USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 883 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 56 MET CE :methyl -169:sc= -5.55! (180deg=-6.44!) USER MOD Set 1.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 60 ASN : amide:sc= -2.04! C(o=-2.2!,f=-5.9!) USER MOD Set 2.2: A 62 CYS SG : rot 28:sc= -0.132 USER MOD Single : A 1 GLY N :NH3+ 179:sc= -0.126 (180deg=-0.131) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.244 K(o=-0.24,f=-5.5!) USER MOD Single : A 8 SER OG : rot 27:sc= 0.0976 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -1.8 K(o=-1.8,f=-2.9) USER MOD Single : A 15 THR OG1 : rot 9:sc= 0.515 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= -0.514 X(o=-0.51,f=-0.12) USER MOD Single : A 20 HIS : no HD1:sc= -0.273 X(o=-0.27,f=-0.28) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.615! C(o=-0.62!,f=-2.5!) USER MOD Single : A 28 LYS NZ :NH3+ 166:sc= 0.185 (180deg=-0.474) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 1:sc= 0.888 USER MOD Single : A 40 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= -3.29! C(o=-3.3!,f=-1.8!) USER MOD Single : A 44 SER OG : rot 69:sc= 1.04 USER MOD Single : A 47 HIS : no HE2:sc= 0.141 K(o=0.14,f=-3.5!) USER MOD Single : A 48 THR OG1 : rot -170:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= -0.753 USER MOD Single : A 57 ASN : amide:sc= -1.03 X(o=-1,f=-0.82!) USER MOD Single : A 58 LYS NZ :NH3+ -159:sc= -0.391 (180deg=-1.38!) USER MOD Single : A 61 ASN : amide:sc= -0.0435 X(o=-0.044,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0127 USER MOD Single : A 65 ASN : amide:sc= -0.053 K(o=-0.053,f=-1.3!) USER MOD Single : A 70 LYS NZ :NH3+ 159:sc= -0.684 (180deg=-1.91!) USER MOD Single : A 73 TYR OH : rot -80:sc= -6.19! USER MOD Single : A 77 TYR OH : rot 90:sc= -1.24 USER MOD Single : A 78 SER OG : rot 180:sc= 0.00959 USER MOD Single : A 79 ASN : amide:sc= -1.8! K(o=-1.8!,f=-0.18) USER MOD Single : A 82 SER OG : rot -73:sc= 0.502! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -3.76! K(o=-3.8!,f=-0.39) USER MOD Single : A 85 ASN : amide:sc= -2.34! K(o=-2.3!,f=-0.41) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc=-0.00262 X(o=-0.0026,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0328) USER MOD Single : A 94 ASN : amide:sc= -0.204 X(o=-0.2,f=-0.00039) USER MOD Single : A 98 THR OG1 : rot 151:sc= -1.69 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 82:sc= 0.939 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.051 9.610 -15.527 1.00 0.00 N ATOM 2 CA GLY A 1 -3.161 10.592 -15.665 1.00 0.00 C ATOM 3 C GLY A 1 -3.135 11.575 -14.493 1.00 0.00 C ATOM 4 O GLY A 1 -3.989 12.433 -14.379 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.085 8.935 -16.317 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.140 10.112 -15.539 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.152 9.096 -14.628 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.065 11.133 -16.607 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.118 10.071 -15.693 1.00 0.00 H new ATOM 10 N SER A 2 -2.155 11.429 -13.644 1.00 0.00 N ATOM 11 CA SER A 2 -2.057 12.342 -12.480 1.00 0.00 C ATOM 12 C SER A 2 -0.615 12.452 -12.000 1.00 0.00 C ATOM 13 O SER A 2 0.304 12.050 -12.688 1.00 0.00 O ATOM 14 CB SER A 2 -2.915 11.768 -11.338 1.00 0.00 C ATOM 15 OG SER A 2 -2.391 10.465 -11.129 1.00 0.00 O ATOM 0 H SER A 2 -1.424 10.720 -13.708 1.00 0.00 H new ATOM 0 HA SER A 2 -2.406 13.332 -12.774 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.838 12.377 -10.437 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.970 11.734 -11.611 1.00 0.00 H new ATOM 0 HG SER A 2 -2.887 10.025 -10.407 1.00 0.00 H new ATOM 21 N HIS A 3 -0.440 12.997 -10.827 1.00 0.00 N ATOM 22 CA HIS A 3 0.934 13.141 -10.290 1.00 0.00 C ATOM 23 C HIS A 3 1.736 11.868 -10.507 1.00 0.00 C ATOM 24 O HIS A 3 1.327 10.797 -10.103 1.00 0.00 O ATOM 25 CB HIS A 3 0.838 13.399 -8.780 1.00 0.00 C ATOM 26 CG HIS A 3 0.543 14.877 -8.529 1.00 0.00 C ATOM 27 ND1 HIS A 3 0.610 15.435 -7.416 1.00 0.00 N ATOM 28 CD2 HIS A 3 0.158 15.865 -9.416 1.00 0.00 C ATOM 29 CE1 HIS A 3 0.311 16.664 -7.492 1.00 0.00 C ATOM 30 NE2 HIS A 3 0.006 17.035 -8.736 1.00 0.00 N ATOM 0 H HIS A 3 -1.186 13.345 -10.224 1.00 0.00 H new ATOM 0 HA HIS A 3 1.430 13.964 -10.804 1.00 0.00 H new ATOM 0 HB2 HIS A 3 0.052 12.782 -8.345 1.00 0.00 H new ATOM 0 HB3 HIS A 3 1.771 13.116 -8.293 1.00 0.00 H new ATOM 0 HD2 HIS A 3 0.003 15.731 -10.476 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.304 17.335 -6.646 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.269 17.953 -9.086 1.00 0.00 H new ATOM 38 N MET A 4 2.865 12.003 -11.140 1.00 0.00 N ATOM 39 CA MET A 4 3.698 10.812 -11.386 1.00 0.00 C ATOM 40 C MET A 4 4.651 10.547 -10.213 1.00 0.00 C ATOM 41 O MET A 4 4.927 9.415 -9.884 1.00 0.00 O ATOM 42 CB MET A 4 4.527 11.041 -12.661 1.00 0.00 C ATOM 43 CG MET A 4 3.789 12.024 -13.571 1.00 0.00 C ATOM 44 SD MET A 4 4.193 13.780 -13.405 1.00 0.00 S ATOM 45 CE MET A 4 4.145 14.186 -15.167 1.00 0.00 C ATOM 0 H MET A 4 3.240 12.883 -11.493 1.00 0.00 H new ATOM 0 HA MET A 4 3.043 9.948 -11.499 1.00 0.00 