00 0.00 H new ATOM 0 HA THR A 28 -13.506 -2.218 -4.058 1.00 0.00 H new ATOM 0 HB THR A 28 -14.634 -4.763 -2.941 1.00 0.00 H new ATOM 0 HG1 THR A 28 -16.559 -3.094 -3.307 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.726 -3.368 -1.242 1.00 0.00 H new ATOM 0 HG22 THR A 28 -13.952 -3.335 -1.103 1.00 0.00 H new ATOM 0 HG23 THR A 28 -14.814 -1.954 -1.822 1.00 0.00 H new ATOM 372 N GLN A 29 -11.593 -2.468 -2.524 1.00 0.00 N ATOM 373 CA GLN A 29 -10.296 -2.455 -1.826 1.00 0.00 C ATOM 374 C GLN A 29 -10.510 -2.087 -0.344 1.00 0.00 C ATOM 375 O GLN A 29 -11.545 -2.427 0.225 1.00 0.00 O ATOM 376 CB GLN A 29 -9.439 -1.438 -2.605 1.00 0.00 C ATOM 377 CG GLN A 29 -7.937 -1.706 -2.548 1.00 0.00 C ATOM 378 CD GLN A 29 -7.573 -3.075 -3.136 1.00 0.00 C ATOM 379 OE1 GLN A 29 -7.315 -4.030 -2.427 1.00 0.00 O ATOM 380 NE2 GLN A 29 -7.495 -3.153 -4.447 1.00 0.00 N ATOM 0 H GLN A 29 -12.041 -1.553 -2.564 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.793 -3.422 -1.806 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -9.756 -1.437 -3.648 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -9.633 -0.440 -2.211 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -7.409 -0.925 -3.095 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.599 -1.655 -1.513 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.716 -2.339 -5.020 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.213 -4.028 -4.890 1.00 0.00 H new ATOM 389 N SER A 30 -9.475 -1.537 0.292 1.00 0.00 N ATOM 390 CA SER A 30 -9.524 -0.929 1.650 1.00 0.00 C ATOM 391 C SER A 30 -10.182 -1.777 2.757 1.00 0.00 C ATOM 392 O SER A 30 -11.380 -1.686 3.010 1.00 0.00 O ATOM 393 CB SER A 30 -10.154 0.470 1.580 1.00 0.00 C ATOM 394 OG SER A 30 -11.502 0.404 1.112 1.00 0.00 O ATOM 0 H SER A 30 -8.545 -1.494 -0.124 1.00 0.00 H new ATOM 0 HA SER A 30 -8.481 -0.867 1.961 1.00 0.00 H new ATOM 0 HB2 SER A 30 -10.131 0.933 2.567 1.00 0.00 H new ATOM 0 HB3 SER A 30 -9.566 1.104 0.917 1.00 0.00 H new ATOM 0 HG SER A 30 -11.998 -0.258 1.637 1.00 0.00 H new ATOM 400 N LEU A 31 -9.368 -2.652 3.344 1.00 0.00 N ATOM 401 CA LEU A 31 -9.744 -3.424 4.551 1.00 0.00 C ATOM 402 C LEU A 31 -8.566 -3.868 5.456 1.00 0.00 C ATOM 403 O LEU A 31 -8.241 -3.108 6.361 1.00 0.00 O ATOM 404 CB LEU A 31 -10.729 -4.572 4.225 1.00 0.00 C ATOM 405 CG LEU A 31 -11.290 -5.271 5.472 1.00 0.00 C ATOM 406 CD1 LEU A 31 -12.349 -4.419 6.171 1.00 0.00 C ATOM 407 CD2 LEU A 31 -11.836 -6.656 5.106 1.00 0.00 C ATOM 0 H LEU A 31 -8.427 -2.854 3.005 1.00 0.00 H new ATOM 0 HA LEU A 31 -10.277 -2.707 5.176 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.557 -4.174 3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.222 -5.309 3.602 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.473 -5.402 6.181 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -12.721 -4.948 7.048 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.908 -3.471 6.479 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.174 -4.229 5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -12.230 -7.140 6.000 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -12.632 -6.550 4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -11.034 -7.264 4.688 1.00 0.00 H new ATOM 419 N PRO A 32 -7.821 -4.951 5.150 1.00 0.00 N ATOM 420 CA PRO A 32 -6.995 -5.663 6.150 1.00 0.00 C ATOM 421 C PRO A 32 -5.859 -4.874 6.831 1.00 0.00 C ATOM 422 O PRO A 32 -5.440 -5.263 7.916 1.00 0.00 O ATOM 423 CB PRO A 32 -6.475 -6.902 5.411 1.00 0.00 C ATOM 424 CG PRO A 32 -6.327 -6.405 3.975 1.00 0.00 C ATOM 425 CD PRO A 32 -7.489 -5.434 3.782 1.00 0.00 C ATOM 0 HA PRO A 32 -7.620 -5.886 7.015 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -5.525 -7.247 5.819 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -7.173 -7.736 5.480 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.368 -5.910 3.824 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -6.377 -7.229 3.263 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -7.208 -4.607 3.129 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -8.344 -5.928 3.320 1.00 0.00 H new ATOM 433 N ASN A 33 -5.259 -3.936 6.106 1.00 0.00 N ATOM 434 CA ASN A 33 -4.276 -2.957 6.630 1.00 0.00 C ATOM 435 C ASN A 33 -3.990 -1.850 5.615 1.00 0.00 C ATOM 436 O ASN A 33 -4.125 -2.052 4.411 1.00 0.00 O ATOM 437 CB ASN A 33 -2.945 -3.595 7.063 1.00 0.00 C ATOM 438 CG ASN A 33 -2.257 -4.403 5.967 1.00 0.00 C ATOM 439 OD1 ASN A 33 -1.564 -3.890 5.104 1.00 0.00 O ATOM 440 ND2 ASN A 33 -2.447 -5.709 6.007 1.00 0.00 N ATOM 0 H ASN A 33 -5.439 -3.821 5.109 1.00 0.00 H new ATOM 0 HA ASN A 33 -4.746 -2.534 7.518 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.269 -2.808 7.398 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -3.127 -4.245 7.919 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.010 -6.310 5.308 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -3.030 -6.117 6.737 1.00 0.00 H new ATOM 447 N MET A 34 -3.785 -0.653 6.161 1.00 0.00 N ATOM 448 CA MET A 34 -3.383 0.542 5.392 1.00 0.00 C ATOM 449 C MET A 34 -2.166 1.300 5.951 1.00 0.00 C ATOM 450 O MET A 34 -1.925 2.457 5.615 1.00 0.00 O ATOM 451 CB MET A 34 -4.602 1.459 5.199 1.00 0.00 C ATOM 452 CG MET A 34 -5.169 2.082 6.476 1.00 0.00 C ATOM 453 SD MET A 34 -6.415 3.374 6.111 1.00 0.00 S ATOM 454 CE MET A 34 -6.913 3.779 7.776 1.00 0.00 C ATOM 0 H MET A 34 -3.892 -0.475 7.160 1.00 0.00 H new ATOM 0 HA MET A 34 -3.033 0.185 4.424 1.00 0.00 H new ATOM 0 HB2 MET A 34 -4.325 2.262 4.516 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.392 0.886 4.714 1.00 0.00 H new ATOM 0 HG2 MET A 34 -5.622 1.303 7.089 1.00 0.00 H new ATOM 0 HG3 MET A 34 -4.357 2.515 7.060 1.00 0.00 H new ATOM 0 HE1 MET A 34 -7.701 4.532 7.747 1.00 0.00 H new ATOM 0 HE2 MET A 34 -7.285 2.883 8.272 1.00 0.00 H new ATOM 0 HE3 MET A 34 -6.057 4.170 8.327 1.00 0.00 H new ATOM 464 N ILE A 35 -1.255 0.575 6.592 1.00 0.00 N ATOM 465 CA ILE A 35 -0.119 1.193 7.321 1.00 0.00 C ATOM 466 C ILE A 35 1.262 0.755 6.783 1.00 0.00 C ATOM 467 O ILE A 35 1.438 -0.378 6.338 1.00 0.00 O ATOM 468 CB ILE A 35 -0.299 0.952 8.838 1.00 0.00 C ATOM 469 CG1 ILE A 35 0.657 1.845 9.646 1.00 0.00 C ATOM 470 CG2 ILE A 35 -0.184 -0.532 9.223 1.00 0.00 C ATOM 471 CD1 ILE A 35 0.264 2.034 11.118 1.00 0.00 C ATOM 0 H ILE A 35 -1.269 -0.444 6.630 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.134 2.268 7.143 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.319 1.239 9.095 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.658 1.415 9.603 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.709 2.824 9.169 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -0.319 -0.640 10.299 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.952 -1.104 8.702 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.800 -0.906 8.941 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.994 2.677 11.610 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.722 2.495 11.175 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.241 1.065 11.616 1.00 0.00 H new ATOM 483 N ILE A 36 2.192 1.717 6.811 1.00 0.00 N ATOM 484 CA ILE A 36 3.623 1.476 6.563 1.00 0.00 C ATOM 485 C ILE A 36 4.368 1.592 7.901 1.00 0.00 C ATOM 486 O ILE A 36 4.078 2.470 8.728 1.00 0.00 O ATOM 487 CB ILE A 36 4.174 2.510 5.549 1.00 0.00 C ATOM 488 CG1 ILE A 36 3.454 2.410 4.207 1.00 0.00 C ATOM 489 CG2 ILE A 36 5.690 2.349 5.333 1.00 0.00 C ATOM 490 CD1 ILE A 36 3.629 3.633 3.294 1.00 0.00 C ATOM 0 H ILE A 36 1.973 2.694 7.008 1.00 0.00 H new ATOM 0 HA ILE A 36 3.767 0.482 6.140 1.00 0.00 H new ATOM 0 HB ILE A 36 3.989 3.495 5.978 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.815 1.526 3.681 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.390 2.260 4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.036 3.093 4.615 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.210 2.490 6.281 1.00 0.00 H new ATOM 0 HG23 ILE A 36 5.899 1.350 4.950 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.084 3.474 2.364 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.241 4.520 3.795 1.00 0.00 H new ATOM 0 HD13 ILE A 36 4.687 3.775 3.074 1.00 0.00 H new ATOM 502 N LEU A 37 5.417 0.786 8.029 1.00 0.00 N ATOM 503 CA LEU A 37 6.326 0.840 9.195 1.00 0.00 C ATOM 504 C LEU A 37 7.663 1.467 8.766 1.00 0.00 C ATOM 505 O LEU A 37 8.212 1.160 7.715 1.00 0.00 O ATOM 506 CB LEU A 37 6.555 -0.555 9.789 1.00 0.00 C ATOM 507 CG LEU A 37 5.338 -1.134 10.543 1.00 0.00 C ATOM 508 CD1 LEU A 37 4.268 -1.711 9.610 1.00 0.00 C ATOM 509 CD2 LEU A 37 5.818 -2.197 11.541 1.00 0.00 C ATOM 0 H LEU A 37 5.670 0.078 7.339 1.00 0.00 H new ATOM 0 HA LEU A 37 5.865 1.453 9.969 1.00 0.00 H new ATOM 0 HB2 LEU A 37 6.828 -1.239 8.985 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.403 -0.511 10.472 1.00 0.00 H new ATOM 0 HG LEU A 37 4.860 -0.310 11.073 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.441 -2.101 10.203 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.902 -0.927 8.948 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.700 -2.516 9.015 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.961 -2.608 12.075 1.00 0.00 H new ATOM 0 HD22 LEU A 37 6.328 -2.997 11.004 1.00 0.00 H new ATOM 0 HD23 LEU A 37 6.506 -1.742 12.254 1.00 0.00 H new ATOM 521 N ASN A 38 8.143 2.369 9.621 1.00 0.00 N ATOM 522 CA ASN A 38 9.382 3.140 9.373 1.00 0.00 C ATOM 523 C ASN A 38 10.520 2.700 10.308 1.00 0.00 C ATOM 524 O ASN A 38 10.427 2.820 11.522 1.00 0.00 O ATOM 525 CB ASN A 38 9.099 4.638 9.555 1.00 0.00 C ATOM 526 CG ASN A 38 10.342 5.540 9.477 1.00 0.00 C ATOM 527 OD1 ASN A 38 10.821 5.947 8.425 1.00 0.00 O ATOM 528 ND2 ASN A 38 10.940 5.794 10.624 1.00 0.00 N ATOM 0 H ASN A 38 7.691 2.593 10.508 1.00 0.00 H new ATOM 0 HA ASN A 38 9.704 2.947 8.350 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.388 4.955 8.792 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.618 4.788 10.521 1.00 0.00 H new ATOM 0 HD21 ASN A 38 11.806 6.332 10.639 1.00 0.00 H new ATOM 0 HD22 ASN A 38 10.536 5.452 11.496 1.00 0.00 H new ATOM 535 N ILE A 39 11.661 2.503 9.655 1.00 0.00 N ATOM 536 CA ILE A 39 12.948 2.225 10.322 1.00 0.00 C ATOM 537 C ILE A 39 14.014 3.248 9.862 1.00 0.00 C ATOM 538 O ILE A 39 14.963 2.944 9.153 1.00 0.00 O ATOM 539 CB ILE A 39 13.305 0.728 10.173 1.00 0.00 C ATOM 540 CG1 ILE A 39 14.532 0.378 11.026 1.00 0.00 C ATOM 541 CG2 ILE A 39 13.433 0.271 8.708 1.00 0.00 C ATOM 542 CD1 ILE A 39 14.670 -1.119 11.344 1.00 0.00 C ATOM 0 H ILE A 39 11.729 2.530 8.638 1.00 0.00 H new ATOM 0 HA ILE A 39 12.887 2.376 11.400 1.00 0.00 H new ATOM 0 HB ILE A 39 12.462 0.155 10.560 1.00 0.00 H new ATOM 0 HG12 ILE A 39 15.430 0.712 10.506 1.00 0.00 H new ATOM 0 HG13 ILE A 39 14.481 0.934 11.962 1.00 0.00 H new ATOM 0 HG21 ILE A 39 13.685 -0.789 8.678 1.00 0.00 H new ATOM 0 HG22 ILE A 39 12.487 0.434 8.192 1.00 0.00 H new ATOM 0 HG23 ILE A 39 14.218 0.844 8.215 1.00 0.00 H new ATOM 0 HD11 ILE A 39 15.561 -1.282 11.950 1.00 0.00 H new ATOM 0 HD12 ILE A 39 13.791 -1.457 11.893 1.00 0.00 H new ATOM 0 HD13 ILE A 39 14.755 -1.682 10.415 1.00 0.00 H new ATOM 554 N GLY A 40 13.643 4.515 10.101 1.00 0.00 N ATOM 555 CA GLY A 40 14.489 5.708 9.889 1.00 0.00 C ATOM 556 C GLY A 40 14.854 5.926 8.408 1.00 0.00 C ATOM 557 O GLY A 40 15.835 5.357 7.925 1.00 0.00 O ATOM 0 H GLY A 40 12.717 4.749 10.459 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.967 6.589 10.263 1.00 0.00 H new ATOM 0 HA3 GLY A 40 15.404 5.607 10.473 1.00 0.00 H new ATOM 561 N ASN A 41 14.014 6.713 7.733 1.00 0.00 N ATOM 562 CA ASN A 41 14.047 7.013 6.277 1.00 0.00 C ATOM 563 C ASN A 41 13.691 5.792 5.393 1.00 0.00 C ATOM 564 O ASN A 41 13.156 5.933 4.296 1.00 0.00 O ATOM 565 CB ASN A 41 15.385 7.608 5.821 1.00 0.00 C ATOM 566 CG ASN A 41 15.735 8.949 6.472 1.00 0.00 C ATOM 567 OD1 ASN A 41 15.495 9.228 7.644 1.00 0.00 O ATOM 568 ND2 ASN A 41 16.381 9.811 5.721 1.00 0.00 N ATOM 0 H ASN A 41 13.245 7.191 8.202 1.00 0.00 H new ATOM 0 HA ASN A 41 13.271 7.766 6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 41 16.179 6.894 6.039 1.00 0.00 H new ATOM 0 HB3 ASN A 41 15.361 7.738 4.739 1.00 0.00 H new ATOM 0 HD21 ASN A 41 16.680 10.705 6.112 1.00 0.00 H new ATOM 0 HD22 ASN A 41 16.584 9.587 4.747 1.00 0.00 H new ATOM 575 N THR A 42 14.176 4.636 5.836 1.00 0.00 N ATOM 576 CA THR A 42 13.826 3.306 5.320 1.00 0.00 C ATOM 577 C THR A 42 12.403 2.962 5.786 1.00 0.00 C ATOM 578 O THR A 42 12.069 3.021 6.970 1.00 0.00 O ATOM 579 CB THR A 42 14.807 2.239 5.846 1.00 0.00 C ATOM 580 OG1 THR A 42 16.132 2.789 5.975 1.00 0.00 O ATOM 581 CG2 THR A 42 14.854 1.038 4.895 1.00 0.00 C ATOM 0 H THR A 42 14.853 4.593 6.597 1.00 0.00 H new ATOM 0 HA THR A 42 13.883 3.317 4.232 1.00 0.00 H new ATOM 0 HB THR A 42 14.454 1.913 6.825 1.00 0.00 H new ATOM 0 HG1 THR A 42 16.741 2.099 6.311 1.00 0.00 H new ATOM 0 HG21 THR A 42 15.551 0.295 5.282 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.860 0.597 4.816 1.00 0.00 H new ATOM 0 HG23 THR A 42 15.184 1.367 3.910 1.00 0.00 H new ATOM 589 N THR A 43 11.620 2.541 4.807 1.00 0.00 N ATOM 590 CA THR A 43 10.174 2.289 4.901 1.00 0.00 C ATOM 591 C THR A 43 9.826 0.878 4.403 1.00 0.00 C ATOM 592 O THR A 43 10.428 0.374 3.458 1.00 0.00 O ATOM 593 CB THR A 43 9.352 3.406 4.192 1.00 0.00 C ATOM 594 OG1 THR A 43 8.163 2.886 3.596 1.00 0.00 O ATOM 595 CG2 THR A 43 10.108 4.273 3.165 1.00 0.00 C ATOM 0 H THR A 43 11.985 2.353 3.873 1.00 0.00 H new ATOM 0 HA THR A 43 9.889 2.326 5.952 1.00 0.00 H new ATOM 0 HB THR A 43 9.110 4.083 5.011 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.641 3.621 3.211 1.00 0.00 H new ATOM 0 HG21 THR A 43 9.428 5.012 2.742 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.936 4.782 3.658 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.495 