H new ATOM 0 HB2 MET A 4 5.511 11.433 -12.404 1.00 0.00 H new ATOM 0 HB3 MET A 4 4.687 10.096 -13.180 1.00 0.00 H new ATOM 0 HG2 MET A 4 3.977 11.732 -14.604 1.00 0.00 H new ATOM 0 HG3 MET A 4 2.720 11.907 -13.396 1.00 0.00 H new ATOM 0 HE1 MET A 4 4.370 15.244 -15.303 1.00 0.00 H new ATOM 0 HE2 MET A 4 4.884 13.587 -15.699 1.00 0.00 H new ATOM 0 HE3 MET A 4 3.152 13.972 -15.563 1.00 0.00 H new ATOM 55 N PRO A 5 5.146 11.612 -9.605 1.00 0.00 N ATOM 56 CA PRO A 5 6.064 11.493 -8.475 1.00 0.00 C ATOM 57 C PRO A 5 5.320 11.166 -7.179 1.00 0.00 C ATOM 58 O PRO A 5 4.159 11.487 -7.031 1.00 0.00 O ATOM 59 CB PRO A 5 6.707 12.891 -8.353 1.00 0.00 C ATOM 60 CG PRO A 5 5.928 13.842 -9.316 1.00 0.00 C ATOM 61 CD PRO A 5 4.859 12.990 -10.024 1.00 0.00 C ATOM 0 HA PRO A 5 6.787 10.693 -8.633 1.00 0.00 H new ATOM 0 HB2 PRO A 5 6.650 13.252 -7.326 1.00 0.00 H new ATOM 0 HB3 PRO A 5 7.763 12.854 -8.620 1.00 0.00 H new ATOM 0 HG2 PRO A 5 5.465 14.658 -8.761 1.00 0.00 H new ATOM 0 HG3 PRO A 5 6.604 14.294 -10.042 1.00 0.00 H new ATOM 0 HD2 PRO A 5 3.853 13.292 -9.731 1.00 0.00 H new ATOM 0 HD3 PRO A 5 4.921 13.096 -11.107 1.00 0.00 H new ATOM 69 N ARG A 6 6.013 10.534 -6.266 1.00 0.00 N ATOM 70 CA ARG A 6 5.382 10.169 -4.963 1.00 0.00 C ATOM 71 C ARG A 6 3.940 9.695 -5.139 1.00 0.00 C ATOM 72 O ARG A 6 3.011 10.477 -5.048 1.00 0.00 O ATOM 73 CB ARG A 6 5.381 11.414 -4.059 1.00 0.00 C ATOM 74 CG ARG A 6 4.860 11.019 -2.666 1.00 0.00 C ATOM 75 CD ARG A 6 3.593 11.821 -2.333 1.00 0.00 C ATOM 76 NE ARG A 6 3.992 13.127 -1.736 1.00 0.00 N ATOM 77 CZ ARG A 6 4.112 14.175 -2.505 1.00 0.00 C ATOM 78 NH1 ARG A 6 5.239 14.372 -3.130 1.00 0.00 N ATOM 79 NH2 ARG A 6 3.101 14.993 -2.618 1.00 0.00 N ATOM 0 H ARG A 6 6.989 10.255 -6.367 1.00 0.00 H new ATOM 0 HA ARG A 6 5.955 9.353 -4.523 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.388 11.825 -3.982 1.00 0.00 H new ATOM 0 HB3 ARG A 6 4.751 12.192 -4.490 1.00 0.00 H new ATOM 0 HG2 ARG A 6 4.642 9.951 -2.639 1.00 0.00 H new ATOM 0 HG3 ARG A 6 5.627 11.207 -1.915 1.00 0.00 H new ATOM 0 HD2 ARG A 6 3.002 11.983 -3.234 1.00 0.00 H new ATOM 0 HD3 ARG A 6 2.966 11.264 -1.637 1.00 0.00 H new ATOM 0 HE ARG A 6 4.170 13.201 -0.734 1.00 0.00 H new ATOM 0 HH11 ARG A 6 6.009 13.713 -3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 6 5.351 15.185 -3.735 1.00 0.00 H new ATOM 0 HH21 ARG A 6 2.236 14.808 -2.110 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.176 15.817 -3.214 1.00 0.00 H new ATOM 93 N ASN A 7 3.786 8.411 -5.370 1.00 0.00 N ATOM 94 CA ASN A 7 2.420 7.841 -5.555 1.00 0.00 C ATOM 95 C ASN A 7 2.158 6.749 -4.526 1.00 0.00 C ATOM 96 O ASN A 7 2.883 5.778 -4.453 1.00 0.00 O ATOM 97 CB ASN A 7 2.339 7.222 -6.960 1.00 0.00 C ATOM 98 CG ASN A 7 3.281 7.970 -7.899 1.00 0.00 C ATOM 99 OD1 ASN A 7 3.193 9.171 -8.061 1.00 0.00 O ATOM 100 ND2 ASN A 7 4.199 7.297 -8.537 1.00 0.00 N ATOM 0 H ASN A 7 4.549 7.737 -5.438 1.00 0.00 H new ATOM 0 HA ASN A 7 1.679 8.631 -5.433 1.00 0.00 H new ATOM 0 HB2 ASN A 7 2.609 6.167 -6.921 1.00 0.00 H new ATOM 0 HB3 ASN A 7 1.317 7.275 -7.334 1.00 0.00 H new ATOM 0 HD21 ASN A 7 4.839 7.779 -9.168 1.00 0.00 H new ATOM 0 HD22 ASN A 7 4.277 6.289 -8.404 1.00 0.00 H new ATOM 107 N SER A 8 1.125 6.924 -3.745 1.00 0.00 N ATOM 108 CA SER A 8 0.810 5.899 -2.718 1.00 0.00 C ATOM 109 C SER A 8 0.740 4.511 -3.341 1.00 0.00 C ATOM 110 O SER A 8 0.203 4.338 -4.417 1.00 0.00 O ATOM 111 CB SER A 8 -0.557 6.232 -2.098 1.00 0.00 C ATOM 112 OG SER A 8 -1.409 6.426 -3.218 1.00 0.00 O ATOM 0 H SER A 8 0.494 7.725 -3.776 1.00 0.00 H new ATOM 0 HA SER A 8 1.594 5.904 -1.961 1.00 0.00 H new ATOM 0 HB2 SER A 8 -0.914 5.422 -1.462 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.506 7.126 -1.477 1.00 0.00 H new ATOM 0 HG SER A 8 -1.070 5.911 -3.980 1.00 0.00 H new ATOM 118 N LYS A 9 1.284 3.544 -2.653 1.00 0.00 N ATOM 119 CA LYS A 9 1.257 2.163 -3.193 1.00 0.00 C ATOM 120 C LYS A 9 -0.126 1.818 -3.729 1.00 0.00 C ATOM 121 O LYS A 9 -0.267 0.967 -4.585 1.00 0.00 O ATOM 122 CB LYS A 9 1.610 1.187 -2.058 1.00 0.00 C ATOM 123 CG LYS A 9 0.874 1.605 -0.782 1.00 0.00 C ATOM 124 CD LYS A 9 1.404 0.778 0.391 1.00 0.00 C ATOM 125 CE LYS A 9 1.034 1.473 1.702 1.00 0.00 C ATOM 126 NZ LYS A 9 2.178 2.288 2.200 1.00 0.00 N ATOM 0 H LYS A 9 1.742 3.653 -1.748 1.00 0.00 H new ATOM 0 HA LYS A 9 1.976 2.087 -4.009 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.330 0.171 -2.337 1.00 0.00 H new ATOM 0 HB3 LYS A 9 2.686 1.185 -1.886 1.00 0.00 H new ATOM 0 HG2 LYS A 9 1.024 2.668 -0.592 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -0.199 1.450 -0.898 1.00 0.00 H new ATOM 0 HD2 LYS A 9 0.980 -0.226 0.365 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.486 0.669 0.316 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.164 2.111 1.549 1.00 0.00 H new ATOM 0 HE3 LYS A 9 0.757 0.730 2.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.911 2.753 3.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.999 1.671 2.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.424 3.010 1.493 1.00 0.00 H new ATOM 140 N ASN A 10 -1.124 2.482 -3.215 1.00 0.00 N ATOM 141 CA ASN A 10 -2.501 2.201 -3.686 1.00 0.00 C ATOM 142 C ASN A 10 -2.564 2.243 -5.208 1.00 0.00 C ATOM 143 O ASN A 10 -2.772 1.236 -5.853 1.00 0.00 O ATOM 144 CB ASN A 10 -3.434 3.287 -3.125 1.00 0.00 C ATOM 145 CG ASN A 10 -4.795 3.194 -3.822 1.00 0.00 C ATOM 146 OD1 ASN A 10 -5.076 3.917 -4.756 1.00 0.00 O ATOM 147 ND2 ASN A 10 -5.665 2.320 -3.398 1.00 0.00 N ATOM 0 H ASN A 10 -1.043 3.200 -2.495 1.00 0.00 H new ATOM 0 HA ASN A 10 -2.803 1.210 -3.347 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -3.554 3.159 -2.049 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -2.998 4.274 -3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -6.576 2.246 -3.851 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.434 1.710 -2.614 1.00 0.00 H new ATOM 154 N ASP A 11 -2.384 3.415 -5.752 1.00 0.00 N ATOM 155 CA ASP A 11 -2.427 3.554 -7.229 1.00 0.00 C ATOM 156 C ASP A 11 -1.250 2.833 -7.877 1.00 0.00 C ATOM 157 O ASP A 11 -1.197 2.690 -9.082 1.00 0.00 O ATOM 158 CB ASP A 11 -2.339 5.049 -7.575 1.00 0.00 C ATOM 159 CG ASP A 11 -3.518 5.786 -6.938 1.00 0.00 C ATOM 160 OD1 ASP A 11 -4.620 5.293 -7.107 1.00 0.00 O ATOM 161 OD2 ASP A 11 -3.250 6.802 -6.317 1.00 0.00 O ATOM 0 H ASP A 11 -2.210 4.278 -5.237 1.00 0.00 H new ATOM 0 HA ASP A 11 -3.353 3.116 -7.601 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -1.398 5.463 -7.213 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -2.352 5.185 -8.656 1.00 0.00 H new ATOM 166 N GLY A 12 -0.330 2.390 -7.055 1.00 0.00 N ATOM 167 CA GLY A 12 0.865 1.670 -7.588 1.00 0.00 C ATOM 168 C GLY A 12 1.029 0.347 -6.858 1.00 0.00 C ATOM 169 O GLY A 12 1.879 0.200 -6.004 1.00 0.00 O ATOM 0 H GLY A 12 -0.356 2.496 -6.041 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.750 1.495 -8.658 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.758 2.281 -7.459 1.00 0.00 H new ATOM 173 N VAL A 13 0.206 -0.591 -7.210 1.00 0.00 N ATOM 174 CA VAL A 13 0.283 -1.913 -6.560 1.00 0.00 C ATOM 175 C VAL A 13 1.242 -2.828 -7.302 1.00 0.00 C ATOM 176 O VAL A 13 1.442 -2.692 -8.494 1.00 0.00 O ATOM 177 CB VAL A 13 -1.132 -2.522 -6.561 1.00 0.00 C ATOM 178 CG1 VAL A 13 -1.708 -2.476 -7.981 1.00 0.00 C ATOM 179 CG2 VAL A 13 -1.068 -3.974 -6.077 1.00 0.00 C ATOM 0 H VAL A 13 -0.518 -0.496 -7.922 1.00 0.00 H new ATOM 0 HA VAL A 13 0.655 -1.802 -5.541 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.774 -1.949 -5.892 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.709 -2.907 -7.982 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.758 -1.441 -8.320 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.067 -3.047 -8.652 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.070 -4.403 -6.079 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.425 -4.551 -6.742 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.663 -4.003 -5.066 1.00 0.00 H new ATOM 189 N ASP A 14 1.821 -3.749 -6.579 1.00 0.00 N ATOM 190 CA ASP A 14 2.771 -4.685 -7.218 1.00 0.00 C ATOM 191 C ASP A 14 2.031 -5.888 -7.763 1.00 0.00 C ATOM 192 O ASP A 14 1.488 -6.677 -7.016 1.00 0.00 O ATOM 193 CB ASP A 14 3.778 -5.163 -6.160 1.00 0.00 C ATOM 194 CG ASP A 14 3.931 -4.094 -5.075 1.00 0.00 C ATOM 195 OD1 ASP A 14 4.154 -2.958 -5.460 1.00 0.00 O ATOM 196 OD2 ASP A 14 3.818 -4.475 -3.920 1.00 0.00 O ATOM 0 H ASP A 14 1.674 -3.888 -5.579 1.00 0.00 H new ATOM 0 HA ASP A 14 3.283 -4.177 -8.035 1.00 0.00 H new ATOM 0 HB2 ASP A 14 3.438 -6.099 -5.717 1.00 0.00 H new ATOM 0 HB3 ASP A 14 4.743 -5.363 -6.626 1.00 0.00 H new ATOM 201 N THR A 15 2.043 -6.019 -9.057 1.00 0.00 N ATOM 202 CA THR A 15 1.351 -7.149 -9.679 1.00 0.00 C ATOM 203 C THR A 15 2.050 -7.528 -10.979 1.00 0.00 C ATOM 204 O THR A 15 1.905 -6.866 -11.988 1.00 0.00 O ATOM 205 CB THR A 15 -0.108 -6.727 -9.967 1.00 0.00 C ATOM 206 OG1 THR A 15 -0.053 -5.892 -11.104 1.00 0.00 O ATOM 207 CG2 THR A 15 -0.648 -5.806 -8.854 1.00 0.00 C ATOM 0 H THR A 15 2.508 -5.382 -9.704 1.00 0.00 H new ATOM 0 HA THR A 15 1.364 -8.012 -9.013 1.00 0.00 H new ATOM 0 HB THR A 15 -0.725 -7.620 -10.067 1.00 0.00 H new ATOM 0 HG1 THR A 15 0.848 -5.921 -11.488 1.00 0.00 H new ATOM 0 HG21 THR A 15 -1.676 -5.524 -9.082 1.00 0.00 H new ATOM 0 HG22 THR A 15 -0.619 -6.333 -7.900 1.00 0.00 H new ATOM 0 HG23 THR A 15 -0.031 -4.909 -8.792 1.00 0.00 H new ATOM 215 N ALA A 16 2.808 -8.582 -10.918 1.00 0.00 N ATOM 216 CA ALA A 16 3.536 -9.046 -12.116 1.00 0.00 C ATOM 217 C ALA A 16 3.120 -10.455 -12.431 1.00 0.00 C ATOM 218 O ALA A 16 3.731 -11.405 -11.984 1.00 0.00 O ATOM 219 CB ALA A 16 5.040 -9.023 -11.801 1.00 0.00 C ATOM 0 H ALA A 16 2.953 -9.144 -10.079 1.00 0.00 H new ATOM 0 HA ALA A 16 3.315 -8.403 -12.968 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.600 -9.362 -12.673 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.343 -8.007 -11.548 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.245 -9.683 -10.958 1.00 0.00 H new ATOM 225 N ILE A 17 2.087 -10.573 -13.201 1.00 0.00 N ATOM 226 CA ILE A 17 1.612 -11.900 -13.555 1.00 0.00 C ATOM 227 C ILE A 17 0.822 -11.852 -14.871 1.00 0.00 C ATOM 228 O ILE A 17 1.334 -12.213 -15.913 1.00 0.00 O ATOM 229 CB ILE A 17 0.716 -12.373 -12.412 1.00 0.00 C ATOM 230 CG1 