3.638 2.368 1.00 0.00 H new ATOM 603 N ILE A 44 8.964 0.205 5.165 1.00 0.00 N ATOM 604 CA ILE A 44 8.494 -1.160 4.832 1.00 0.00 C ATOM 605 C ILE A 44 6.959 -1.240 4.808 1.00 0.00 C ATOM 606 O ILE A 44 6.261 -0.905 5.771 1.00 0.00 O ATOM 607 CB ILE A 44 9.221 -2.203 5.703 1.00 0.00 C ATOM 608 CG1 ILE A 44 9.200 -3.635 5.128 1.00 0.00 C ATOM 609 CG2 ILE A 44 8.867 -2.130 7.200 1.00 0.00 C ATOM 610 CD1 ILE A 44 7.862 -4.395 5.102 1.00 0.00 C ATOM 0 H ILE A 44 8.568 0.579 6.027 1.00 0.00 H new ATOM 0 HA ILE A 44 8.771 -1.414 3.809 1.00 0.00 H new ATOM 0 HB ILE A 44 10.268 -1.905 5.653 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.574 -3.587 4.105 1.00 0.00 H new ATOM 0 HG13 ILE A 44 9.910 -4.233 5.700 1.00 0.00 H new ATOM 0 HG21 ILE A 44 9.420 -2.897 7.743 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.132 -1.147 7.589 1.00 0.00 H new ATOM 0 HG23 ILE A 44 7.797 -2.295 7.329 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.014 -5.384 4.670 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.482 -4.498 6.118 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.141 -3.842 4.499 1.00 0.00 H new ATOM 622 N ILE A 45 6.480 -1.700 3.656 1.00 0.00 N ATOM 623 CA ILE A 45 5.056 -1.867 3.322 1.00 0.00 C ATOM 624 C ILE A 45 4.763 -3.373 3.171 1.00 0.00 C ATOM 625 O ILE A 45 5.483 -4.102 2.479 1.00 0.00 O ATOM 626 CB ILE A 45 4.708 -1.156 1.989 1.00 0.00 C ATOM 627 CG1 ILE A 45 5.293 0.272 1.923 1.00 0.00 C ATOM 628 CG2 ILE A 45 3.181 -1.107 1.833 1.00 0.00 C ATOM 629 CD1 ILE A 45 5.272 0.922 0.535 1.00 0.00 C ATOM 0 H ILE A 45 7.095 -1.981 2.892 1.00 0.00 H new ATOM 0 HA ILE A 45 4.455 -1.427 4.117 1.00 0.00 H new ATOM 0 HB ILE A 45 5.154 -1.724 1.173 1.00 0.00 H new ATOM 0 HG12 ILE A 45 4.737 0.907 2.613 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.323 0.242 2.277 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.927 -0.608 0.898 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.784 -2.122 1.823 1.00 0.00 H new ATOM 0 HG23 ILE A 45 2.748 -0.556 2.668 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.704 1.921 0.595 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.854 0.316 -0.159 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.243 0.992 0.181 1.00 0.00 H new ATOM 641 N ARG A 46 3.712 -3.802 3.854 1.00 0.00 N ATOM 642 CA ARG A 46 3.199 -5.179 3.787 1.00 0.00 C ATOM 643 C ARG A 46 2.282 -5.454 2.583 1.00 0.00 C ATOM 644 O ARG A 46 2.753 -5.953 1.560 1.00 0.00 O ATOM 645 CB ARG A 46 2.643 -5.646 5.137 1.00 0.00 C ATOM 646 CG ARG A 46 1.608 -4.716 5.788 1.00 0.00 C ATOM 647 CD ARG A 46 1.331 -5.127 7.237 1.00 0.00 C ATOM 648 NE ARG A 46 2.504 -4.815 8.087 1.00 0.00 N ATOM 649 CZ ARG A 46 3.362 -5.685 8.630 1.00 0.00 C ATOM 650 NH1 ARG A 46 3.295 -6.989 8.395 1.00 0.00 N ATOM 651 NH2 ARG A 46 4.360 -5.232 9.370 1.00 0.00 N ATOM 0 H ARG A 46 3.178 -3.201 4.482 1.00 0.00 H new ATOM 0 HA ARG A 46 4.059 -5.817 3.585 1.00 0.00 H new ATOM 0 HB2 ARG A 46 2.189 -6.628 5.002 1.00 0.00 H new ATOM 0 HB3 ARG A 46 3.476 -5.773 5.828 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.970 -3.688 5.761 1.00 0.00 H new ATOM 0 HG3 ARG A 46 0.681 -4.742 5.216 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.452 -4.602 7.610 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.110 -6.193 7.285 1.00 0.00 H new ATOM 0 HE ARG A 46 2.676 -3.828 8.279 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.570 -7.360 7.781 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.969 -7.621 8.828 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.469 -4.229 9.521 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.021 -5.885 9.790 1.00 0.00 H new ATOM 665 N ASN A 47 1.001 -5.082 2.673 1.00 0.00 N ATOM 666 CA ASN A 47 0.015 -5.257 1.578 1.00 0.00 C ATOM 667 C ASN A 47 0.162 -4.234 0.422 1.00 0.00 C ATOM 668 O ASN A 47 -0.815 -3.641 -0.048 1.00 0.00 O ATOM 669 CB ASN A 47 -1.401 -5.248 2.178 1.00 0.00 C ATOM 670 CG ASN A 47 -1.732 -6.502 3.003 1.00 0.00 C ATOM 671 OD1 ASN A 47 -0.980 -6.974 3.842 1.00 0.00 O ATOM 672 ND2 ASN A 47 -2.971 -6.921 2.934 1.00 0.00 N ATOM 0 H ASN A 47 0.607 -4.648 3.508 1.00 0.00 H new ATOM 0 HA ASN A 47 0.213 -6.220 1.108 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -1.512 -4.368 2.811 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -2.127 -5.153 1.371 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -3.304 -7.638 3.579 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -3.603 -6.530 2.235 1.00 0.00 H new ATOM 679 N PHE A 48 1.352 -4.235 -0.164 1.00 0.00 N ATOM 680 CA PHE A 48 1.743 -3.293 -1.244 1.00 0.00 C ATOM 681 C PHE A 48 0.848 -3.279 -2.488 1.00 0.00 C ATOM 682 O PHE A 48 0.530 -2.214 -3.009 1.00 0.00 O ATOM 683 CB PHE A 48 3.215 -3.439 -1.625 1.00 0.00 C ATOM 684 CG PHE A 48 3.636 -4.825 -2.132 1.00 0.00 C ATOM 685 CD1 PHE A 48 3.552 -5.125 -3.505 1.00 0.00 C ATOM 686 CD2 PHE A 48 4.194 -5.766 -1.254 1.00 0.00 C ATOM 687 CE1 PHE A 48 4.040 -6.348 -3.984 1.00 0.00 C ATOM 688 CE2 PHE A 48 4.681 -6.989 -1.733 1.00 0.00 C ATOM 689 CZ PHE A 48 4.599 -7.279 -3.106 1.00 0.00 C ATOM 0 H PHE A 48 2.092 -4.890 0.088 1.00 0.00 H new ATOM 0 HA PHE A 48 1.585 -2.315 -0.790 1.00 0.00 H new ATOM 0 HB2 PHE A 48 3.446 -2.704 -2.396 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.823 -3.190 -0.755 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.112 -4.413 -4.188 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.249 -5.545 -0.198 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.983 -6.572 -5.039 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.117 -7.705 -1.052 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.968 -8.222 -3.482 1.00 0.00 H new ATOM 699 N ALA A 49 0.336 -4.456 -2.860 1.00 0.00 N ATOM 700 CA ALA A 49 -0.649 -4.622 -3.956 1.00 0.00 C ATOM 701 C ALA A 49 -1.914 -3.767 -3.776 1.00 0.00 C ATOM 702 O ALA A 49 -2.252 -2.974 -4.651 1.00 0.00 O ATOM 703 CB ALA A 49 -1.005 -6.100 -4.096 1.00 0.00 C ATOM 0 H ALA A 49 0.590 -5.335 -2.410 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.180 -4.263 -4.872 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -1.729 -6.225 -4.901 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.105 -6.671 -4.325 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.435 -6.461 -3.162 1.00 0.00 H new ATOM 709 N GLU A 50 -2.523 -3.825 -2.588 1.00 0.00 N ATOM 710 CA GLU A 50 -3.664 -2.944 -2.260 1.00 0.00 C ATOM 711 C GLU A 50 -3.215 -1.478 -2.077 1.00 0.00 C ATOM 712 O GLU A 50 -3.793 -0.583 -2.685 1.00 0.00 O ATOM 713 CB GLU A 50 -4.502 -3.447 -1.069 1.00 0.00 C ATOM 714 CG GLU A 50 -3.976 -3.142 0.345 1.00 0.00 C ATOM 715 CD GLU A 50 -4.934 -3.671 1.411 1.00 0.00 C ATOM 716 OE1 GLU A 50 -5.875 -2.926 1.781 1.00 0.00 O ATOM 717 OE2 GLU A 50 -4.726 -4.834 1.817 1.00 0.00 O ATOM 0 H GLU A 50 -2.254 -4.464 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.331 -2.979 -3.121 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.501 -3.021 -1.156 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.607 -4.528 -1.164 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.993 -3.595 0.477 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.850 -2.066 0.466 1.00 0.00 H new ATOM 724 N TYR A 51 -2.047 -1.308 -1.446 1.00 0.00 N ATOM 725 CA TYR A 51 -1.451 -0.010 -1.099 1.00 0.00 C ATOM 726 C TYR A 51 -1.277 0.919 -2.320 1.00 0.00 C ATOM 727 O TYR A 51 -1.829 2.026 -2.335 1.00 0.00 O ATOM 728 CB TYR A 51 -0.099 -0.286 -0.429 1.00 0.00 C ATOM 729 CG TYR A 51 0.102 0.533 0.842 1.00 0.00 C ATOM 730 CD1 TYR A 51 0.644 1.825 0.758 1.00 0.00 C ATOM 731 CD2 TYR A 51 -0.318 0.028 2.078 1.00 0.00 C ATOM 732 CE1 TYR A 51 0.725 2.618 1.904 1.00 0.00 C ATOM 733 CE2 TYR A 51 -0.209 0.817 3.228 1.00 0.00 C ATOM 734 CZ TYR A 51 0.284 2.126 3.143 1.00 0.00 C ATOM 735 OH TYR A 51 0.261 2.961 4.206 1.00 0.00 O ATOM 0 H TYR A 51 -1.470 -2.096 -1.152 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.124 0.518 -0.424 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -0.026 -1.347 -0.189 1.00 0.00 H new ATOM 0 HB3 TYR A 51 0.703 -0.062 -1.132 1.00 0.00 H new ATOM 0 HD1 TYR A 51 0.997 2.204 -0.190 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -0.726 -0.970 2.144 1.00 0.00 H new ATOM 0 HE1 TYR A 51 1.130 3.617 1.837 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -0.506 0.416 4.186 1.00 0.00 H new ATOM 0 HH TYR A 51 -0.587 2.857 4.686 1.00 0.00 H new ATOM 745 N CYS A 52 -0.641 0.390 -3.367 1.00 0.00 N ATOM 746 CA CYS A 52 -0.441 1.113 -4.635 1.00 0.00 C ATOM 747 C CYS A 52 -1.763 1.446 -5.360 1.00 0.00 C ATOM 748 O CYS A 52 -1.974 2.588 -5.766 1.00 0.00 O ATOM 749 CB CYS A 52 0.509 0.324 -5.547 1.00 0.00 C ATOM 750 SG CYS A 52 -0.053 -1.342 -6.037 1.00 0.00 S ATOM 0 H CYS A 52 -0.248 -0.551 -3.365 1.00 0.00 H new ATOM 0 HA CYS A 52 0.013 2.073 -4.388 1.00 0.00 H new ATOM 0 HB2 CYS A 52 0.682 0.908 -6.451 1.00 0.00 H new ATOM 0 HB3 CYS A 52 1.470 0.228 -5.041 1.00 0.00 H new ATOM 0 HG CYS A 52 -0.996 -1.736 -5.233 1.00 0.00 H new ATOM 756 N ASP A 53 -2.690 0.493 -5.353 1.00 0.00 N ATOM 757 CA ASP A 53 -4.052 0.671 -5.901 1.00 0.00 C ATOM 758 C ASP A 53 -4.854 1.753 -5.145 1.00 0.00 C ATOM 759 O ASP A 53 -5.460 2.611 -5.785 1.00 0.00 O ATOM 760 CB ASP A 53 -4.748 -0.693 -5.861 1.00 0.00 C ATOM 761 CG ASP A 53 -6.118 -0.717 -6.555 1.00 0.00 C ATOM 762 OD1 ASP A 53 -6.132 -0.995 -7.767 1.00 0.00 O ATOM 763 OD2 ASP A 53 -7.122 -0.587 -5.821 1.00 0.00 O ATOM 0 H ASP A 53 -2.526 -0.436 -4.966 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.991 1.031 -6.928 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.101 -1.433 -6.332 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -4.874 -0.995 -4.821 1.00 0.00 H new ATOM 768 N ARG A 54 -4.774 1.731 -3.821 1.00 0.00 N ATOM 769 CA ARG A 54 -5.426 2.704 -2.911 1.00 0.00 C ATOM 770 C ARG A 54 -4.947 4.155 -3.108 1.00 0.00 C ATOM 771 O ARG A 54 -5.752 5.073 -3.008 1.00 0.00 O ATOM 772 CB ARG A 54 -5.208 2.283 -1.448 1.00 0.00 C ATOM 773 CG ARG A 54 -5.985 1.042 -1.030 1.00 0.00 C ATOM 774 CD ARG A 54 -5.376 0.429 0.234 1.00 0.00 C ATOM 775 NE ARG A 54 -6.221 0.421 1.448 1.00 0.00 N ATOM 776 CZ ARG A 54 -6.774 1.451 2.094 1.00 0.00 C ATOM 777 NH1 ARG A 54 -6.907 2.654 1.562 1.00 0.00 N ATOM 778 NH2 ARG A 54 -7.389 1.242 3.248 1.00 0.00 N ATOM 0 H ARG A 54 -4.241 1.020 -3.321 1.00 0.00 H new ATOM 0 HA ARG A 54 -6.487 2.690 -3.161 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -4.145 2.102 -1.289 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.491 3.111 -0.798 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -7.028 1.302 -0.849 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -5.975 0.310 -1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -5.094 -0.600 0.010 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -4.457 0.968 0.464 1.00 0.00 H new ATOM 0 HE ARG A 54 -6.407 -0.499 1.847 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -6.579 2.831 0.612 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -7.337 3.405 2.101 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.438 0.300 3.637 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -7.814 2.023 3.748 1.00 0.00 H new ATOM 792 N ILE A 55 -3.632 4.352 -3.286 1.00 0.00 N ATOM 793 CA ILE A 55 -3.088 5.683 -3.664 1.00 0.00 C ATOM 794 C ILE A 55 -3.473 6.065 -5.109 1.00 0.00 C ATOM 795 O ILE A 55 -3.927 7.179 -5.331 1.00 0.00 O ATOM 796 CB ILE A 55 -1.588 5.850 -3.311 1.00 0.00 C ATOM 797 CG1 ILE A 55 -1.056 7.294 -3.436 1.00 0.00 C ATOM 798 CG2 ILE A 55 -0.668 4.804 -3.963 1.00 0.00 C ATOM 799 CD1 ILE A 55 -0.803 7.879 -4.829 1.00 0.00 C ATOM 0 H ILE A 55 -2.927 3.623 -3.178 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.575 6.429 -3.036 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.552 5.635 -2.243 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.764 7.949 -2.928 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -0.119 7.347 -2.882 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.364 4.991 -3.666 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -0.964 3.806 -3.638 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.751 4.872 -5.048 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.432 8.900 -4.733 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -0.063 7.271 -5.350 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.734 7.883 -5.396 1.00 0.00 H new ATOM 811 N ARG A 56 -3.256 5.146 -6.047 1.00 0.00 N ATOM 812 CA ARG A 56 -3.726 5.257 -7.441 1.00 0.00 C ATOM 813 C ARG A 56 -3.743 3.944 -8.219 1.00 0.00 C ATOM 814 O ARG A 56 -2.714 3.360 -8.565 1.00 0.00 O ATOM 815 CB ARG A 56 -3.019 6.323 -8.281 1.00 0.00 C ATOM 816 CG ARG A 56 -3.848 7.615 -8.365 1.00 0.00 C ATOM 817 CD ARG A 56 -5.052 7.599 -9.327 1.00 0.00 C ATOM 818 NE ARG A 56 -6.129 6.606 -9.142 1.00 0.00 N ATOM 819 CZ ARG A 56 -6.834 6.298 -8.042 1.00 0.00 C ATOM 820 NH1 ARG A 56 -6.534 6.741 -6.825 1.00 0.00 N ATOM 821 NH2 ARG A 56 -7.810 5.411 -8.130 1.00 0.00 N ATOM 0 H ARG A 56 -2.740 4.285 -5.864 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.757 5.577 -7.289 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.044 6.543 -7.846 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.841 5.938 -9.285 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -4.213 7.851 -7.366 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.185 8.427 -8.662 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.511 8.587 -9.289 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.660 7.469 -10.336 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.374 6.073 -9.977 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -5.728 7.351 -6.689 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -7.110 6.471 -6.028 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.019 