ILE A 17 -0.005 -13.620 -12.827 1.00 0.00 C ATOM 231 CG2 ILE A 17 -0.309 -11.273 -12.078 1.00 0.00 C ATOM 232 CD1 ILE A 17 1.044 -14.651 -13.194 1.00 0.00 C ATOM 0 H ILE A 17 1.557 -9.796 -13.596 1.00 0.00 H new ATOM 0 HA ILE A 17 2.447 -12.585 -13.701 1.00 0.00 H new ATOM 0 HB ILE A 17 1.325 -12.582 -11.533 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.636 -13.986 -12.017 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -0.660 -13.420 -13.675 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.950 -11.608 -11.262 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.216 -10.366 -11.778 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.919 -11.065 -12.957 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.554 -15.575 -13.502 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.654 -14.273 -14.014 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.679 -14.848 -12.330 1.00 0.00 H new ATOM 244 N TYR A 18 -0.408 -11.413 -14.802 1.00 0.00 N ATOM 245 CA TYR A 18 -1.230 -11.339 -16.039 1.00 0.00 C ATOM 246 C TYR A 18 -0.938 -10.031 -16.773 1.00 0.00 C ATOM 247 O TYR A 18 -1.373 -9.823 -17.882 1.00 0.00 O ATOM 248 CB TYR A 18 -2.713 -11.363 -15.639 1.00 0.00 C ATOM 249 CG TYR A 18 -2.979 -12.591 -14.769 1.00 0.00 C ATOM 250 CD1 TYR A 18 -2.899 -13.859 -15.304 1.00 0.00 C ATOM 251 CD2 TYR A 18 -3.293 -12.449 -13.433 1.00 0.00 C ATOM 252 CE1 TYR A 18 -3.126 -14.968 -14.517 1.00 0.00 C ATOM 253 CE2 TYR A 18 -3.519 -13.557 -12.644 1.00 0.00 C ATOM 254 CZ TYR A 18 -3.437 -14.826 -13.180 1.00 0.00 C ATOM 255 OH TYR A 18 -3.661 -15.935 -12.393 1.00 0.00 O ATOM 0 H TYR A 18 -0.873 -11.105 -13.948 1.00 0.00 H new ATOM 0 HA TYR A 18 -0.994 -12.181 -16.690 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -2.970 -10.454 -15.095 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -3.342 -11.390 -16.529 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -2.656 -13.985 -16.349 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.362 -11.461 -13.001 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -3.060 -15.955 -14.950 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.762 -13.431 -11.599 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.866 -15.651 -11.478 1.00 0.00 H new ATOM 265 N HIS A 19 -0.204 -9.181 -16.101 1.00 0.00 N ATOM 266 CA HIS A 19 0.179 -7.848 -16.669 1.00 0.00 C ATOM 267 C HIS A 19 0.639 -7.920 -18.132 1.00 0.00 C ATOM 268 O HIS A 19 0.914 -6.901 -18.732 1.00 0.00 O ATOM 269 CB HIS A 19 1.333 -7.290 -15.825 1.00 0.00 C ATOM 270 CG HIS A 19 2.634 -7.973 -16.247 1.00 0.00 C ATOM 271 ND1 HIS A 19 3.526 -7.440 -16.937 1.00 0.00 N ATOM 272 CD2 HIS A 19 3.084 -9.253 -15.989 1.00 0.00 C ATOM 273 CE1 HIS A 19 4.489 -8.235 -17.148 1.00 0.00 C ATOM 274 NE2 HIS A 19 4.299 -9.426 -16.579 1.00 0.00 N ATOM 0 H HIS A 19 0.154 -9.357 -15.162 1.00 0.00 H new ATOM 0 HA HIS A 19 -0.706 -7.212 -16.642 1.00 0.00 H new ATOM 0 HB2 HIS A 19 1.412 -6.212 -15.962 1.00 0.00 H new ATOM 0 HB3 HIS A 19 1.143 -7.464 -14.766 1.00 0.00 H new ATOM 0 HD2 HIS A 19 2.557 -9.998 -15.412 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.366 -7.977 -17.724 1.00 0.00 H new ATOM 0 HE2 HIS A 19 4.903 -10.248 -16.584 1.00 0.00 H new ATOM 282 N HIS A 20 0.725 -9.114 -18.664 1.00 0.00 N ATOM 283 CA HIS A 20 1.171 -9.277 -20.088 1.00 0.00 C ATOM 284 C HIS A 20 0.788 -8.076 -20.978 1.00 0.00 C ATOM 285 O HIS A 20 1.648 -7.315 -21.374 1.00 0.00 O ATOM 286 CB HIS A 20 0.472 -10.529 -20.655 1.00 0.00 C ATOM 287 CG HIS A 20 1.487 -11.662 -20.811 1.00 0.00 C ATOM 288 ND1 HIS A 20 2.528 -11.787 -20.136 1.00 0.00 N ATOM 289 CD2 HIS A 20 1.474 -12.745 -21.672 1.00 0.00 C ATOM 290 CE1 HIS A 20 3.177 -12.825 -20.469 1.00 0.00 C ATOM 291 NE2 HIS A 20 2.581 -13.506 -21.447 1.00 0.00 N ATOM 0 H HIS A 20 0.507 -9.983 -18.177 1.00 0.00 H new ATOM 0 HA HIS A 20 2.258 -9.359 -20.093 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.334 -10.839 -19.990 1.00 0.00 H new ATOM 0 HB3 HIS A 20 0.019 -10.299 -21.619 1.00 0.00 H new ATOM 0 HD2 HIS A 20 0.709 -12.954 -22.405 1.00 0.00 H new ATOM 0 HE1 HIS A 20 4.108 -13.123 -20.011 1.00 0.00 H new ATOM 0 HE2 HIS A 20 2.876 -14.368 -21.905 1.00 0.00 H new ATOM 299 N LYS A 21 -0.482 -7.924 -21.272 1.00 0.00 N ATOM 300 CA LYS A 21 -0.896 -6.770 -22.137 1.00 0.00 C ATOM 301 C LYS A 21 -1.374 -5.568 -21.313 1.00 0.00 C ATOM 302 O LYS A 21 -0.706 -4.555 -21.238 1.00 0.00 O ATOM 303 CB LYS A 21 -2.049 -7.238 -23.038 1.00 0.00 C ATOM 304 CG LYS A 21 -1.591 -8.454 -23.846 1.00 0.00 C ATOM 305 CD LYS A 21 -1.077 -7.988 -25.211 1.00 0.00 C ATOM 306 CE LYS A 21 -0.823 -9.210 -26.098 1.00 0.00 C ATOM 307 NZ LYS A 21 -0.161 -8.803 -27.370 1.00 0.00 N ATOM 0 H LYS A 21 -1.237 -8.534 -20.959 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.030 -6.451 -22.717 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.919 -7.494 -22.433 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -2.353 -6.434 -23.708 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -0.805 -8.986 -23.310 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.418 -9.152 -23.975 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.806 -7.328 -25.681 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.158 -7.414 -25.090 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -0.196 -9.927 -25.568 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -1.766 -9.711 -26.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 0.004 -9.644 -27.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.773 -8.136 -27.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.748 -8.345 -27.157 1.00 0.00 H new ATOM 321 N LEU A 22 -2.523 -5.708 -20.714 1.00 0.00 N ATOM 322 CA LEU A 22 -3.081 -4.598 -19.886 1.00 0.00 C ATOM 323 C LEU A 22 -3.912 -5.163 -18.765 1.00 0.00 C ATOM 324 O LEU A 22 -4.561 -4.440 -18.038 1.00 0.00 O ATOM 325 CB LEU A 22 -3.978 -3.715 -20.780 1.00 0.00 C ATOM 326 CG LEU A 22 -5.233 -4.497 -21.183 1.00 0.00 C ATOM 327 CD1 LEU A 22 -6.142 -3.591 -22.017 1.00 0.00 C ATOM 328 CD2 LEU A 22 -4.822 -5.705 -22.023 1.00 0.00 C ATOM 0 H LEU A 22 -3.103 -6.546 -20.761 1.00 0.00 H new ATOM 0 HA LEU A 22 -2.264 -4.010 -19.468 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.259 -2.807 -20.246 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.429 -3.405 -21.669 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.763 -4.831 -20.291 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.037 -4.141 -22.307 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.427 -2.720 -21.427 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.610 -3.266 -22.911 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.711 -6.266 -22.313 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.299 -5.365 -22.917 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.162 -6.347 -21.439 1.00 0.00 H new ATOM 340 N ARG A 23 -3.871 -6.455 -18.637 1.00 0.00 N ATOM 341 CA ARG A 23 -4.646 -7.091 -17.575 1.00 0.00 C ATOM 342 C ARG A 23 -4.224 -6.520 -16.243 1.00 0.00 C ATOM 343 O ARG A 23 -4.927 -6.635 -15.268 1.00 0.00 O ATOM 344 CB ARG A 23 -4.370 -8.604 -17.617 1.00 0.00 C ATOM 345 CG ARG A 23 -5.494 -9.316 -18.393 1.00 0.00 C ATOM 346 CD ARG A 23 -4.872 -10.288 -19.399 1.00 0.00 C ATOM 347 NE ARG A 23 -4.505 -9.539 -20.637 1.00 0.00 N ATOM 348 CZ ARG A 23 -4.893 -9.993 -21.799 1.00 0.00 C ATOM 349 NH1 ARG A 23 -4.694 -11.251 -22.083 1.00 0.00 N ATOM 350 NH2 ARG A 23 -5.467 -9.174 -22.640 1.00 0.00 N ATOM 0 H ARG A 23 -3.331 -7.088 -19.227 1.00 0.00 H new ATOM 0 HA ARG A 23 -5.712 -6.908 -17.713 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.409 -8.795 -18.094 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.307 -9.000 -16.603 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -6.144 -9.854 -17.703 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -6.114 -8.585 -18.911 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -3.989 -10.760 -18.969 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -5.576 -11.085 -19.636 1.00 0.00 H new ATOM 0 HE ARG A 23 -3.957 -8.681 -20.576 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -4.242 -11.862 -21.403 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.990 -11.623 -22.985 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -5.606 -8.196 -22.385 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -5.776 -9.512 -23.551 1.00 0.00 H new ATOM 364 N ASP A 24 -3.067 -5.904 -16.227 1.00 0.00 N ATOM 365 CA ASP A 24 -2.592 -5.316 -14.962 1.00 0.00 C ATOM 366 C ASP A 24 -3.427 -4.090 -14.665 1.00 0.00 C ATOM 367 O ASP A 24 -3.717 -3.776 -13.527 1.00 0.00 O ATOM 368 CB ASP A 24 -1.124 -4.893 -15.122 1.00 0.00 C ATOM 369 CG ASP A 24 -0.915 -4.308 -16.519 1.00 0.00 C ATOM 370 OD1 ASP A 24 -0.945 -5.098 -17.447 1.00 0.00 O ATOM 371 OD2 ASP A 24 -0.739 -3.103 -16.580 1.00 0.00 O ATOM 0 H ASP A 24 -2.447 -5.790 -17.029 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.678 -6.041 -14.153 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.862 -4.155 -14.364 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.468 -5.751 -14.973 1.00 0.00 H new ATOM 376 N GLN A 25 -3.796 -3.417 -15.717 1.00 0.00 N ATOM 377 CA GLN A 25 -4.616 -2.205 -15.571 1.00 0.00 C ATOM 378 C GLN A 25 -5.976 -2.608 -15.106 1.00 0.00 C ATOM 379 O GLN A 25 -6.661 -1.867 -14.431 1.00 0.00 O ATOM 380 CB GLN A 25 -4.718 -1.539 -16.952 1.00 0.00 C ATOM 381 CG GLN A 25 -3.334 -1.502 -17.590 1.00 0.00 C ATOM 382 CD GLN A 25 -2.450 -0.518 -16.821 1.00 0.00 C ATOM 383 OE1 GLN A 25 -2.930 0.400 -16.185 1.00 0.00 O ATOM 384 NE2 GLN A 25 -1.154 -0.675 -16.850 1.00 0.00 N ATOM 0 H GLN A 25 -3.558 -3.665 -16.677 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.176 -1.513 -14.852 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -5.410 -2.093 -17.587 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -5.114 -0.528 -16.854 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -2.888 -2.496 -17.577 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -3.410 -1.201 -18.635 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -0.745 -1.443 -17.382 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -0.551 -0.029 -16.341 1.00 0.00 H new ATOM 393 N VAL A 26 -6.352 -3.787 -15.480 1.00 0.00 N ATOM 394 CA VAL A 26 -7.663 -4.274 -15.072 1.00 0.00 C ATOM 395 C