4.970 -9.026 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.354 5.167 -7.302 1.00 0.00 H new ATOM 835 N ARG A 57 -4.963 3.631 -8.639 1.00 0.00 N ATOM 836 CA ARG A 57 -5.259 2.554 -9.604 1.00 0.00 C ATOM 837 C ARG A 57 -4.563 2.802 -10.961 1.00 0.00 C ATOM 838 O ARG A 57 -4.116 1.875 -11.634 1.00 0.00 O ATOM 839 CB ARG A 57 -6.774 2.440 -9.782 1.00 0.00 C ATOM 840 CG ARG A 57 -7.420 1.944 -8.482 1.00 0.00 C ATOM 841 CD ARG A 57 -8.934 2.134 -8.474 1.00 0.00 C ATOM 842 NE ARG A 57 -9.536 1.743 -7.184 1.00 0.00 N ATOM 843 CZ ARG A 57 -9.433 2.362 -5.995 1.00 0.00 C ATOM 844 NH1 ARG A 57 -8.494 3.253 -5.719 1.00 0.00 N ATOM 845 NH2 ARG A 57 -10.138 1.902 -4.970 1.00 0.00 N ATOM 0 H ARG A 57 -5.797 4.122 -8.318 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.868 1.615 -9.212 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.190 3.409 -10.058 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.002 1.752 -10.596 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.189 0.888 -8.345 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.985 2.478 -7.637 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.169 3.178 -8.682 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.377 1.542 -9.275 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.102 0.895 -7.196 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -7.802 3.500 -6.426 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -8.463 3.693 -4.799 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -10.745 1.092 -5.092 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -10.073 2.359 -4.060 1.00 0.00 H new ATOM 859 N GLU A 58 -4.354 4.084 -11.276 1.00 0.00 N ATOM 860 CA GLU A 58 -3.545 4.520 -12.427 1.00 0.00 C ATOM 861 C GLU A 58 -2.055 4.457 -12.048 1.00 0.00 C ATOM 862 O GLU A 58 -1.437 5.430 -11.597 1.00 0.00 O ATOM 863 CB GLU A 58 -3.946 5.918 -12.934 1.00 0.00 C ATOM 864 CG GLU A 58 -5.338 5.957 -13.584 1.00 0.00 C ATOM 865 CD GLU A 58 -6.440 6.363 -12.607 1.00 0.00 C ATOM 866 OE1 GLU A 58 -6.863 5.503 -11.807 1.00 0.00 O ATOM 867 OE2 GLU A 58 -6.793 7.566 -12.622 1.00 0.00 O ATOM 0 H GLU A 58 -4.743 4.858 -10.737 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.734 3.841 -13.258 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.923 6.619 -12.100 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -3.206 6.260 -13.658 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -5.324 6.657 -14.419 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.569 4.975 -13.996 1.00 0.00 H new ATOM 874 N ASP A 59 -1.510 3.259 -12.233 1.00 0.00 N ATOM 875 CA ASP A 59 -0.126 2.896 -11.877 1.00 0.00 C ATOM 876 C ASP A 59 0.973 3.895 -12.289 1.00 0.00 C ATOM 877 O ASP A 59 1.929 4.072 -11.541 1.00 0.00 O ATOM 878 CB ASP A 59 0.179 1.484 -12.402 1.00 0.00 C ATOM 879 CG ASP A 59 1.524 0.936 -11.897 1.00 0.00 C ATOM 880 OD1 ASP A 59 1.511 0.309 -10.817 1.00 0.00 O ATOM 881 OD2 ASP A 59 2.518 1.150 -12.620 1.00 0.00 O ATOM 0 H ASP A 59 -2.028 2.484 -12.647 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.091 2.927 -10.788 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -0.620 0.808 -12.098 1.00 0.00 H new ATOM 0 HB3 ASP A 59 0.185 1.500 -13.492 1.00 0.00 H new ATOM 886 N LYS A 60 0.807 4.564 -13.434 1.00 0.00 N ATOM 887 CA LYS A 60 1.748 5.613 -13.900 1.00 0.00 C ATOM 888 C LYS A 60 1.996 6.726 -12.873 1.00 0.00 C ATOM 889 O LYS A 60 3.111 6.842 -12.357 1.00 0.00 O ATOM 890 CB LYS A 60 1.271 6.209 -15.236 1.00 0.00 C ATOM 891 CG LYS A 60 1.410 5.207 -16.385 1.00 0.00 C ATOM 892 CD LYS A 60 0.933 5.813 -17.707 1.00 0.00 C ATOM 893 CE LYS A 60 1.118 4.856 -18.885 1.00 0.00 C ATOM 894 NZ LYS A 60 2.545 4.615 -19.191 1.00 0.00 N ATOM 0 H LYS A 60 0.024 4.402 -14.068 1.00 0.00 H new ATOM 0 HA LYS A 60 2.707 5.115 -14.041 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.229 6.517 -15.146 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.850 7.105 -15.462 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.451 4.898 -16.478 1.00 0.00 H new ATOM 0 HG3 LYS A 60 0.830 4.311 -16.162 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.120 6.081 -17.622 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.482 6.734 -17.901 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.631 3.907 -18.660 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.624 5.267 -19.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.624 4.087 -20.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.039 5.526 -19.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.976 4.062 -18.423 1.00 0.00 H new ATOM 908 N ILE A 61 0.936 7.426 -12.470 1.00 0.00 N ATOM 909 CA ILE A 61 0.996 8.462 -11.413 1.00 0.00 C ATOM 910 C ILE A 61 1.336 7.874 -10.027 1.00 0.00 C ATOM 911 O ILE A 61 2.092 8.489 -9.273 1.00 0.00 O ATOM 912 CB ILE A 61 -0.241 9.383 -11.445 1.00 0.00 C ATOM 913 CG1 ILE A 61 -0.057 10.565 -10.465 1.00 0.00 C ATOM 914 CG2 ILE A 61 -1.552 8.621 -11.195 1.00 0.00 C ATOM 915 CD1 ILE A 61 -1.014 11.742 -10.689 1.00 0.00 C ATOM 0 H ILE A 61 0.003 7.298 -12.862 1.00 0.00 H new ATOM 0 HA ILE A 61 1.839 9.117 -11.635 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.325 9.788 -12.453 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.187 10.198 -9.447 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.968 10.928 -10.544 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.390 9.318 -11.229 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.682 7.859 -11.964 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.515 8.145 -10.215 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.810 12.522 -9.955 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.870 12.142 -11.693 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.043 11.400 -10.578 1.00 0.00 H new ATOM 927 N CYS A 62 0.888 6.651 -9.759 1.00 0.00 N ATOM 928 CA CYS A 62 1.271 5.905 -8.541 1.00 0.00 C ATOM 929 C CYS A 62 2.799 5.694 -8.424 1.00 0.00 C ATOM 930 O CYS A 62 3.405 6.058 -7.422 1.00 0.00 O ATOM 931 CB CYS A 62 0.519 4.568 -8.532 1.00 0.00 C ATOM 932 SG CYS A 62 0.819 3.562 -7.042 1.00 0.00 S ATOM 0 H CYS A 62 0.251 6.141 -10.371 1.00 0.00 H new ATOM 0 HA CYS A 62 0.991 6.496 -7.669 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -0.550 4.763 -8.618 1.00 0.00 H new ATOM 0 HB3 CYS A 62 0.810 3.993 -9.411 1.00 0.00 H new ATOM 0 HG CYS A 62 -0.318 3.198 -6.528 1.00 0.00 H new ATOM 938 N MET A 63 3.423 5.237 -9.517 1.00 0.00 N ATOM 939 CA MET A 63 4.884 5.134 -9.665 1.00 0.00 C ATOM 940 C MET A 63 5.573 6.509 -9.613 1.00 0.00 C ATOM 941 O MET A 63 6.618 6.675 -8.980 1.00 0.00 O ATOM 942 CB MET A 63 5.195 4.422 -10.987 1.00 0.00 C ATOM 943 CG MET A 63 6.667 4.056 -11.140 1.00 0.00 C ATOM 944 SD MET A 63 7.033 3.245 -12.744 1.00 0.00 S ATOM 945 CE MET A 63 8.797 3.025 -12.576 1.00 0.00 C ATOM 0 H MET A 63 2.916 4.921 -10.344 1.00 0.00 H new ATOM 0 HA MET A 63 5.278 4.559 -8.827 1.00 0.00 H new ATOM 0 HB2 MET A 63 4.593 3.516 -11.055 1.00 0.00 H new ATOM 0 HB3 MET A 63 4.899 5.064 -11.817 1.00 0.00 H new ATOM 0 HG2 MET A 63 7.273 4.957 -11.047 1.00 0.00 H new ATOM 0 HG3 MET A 63 6.958 3.391 -10.327 1.00 0.00 H new ATOM 0 HE1 MET A 63 9.190 2.541 -13.470 1.00 0.00 H new ATOM 0 HE2 MET A 63 9.274 3.997 -12.450 1.00 0.00 H new ATOM 0 HE3 MET A 63 9.005 2.403 -11.705 1.00 0.00 H new ATOM 955 N LYS A 64 4.930 7.493 -10.240 1.00 0.00 N ATOM 956 CA LYS A 64 5.321 8.916 -10.179 1.00 0.00 C ATOM 957 C LYS A 64 5.223 9.541 -8.771 1.00 0.00 C ATOM 958 O LYS A 64 5.601 10.684 -8.576 1.00 0.00 O ATOM 959 CB LYS A 64 4.486 9.669 -11.232 1.00 0.00 C ATOM 960 CG LYS A 64 5.134 10.987 -11.686 1.00 0.00 C ATOM 961 CD LYS A 64 4.454 11.578 -12.925 1.00 0.00 C ATOM 962 CE LYS A 64 4.924 10.978 -14.254 1.00 0.00 C ATOM 963 NZ LYS A 64 4.508 9.577 -14.455 1.00 0.00 N ATOM 0 H LYS A 64 4.106 7.329 -10.818 1.00 0.00 H new ATOM 0 HA LYS A 64 6.383 9.001 -10.408 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.340 9.025 -12.099 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.498 9.879 -10.821 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.089 11.710 -10.871 1.00 0.00 H new ATOM 0 HG3 LYS A 64 6.188 10.814 -11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.377 11.434 -12.836 1.00 0.00 H new ATOM 0 HD3 LYS A 64 4.631 12.653 -12.943 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.536 11.584 -15.073 1.00 0.00 H new ATOM 0 HE3 LYS A 64 6.011 11.035 -14.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.470 9.369 -15.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.193 8.942 -13.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.567 9.431 -14.036 1.00 0.00 H new ATOM 977 N TYR A 65 4.542 8.856 -7.844 1.00 0.00 N ATOM 978 CA TYR A 65 4.676 9.130 -6.398 1.00 0.00 C ATOM 979 C TYR A 65 5.786 8.289 -5.737 1.00 0.00 C ATOM 980 O TYR A 65 6.694 8.844 -5.121 1.00 0.00 O ATOM 981 CB TYR A 65 3.352 8.886 -5.662 1.00 0.00 C ATOM 982 CG TYR A 65 2.379 10.066 -5.702 1.00 0.00 C ATOM 983 CD1 TYR A 65 2.069 10.743 -6.892 1.00 0.00 C ATOM 984 CD2 TYR A 65 1.722 10.427 -4.518 1.00 0.00 C ATOM 985 CE1 TYR A 65 1.117 11.779 -6.896 1.00 0.00 C ATOM 986 CE2 TYR A 65 0.773 11.453 -4.515 1.00 0.00 C ATOM 987 CZ TYR A 65 0.479 12.138 -5.703 1.00 0.00 C ATOM 988 OH TYR A 65 -0.414 13.157 -5.690 1.00 0.00 O ATOM 0 H TYR A 65 3.889 8.104 -8.065 1.00 0.00 H new ATOM 0 HA TYR A 65 4.952 10.181 -6.315 1.00 0.00 H new ATOM 0 HB2 TYR A 65 2.864 8.014 -6.097 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.568 8.644 -4.621 1.00 0.00 H new ATOM 0 HD1 TYR A 65 2.565 10.467 -7.811 1.00 0.00 H new ATOM 0 HD2 TYR A 65 1.951 9.908 -3.599 1.00 0.00 H new ATOM 0 HE1 TYR A 65 0.880 12.295 -7.815 1.00 0.00 H new ATOM 0 HE2 TYR A 65 0.267 11.718 -3.599 1.00 0.00 H new ATOM 0 HH TYR A 65 -0.764 13.273 -4.782 1.00 0.00 H new ATOM 998 N LEU A 66 5.765 7.000 -6.065 1.00 0.00 N ATOM 999 CA LEU A 66 6.714 5.967 -5.589 1.00 0.00 C ATOM 1000 C LEU A 66 8.199 6.314 -5.801 1.00 0.00 C ATOM 1001 O LEU A 66 9.051 5.808 -5.074 1.00 0.00 O ATOM 1002 CB LEU A 66 6.322 4.631 -6.247 1.00 0.00 C ATOM 1003 CG LEU A 66 7.073 3.401 -5.718 1.00 0.00 C ATOM 1004 CD1 LEU A 66 6.099 2.224 -5.597 1.00 0.00 C ATOM 1005 CD2 LEU A 66 8.207 3.002 -6.668 1.00 0.00 C ATOM 0 H LEU A 66 5.060 6.618 -6.696 1.00 0.00 H new ATOM 0 HA LEU A 66 6.629 5.899 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU A 66 5.253 4.474 -6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.493 4.708 -7.321 1.00 0.00 H new ATOM 0 HG LEU A 66 7.496 3.651 -4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.630 1.349 -5.222 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.297 2.485 -4.907 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.677 1.999 -6.576 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.724 2.128 -6.271 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.794 2.765 -7.648 1.00 0.00 H new ATOM 0 HD23 LEU A 66 8.911 3.829 -6.761 1.00 0.00 H new ATOM 1017 N LEU A 67 8.490 7.077 -6.849 1.00 0.00 N ATOM 1018 CA LEU A 67 9.852 7.621 -7.043 1.00 0.00 C ATOM 1019 C LEU A 67 9.989 9.108 -6.658 1.00 0.00 C ATOM 1020 O LEU A 67 10.861 9.427 -5.863 1.00 0.00 O ATOM 1021 CB LEU A 67 10.302 7.345 -8.490 1.00 0.00 C ATOM 1022 CG LEU A 67 11.819 7.325 -8.745 1.00 0.00 C ATOM 1023 CD1 LEU A 67 12.474 8.715 -8.692 1.00 0.00 C ATOM 1024 CD2 LEU A 67 12.545 6.332 -7.832 1.00 0.00 C ATOM 0 H LEU A 67 7.821 7.336 -7.574 1.00 0.00 H new ATOM 0 HA LEU A 67 10.519 7.105 -6.352 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.892 6.383 -8.797 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.857 8.102 -9.136 1.00 0.00 H new ATOM 0 HG LEU A 67 11.930 6.978 -9.772 1.00 0.00 H new ATOM 0 HD11 LEU A 67 13.543 8.621 -8.881 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.027 9.357 -9.451 1.00 0.00 H new ATOM 0 HD13 LEU A 67 12.317 9.154 -7.707 1.00 0.00 H new ATOM 0 HD21 LEU A 67 13.613 6.353 -8.048 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.380 6.608 -6.790 1.00 0.00 H new ATOM 0 HD23 LEU A 67 12.159 5.328 -8.007 1.00 0.00 H new ATOM 1036 N LYS A 68 9.069 9.966 -7.096 1.00 0.00 N ATOM 1037 CA LYS A 68 9.166 11.427 -6.882 1.00 0.00 C ATOM 1038 C LYS A 68 9.283 11.844 -5.399 1.00 0.00 C ATOM 1039 O LYS A 68 10.076 12.735 -5.068 1.00 0.00 O ATOM 1040 CB LYS A 68 7.971 12.107 -7.546 1.00 0.00 C ATOM 1041 CG LYS A 68 7.987 13.637 -7.539 1.00 0.00 C ATOM 1042 CD LYS A 68 6.762 14.240 -8.248 1.00 0.00 C ATOM 1043 CE LYS A 68 6.793 14.086 -9.779 1.00 0.00 C ATOM 1044 NZ LYS A 68 7.875 14.874 -10.381 1.00 0.00 N ATOM 0 H LYS A 68 8.235 9.679 -7.608 1.00 0.00 H new ATOM 0 HA LYS A 68 10.098 11.755 -7.341 1.00 0.00 H new ATOM 0 HB2 LYS A 68 7.912 11.768 -8.580 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.062 11.770 -7.048 1.00 0.00 H new ATOM 0 HG2 LYS A 68 8.019 13.993 -6.509 1.00 0.00 H new ATOM 0 HG3 LYS A 68 8.896 13.990 -8.026 1.00 0.00 H new ATOM 0 HD2 LYS A 68 5.860 13.765 -7.862 1.00 0.00 H new ATOM 0 HD3 LYS A 68 6.695 15.299 -8.000 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.921 13.035 -10.037 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.837 14.402 -10.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.764 14.883 -11.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 7.837 15.849 -10.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 8.792 14.449 -10.135 1.00 0.00 H new ATOM 1058 N GLU A 69 8.578 11.141 -4.519 1.00 0.00 N ATOM 1059 CA GLU A 69 8.626 11.376 -3.063 1.00 0.00 C ATOM 1060 C GLU A 69 9.980 10.968 -2.418 1.00 0.00 C ATOM 1061 O GLU A 69 10.304 11.367 -1.296 1.00 0.00 O ATOM 1062 CB GLU A 69 7.474 10.596 -2.423 1.00 0.00 C ATOM 1063 CG GLU A 69 7.060 11.160 -1.063 1.00 0.00 C ATOM 1064 CD GLU A 69 6.334 12.510 -1.118 1.00 0.00 C ATOM 1065 OE1 GLU A 69 5.596 12.738 -2.099 1.00 0.00 O ATOM 1066 OE2 GLU A 69 6.443 13.238 -0.110 1.00 0.00 O ATOM 0 H GLU A 69 7.950 10.384 -4.789 1.00 0.00 H new ATOM 0 HA GLU A 69 8.527 12.447 -2.886 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.615 10.610 -3.094 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.769 9.553 -2.304 1.00 0.00 H new ATOM 0 HG2 GLU A 69 6.413 10.436 -0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.951 11.268 -0.444 1.00 0.00 H new ATOM 1073 N LEU A 70 10.747 10.142 -3.114 1.00 0.00 N ATOM 1074 CA LEU A 70 11.999 9.545 -2.608 1.00 0.00 C ATOM 1075 C LEU A 70 13.209 10.471 -2.735 1.00 0.00 C ATOM 1076 O LEU A 70 13.988 10.409 -3.685 1.00 0.00 O ATOM 1077 CB LEU A 70 12.221 8.203 -3.327 1.00 0.00 C ATOM 1078 CG LEU A 70 11.614 6.963 -2.660 1.00 0.00 C ATOM 1079 CD1 LEU A 70 10.106 7.062 -2.406 1.00 0.00 C ATOM 1080 CD2 LEU A 70 11.931 5.759 -3.546 1.00 0.00 C ATOM 0 H LEU A 70 10.522 9.855 -4.067 1.00 0.00 H new ATOM 0 HA LEU A 70 11.894 9.380 -1.536 1.00 0.00 H new ATOM 0 HB2 LEU A 70 11.812 8.284 -4.334 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.294 8.044 -3.430 1.00 0.00 H new ATOM 0 HG LEU A 70 12.058 6.863 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.756 6.145 -1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.902 7.909 -1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.586 7.202 -3.354 1.00 0.00 H new ATOM 0 HD21 LEU A 70 11.512 4.858 -3.099 1.00 0.00 H new ATOM 0 HD22 LEU A 70 11.496 5.910 -4.534 1.00 0.00 H new ATOM 0 HD23 LEU A 70 13.012 5.650 -3.638 1.00 0.00 H new ATOM 1092 N ALA A 71 13.345 11.317 -1.712 1.00 0.00 N ATOM 1093 CA ALA A 71 14.553 12.155 -1.486 1.00 0.00 C ATOM 1094 C ALA A 71 15.873 11.354 -1.566 1.00 0.00 C ATOM 1095 O ALA A 71 16.924 11.896 -1.894 1.00 0.00 O ATOM 1096 CB ALA A 71 14.427 12.844 -0.127 1.00 0.00 C ATOM 0 H ALA A 71 12.622 11.450 -1.005 1.00 0.00 H new ATOM 0 HA ALA A 71 14.601 12.893 -2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 71 15.307 13.462 0.051 1.00 0.00 H new ATOM 0 HB2 ALA A 71 13.536 13.471 -0.118 1.00 0.00 H new ATOM 0 HB3 ALA A 71 14.348 12.091 0.657 1.00 0.00 H new ATOM 1102 N ALA A 72 15.790 10.107 -1.117 1.00 0.00 N ATOM 1103 CA ALA A 72 16.777 9.045 -1.386 1.00 0.00 C ATOM 1104 C ALA A 72 16.026 7.915 -2.127 1.00 0.00 C ATOM 1105 O ALA A 72 15.046 7.416 -1.574 1.00 0.00 O ATOM 1106 CB ALA A 72 17.360 8.526 -0.071 1.00 0.00 C ATOM 0 H ALA A 72 15.014 9.788 -0.537 1.00 0.00 H new ATOM 0 HA ALA A 72 17.605 9.419 -1.988 1.00 0.00 H new ATOM 0 HB1 ALA A 72 18.088 7.742 -0.280 1.00 0.00 H new ATOM 0 HB2 ALA A 72 17.849 9.344 0.458 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.559 8.122 0.548 1.00 0.00 H new ATOM 1112 N PRO A 73 16.313 7.690 -3.415 1.00 0.00 N ATOM 1113 CA PRO A 73 15.628 6.653 -4.220 1.00 0.00 C ATOM 1114 C PRO A 73 15.988 5.219 -3.797 1.00 0.00 C ATOM 1115 O PRO A 73 16.936 4.614 -4.284 1.00 0.00 O ATOM 1116 CB PRO A 73 16.008 6.980 -5.665 1.00 0.00 C ATOM 1117 CG PRO A 73 17.390 7.634 -5.543 1.00 0.00 C ATOM 1118 CD PRO A 73 17.288 8.430 -4.240 1.00 0.00 C ATOM 0 HA PRO A 73 14.548 6.674 -4.076 1.00 0.00 H new ATOM 0 HB2 PRO A 73 16.044 6.082 -6.282 1.00 0.00 H new ATOM 0 HB3 PRO A 73 15.286 7.654 -6.125 1.00 0.00 H new ATOM 0 HG2 PRO A 73 18.185 6.890 -5.499 1.00 0.00 H new ATOM 0 HG3 PRO A 73 17.606 8.280 -6.394 1.00 0.00 H new ATOM 0 HD2 PRO A 73 18.255 8.498 -3.742 1.00 0.00 H new ATOM 0 HD3 PRO A 73 16.953 9.451 -4.426 1.00 0.00 H new ATOM 1126 N GLY A 74 15.249 4.743 -2.798 1.00 0.00 N ATOM 1127 CA GLY A 74 15.414 3.396 -2.215 1.00 0.00 C ATOM 1128 C GLY A 74 14.808 2.277 -3.084 1.00 0.00 C ATOM 1129 O GLY A 74 13.668 2.357 -3.516 1.00 0.00 O ATOM 0 H GLY A 74 14.505 5.284 -2.358 1.00 0.00 H new ATOM 0 HA2 GLY A 74 16.476 3.198 -2.069 1.00 0.00 H new ATOM 0 HA3 GLY A 74 14.948 3.374 -1.230 1.00 0.00 H new ATOM 1133 N ASN A 75 15.552 1.176 -3.132 1.00 0.00 N ATOM 1134 CA ASN A 75 15.175 -0.061 -3.855 1.00 0.00 C ATOM 1135 C ASN A 75 14.023 -0.810 -3.186 1.00 0.00 C ATOM 1136 O ASN A 75 13.914 -0.860 -1.963 1.00 0.00 O ATOM 1137 CB ASN A 75 16.406 -0.972 -4.003 1.00 0.00 C ATOM 1138 CG ASN A 75 17.071 -1.339 -2.672 1.00 0.00 C ATOM 1139 OD1 ASN A 75 17.740 -0.533 -2.036 1.00 0.00 O ATOM 1140 ND2 ASN A 75 16.808 -2.523 -2.175 1.00 0.00 N ATOM 0 H ASN A 75 16.455 1.105 -2.663 1.00 0.00 H new ATOM 0 HA ASN A 75 14.817 0.233 -4.842 1.00 0.00 H new ATOM 0 HB2 ASN A 75 16.109 -1.888 -4.514 1.00 0.00 H new ATOM 0 HB3 ASN A 75 17.139 -0.476 -4.639 1.00 0.00 H new ATOM 0 HD21 ASN A 75 17.161 -2.779 -1.253 1.00 0.00 H new ATOM 0 HD22 ASN A 75 16.250 -3.188 -2.710 1.00 0.00 H new ATOM 1147 N VAL A 76 13.263 -1.516 -4.032 1.00 0.00 N ATOM 1148 CA VAL A 76 12.086 -2.293 -3.596 1.00 0.00 C ATOM 1149 C VAL A 76 12.330 -3.805 -3.591 1.00 0.00 C ATOM 1150 O VAL A 76 12.806 -4.384 -4.575 1.00 0.00 O ATOM 1151 CB VAL A 76 10.808 -1.946 -4.400 1.00 0.00 C ATOM 1152 CG1 VAL A 76 10.353 -0.517 -4.100 1.00 0.00 C ATOM 1153 CG2 VAL A 76 10.956 -2.135 -5.919 1.00 0.00 C ATOM 0 H VAL A 76 13.442 -1.568 -5.035 1.00 0.00 H new ATOM 0 HA VAL A 76 11.918 -1.991 -2.562 1.00 0.00 H new ATOM 0 HB VAL A 76 10.052 -2.658 -4.070 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.454 -0.293 -4.675 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.137 -0.420 -3.036 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.143 0.182 -4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.020 -1.872 -6.411 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.754 -1.492 -6.290 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.199 -3.176 -6.134 1.00 0.00 H new ATOM 1163 N ASP A 77 11.890 -4.449 -2.512 1.00 0.00 N ATOM 1164 CA ASP A 77 12.016 -5.915 -2.369 1.00 0.00 C ATOM 1165 C ASP A 77 10.683 -6.667 -2.509 1.00 0.00 C ATOM 1166 O ASP A 77 10.423 -7.678 -1.851 1.00 0.00 O ATOM 1167 CB ASP A 77 12.783 -6.276 -1.086 1.00 0.00 C ATOM 1168 CG ASP A 77 14.292 -6.002 -1.150 1.00 0.00 C ATOM 1169 OD1 ASP A 77 14.704 -4.999 -1.769 1.00 0.00 O ATOM 1170 OD2 ASP A 77 15.018 -6.825 -0.556 1.00 0.00 O ATOM 0 H ASP A 77 11.442 -3.988 -1.720 1.00 0.00 H new ATOM 0 HA ASP A 77 12.609 -6.265 -3.214 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.359 -5.714 -0.254 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.627 -7.333 -0.869 1.00 0.00 H new ATOM 1175 N ASP A 78 10.014 -6.337 -3.618 1.00 0.00 N ATOM 1176 CA ASP A 78 8.671 -6.847 -4.002 1.00 0.00 C ATOM 1177 C ASP A 78 8.496 -8.377 -4.055 1.00 0.00 C ATOM 1178 O ASP A 78 7.396 -8.863 -3.822 1.00 0.00 O ATOM 1179 CB ASP A 78 8.211 -6.212 -5.322 1.00 0.00 C ATOM 1180 CG ASP A 78 9.217 -6.385 -6.470 1.00 0.00 C ATOM 1181 OD1 ASP A 78 10.094 -5.498 -6.570 1.00 0.00 O ATOM 1182 OD2 ASP A 78 9.191 -7.464 -7.098 1.00 0.00 O ATOM 0 H ASP A 78 10.396 -5.686 -4.304 1.00 0.00 H new ATOM 0 HA ASP A 78 8.033 -6.539 -3.174 1.00 0.00 H new ATOM 0 HB2 ASP A 78 7.258 -6.653 -5.615 1.00 0.00 H new ATOM 0 HB3 ASP A 78 8.034 -5.148 -5.162 1.00 0.00 H new ATOM 1187 N LYS A 79 9.574 -9.098 -4.362 1.00 0.00 N ATOM 1188 CA LYS A 79 9.619 -10.575 -4.345 1.00 0.00 C ATOM 1189 C LYS A 79 9.222 -11.223 -3.002 1.00 0.00 C ATOM 1190 O LYS A 79 8.821 -12.382 -2.971 1.00 0.00 O ATOM 1191 CB LYS A 79 11.030 -11.046 -4.735 1.00 0.00 C ATOM 1192 CG LYS A 79 11.369 -10.714 -6.186 1.00 0.00 C ATOM 1193 CD LYS A 79 12.803 -11.148 -6.515 1.00 0.00 C ATOM 1194 CE LYS A 79 13.188 -10.852 -7.966 1.00 0.00 C ATOM 1195 NZ LYS A 79 12.443 -11.691 -8.921 1.00 0.00 N ATOM 0 H LYS A 79 10.460 -8.673 -4.635 1.00 0.00 H new ATOM 0 HA LYS A 79 8.869 -10.900 -5.066 1.00 0.00 H new ATOM 0 HB2 LYS A 79 11.762 -10.578 -4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 79 11.107 -12.123 -4.583 1.00 0.00 H new ATOM 0 HG2 LYS A 79 10.669 -11.216 -6.853 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.259 -9.643 -6.356 1.00 0.00 H new ATOM 0 HD2 LYS A 79 13.496 -10.636 -5.847 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.908 -12.216 -6.326 1.00 0.00 H new ATOM 0 HE2 LYS A 79 12.998 -9.801 -8.183 1.00 0.00 H new ATOM 0 HE3 LYS A 79 14.257 -11.017 -8.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 12.784 -11.505 -9.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 12.589 -12.694 -8.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 11.429 -11.467 -8.863 1.00 0.00 H new ATOM 1209 N GLY A 80 9.451 -10.480 -1.918 1.00 0.00 N ATOM 1210 CA GLY A 80 9.086 -10.880 -0.541 1.00 0.00 C ATOM 1211 C GLY A 80 8.210 -9.808 0.132 1.00 0.00 C ATOM 1212 O GLY A 80 6.988 -9.817 0.048 1.00 0.00 O ATOM 0 H GLY A 80 9.902 -9.567 -1.964 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.551 -11.829 -0.564 1.00 0.00 H new ATOM 0 HA3 GLY A 80 9.990 -11.038 0.047 1.00 0.00 H new ATOM 1216 N GLU A 81 8.910 -8.864 0.769 1.00 0.00 N ATOM 1217 CA GLU A 81 8.284 -7.724 1.465 1.00 0.00 C ATOM 1218 C GLU A 81 8.756 -6.416 0.840 1.00 0.00 C ATOM 1219 O GLU A 81 9.957 -6.235 0.595 1.00 0.00 O ATOM 1220 CB GLU A 81 8.663 -7.742 2.957 1.00 0.00 C ATOM 1221 CG GLU A 81 8.042 -8.920 3.713 1.00 0.00 C ATOM 1222 CD GLU A 81 8.491 -8.988 5.175 1.00 0.00 C ATOM 1223 OE1 GLU A 81 9.715 -8.878 5.414 1.00 0.00 O ATOM 1224 OE2 GLU A 81 7.606 -9.205 6.029 1.00 0.00 O ATOM 0 H GLU A 81 9.929 -8.864 0.819 1.00 0.00 H new ATOM 0 HA GLU A 81 7.201 -7.805 1.369 1.00 0.00 H new ATOM 0 HB2 GLU A 81 9.748 -7.787 3.051 1.00 0.00 H new ATOM 0 HB3 GLU A 81 8.342 -6.809 3.420 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.956 -8.839 3.674 1.00 0.00 H new ATOM 0 HG3 GLU A 81 8.310 -9.850 3.211 1.00 0.00 H new ATOM 1231 N LEU A 82 7.834 -5.455 0.721 1.00 0.00 N ATOM 1232 CA LEU A 82 8.121 -4.174 0.053 1.00 0.00 C ATOM 1233 C LEU A 82 8.848 -3.212 0.995 1.00 0.00 C ATOM 1234 O LEU A 82 8.249 -2.407 1.704 1.00 0.00 O ATOM 1235 CB LEU A 82 6.809 -3.580 -0.483 1.00 0.00 C ATOM 1236 CG LEU A 82 6.897 -2.630 -1.689 1.00 0.00 C ATOM 1237 CD1 LEU A 82 7.684 -1.347 -1.419 1.00 0.00 C ATOM 1238 CD2 LEU A 82 7.426 -3.349 -2.934 1.00 0.00 C ATOM 0 H LEU A 82 6.882 -5.537 1.077 1.00 0.00 H new ATOM 0 HA LEU A 82 8.792 -4.344 -0.789 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.152 -4.407 -0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 82 6.325 -3.043 0.333 1.00 0.00 H new ATOM 0 HG LEU A 82 5.871 -2.313 -1.878 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.698 -0.733 -2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.210 -0.793 -0.609 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.706 -1.600 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 82 7.475 -2.647 -3.766 1.00 0.00 H new ATOM 0 HD22 LEU A 82 8.422 -3.742 -2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.758 -4.171 -3.191 1.00 0.00 H new ATOM 1250 N VAL A 83 10.149 -3.444 1.112 1.00 0.00 N ATOM 1251 CA VAL A 83 11.073 -2.428 1.669 1.00 0.00 C ATOM 1252 C VAL A 83 11.481 -1.458 0.555 1.00 0.00 C ATOM 1253 O VAL A 83 11.557 -1.837 -0.619 1.00 0.00 O ATOM 1254 CB VAL A 83 12.249 -3.085 2.421 1.00 0.00 C ATOM 1255 CG1 VAL A 83 13.294 -3.745 1.514 1.00 0.00 C ATOM 1256 CG2 VAL A 83 12.885 -2.100 3.406 1.00 0.00 C ATOM 0 H VAL A 83 10.599 -4.316 0.835 1.00 0.00 H new ATOM 0 HA VAL A 83 10.570 -1.834 2.433 1.00 0.00 H new ATOM 0 HB VAL A 83 11.816 -3.911 2.985 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.084 -4.181 2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.820 -4.528 0.922 1.00 0.00 H new ATOM 0 HG13 VAL A 83 13.723 -2.996 0.848 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.712 -2.586 3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 83 13.258 -1.232 2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.139 -1.780 4.133 1.00 0.00 H new ATOM 1266 N ILE A 84 11.473 -0.194 0.951 1.00 0.00 N ATOM 1267 CA ILE A 84 11.789 1.001 0.133 1.00 0.00 C ATOM 1268 C ILE A 84 12.442 2.053 1.061 1.00 0.00 C ATOM 1269 O ILE A 84 12.388 1.926 2.287 1.00 0.00 O ATOM 1270 CB ILE A 84 10.496 1.481 -0.563 1.00 0.00 C ATOM 1271 CG1 ILE A 84 10.777 2.619 -1.571 1.00 0.00 C ATOM 1272 CG2 ILE A 84 9.371 1.839 0.426 1.00 0.00 C ATOM 1273 CD1 ILE A 84 9.633 2.908 -2.539 1.00 0.00 C ATOM 0 H ILE A 84 11.232 0.056 1.910 1.00 0.00 H new ATOM 0 HA ILE A 84 12.503 0.792 -0.664 1.00 0.00 H new ATOM 0 HB ILE A 84 10.123 0.630 -1.133 1.00 0.00 H new ATOM 0 HG12 ILE A 84 11.005 3.529 -1.017 1.00 0.00 H new ATOM 0 HG13 ILE A 84 11.667 2.365 -2.147 1.00 0.00 H new ATOM 0 HG21 ILE A 84 8.491 2.169 -0.127 1.00 0.00 H new ATOM 0 HG22 ILE A 84 9.118 0.962 1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 84 9.707 2.640 1.084 1.00 0.00 H new ATOM 0 HD11 ILE A 84 9.919 3.720 -3.208 1.00 0.00 H new ATOM 0 HD12 ILE A 84 9.417 2.014 -3.124 1.00 0.00 H new ATOM 0 HD13 ILE A 84 8.745 3.197 -1.977 1.00 0.00 H new ATOM 1285 N GLN A 85 13.190 2.995 0.503 1.00 0.00 N ATOM 1286 CA GLN A 85 13.724 4.131 1.288 1.00 0.00 C ATOM 1287 C GLN A 85 13.355 5.464 0.616 1.00 0.00 C ATOM 1288 O GLN A 85 13.310 5.553 -0.604 1.00 0.00 O ATOM 1289 CB GLN A 85 15.250 3.972 1.460 1.00 0.00 C ATOM 1290 CG GLN A 85 15.807 4.936 2.511 1.00 0.00 C ATOM 1291 CD GLN A 85 17.304 4.730 2.738 1.00 0.00 C ATOM 1292 OE1 GLN A 85 18.148 5.316 2.068 1.00 0.00 O ATOM 1293 NE2 GLN A 85 17.667 3.944 3.731 1.00 0.00 N ATOM 0 H GLN A 85 13.447 3.007 -0.484 1.00 0.00 H new ATOM 0 HA GLN A 85 13.274 4.135 2.281 1.00 0.00 H new ATOM 0 HB2 GLN A 85 15.478 2.946 1.750 1.00 0.00 H new ATOM 0 HB3 GLN A 85 15.744 4.150 0.505 1.00 0.00 H new ATOM 0 HG2 GLN A 85 15.626 5.963 2.194 1.00 0.00 H new ATOM 0 HG3 GLN A 85 15.275 4.795 3.452 1.00 0.00 H new ATOM 0 HE21 GLN A 85 16.959 3.460 4.283 1.00 0.00 H new ATOM 0 HE22 GLN A 85 18.656 3.819 3.947 1.00 0.00 H new ATOM 1302 N GLY A 86 13.059 6.443 1.468 1.00 0.00 N ATOM 1303 CA GLY A 86 12.642 7.813 1.081 1.00 0.00 C ATOM 1304 C GLY A 86 11.434 8.272 1.904 1.00 0.00 C ATOM 1305 O GLY A 86 11.067 7.638 2.893 1.00 0.00 O ATOM 0 H GLY A 86 13.100 6.314 2.479 1.00 0.00 H new ATOM 0 HA2 GLY A 86 13.471 8.505 1.229 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.393 7.835 0.020 1.00 0.00 H new ATOM 1309 N LYS A 87 10.709 9.276 1.399 1.00 0.00 N ATOM 1310 CA LYS A 87 9.571 9.877 2.121 1.00 0.00 C ATOM 1311 C LYS A 87 8.246 9.104 1.911 1.00 0.00 C ATOM 1312 O LYS A 87 7.151 9.653 1.746 1.00 0.00 O ATOM 1313 CB LYS A 87 9.491 11.366 1.748 1.00 0.00 C ATOM 1314 CG LYS A 87 8.730 12.193 2.775 1.00 0.00 C ATOM 1315 CD LYS A 87 8.726 13.673 2.371 1.00 0.00 C ATOM 1316 CE LYS A 87 8.013 14.554 3.404 1.00 0.00 C ATOM 1317 NZ LYS A 87 6.570 14.261 3.492 1.00 0.00 N ATOM 0 H LYS A 87 10.888 9.695 0.487 1.00 0.00 H new ATOM 0 HA LYS A 87 9.740 9.800 3.195 1.00 0.00 H new ATOM 0 HB2 LYS A 87 10.500 11.764 1.644 1.00 0.00 H new ATOM 0 HB3 LYS A 87 9.007 11.467 0.777 1.00 0.00 H new ATOM 0 HG2 LYS A 87 7.706 11.829 2.858 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.190 12.078 3.757 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.753 14.017 2.249 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.237 13.782 1.403 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.471 14.406 4.382 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.153 15.603 3.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 6.120 14.926 4.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 6.137 14.361 2.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.433 13.288 3.834 1.00 0.00 H new ATOM 1331 N PHE A 88 8.378 7.788 2.051 1.00 0.00 N ATOM 1332 CA PHE A 88 7.271 6.817 1.902 1.00 0.00 C ATOM 1333 C PHE A 88 6.961 6.068 3.211 1.00 0.00 C ATOM 1334 O PHE A 88 6.482 4.928 3.201 1.00 0.00 O ATOM 1335 CB PHE A 88 7.636 5.848 0.767 1.00 0.00 C ATOM 1336 CG PHE A 88 6.778 6.018 -0.504 1.00 0.00 C ATOM 1337 CD1 PHE A 88 6.390 7.284 -0.969 1.00 0.00 C ATOM 1338 CD2 PHE A 88 6.372 4.876 -1.197 1.00 0.00 C ATOM 1339 CE1 PHE A 88 5.576 7.399 -2.103 1.00 0.00 C ATOM 1340 CE2 PHE A 88 5.557 4.981 -2.330 1.00 0.00 C ATOM 1341 CZ PHE A 88 5.149 6.239 -2.770 1.00 0.00 C ATOM 0 H PHE A 88 9.270 7.347 2.275 1.00 0.00 H new ATOM 0 HA PHE A 88 6.356 7.355 1.655 1.00 0.00 H new ATOM 0 HB2 PHE A 88 8.685 5.989 0.506 1.00 0.00 H new ATOM 0 HB3 PHE A 88 7.532 4.825 1.129 1.00 0.00 H new ATOM 0 HD1 PHE A 88 6.720 8.172 -0.451 1.00 0.00 H new ATOM 0 HD2 PHE A 88 6.690 3.902 -0.855 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.279 8.373 -2.462 1.00 0.00 H new ATOM 0 HE2 PHE A 88 5.246 4.093 -2.860 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.500 6.322 -3.629 1.00 0.00 H new ATOM 1351 N SER A 89 7.174 6.743 4.337 1.00 0.00 N ATOM 1352 CA SER A 89 6.924 6.167 5.680 1.00 0.00 C ATOM 1353 C SER A 89 5.558 6.613 6.220 1.00 0.00 C ATOM 1354 O SER A 89 5.416 7.683 6.808 1.00 0.00 O ATOM 1355 CB SER A 89 8.034 6.598 6.646 1.00 0.00 C ATOM 1356 OG SER A 89 9.302 6.134 6.163 1.00 0.00 O ATOM 0 H SER A 89 7.523 7.701 4.358 1.00 0.00 H new ATOM 0 HA SER A 89 6.921 5.080 5.594 1.00 0.00 H new ATOM 0 HB2 SER A 89 8.045 7.684 6.741 1.00 0.00 H new ATOM 0 HB3 SER A 89 7.842 6.193 7.640 1.00 0.00 H new ATOM 0 HG SER A 89 9.958 6.158 6.891 1.00 0.00 H new ATOM 1362 N SER A 90 4.538 5.882 5.757 1.00 0.00 N ATOM 1363 CA SER A 90 3.093 6.054 6.083 1.00 0.00 C ATOM 1364 C SER A 90 2.582 7.509 6.081 1.00 0.00 C ATOM 1365 O SER A 90 1.716 7.894 6.873 1.00 0.00 O ATOM 1366 CB SER A 90 2.749 5.329 7.394 1.00 0.00 C ATOM 1367 OG SER A 90 1.533 4.603 7.221 1.00 0.00 O ATOM 0 H SER A 90 4.692 5.110 5.109 1.00 0.00 H new ATOM 0 HA SER A 90 2.554 5.589 5.258 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.556 4.651 7.671 1.00 0.00 H new ATOM 0 HB3 SER A 90 2.645 6.049 8.206 1.00 0.00 H new ATOM 0 HG SER A 90 0.810 5.225 6.996 1.00 0.00 H new ATOM 1373 N GLN A 91 3.070 8.279 5.114 1.00 0.00 N ATOM 1374 CA GLN A 91 2.754 9.719 5.006 1.00 0.00 C ATOM 1375 C GLN A 91 1.907 10.069 3.768 1.00 0.00 C ATOM 1376 O GLN A 91 0.694 9.869 3.798 1.00 0.00 O ATOM 1377 CB GLN A 91 4.059 10.523 5.097 1.00 0.00 C ATOM 1378 CG GLN A 91 3.854 11.903 5.732 1.00 0.00 C ATOM 1379 CD GLN A 91 3.655 11.796 7.250 1.00 0.00 C ATOM 1380 OE1 GLN A 91 4.598 11.844 8.020 1.00 0.00 O ATOM 1381 NE2 GLN A 91 2.434 11.659 7.699 1.00 0.00 N ATOM 0 H GLN A 91 3.692 7.936 4.382 1.00 0.00 H new ATOM 0 HA GLN A 91 2.114 9.997 5.843 1.00 0.00 H new ATOM 0 HB2 GLN A 91 4.788 9.962 5.682 1.00 0.00 H new ATOM 0 HB3 GLN A 91 4.478 10.645 4.098 1.00 0.00 H new ATOM 0 HG2 GLN A 91 4.717 12.535 5.520 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.987 12.387 5.283 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.652 11.620 7.046 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.264 11.591 8.702 1.00 0.00 H new ATOM 1390 N VAL A 92 2.558 10.375 2.646 1.00 0.00 N ATOM 1391 CA VAL A 92 1.908 10.852 1.400 1.00 0.00 C ATOM 1392 C VAL A 92 0.695 10.013 0.930 1.00 0.00 C ATOM 1393 O VAL A 92 -0.419 10.535 0.863 1.00 0.00 O ATOM 1394 CB VAL A 92 2.979 11.104 0.316 1.00 0.00 C ATOM 1395 CG1 VAL A 92 3.725 9.839 -0.143 1.00 0.00 C ATOM 1396 CG2 VAL A 92 2.415 11.874 -0.881 1.00 0.00 C ATOM 0 H VAL A 92 3.572 10.301 2.564 1.00 0.00 H new ATOM 0 HA VAL A 92 1.434 11.807 1.626 1.00 0.00 H new ATOM 0 HB VAL A 92 3.726 11.729 0.806 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.458 10.105 -0.904 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.234 9.387 0.709 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.012 9.127 -0.559 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.203 12.029 -1.618 1.00 0.00 H new ATOM 0 HG22 VAL A 92 1.604 11.303 -1.332 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.036 12.840 -0.547 1.00 0.00 H new ATOM 1406 N ILE A 93 0.909 8.706 0.789 1.00 0.00 N ATOM 1407 CA ILE A 93 -0.123 7.704 0.423 1.00 0.00 C ATOM 1408 C ILE A 93 -1.276 7.693 1.438 1.00 0.00 C ATOM 1409 O ILE A 93 -2.435 7.906 1.093 1.00 0.00 O ATOM 1410 CB ILE A 93 0.538 6.311 0.348 1.00 0.00 C ATOM 1411 CG1 ILE A 93 1.737 6.296 -0.616 1.00 0.00 C ATOM 1412 CG2 ILE A 93 -0.485 5.247 -0.079 1.00 0.00 C ATOM 1413 CD1 ILE A 93 2.703 5.139 -0.334 1.00 0.00 C ATOM 0 H ILE A 93 1.830 8.290 0.928 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.544 7.969 -0.547 1.00 0.00 H new ATOM 0 HB ILE A 93 0.905 6.077 1.347 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.374 6.220 -1.641 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.274 7.241 -0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.001 4.273 -0.126 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -1.298 5.212 0.646 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.885 5.500 -1.061 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.531 5.175 -1.042 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.090 5.227 0.681 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.176 4.191 -0.440 1.00 0.00 H new ATOM 1425 N ASN A 94 -0.874 7.640 2.713 1.00 0.00 N ATOM 1426 CA ASN A 94 -1.751 7.414 3.870 1.00 0.00 C ATOM 1427 C ASN A 94 -2.834 8.498 4.037 1.00 0.00 C ATOM 1428 O ASN A 94 -3.963 8.167 4.391 1.00 0.00 O ATOM 1429 CB ASN A 94 -0.853 7.288 5.102 1.00 0.00 C ATOM 1430 CG ASN A 94 -1.554 6.748 6.352 1.00 0.00 C ATOM 1431 OD1 ASN A 94 -2.494 5.979 6.310 1.00 0.00 O ATOM 1432 ND2 ASN A 94 -1.024 7.102 7.508 1.00 0.00 N ATOM 0 H ASN A 94 0.104 7.757 2.978 1.00 0.00 H new ATOM 0 HA ASN A 94 -2.321 6.497 3.721 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -0.016 6.633 4.860 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -0.434 8.268 5.331 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -1.403 6.729 8.378 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.235 7.748 7.531 1.00 0.00 H new ATOM 1439 N THR A 95 -2.534 9.727 3.616 1.00 0.00 N ATOM 1440 CA THR A 95 -3.490 10.854 3.523 1.00 0.00 C ATOM 1441 C THR A 95 -4.797 10.439 2.798 1.00 0.00 C ATOM 1442 O THR A 95 -5.824 10.209 3.445 1.00 0.00 O ATOM 1443 CB THR A 95 -2.868 12.042 2.767 1.00 0.00 C ATOM 1444 OG1 THR A 95 -1.440 12.045 2.862 1.00 0.00 O ATOM 1445 CG2 THR A 95 -3.435 13.376 3.288 1.00 0.00 C ATOM 0 H THR A 95 -1.593 9.984 3.319 1.00 0.00 H new ATOM 0 HA THR A 95 -3.726 11.147 4.546 1.00 0.00 H new ATOM 0 HB THR A 95 -3.133 11.929 1.716 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.062 11.511 2.132 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.982 14.202 2.740 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.515 13.393 3.143 1.00 0.00 H new ATOM 0 HG23 THR A 95 -3.209 13.477 4.350 1.00 0.00 H new ATOM 1453 N LEU A 96 -4.676 10.185 1.492 1.00 0.00 N ATOM 1454 CA LEU A 96 -5.783 9.704 0.643 1.00 0.00 C ATOM 1455 C LEU A 96 -6.331 8.354 1.121 1.00 0.00 C ATOM 1456 O LEU A 96 -7.537 8.194 1.322 1.00 0.00 O ATOM 1457 CB LEU A 96 -5.290 9.593 -0.809 1.00 0.00 C ATOM 1458 CG LEU A 96 -6.345 9.024 -1.777 1.00 0.00 C ATOM 1459 CD1 LEU A 96 -7.395 10.060 -2.169 1.00 0.00 C ATOM 1460 CD2 LEU A 96 -5.659 8.437 -3.000 1.00 0.00 C ATOM 0 H LEU A 96 -3.800 10.307 0.984 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.600 10.422 0.709 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.985 10.580 -1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.405 8.958 -0.836 1.00 0.00 H new ATOM 0 HG LEU A 96 -6.882 8.230 -1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -8.115 9.608 -2.852 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -7.913 10.410 -1.276 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.909 10.903 -2.660 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.410 8.036 -3.681 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -5.089 9.216 -3.506 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.986 7.637 -2.691 1.00 0.00 H new ATOM 1472 N MET A 97 -5.418 7.435 1.424 1.00 0.00 N ATOM 1473 CA MET A 97 -5.701 6.073 1.908 1.00 0.00 C ATOM 1474 C MET A 97 -6.652 6.027 3.120 1.00 0.00 C ATOM 1475 O MET A 97 -7.656 5.316 3.117 1.00 0.00 O ATOM 1476 CB MET A 97 -4.324 5.479 2.175 1.00 0.00 C ATOM 1477 CG MET A 97 -4.324 4.122 2.876 1.00 0.00 C ATOM 1478 SD MET A 97 -2.674 3.351 2.833 1.00 0.00 S ATOM 1479 CE MET A 97 -2.739 2.684 1.193 1.00 0.00 C ATOM 0 H MET A 97 -4.418 7.619 1.338 1.00 0.00 H new ATOM 0 HA MET A 97 -6.256 5.488 1.175 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.799 5.379 1.225 1.00 0.00 H new ATOM 0 HB3 MET A 97 -3.754 6.183 2.781 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.643 4.246 3.911 1.00 0.00 H new ATOM 0 HG3 MET A 97 -5.048 3.463 2.396 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.677 1.597 1.240 1.00 0.00 H new ATOM 0 HE2 MET A 97 -3.677 2.974 0.719 1.00 0.00 H new ATOM 0 HE3 MET A 97 -1.903 3.070 0.610 1.00 0.00 H new ATOM 1489 N GLU A 98 -6.335 6.850 4.123 1.00 0.00 N ATOM 1490 CA GLU A 98 -7.175 7.043 5.325 1.00 0.00 C ATOM 1491 C GLU A 98 -8.528 7.674 4.982 1.00 0.00 C ATOM 1492 O GLU A 98 -9.548 7.047 5.281 1.00 0.00 O ATOM 1493 CB GLU A 98 -6.442 7.894 6.364 1.00 0.00 C ATOM 1494 CG GLU A 98 -5.303 7.131 7.035 1.00 0.00 C ATOM 1495 CD GLU A 98 -4.345 8.023 7.828 1.00 0.00 C ATOM 1496 OE1 GLU A 98 -4.073 9.156 7.370 1.00 0.00 O ATOM 1497 OE2 GLU A 98 -3.822 7.520 8.854 1.00 0.00 O ATOM 0 H GLU A 98 -5.482 7.409 4.131 1.00 0.00 H new ATOM 0 HA GLU A 98 -7.368 6.056 5.746 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.045 8.788 5.884 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.150 8.228 7.123 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.725 6.382 7.705 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.738 6.595 6.272 1.00 0.00 H new ATOM 1504 N ARG A 99 -8.545 8.780 4.235 1.00 0.00 N ATOM 1505 CA ARG A 99 -9.816 9.431 3.846 1.00 0.00 C ATOM 1506 C ARG A 99 -10.721 8.531 2.990 1.00 0.00 C ATOM 1507 O ARG A 99 -11.937 8.523 3.185 1.00 0.00 O ATOM 1508 CB ARG A 99 -9.597 10.831 3.251 1.00 0.00 C ATOM 1509 CG ARG A 99 -9.133 10.885 1.797 1.00 0.00 C ATOM 1510 CD ARG A 99 -8.884 12.323 1.356 1.00 0.00 C ATOM 1511 NE ARG A 99 -8.829 12.378 -0.112 1.00 0.00 N ATOM 1512 CZ ARG A 99 -8.498 13.431 -0.867 1.00 0.00 C ATOM 1513 NH1 ARG A 99 -8.023 14.554 -0.349 1.00 0.00 N ATOM 1514 NH2 ARG A 99 -8.557 13.340 -2.192 1.00 0.00 N ATOM 0 H ARG A 99 -7.707 9.246 3.886 1.00 0.00 H new ATOM 0 HA ARG A 99 -10.375 9.586 4.769 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -10.531 11.387 3.333 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.861 11.352 3.864 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -8.219 10.302 1.681 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.886 10.429 1.154 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -9.678 12.972 1.726 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -7.949 12.689 1.780 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.069 11.520 -0.609 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -7.898 14.637 0.660 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -7.782 15.335 -0.959 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -8.854 12.468 -2.631 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -8.305 14.142 -2.770 1.00 0.00 H new ATOM 1528 N PHE A 100 -10.106 7.674 2.177 1.00 0.00 N ATOM 1529 CA PHE A 100 -10.764 6.583 1.436 1.00 0.00 C ATOM 1530 C PHE A 100 -11.478 5.589 2.373 1.00 0.00 C ATOM 1531 O PHE A 100 -12.705 5.602 2.430 1.00 0.00 O ATOM 1532 CB PHE A 100 -9.717 5.922 0.514 1.00 0.00 C ATOM 1533 CG PHE A 100 -10.145 4.691 -0.295 1.00 0.00 C ATOM 1534 CD1 PHE A 100 -11.487 4.454 -0.657 1.00 0.00 C ATOM 1535 CD2 PHE A 100 -9.153 3.769 -0.667 1.00 0.00 C ATOM 1536 CE1 PHE A 100 -11.820 3.292 -1.367 1.00 0.00 C ATOM 1537 CE2 PHE A 100 -9.491 2.617 -1.385 1.00 0.00 C ATOM 1538 CZ PHE A 100 -10.831 2.370 -1.725 1.00 0.00 C ATOM 0 H PHE A 100 -9.101 7.716 2.006 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.564 6.986 0.815 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.366 6.678 -0.189 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -8.863 5.637 1.129 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -12.255 5.164 -0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.123 3.950 -0.397 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -12.849 3.107 -1.640 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -8.722 1.918 -1.678 1.00 0.00 H new ATOM 0 HZ PHE A 100 -11.097 1.471 -2.261 1.00 0.00 H new ATOM 1548 N LEU A 101 -10.717 4.843 3.170 1.00 0.00 N ATOM 1549 CA LEU A 101 -11.274 3.830 4.104 1.00 0.00 C ATOM 1550 C LEU A 101 -12.192 4.415 5.197 1.00 0.00 C ATOM 1551 O LEU A 101 -13.214 3.819 5.525 1.00 0.00 O ATOM 1552 CB LEU A 101 -10.140 2.986 4.697 1.00 0.00 C ATOM 1553 CG LEU A 101 -10.571 1.887 5.681 1.00 0.00 C ATOM 1554 CD1 LEU A 101 -11.536 0.875 5.069 1.00 0.00 C ATOM 1555 CD2 LEU A 101 -9.349 1.152 6.222 1.00 0.00 C ATOM 0 H LEU A 101 -9.700 4.912 3.197 1.00 0.00 H new ATOM 0 HA LEU A 101 -11.929 3.187 3.516 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.592 2.520 3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.445 3.652 5.207 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.100 2.393 6.489 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -11.801 0.127 5.816 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -12.438 1.388 4.734 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.060 0.386 4.219 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -9.669 0.376 6.918 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -8.804 0.696 5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -8.699 1.858 6.740 1.00 0.00 H new ATOM 1567 N LYS A 102 -11.804 5.549 5.767 1.00 0.00 N ATOM 1568 CA LYS A 102 -12.553 6.213 6.856 1.00 0.00 C ATOM 1569 C LYS A 102 -13.804 6.982 6.389 1.00 0.00 C ATOM 1570 O LYS A 102 -14.830 6.923 7.075 1.00 0.00 O ATOM 1571 CB LYS A 102 -11.652 7.193 7.625 1.00 0.00 C ATOM 1572 CG LYS A 102 -10.498 6.539 8.381 1.00 0.00 C ATOM 1573 CD LYS A 102 -10.987 5.650 9.523 1.00 0.00 C ATOM 1574 CE LYS A 102 -9.805 5.073 10.303 1.00 0.00 C ATOM 1575 NZ LYS A 102 -10.275 4.231 11.411 1.00 0.00 N ATOM 0 H LYS A 102 -10.957 6.047 5.493 1.00 0.00 H new ATOM 0 HA LYS A 102 -12.886 5.396 7.496 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.243 7.918 6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.265 7.749 8.335 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.903 5.944 7.688 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.842 7.313 8.780 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.624 6.228 10.193 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -11.596 4.839 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.174 4.486 9.636 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -9.189 5.884 10.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -9.457 3.849 11.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.858 4.801 12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -10.843 3.446 11.034 1.00 0.00 H new ATOM 1589 N ALA A 103 -13.672 7.694 5.268 1.00 0.00 N ATOM 1590 CA ALA A 103 -14.601 8.745 4.766 1.00 0.00 C ATOM 1591 C ALA A 103 -14.837 9.889 5.773 1.00 0.00 C ATOM 1592 O ALA A 103 -14.103 10.876 5.785 1.00 0.00 O ATOM 1593 CB ALA A 103 -15.903 8.129 4.219 1.00 0.00 C ATOM 0 H ALA A 103 -12.878 7.557 4.643 1.00 0.00 H new ATOM 0 HA ALA A 103 -14.104 9.227 3.924 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -16.559 8.923 3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -15.668 7.453 3.396 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -16.404 7.574 5.012 1.00 0.00 H new ATOM 1599 N TYR A 104 -15.576 9.534 6.819 1.00 0.00 N ATOM 1600 CA TYR A 104 -16.058 10.377 7.918 1.00 0.00 C ATOM 1601 C TYR A 104 -14.961 11.141 8.686 1.00 0.00 C ATOM 1602 O TYR A 104 -14.729 12.320 8.421 1.00 0.00 O ATOM 1603 CB TYR A 104 -16.882 9.417 8.801 1.00 0.00 C ATOM 1604 CG TYR A 104 -17.452 10.020 10.078 1.00 0.00 C ATOM 1605 CD1 TYR A 104 -18.663 10.725 10.034 1.00 0.00 C ATOM 1606 CD2 TYR A 104 -16.865 9.712 11.309 1.00 0.00 C ATOM 1607 CE1 TYR A 104 -19.299 11.094 11.228 1.00 0.00 C ATOM 1608 CE2 TYR A 104 -17.500 10.090 12.503 1.00 0.00 C ATOM 1609 CZ TYR A 104 -18.714 10.776 12.459 1.00 0.00 C ATOM 1610 OH TYR A 104 -19.373 11.067 13.601 1.00 0.00 O ATOM 0 H TYR A 104 -15.881 8.568 6.933 1.00 0.00 H new ATOM 0 HA TYR A 104 -16.656 11.206 7.539 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -17.707 9.024 8.207 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -16.252 8.570 9.071 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -19.105 10.983 9.083 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -15.924 9.184 11.342 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -20.240 11.623 11.198 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -17.049 9.850 13.455 1.00 0.00 H new ATOM 0 HH TYR A 104 -18.836 10.783 14.370 1.00 0.00 H new ATOM 1620 N VAL A 105 -14.260 10.444 9.580 1.00 0.00 N ATOM 1621 CA VAL A 105 -13.337 11.070 10.562 1.00 0.00 C ATOM 1622 C VAL A 105 -12.070 11.744 9.977 1.00 0.00 C ATOM 1623 O VAL A 105 -11.744 12.855 10.380 1.00 0.00 O ATOM 1624 CB VAL A 105 -13.054 10.083 11.720 1.00 0.00 C ATOM 1625 CG1 VAL A 105 -12.202 8.876 11.326 1.00 0.00 C ATOM 1626 CG2 VAL A 105 -12.483 10.805 12.951 1.00 0.00 C ATOM 0 H VAL A 105 -14.307 9.428 9.654 1.00 0.00 H new ATOM 0 HA VAL A 105 -13.863 11.936 10.964 1.00 0.00 H new ATOM 0 HB VAL A 105 -14.026 9.668 11.987 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -12.052 8.237 12.196 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -12.710 8.312 10.544 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -11.235 9.218 10.956 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -12.297 10.081 13.744 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -11.548 11.298 12.683 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -13.198 11.549 13.301 1.00 0.00 H new ATOM 1636 N GLU A 106 -11.447 11.116 8.982 1.00 0.00 N ATOM 1637 CA GLU A 106 -10.236 11.676 8.341 1.00 0.00 C ATOM 1638 C GLU A 106 -10.482 13.023 7.631 1.00 0.00 C ATOM 1639 O GLU A 106 -9.600 13.880 7.612 1.00 0.00 O ATOM 1640 CB GLU A 106 -9.603 10.654 7.379 1.00 0.00 C ATOM 1641 CG GLU A 106 -8.196 11.060 6.931 1.00 0.00 C ATOM 1642 CD GLU A 106 -7.124 11.003 8.032 1.00 0.00 C ATOM 1643 OE1 GLU A 106 -7.133 10.001 8.793 1.00 0.00 O ATOM 1644 OE2 GLU A 106 -6.286 11.926 8.061 1.00 0.00 O ATOM 0 H GLU A 106 -11.751 10.222 8.596 1.00 0.00 H new ATOM 0 HA GLU A 106 -9.534 11.885 9.149 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -9.558 9.680 7.867 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -10.241 10.542 6.503 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -7.890 10.410 6.112 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -8.235 12.075 6.535 1.00 0.00 H new ATOM 1651 N CYS A 107 -11.687 13.181 7.080 1.00 0.00 N ATOM 1652 CA CYS A 107 -12.123 14.451 6.463 1.00 0.00 C ATOM 1653 C CYS A 107 -13.168 15.152 7.362 1.00 0.00 C ATOM 1654 O CYS A 107 -14.056 15.855 6.875 1.00 0.00 O ATOM 1655 CB CYS A 107 -12.671 14.109 5.075 1.00 0.00 C ATOM 1656 SG CYS A 107 -13.027 15.558 4.009 1.00 0.00 S ATOM 0 H CYS A 107 -12.389 12.442 7.045 1.00 0.00 H new ATOM 0 HA CYS A 107 -11.297 15.155 6.360 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -11.953 13.468 4.564 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -13.587 13.530 5.194 1.00 0.00 H new ATOM 0 HG CYS A 107 -13.668 16.456 4.697 1.00 0.00 H new ATOM 1662 N SER A 108 -12.962 15.023 8.673 1.00 0.00 N ATOM 1663 CA SER A 108 -13.858 15.414 9.796 1.00 0.00 C ATOM 1664 C SER A 108 -15.139 16.176 9.425 1.00 0.00 C ATOM 1665 O SER A 108 -15.168 17.409 9.389 1.00 0.00 O ATOM 1666 CB SER A 108 -13.059 16.156 10.877 1.00 0.00 C ATOM 1667 OG SER A 108 -12.527 17.377 10.349 1.00 0.00 O ATOM 0 H SER A 108 -12.097 14.610 9.021 1.00 0.00 H new ATOM 0 HA SER A 108 -14.238 14.468 10.181 1.00 0.00 H new ATOM 0 HB2 SER A 108 -13.701 16.370 11.731 1.00 0.00 H new ATOM 0 HB3 SER A 108 -12.248 15.524 11.238 1.00 0.00 H new ATOM 0 HG SER A 108 -12.021 17.842 11.047 1.00 0.00 H new ATOM 1673 N THR A 109 -16.087 15.385 8.917 1.00 0.00 N ATOM 1674 CA THR A 109 -17.443 15.814 8.485 1.00 0.00 C ATOM 1675 C THR A 109 -17.473 17.134 7.666 1.00 0.00 C ATOM 1676 O THR A 109 -18.186 18.071 8.024 1.00 0.00 O ATOM 1677 CB THR A 109 -18.438 15.875 9.652 1.00 0.00 C ATOM 1678 OG1 THR A 109 -17.992 16.803 10.643 1.00 0.00 O ATOM 1679 CG2 THR A 109 -18.708 14.491 10.260 1.00 0.00 C ATOM 0 H THR A 109 -15.937 14.385 8.785 1.00 0.00 H new ATOM 0 HA THR A 109 -17.763 15.029 7.800 1.00 0.00 H new ATOM 0 HB THR A 109 -19.389 16.228 9.253 1.00 0.00 H new ATOM 0 HG1 THR A 109 -17.950 17.702 10.254 1.00 0.00 H new ATOM 0 HG21 THR A 109 -19.418 14.587 11.082 1.00 0.00 H new ATOM 0 HG22 THR A 109 -19.123 13.833 9.497 1.00 0.00 H new ATOM 0 HG23 THR A 109 -17.775 14.070 10.634 1.00 0.00 H new ATOM 1687 N CYS A 110 -16.537 17.243 6.729 1.00 0.00 N ATOM 1688 CA CYS A 110 -16.306 18.398 5.820 1.00 0.00 C ATOM 1689 C CYS A 110 -16.145 19.772 6.512 1.00 0.00 C ATOM 1690 O CYS A 110 -16.302 20.816 5.873 1.00 0.00 O ATOM 1691 CB CYS A 110 -17.340 18.430 4.690 1.00 0.00 C ATOM 1692 SG CYS A 110 -19.063 18.830 5.175 1.00 0.00 S ATOM 0 H CYS A 110 -15.870 16.490 6.561 1.00 0.00 H new ATOM 0 HA CYS A 110 -15.323 18.218 5.386 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -17.015 19.161 3.949 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -17.340 17.457 4.199 1.00 0.00 H new ATOM 0 HG CYS A 110 -19.215 18.620 6.449 1.00 0.00 H new ATOM 1698 N LYS A 111 -15.634 19.726 7.746 1.00 0.00 N ATOM 1699 CA LYS A 111 -15.348 20.844 8.672 1.00 0.00 C ATOM 1700 C LYS A 111 -15.638 22.279 8.174 1.00 0.00 C ATOM 1701 O LYS A 111 -16.711 22.807 8.436 1.00 0.00 O ATOM 1702 CB LYS A 111 -13.910 20.637 9.175 1.00 0.00 C ATOM 1703 CG LYS A 111 -13.548 21.516 10.384 1.00 0.00 C ATOM 1704 CD LYS A 111 -12.099 21.297 10.854 1.00 0.00 C ATOM 1705 CE LYS A 111 -11.058 21.836 9.865 1.00 0.00 C ATOM 1706 NZ LYS A 111 -9.703 21.558 10.336 1.00 0.00 N ATOM 0 H LYS A 111 -15.386 18.830 8.166 1.00 0.00 H new ATOM 0 HA LYS A 111 -16.073 20.795 9.484 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -13.776 19.589 9.445 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -13.216 20.848 8.362 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -13.688 22.565 10.122 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -14.231 21.299 11.206 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -11.959 21.782 11.820 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -11.930 20.231 11.006 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -11.209 21.380 8.887 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -11.191 22.911 9.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -9.014 21.931 9.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -9.556 22.014 11.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.573 20.531 10.433 1.00 0.00 H new ATOM 1720 N SER A 112 -14.678 22.890 7.472 1.00 0.00 N ATOM 1721 CA SER A 112 -14.822 24.245 6.899 1.00 0.00 C ATOM 1722 C SER A 112 -14.839 24.258 5.357 1.00 0.00 C ATOM 1723 O SER A 112 -14.435 25.232 4.715 1.00 0.00 O ATOM 1724 CB SER A 112 -13.667 25.101 7.424 1.00 0.00 C ATOM 1725 OG SER A 112 -12.422 24.580 6.953 1.00 0.00 O ATOM 0 H SER A 112 -13.772 22.462 7.281 1.00 0.00 H new ATOM 0 HA SER A 112 -15.787 24.646 7.208 1.00 0.00 H new ATOM 0 HB2 SER A 112 -13.788 26.133 7.093 1.00 0.00 H new ATOM 0 HB3 SER A 112 -13.677 25.112 8.514 1.00 0.00 H new ATOM 0 HG SER A 112 -11.687 25.133 7.291 1.00 0.00 H new ATOM 1731 N LEU A 113 -15.295 23.153 4.776 1.00 0.00 N ATOM 1732 CA LEU A 113 -15.299 22.873 3.322 1.00 0.00 C ATOM 1733 C LEU A 113 -13.922 23.090 2.645 1.00 0.00 C ATOM 1734 O LEU A 113 -12.889 23.035 3.317 1.00 0.00 O ATOM 1735 CB LEU A 113 -16.458 23.619 2.627 1.00 0.00 C ATOM 1736 CG LEU A 113 -17.843 22.946 2.691 1.00 0.00 C ATOM 1737 CD1 LEU A 113 -17.826 21.549 2.042 1.00 0.00 C ATOM 1738 CD2 LEU A 113 -18.440 22.918 4.094 1.00 0.00 C ATOM 0 H LEU A 113 -15.692 22.387 5.319 1.00 0.00 H new ATOM 0 HA LEU A 113 -15.483 21.806 3.197 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -16.540 24.611 3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -16.194 23.759 1.579 1.00 0.00 H new ATOM 0 HG LEU A 113 -18.510 23.575 2.102 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -18.820 21.106 2.106 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -17.535 21.638 0.995 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -17.111 20.914 2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -19.414 22.430 4.065 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -17.777 22.366 4.760 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -18.555 23.938 4.461 1.00 0.00 H new ATOM 1750 N ASP A 114 -13.918 23.273 1.324 1.00 0.00 N ATOM 1751 CA ASP A 114 -12.687 23.427 0.511 1.00 0.00 C ATOM 1752 C ASP A 114 -12.981 23.919 -0.916 1.00 0.00 C ATOM 1753 O ASP A 114 -13.559 23.210 -1.733 1.00 0.00 O ATOM 1754 CB ASP A 114 -11.854 22.133 0.481 1.00 0.00 C ATOM 1755 CG ASP A 114 -12.575 20.880 -0.044 1.00 0.00 C ATOM 1756 OD1 ASP A 114 -13.566 20.453 0.584 1.00 0.00 O ATOM 1757 OD2 ASP A 114 -12.081 20.348 -1.063 1.00 0.00 O ATOM 0 H ASP A 114 -14.774 23.321 0.772 1.00 0.00 H new ATOM 0 HA ASP A 114 -12.095 24.198 1.004 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -10.972 22.306 -0.136 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -11.501 21.928 1.492 1.00 0.00 H new ATOM 1762 N THR A 115 -12.763 25.221 -1.086 1.00 0.00 N ATOM 1763 CA THR A 115 -12.886 25.904 -2.398 1.00 0.00 C ATOM 1764 C THR A 115 -11.709 25.550 -3.313 1.00 0.00 C ATOM 1765 O THR A 115 -10.675 26.216 -3.347 1.00 0.00 O ATOM 1766 CB THR A 115 -12.959 27.426 -2.205 1.00 0.00 C ATOM 1767 OG1 THR A 115 -13.708 27.748 -1.020 1.00 0.00 O ATOM 1768 CG2 THR A 115 -13.634 28.098 -3.416 1.00 0.00 C ATOM 0 H THR A 115 -12.495 25.845 -0.325 1.00 0.00 H new ATOM 0 HA THR A 115 -13.806 25.561 -2.870 1.00 0.00 H new ATOM 0 HB THR A 115 -11.939 27.797 -2.107 1.00 0.00 H new ATOM 0 HG1 THR A 115 -13.744 28.721 -0.910 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.675 29.176 -3.258 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.059 27.885 -4.317 1.00 0.00 H new ATOM 0 HG23 THR A 115 -14.646 27.709 -3.531 1.00 0.00 H new ATOM 1776 N ILE A 116 -11.852 24.385 -3.951 1.00 0.00 N ATOM 1777 CA ILE A 116 -10.882 23.844 -4.930 1.00 0.00 C ATOM 1778 C ILE A 116 -11.651 23.278 -6.153 1.00 0.00 C ATOM 1779 O ILE A 116 -12.855 23.057 -6.058 1.00 0.00 O ATOM 1780 CB ILE A 116 -9.961 22.806 -4.236 1.00 0.00 C ATOM 1781 CG1 ILE A 116 -8.827 22.356 -5.178 1.00 0.00 C ATOM 1782 CG2 ILE A 116 -10.750 21.628 -3.643 1.00 0.00 C ATOM 1783 CD1 ILE A 116 -7.663 21.640 -4.482 1.00 0.00 C ATOM 0 H ILE A 116 -12.656 23.775 -3.805 1.00 0.00 H new ATOM 0 HA ILE A 116 -10.227 24.630 -5.307 1.00 0.00 H new ATOM 0 HB ILE A 116 -9.491 23.299 -3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -9.244 21.692 -5.935 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -8.438 23.230 -5.700 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -10.060 20.930 -3.169 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -11.457 22.000 -2.901 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -11.294 21.117 -4.438 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -6.913 21.360 -5.222 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -7.215 22.306 -3.745 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -8.033 20.744 -3.984 1.00 0.00 H new ATOM 1795 N LEU A 117 -11.009 23.342 -7.314 1.00 0.00 N ATOM 1796 CA LEU A 117 -11.522 22.724 -8.554 1.00 0.00 C ATOM 1797 C LEU A 117 -10.444 21.890 -9.265 1.00 0.00 C ATOM 1798 O LEU A 117 -9.292 22.319 -9.367 1.00 0.00 O ATOM 1799 CB LEU A 117 -12.071 23.755 -9.554 1.00 0.00 C ATOM 1800 CG LEU A 117 -13.461 24.374 -9.266 1.00 0.00 C ATOM 1801 CD1 LEU A 117 -14.529 23.310 -8.969 1.00 0.00 C ATOM 1802 CD2 LEU A 117 -13.392 25.480 -8.209 1.00 0.00 C ATOM 0 H LEU A 117 -10.117 23.822 -7.433 1.00 0.00 H new ATOM 0 HA LEU A 117 -12.339 22.079 -8.231 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -11.350 24.570 -9.624 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -12.113 23.281 -10.535 1.00 0.00 H new ATOM 0 HG LEU A 117 -13.787 24.861 -10.185 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -15.484 23.798 -8.774 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -14.629 22.646 -9.827 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -14.232 22.731 -8.095 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -14.390 25.884 -8.040 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -13.004 25.069 -7.277 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -12.732 26.275 -8.557 1.00 0.00 H new ATOM 1814 N LYS A 118 -10.834 20.687 -9.654 1.00 0.00 N ATOM 1815 CA LYS A 118 -10.023 19.764 -10.476 1.00 0.00 C ATOM 1816 C LYS A 118 -10.878 19.089 -11.560 1.00 0.00 C ATOM 1817 O LYS A 118 -12.103 19.041 -11.472 1.00 0.00 O ATOM 1818 CB LYS A 118 -9.332 18.695 -9.632 1.00 0.00 C ATOM 1819 CG LYS A 118 -8.108 19.231 -8.887 1.00 0.00 C ATOM 1820 CD LYS A 118 -7.365 18.104 -8.183 1.00 0.00 C ATOM 1821 CE LYS A 118 -6.111 18.617 -7.462 1.00 0.00 C ATOM 1822 NZ LYS A 118 -5.110 19.151 -8.385 1.00 0.00 N ATOM 0 H LYS A 118 -11.746 20.302 -9.407 1.00 0.00 H new ATOM 0 HA LYS A 118 -9.253 20.371 -10.952 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -10.043 18.291 -8.911 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -9.028 17.870 -10.276 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -7.440 19.730 -9.589 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -8.420 19.978 -8.157 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -8.028 17.624 -7.463 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.081 17.344 -8.911 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -6.397 19.394 -6.753 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -5.670 17.804 -6.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -4.223 19.326 -7.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -4.939 18.464 -9.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -5.455 20.043 -8.793 1.00 0.00 H new ATOM 1836 N LYS A 119 -10.211 18.666 -12.633 1.00 0.00 N ATOM 1837 CA LYS A 119 -10.878 17.927 -13.722 1.00 0.00 C ATOM 1838 C LYS A 119 -11.206 16.458 -13.399 1.00 0.00 C ATOM 1839 O LYS A 119 -10.457 15.734 -12.740 1.00 0.00 O ATOM 1840 CB LYS A 119 -10.092 18.033 -15.033 1.00 0.00 C ATOM 1841 CG LYS A 119 -10.261 19.441 -15.632 1.00 0.00 C ATOM 1842 CD LYS A 119 -9.473 19.648 -16.924 1.00 0.00 C ATOM 1843 CE LYS A 119 -7.972 19.784 -16.684 1.00 0.00 C ATOM 1844 NZ LYS A 119 -7.270 20.092 -17.942 1.00 0.00 N ATOM 0 H LYS A 119 -9.213 18.818 -12.778 1.00 0.00 H new ATOM 0 HA LYS A 119 -11.843 18.420 -13.840 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.037 17.829 -14.852 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -10.445 17.282 -15.740 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -11.318 19.621 -15.827 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -9.942 20.181 -14.898 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -9.655 18.808 -17.594 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -9.839 20.543 -17.428 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.785 20.572 -15.955 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.581 18.859 -16.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.250 20.181 -17.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.433 19.326 -18.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.631 20.987 -18.331 1.00 0.00 H new ATOM 1858 N GLU A 120 -12.392 16.100 -13.884 1.00 0.00 N ATOM 1859 CA GLU A 120 -12.962 14.740 -13.860 1.00 0.00 C ATOM 1860 C GLU A 120 -12.015 13.781 -14.611 1.00 0.00 C ATOM 1861 O GLU A 120 -11.787 13.957 -15.811 1.00 0.00 O ATOM 1862 CB GLU A 120 -14.330 14.847 -14.558 1.00 0.00 C ATOM 1863 CG GLU A 120 -15.335 13.735 -14.237 1.00 0.00 C ATOM 1864 CD GLU A 120 -14.961 12.365 -14.794 1.00 0.00 C ATOM 1865 OE1 GLU A 120 -14.253 11.646 -14.056 1.00 0.00 O ATOM 1866 OE2 GLU A 120 -15.336 12.093 -15.956 1.00 0.00 O ATOM 0 H GLU A 120 -13.016 16.775 -14.326 1.00 0.00 H new ATOM 0 HA GLU A 120 -13.080 14.349 -12.849 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -14.779 15.804 -14.291 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -14.166 14.862 -15.636 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -15.438 13.657 -13.155 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -16.311 14.019 -14.631 1.00 0.00 H new ATOM 1873 N LYS A 121 -11.398 12.882 -13.847 1.00 0.00 N ATOM 1874 CA LYS A 121 -10.294 11.985 -14.273 1.00 0.00 C ATOM 1875 C LYS A 121 -8.967 12.694 -14.577 1.00 0.00 C ATOM 1876 O LYS A 121 -7.973 12.443 -13.906 1.00 0.00 O ATOM 1877 CB LYS A 121 -10.675 11.059 -15.448 1.00 0.00 C ATOM 1878 CG LYS A 121 -11.612 9.908 -15.043 1.00 0.00 C ATOM 1879 CD LYS A 121 -10.941 8.862 -14.145 1.00 0.00 C ATOM 1880 CE LYS A 121 -9.942 7.957 -14.867 1.00 0.00 C ATOM 1881 NZ LYS A 121 -10.604 7.067 -15.836 1.00 0.00 N ATOM 0 H LYS A 121 -11.655 12.743 -12.870 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.128 11.371 -13.388 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -11.156 11.652 -16.226 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -9.766 10.642 -15.881 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -12.477 10.320 -14.524 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -11.983 9.418 -15.943 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -10.427 9.375 -13.332 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -11.714 8.241 -13.692 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -9.204 8.571 -15.384 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -9.401 7.357 -14.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -9.924 6.359 -16.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -11.403 6.586 -15.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -10.954 7.627 -16.639 1.00 0.00 H new ATOM 1895 N LYS A 122 -9.002 13.681 -15.481 1.00 0.00 N ATOM 1896 CA LYS A 122 -7.829 14.459 -15.939 1.00 0.00 C ATOM 1897 C LYS A 122 -7.266 15.513 -14.947 1.00 0.00 C ATOM 1898 O LYS A 122 -6.876 16.621 -15.307 1.00 0.00 O ATOM 1899 CB LYS A 122 -8.118 15.072 -17.310 1.00 0.00 C ATOM 1900 CG LYS A 122 -8.197 14.007 -18.406 1.00 0.00 C ATOM 1901 CD LYS A 122 -8.295 14.585 -19.818 1.00 0.00 C ATOM 1902 CE LYS A 122 -9.627 15.284 -20.109 1.00 0.00 C ATOM 1903 NZ LYS A 122 -9.644 15.823 -21.472 1.00 0.00 N ATOM 0 H LYS A 122 -9.869 13.974 -15.931 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.018 13.734 -16.007 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.058 15.623 -17.271 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.337 15.791 -17.558 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.316 13.369 -18.344 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.064 13.372 -18.222 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -7.482 15.296 -19.967 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -8.152 13.781 -20.540 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.448 14.579 -19.981 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.784 16.090 -19.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.555 16.292 -21.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.873 16.512 -21.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -9.516 15.048 -22.153 1.00 0.00 H new ATOM 1917 N SER A 123 -7.196 15.088 -13.686 1.00 0.00 N ATOM 1918 CA SER A 123 -6.671 15.795 -12.498 1.00 0.00 C ATOM 1919 C SER A 123 -6.809 14.832 -11.306 1.00 0.00 C ATOM 1920 O SER A 123 -5.954 13.970 -11.142 1.00 0.00 O ATOM 1921 CB SER A 123 -7.364 17.133 -12.182 1.00 0.00 C ATOM 1922 OG SER A 123 -7.250 18.121 -13.206 1.00 0.00 O ATOM 0 H SER A 123 -7.533 14.158 -13.438 1.00 0.00 H new ATOM 0 HA SER A 123 -5.635 16.067 -12.702 1.00 0.00 H new ATOM 0 HB2 SER A 123 -8.421 16.944 -11.995 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.944 17.535 -11.260 1.00 0.00 H new ATOM 0 HG SER A 123 -6.870 17.714 -14.012 1.00 0.00 H new ATOM 1928 N TRP A 124 -7.933 14.916 -10.576 1.00 0.00 N ATOM 1929 CA TRP A 124 -8.357 13.947 -9.536 1.00 0.00 C ATOM 1930 C TRP A 124 -9.789 14.230 -9.024 1.00 0.00 C ATOM 1931 O TRP A 124 -10.123 13.966 -7.867 1.00 0.00 O ATOM 1932 CB TRP A 124 -7.360 13.960 -8.363 1.00 0.00 C ATOM 1933 CG TRP A 124 -7.166 12.579 -7.718 1.00 0.00 C ATOM 1934 CD1 TRP A 124 -8.092 11.628 -7.538 1.00 0.00 C ATOM 1935 CD2 TRP A 124 -5.973 12.080 -7.224 1.00 0.00 C ATOM 1936 NE1 TRP A 124 -7.536 10.554 -6.979 1.00 0.00 N ATOM 1937 CE2 TRP A 124 -6.243 10.797 -6.754 1.00 0.00 C ATOM 1938 CE3 TRP A 124 -4.670 12.593 -7.118 1.00 0.00 C ATOM 1939 CZ2 TRP A 124 -5.225 10.017 -6.194 1.00 0.00 C ATOM 1940 CZ3 TRP A 124 -3.651 11.824 -6.559 1.00 0.00 C ATOM 1941 CH2 TRP A 124 -3.923 10.530 -6.089 1.00 0.00 C ATOM 0 H TRP A 124 -8.597 15.682 -10.692 1.00 0.00 H new ATOM 0 HA TRP A 124 -8.366 12.958 -9.995 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -6.397 14.327 -8.717 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -7.709 14.662 -7.606 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -9.134 11.718 -7.806 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -8.021 9.684 -6.758 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -4.456 13.591 -7.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -5.442 9.019 -5.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 -2.651 12.224 -6.487 1.00 0.00 H new ATOM 0 HH2 TRP A 124 -3.137 9.934 -5.650 1.00 0.00 H new ATOM 1952 N TYR A 125 -10.648 14.675 -9.937 1.00 0.00 N ATOM 1953 CA TYR A 125 -12.071 15.076 -9.705 1.00 0.00 C ATOM 1954 C TYR A 125 -12.205 16.258 -8.718 1.00 0.00 C ATOM 1955 O TYR A 125 -12.385 17.397 -9.148 1.00 0.00 O ATOM 1956 CB TYR A 125 -12.989 13.924 -9.240 1.00 0.00 C ATOM 1957 CG TYR A 125 -12.641 12.527 -9.744 1.00 0.00 C ATOM 1958 CD1 TYR A 125 -13.032 12.095 -11.019 1.00 0.00 C ATOM 1959 CD2 TYR A 125 -11.947 11.659 -8.897 1.00 0.00 C ATOM 1960 CE1 TYR A 125 -12.714 10.793 -11.444 1.00 0.00 C ATOM 1961 CE2 TYR A 125 -11.637 10.358 -9.316 1.00 0.00 C ATOM 1962 CZ TYR A 125 -12.022 9.925 -10.583 1.00 0.00 C ATOM 1963 OH TYR A 125 -11.863 8.624 -10.918 1.00 0.00 O ATOM 0 H TYR A 125 -10.377 14.778 -10.915 1.00 0.00 H new ATOM 0 HA TYR A 125 -12.411 15.389 -10.692 1.00 0.00 H new ATOM 0 HB2 TYR A 125 -12.985 13.904 -8.150 1.00 0.00 H new ATOM 0 HB3 TYR A 125 -14.008 14.154 -9.551 1.00 0.00 H new ATOM 0 HD1 TYR A 125 -13.576 12.760 -11.673 1.00 0.00 H new ATOM 0 HD2 TYR A 125 -11.648 11.992 -7.914 1.00 0.00 H new ATOM 0 HE1 TYR A 125 -13.001 10.461 -12.431 1.00 0.00 H new ATOM 0 HE2 TYR A 125 -11.100 9.692 -8.657 1.00 0.00 H new ATOM 0 HH TYR A 125 -11.361 8.164 -10.213 1.00 0.00 H new ATOM 1973 N ILE A 126 -12.014 15.969 -7.435 1.00 0.00 N ATOM 1974 CA ILE A 126 -12.131 16.908 -6.296 1.00 0.00 C ATOM 1975 C ILE A 126 -13.523 17.537 -6.079 1.00 0.00 C ATOM 1976 O ILE A 126 -14.479 17.309 -6.818 1.00 0.00 O ATOM 1977 CB ILE A 126 -10.911 17.874 -6.315 1.00 0.00 C ATOM 1978 CG1 ILE A 126 -10.047 17.672 -5.064 1.00 0.00 C ATOM 1979 CG2 ILE A 126 -11.225 19.363 -6.531 1.00 0.00 C ATOM 1980 CD1 ILE A 126 -9.296 16.328 -5.076 1.00 0.00 C ATOM 0 H ILE A 126 -11.760 15.028 -7.133 1.00 0.00 H new ATOM 0 HA ILE A 126 -12.074 16.338 -5.369 1.00 0.00 H new ATOM 0 HB ILE A 126 -10.357 17.592 -7.211 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -9.326 18.486 -4.989 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -10.679 17.723 -4.178 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -10.297 19.935 -6.525 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -11.726 19.494 -7.490 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -11.875 19.717 -5.731 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -8.700 16.236 -4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -10.015 15.510 -5.122 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -8.641 16.285 -5.946 1.00 0.00 H new ATOM 1992 N VAL A 127 -13.641 18.083 -4.873 1.00 0.00 N ATOM 1993 CA VAL A 127 -14.820 18.828 -4.369 1.00 0.00 C ATOM 1994 C VAL A 127 -15.099 20.026 -5.302 1.00 0.00 C ATOM 1995 O VAL A 127 -14.185 20.756 -5.664 1.00 0.00 O ATOM 1996 CB VAL A 127 -14.536 19.274 -2.918 1.00 0.00 C ATOM 1997 CG1 VAL A 127 -15.674 20.085 -2.301 1.00 0.00 C ATOM 1998 CG2 VAL A 127 -14.246 18.084 -2.004 1.00 0.00 C ATOM 0 H VAL A 127 -12.894 18.023 -4.181 1.00 0.00 H new ATOM 0 HA VAL A 127 -15.711 18.200 -4.364 1.00 0.00 H new ATOM 0 HB VAL A 127 -13.656 19.913 -2.992 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -15.409 20.366 -1.282 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -15.843 20.984 -2.893 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -16.583 19.484 -2.287 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -14.051 18.441 -0.993 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -15.107 17.415 -1.994 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -13.373 17.546 -2.373 1.00 0.00 H new ATOM 2008 N CYS A 128 -16.352 20.140 -5.724 1.00 0.00 N ATOM 2009 CA CYS A 128 -16.878 21.341 -6.417 1.00 0.00 C ATOM 2010 C CYS A 128 -16.747 22.560 -5.483 1.00 0.00 C ATOM 2011 O CYS A 128 -16.740 22.384 -4.267 1.00 0.00 O ATOM 2012 CB CYS A 128 -18.352 21.070 -6.750 1.00 0.00 C ATOM 2013 SG CYS A 128 -19.162 22.375 -7.748 1.00 0.00 S ATOM 0 H CYS A 128 -17.048 19.404 -5.601 1.00 0.00 H new ATOM 0 HA CYS A 128 -16.322 21.550 -7.331 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -18.421 20.124 -7.288 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -18.905 20.948 -5.818 1.00 0.00 H new ATOM 0 HG CYS A 128 -20.399 22.045 -7.973 1.00 0.00 H new ATOM 2019 N LEU A 129 -16.635 23.762 -6.054 1.00 0.00 N ATOM 2020 CA LEU A 129 -16.413 25.038 -5.329 1.00 0.00 C ATOM 2021 C LEU A 129 -17.071 25.189 -3.940 1.00 0.00 C ATOM 2022 O LEU A 129 -18.226 25.597 -3.802 1.00 0.00 O ATOM 2023 CB LEU A 129 -16.650 26.282 -6.214 1.00 0.00 C ATOM 2024 CG LEU A 129 -17.806 26.401 -7.236 1.00 0.00 C ATOM 2025 CD1 LEU A 129 -17.534 25.613 -8.512 1.00 0.00 C ATOM 2026 CD2 LEU A 129 -19.188 26.063 -6.665 1.00 0.00 C ATOM 0 H LEU A 129 -16.697 23.889 -7.064 1.00 0.00 H new ATOM 0 HA LEU A 129 -15.351 24.975 -5.093 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -16.756 27.126 -5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -15.729 26.438 -6.775 1.00 0.00 H new ATOM 0 HG LEU A 129 -17.837 27.460 -7.491 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -18.374 25.728 -9.197 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -16.626 25.988 -8.985 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -17.407 24.558 -8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -19.941 26.171 -7.446 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -19.189 25.036 -6.300 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -19.418 26.741 -5.843 1.00 0.00 H new ATOM 2038 N ALA A 130 -16.321 24.759 -2.923 1.00 0.00 N ATOM 2039 CA ALA A 130 -16.739 24.678 -1.504 1.00 0.00 C ATOM 2040 C ALA A 130 -18.076 23.950 -1.245 1.00 0.00 C ATOM 2041 O ALA A 130 -18.666 24.080 -0.167 1.00 0.00 O ATOM 2042 CB ALA A 130 -16.714 26.089 -0.885 1.00 0.00 C ATOM 0 H ALA A 130 -15.362 24.442 -3.062 1.00 0.00 H new ATOM 0 HA ALA A 130 -16.011 24.038 -1.006 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -17.021 26.034 0.159 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -15.704 26.495 -0.945 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -17.399 26.738 -1.431 1.00 0.00 H new ATOM 2048 N CYS A 131 -18.413 23.009 -2.119 1.00 0.00 N ATOM 2049 CA CYS A 131 -19.728 22.327 -2.143 1.00 0.00 C ATOM 2050 C CYS A 131 -19.679 20.956 -2.838 1.00 0.00 C ATOM 2051 O CYS A 131 -18.687 20.587 -3.460 1.00 0.00 O ATOM 2052 CB CYS A 131 -20.726 23.254 -2.854 1.00 0.00 C ATOM 2053 SG CYS A 131 -22.478 22.749 -2.708 1.00 0.00 S ATOM 0 H CYS A 131 -17.779 22.684 -2.849 1.00 0.00 H new ATOM 0 HA CYS A 131 -20.036 22.130 -1.116 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -20.617 24.260 -2.450 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -20.464 23.305 -3.911 1.00 0.00 H new ATOM 0 HG CYS A 131 -23.229 23.601 -3.341 1.00 0.00 H new ATOM 2059 N GLY A 132 -20.695 20.138 -2.533 1.00 0.00 N ATOM 2060 CA GLY A 132 -20.936 18.824 -3.175 1.00 0.00 C ATOM 2061 C GLY A 132 -20.077 17.641 -2.695 1.00 0.00 C ATOM 2062 O GLY A 132 -20.552 16.511 -2.683 1.00 0.00 O ATOM 0 H GLY A 132 -21.389 20.368 -1.822 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -21.984 18.563 -3.028 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -20.784 18.939 -4.248 1.00 0.00 H new ATOM 2066 N ALA A 133 -18.820 17.939 -2.340 1.00 0.00 N ATOM 2067 CA ALA A 133 -17.807 16.979 -1.841 1.00 0.00 C ATOM 2068 C ALA A 133 -17.458 15.841 -2.831 1.00 0.00 C ATOM 2069 O ALA A 133 -17.658 14.658 -2.589 1.00 0.00 O ATOM 2070 CB ALA A 133 -18.160 16.487 -0.430 1.00 0.00 C ATOM 0 H ALA A 133 -18.459 18.892 -2.392 1.00 0.00 H new ATOM 0 HA ALA A 133 -16.872 17.533 -1.763 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -17.400 15.784 -0.089 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -18.201 17.336 0.252 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -19.130 15.991 -0.450 1.00 0.00 H new ATOM 2076 N GLN A 134 -16.663 16.270 -3.813 1.00 0.00 N ATOM 2077 CA GLN A 134 -16.122 15.500 -4.947 1.00 0.00 C ATOM 2078 C GLN A 134 -17.148 14.787 -5.849 1.00 0.00 C ATOM 2079 O GLN A 134 -17.974 13.996 -5.407 1.00 0.00 O ATOM 2080 CB GLN A 134 -15.000 14.556 -4.488 1.00 0.00 C ATOM 2081 CG GLN A 134 -14.302 13.847 -5.657 1.00 0.00 C ATOM 2082 CD GLN A 134 -13.005 13.143 -5.242 1.00 0.00 C ATOM 2083 OE1 GLN A 134 -11.908 13.660 -5.383 1.00 0.00 O ATOM 2084 NE2 GLN A 134 -13.128 11.911 -4.800 1.00 0.00 N ATOM 0 H GLN A 134 -16.353 17.241 -3.843 1.00 0.00 H new ATOM 0 HA GLN A 134 -15.707 16.260 -5.609 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -14.262 15.125 -3.922 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -15.415 13.809 -3.811 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -14.984 13.115 -6.090 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -14.080 14.576 -6.436 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -14.054 11.499 -4.690 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -12.297 11.367 -4.567 1.00 0.00 H new ATOM 2093 N THR A 135 -16.963 15.008 -7.150 1.00 0.00 N ATOM 2094 CA THR A 135 -17.686 14.266 -8.211 1.00 0.00 C ATOM 2095 C THR A 135 -17.136 12.826 -8.346 1.00 0.00 C ATOM 2096 O THR A 135 -15.947 12.655 -8.649 1.00 0.00 O ATOM 2097 CB THR A 135 -17.715 14.998 -9.574 1.00 0.00 C ATOM 2098 OG1 THR A 135 -18.372 14.167 -10.529 1.00 0.00 O ATOM 2099 CG2 THR A 135 -16.348 15.468 -10.087 1.00 0.00 C ATOM 0 H THR A 135 -16.310 15.704 -7.510 1.00 0.00 H new ATOM 0 HA THR A 135 -18.727 14.212 -7.892 1.00 0.00 H new ATOM 0 HB THR A 135 -18.270 15.924 -9.422 1.00 0.00 H new ATOM 0 HG1 THR A 135 -18.397 14.622 -11.396 1.00 0.00 H new ATOM 0 HG21 THR A 135 -16.472 15.969 -11.047 1.00 0.00 H new ATOM 0 HG22 THR A 135 -15.909 16.162 -9.370 1.00 0.00 H new ATOM 0 HG23 THR A 135 -15.690 14.608 -10.209 1.00 0.00 H new ATOM 2107 N PRO A 136 -17.941 11.810 -8.024 1.00 0.00 N ATOM 2108 CA PRO A 136 -17.524 10.396 -8.123 1.00 0.00 C ATOM 2109 C PRO A 136 -17.507 9.922 -9.583 1.00 0.00 C ATOM 2110 O PRO A 136 -18.463 9.324 -10.069 1.00 0.00 O ATOM 2111 CB PRO A 136 -18.525 9.650 -7.230 1.00 0.00 C ATOM 2112 CG PRO A 136 -19.807 10.465 -7.374 1.00 0.00 C ATOM 2113 CD PRO A 136 -19.316 11.915 -7.470 1.00 0.00 C ATOM 0 HA PRO A 136 -16.502 10.216 -7.788 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -18.665 8.620 -7.558 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -18.188 9.612 -6.194 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.367 10.174 -8.262 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.468 10.323 -6.519 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -19.960 12.509 -8.118 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -19.314 12.398 -6.493 1.00 0.00 H new ATOM 2121 N VAL A 137 -16.405 10.254 -10.263 1.00 0.00 N ATOM 2122 CA VAL A 137 -16.130 9.979 -11.695 1.00 0.00 C ATOM 2123 C VAL A 137 -17.264 10.428 -12.644 1.00 0.00 C ATOM 2124 O VAL A 137 -17.242 11.562 -13.120 1.00 0.00 O ATOM 2125 CB VAL A 137 -15.516 8.571 -11.935 1.00 0.00 C ATOM 2126 CG1 VAL A 137 -16.386 7.372 -11.533 1.00 0.00 C ATOM 2127 CG2 VAL A 137 -15.008 8.418 -13.377 1.00 0.00 C ATOM 0 H VAL A 137 -15.634 10.748 -9.814 1.00 0.00 H new ATOM 0 HA VAL A 137 -15.320 10.643 -11.999 1.00 0.00 H new ATOM 0 HB VAL A 137 -14.677 8.538 -11.240 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -15.852 6.447 -11.748 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -16.607 7.424 -10.467 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -17.318 7.393 -12.098 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -14.585 7.422 -13.510 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -15.837 8.556 -14.071 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -14.241 9.167 -13.574 1.00 0.00 H new ATOM 2137 N LYS A 138 -18.255 9.574 -12.842 1.00 0.00 N ATOM 2138 CA LYS A 138 -19.481 9.874 -13.601 1.00 0.00 C ATOM 2139 C LYS A 138 -20.662 9.715 -12.616 1.00 0.00 C ATOM 2140 O LYS A 138 -21.028 8.584 -12.286 1.00 0.00 O ATOM 2141 CB LYS A 138 -19.565 8.920 -14.807 1.00 0.00 C ATOM 2142 CG LYS A 138 -20.646 9.281 -15.839 1.00 0.00 C ATOM 2143 CD LYS A 138 -22.052 8.824 -15.432 1.00 0.00 C ATOM 2144 CE LYS A 138 -23.083 9.199 -16.499 1.00 0.00 C ATOM 2145 NZ LYS A 138 -24.427 8.755 -16.112 1.00 0.00 N ATOM 0 H LYS A 138 -18.238 8.623 -12.473 1.00 0.00 H new ATOM 0 HA LYS A 138 -19.496 10.886 -14.005 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -18.597 8.902 -15.307 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -19.754 7.911 -14.442 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.651 10.361 -15.986 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -20.388 8.830 -16.797 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -22.057 7.745 -15.280 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.325 9.281 -14.481 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -23.082 10.279 -16.647 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -22.807 8.746 -17.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -24.987 8.559 -16.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -24.355 7.890 -15.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -24.892 9.501 -15.556 1.00 0.00 H new ATOM 2159 N PRO A 139 -21.152 10.818 -12.034 1.00 0.00 N ATOM 2160 CA PRO A 139 -22.281 10.793 -11.086 1.00 0.00 C ATOM 2161 C PRO A 139 -23.613 10.452 -11.774 1.00 0.00 C ATOM 2162 O PRO A 139 -24.336 11.295 -12.281 1.00 0.00 O ATOM 2163 CB PRO A 139 -22.265 12.186 -10.425 1.00 0.00 C ATOM 2164 CG PRO A 139 -21.669 13.083 -11.507 1.00 0.00 C ATOM 2165 CD PRO A 139 -20.631 12.193 -12.194 1.00 0.00 C ATOM 0 HA PRO A 139 -22.179 10.005 -10.340 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -23.267 12.508 -10.143 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -21.660 12.194 -9.518 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -22.431 13.422 -12.209 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -21.210 13.974 -11.079 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -20.519 12.454 -13.246 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -19.649 12.301 -11.733 1.00 0.00 H new ATOM 2173 N LEU A 140 -23.818 9.147 -11.909 1.00 0.00 N ATOM 2174 CA LEU A 140 -25.041 8.550 -12.487 1.00 0.00 C ATOM 2175 C LEU A 140 -26.346 8.849 -11.719 1.00 0.00 C ATOM 2176 O LEU A 140 -27.391 8.916 -12.393 1.00 0.00 O ATOM 2177 CB LEU A 140 -24.876 7.037 -12.709 1.00 0.00 C ATOM 2178 CG LEU A 140 -24.666 6.182 -11.437 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -25.122 4.756 -11.723 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -23.201 6.152 -11.012 1.00 0.00 C ATOM 2181 OXT LEU A 140 -26.271 8.918 -10.470 1.00 0.00 O ATOM 0 H LEU A 140 -23.132 8.451 -11.617 1.00 0.00 H new ATOM 0 HA LEU A 140 -25.156 9.049 -13.449 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -25.760 6.668 -13.228 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -24.027 6.878 -13.373 1.00 0.00 H new ATOM 0 HG LEU A 140 -25.247 6.627 -10.629 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -24.979 4.143 -10.833 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -26.177 4.759 -11.996 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -24.536 4.345 -12.545 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -23.095 5.542 -10.115 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -22.598 5.726 -11.814 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -22.862 7.167 -10.803 1.00 0.00 H new TER 2193 LEU A 140