VAL A 26 -7.579 -4.716 -13.628 1.00 0.00 C ATOM 396 O VAL A 26 -8.335 -4.277 -12.794 1.00 0.00 O ATOM 397 CB VAL A 26 -8.042 -5.470 -15.957 1.00 0.00 C ATOM 398 CG1 VAL A 26 -9.527 -5.772 -15.770 1.00 0.00 C ATOM 399 CG2 VAL A 26 -7.776 -5.116 -17.429 1.00 0.00 C ATOM 0 H VAL A 26 -5.801 -4.428 -16.051 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.415 -3.492 -15.176 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.449 -6.341 -15.679 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.807 -6.620 -16.394 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.721 -6.011 -14.724 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.115 -4.900 -16.058 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.044 -5.963 -18.061 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.376 -4.250 -17.709 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.719 -4.884 -17.562 1.00 0.00 H new ATOM 409 N LEU A 27 -6.636 -5.569 -13.357 1.00 0.00 N ATOM 410 CA LEU A 27 -6.472 -6.056 -11.975 1.00 0.00 C ATOM 411 C LEU A 27 -6.242 -4.878 -11.044 1.00 0.00 C ATOM 412 O LEU A 27 -6.400 -4.985 -9.843 1.00 0.00 O ATOM 413 CB LEU A 27 -5.233 -6.976 -11.927 1.00 0.00 C ATOM 414 CG LEU A 27 -5.649 -8.424 -12.212 1.00 0.00 C ATOM 415 CD1 LEU A 27 -4.585 -9.096 -13.087 1.00 0.00 C ATOM 416 CD2 LEU A 27 -5.750 -9.185 -10.892 1.00 0.00 C ATOM 0 H LEU A 27 -5.975 -5.947 -14.036 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.366 -6.597 -11.664 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -4.497 -6.648 -12.661 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -4.758 -6.911 -10.948 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.611 -8.432 -12.725 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.879 -10.126 -13.291 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.491 -8.553 -14.027 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.628 -9.088 -12.566 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.046 -10.216 -11.088 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.782 -9.174 -10.391 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.495 -8.709 -10.254 1.00 0.00 H new ATOM 428 N LYS A 28 -5.878 -3.766 -11.623 1.00 0.00 N ATOM 429 CA LYS A 28 -5.631 -2.566 -10.795 1.00 0.00 C ATOM 430 C LYS A 28 -6.920 -1.811 -10.587 1.00 0.00 C ATOM 431 O LYS A 28 -7.267 -1.455 -9.477 1.00 0.00 O ATOM 432 CB LYS A 28 -4.634 -1.656 -11.535 1.00 0.00 C ATOM 433 CG LYS A 28 -3.206 -2.049 -11.148 1.00 0.00 C ATOM 434 CD LYS A 28 -2.227 -1.468 -12.177 1.00 0.00 C ATOM 435 CE LYS A 28 -2.192 0.056 -12.038 1.00 0.00 C ATOM 436 NZ LYS A 28 -1.785 0.448 -10.659 1.00 0.00 N ATOM 0 H LYS A 28 -5.743 -3.643 -12.627 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.230 -2.866 -9.827 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -4.770 -1.749 -12.612 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.818 -0.612 -11.280 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.970 -1.674 -10.152 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.112 -3.134 -11.111 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.231 -1.882 -12.022 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.534 -1.746 -13.185 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.494 0.477 -12.762 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.175 0.470 -12.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.537 1.458 -10.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.573 0.275 -10.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.961 -0.115 -10.367 1.00 0.00 H new ATOM 450 N ALA A 29 -7.612 -1.578 -11.658 1.00 0.00 N ATOM 451 CA ALA A 29 -8.892 -0.845 -11.537 1.00 0.00 C ATOM 452 C ALA A 29 -9.905 -1.676 -10.756 1.00 0.00 C ATOM 453 O ALA A 29 -10.828 -1.148 -10.166 1.00 0.00 O ATOM 454 CB ALA A 29 -9.440 -0.590 -12.950 1.00 0.00 C ATOM 0 H ALA A 29 -7.351 -1.860 -12.603 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.724 0.095 -11.011 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -10.384 -0.050 -12.882 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.723 0.004 -13.517 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.602 -1.542 -13.455 1.00 0.00 H new ATOM 460 N LEU A 30 -9.698 -2.964 -10.743 1.00 0.00 N ATOM 461 CA LEU A 30 -10.630 -3.845 -10.014 1.00 0.00 C ATOM 462 C LEU A 30 -10.343 -3.847 -8.532 1.00 0.00 C ATOM 463 O LEU A 30 -11.223 -3.610 -7.717 1.00 0.00 O ATOM 464 CB LEU A 30 -10.428 -5.275 -10.532 1.00 0.00 C ATOM 465 CG LEU A 30 -10.962 -5.380 -11.957 1.00 0.00 C ATOM 466 CD1 LEU A 30 -10.455 -6.678 -12.587 1.00 0.00 C ATOM 467 CD2 LEU A 30 -12.487 -5.385 -11.930 1.00 0.00 C ATOM 0 H LEU A 30 -8.923 -3.437 -11.207 1.00 0.00 H new ATOM 0 HA LEU A 30 -11.647 -3.487 -10.174 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.370 -5.536 -10.509 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -10.945 -5.984 -9.885 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.616 -4.529 -12.544 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.833 -6.760 -13.606 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.365 -6.673 -12.604 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.805 -7.528 -12.001 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.869 -5.460 -12.948 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.838 -6.237 -11.347 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.846 -4.462 -11.475 1.00 0.00 H new ATOM 479 N TYR A 31 -9.115 -4.086 -8.204 1.00 0.00 N ATOM 480 CA TYR A 31 -8.747 -4.114 -6.784 1.00 0.00 C ATOM 481 C TYR A 31 -8.671 -2.731 -6.144 1.00 0.00 C ATOM 482 O TYR A 31 -8.999 -2.573 -4.985 1.00 0.00 O ATOM 483 CB TYR A 31 -7.377 -4.784 -6.669 1.00 0.00 C ATOM 484 CG TYR A 31 -6.779 -4.457 -5.307 1.00 0.00 C ATOM 485 CD1 TYR A 31 -6.221 -3.220 -5.074 1.00 0.00 C ATOM 486 CD2 TYR A 31 -6.794 -5.389 -4.292 1.00 0.00 C ATOM 487 CE1 TYR A 31 -5.685 -2.915 -3.844 1.00 0.00 C ATOM 488 CE2 TYR A 31 -6.260 -5.085 -3.061 1.00 0.00 C ATOM 489 CZ TYR A 31 -5.700 -3.846 -2.825 1.00 0.00 C ATOM 490 OH TYR A 31 -5.160 -3.544 -1.591 1.00 0.00 O ATOM 0 H TYR A 31 -8.354 -4.262 -8.860 1.00 0.00 H new ATOM 0 HA TYR A 31 -9.526 -4.661 -6.253 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.474 -5.863 -6.788 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -6.718 -4.433 -7.464 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -6.204 -2.483 -5.863 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.227 -6.363 -4.464 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.250 -1.941 -3.675 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.279 -5.823 -2.272 1.00 0.00 H new ATOM 0 HH TYR A 31 -5.258 -4.315 -0.994 1.00 0.00 H new ATOM 500 N ASP A 32 -8.250 -1.759 -6.885 1.00 0.00 N ATOM 501 CA ASP A 32 -8.158 -0.399 -6.296 1.00 0.00 C ATOM 502 C ASP A 32 -9.496 0.344 -6.256 1.00 0.00 C ATOM 503 O ASP A 32 -9.690 1.192 -5.406 1.00 0.00 O ATOM 504 CB ASP A 32 -7.156 0.416 -7.126 1.00 0.00 C ATOM 505 CG ASP A 32 -6.623 1.572 -6.279 1.00 0.00 C ATOM 506 OD1 ASP A 32 -7.421 2.452 -6.000 1.00 0.00 O ATOM 507 OD2 ASP A 32 -5.449 1.510 -5.956 1.00 0.00 O ATOM 0 H ASP A 32 -7.967 -1.839 -7.862 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.836 -0.513 -5.261 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -6.334 -0.220 -7.453 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.638 0.800 -8.025 1.00 0.00 H new ATOM 512 N VAL A 33 -10.400 0.040 -7.149 1.00 0.00 N ATOM 513 CA VAL A 33 -11.690 0.766 -7.099 1.00 0.00 C ATOM 514 C VAL A 33 -12.593 0.163 -6.041 1.00 0.00 C ATOM 515 O VAL A 33 -13.351 0.863 -5.397 1.00 0.00 O ATOM 516 CB VAL A 33 -12.378 0.672 -8.463 1.00 0.00 C ATOM 517 CG1 VAL A 33 -13.699 1.441 -8.402 1.00 0.00 C ATOM 518 CG2 VAL A 33 -11.477 1.309 -9.524 1.00 0.00 C ATOM 0 H VAL A 33 -10.303 -0.658 -7.887 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.499 1.810 -6.849 1.00 0.00 H new ATOM 0 HB VAL A 33 -12.564 -0.372 -8.716 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -14.199 1.382 -9.369 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -14.339 1.005 -7.635 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.501 2.485 -8.159 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.961 1.245 -10.498 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.303 2.355 -9.273 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.524 0.780 -9.557 1.00 0.00 H new ATOM 528 N LEU A 34 -12.501 -1.129 -5.876 1.00 0.00 N ATOM 529 CA LEU A 34 -13.351 -1.782 -4.860 1.00 0.00 C ATOM 530 C LEU A 34 -12.768 -1.606 -3.471 1.00 0.00 C ATOM 531 O LEU A 34 -13.465 -1.260 -2.537 1.00 0.00 O ATOM 532 CB LEU A 34 -13.400 -3.284 -5.153 1.00 0.00 C ATOM 533 CG LEU A 34 -14.573 -3.585 -6.080 1.00 0.00 C ATOM 534 CD1 LEU A 34 -14.235 -4.810 -6.941 1.00 0.00 C ATOM 535 CD2 LEU A 34 -15.812 -3.890 -5.236 1.00 0.00 C ATOM 0 H LEU A 34 -11.880 -1.748 -6.397 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.342 -1.330 -4.899 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -12.466 -3.606 -5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -13.505 -3.843 -4.223 1.00 0.00 H new ATOM 0 HG LEU A 34 -14.766 -2.726 -6.723 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -15.071 -5.029 -7.606 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.344 -4.603 -7.534 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -14.050 -5.669 -6.295 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.655 -4.106 -5.892 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.616 -4.754 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -16.049 -3.028 -4.613 1.00 0.00 H new ATOM 547 N ALA A 35 -11.493 -1.844 -3.363 1.00 0.00 N ATOM 548 CA ALA A 35 -10.835 -1.703 -2.049 1.00 0.00 C ATOM 549 C ALA A 35 -11.068 -0.324 -1.438 1.00 0.00 C ATOM 550 O ALA A 35 -11.565 -0.204 -0.337 1.00 0.00 O ATOM 551 CB ALA A 35 -9.325 -1.911 -2.244 1.00 0.00 C ATOM 0 H ALA A 35 -10.884 -2.129 -4.129 1.00 0.00 H new ATOM 0 HA ALA A 35 -11.258 -2.444 -1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -8.817 -1.811 -1.285 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -9.144 -2.907 -2.649 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -8.941 -1.163 -2.937 1.00 0.00 H new ATOM 557 N LYS A 36 -10.705 0.685 -2.166 1.00 0.00 N ATOM 558 CA LYS A 36 -10.888 2.070 -1.656 1.00 0.00 C ATOM 559 C LYS A 36 -12.291 2.311 -1.095 1.00 0.00 C ATOM 560 O LYS A 36 -12.464 2.483 0.096 1.00 0.00 O ATOM 561 CB LYS A 36 -10.656 3.045 -2.820 1.00 0.00 C ATOM 562 CG LYS A 36 -10.620 4.476 -2.275 1.00 0.00 C ATOM 563 CD LYS A 36 -10.588 5.459 -3.447 1.00 0.00 C ATOM 564 CE LYS A 36 -9.152 5.591 -3.958 1.00 0.00 C ATOM 565 NZ LYS A 36 -9.113 5.477 -5.442 1.00 0.00 N ATOM 0 H LYS A 36 -10.288 0.614 -3.094 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.177 2.224 -0.844 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.719 2.811 -3.325 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.451 2.944 -3.559 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.494 4.663 -1.652 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -9.743 4.616 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -11.240 5.110 -4.247 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.964 6.432 -3.131 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.737 6.551 -3.650 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -8.528 4.816 -3.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.131 5.569 -5.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -9.489 4.551 -5.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.692 6.231 -5.863 1.00 0.00 H new ATOM 579 N GLU A 37 -13.265 2.320 -1.959 1.00 0.00 N ATOM 580 CA GLU A 37 -14.660 2.553 -1.490 1.00 0.00 C ATOM 581 C GLU A 37 -14.983 1.774 -0.211 1.00 0.00 C ATOM 582 O GLU A 37 -15.069 2.346 0.856 1.00 0.00 O ATOM 583 CB GLU A 37 -15.623 2.091 -2.599 1.00 0.00 C ATOM 584 CG GLU A 37 -16.986 2.759 -2.396 1.00 0.00 C ATOM 585 CD GLU A 37 -17.723 2.826 -3.736 1.00 0.00 C ATOM 586 OE1 GLU A 37 -17.928 1.761 -4.295 1.00 0.00 O ATOM 587 OE2 GLU A 37 -18.039 3.938 -4.124 1.00 0.00 O ATOM 0 H GLU A 37 -13.159 2.177 -2.963 1.00 0.00 H new ATOM 0 HA GLU A 37 -14.770 3.615 -1.270 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -15.220 2.351 -3.578 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -15.730 1.006 -2.576 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -17.575 2.196 -1.672 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -16.855 3.762 -1.990 1.00 0.00 H new ATOM 594 N SER A 38 -15.154 0.487 -0.341 1.00 0.00 N ATOM 595 CA SER A 38 -15.474 -0.336 0.864 1.00 0.00 C ATOM 596 C SER A 38 -14.999 -1.776 0.693 1.00 0.00 C ATOM 597 O SER A 38 -15.299 -2.420 -0.293 1.00 0.00 O ATOM 598 CB SER A 38 -16.994 -0.317 1.057 1.00 0.00 C ATOM 599 OG SER A 38 -17.256 0.973 1.587 1.00 0.00 O ATOM 0 H SER A 38 -15.087 -0.028 -1.219 1.00 0.00 H new ATOM 0 HA SER A 38 -14.963 0.081 1.732 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.518 -0.475 0.115 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.320 -1.103 1.739 1.00 0.00 H new ATOM 0 HG SER A 38 -16.415 1.470 1.668 1.00 0.00 H new ATOM 605 N GLU A 39 -14.266 -2.256 1.666 1.00 0.00 N ATOM 606 CA GLU A 39 -13.755 -3.652 1.586 1.00 0.00 C ATOM 607 C GLU A 39 -14.642 -4.651 2.350 1.00 0.00 C ATOM 608 O GLU A 39 -14.448 -5.845 2.246 1.00 0.00 O ATOM 609 CB GLU A 39 -12.346 -3.690 2.213 1.00 0.00 C ATOM 610 CG GLU A 39 -11.506 -2.518 1.689 1.00 0.00 C ATOM 611 CD GLU A 39 -10.423 -2.180 2.716 1.00 0.00 C ATOM 612 OE1 GLU A 39 -10.233 -3.007 3.593 1.00 0.00 O ATOM 613 OE2 GLU A 39 -9.847 -1.115 2.566 1.00 0.00 O ATOM 0 H GLU A 39 -14.002 -1.742 2.507 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.748 -3.942 0.535 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.421 -3.637 3.299 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.857 -4.634 1.973 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.050 -2.779 0.734 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.141 -1.650 1.512 1.00 0.00 H new ATOM 620 N HIS A 40 -15.593 -4.159 3.105 1.00 0.00 N ATOM 621 CA HIS A 40 -16.472 -5.111 3.867 1.00 0.00 C ATOM 622 C HIS A 40 -17.661 -5.662 3.047 1.00 0.00 C ATOM 623 O HIS A 40 -17.950 -6.840 3.106 1.00 0.00 O ATOM 624 CB HIS A 40 -17.022 -4.400 5.115 1.00 0.00 C ATOM 625 CG HIS A 40 -16.920 -5.352 6.311 1.00 0.00 C ATOM 626 ND1 HIS A 40 -15.871 -5.598 6.944 1.00 0.00 N ATOM 627 CD2 HIS A 40 -17.901 -6.119 6.914 1.00 0.00 C ATOM 628 CE1 HIS A 40 -16.076 -6.433 7.877 1.00 0.00 C ATOM 629 NE2 HIS A 40 -17.349 -6.825 7.939 1.00 0.00 N ATOM 0 H HIS A 40 -15.799 -3.168 3.228 1.00 0.00 H new ATOM 0 HA HIS A 40 -15.846 -5.964 4.128 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -16.457 -3.488 5.309 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -18.059 -4.105 4.955 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -18.939 -6.152 6.619 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -15.306 -6.787 8.546 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -17.792 -7.480 8.583 1.00 0.00 H new ATOM 637 N PRO A 41 -18.332 -4.803 2.300 1.00 0.00 N ATOM 638 CA PRO A 41 -19.479 -5.232 1.491 1.00 0.00 C ATOM 639 C PRO A 41 -19.139 -6.328 0.455 1.00 0.00 C ATOM 640 O PRO A 41 -19.886 -7.274 0.291 1.00 0.00 O ATOM 641 CB PRO A 41 -19.951 -3.959 0.764 1.00 0.00 C ATOM 642 CG PRO A 41 -19.093 -2.773 1.296 1.00 0.00 C ATOM 643 CD PRO A 41 -18.010 -3.367 2.216 1.00 0.00 C ATOM 0 HA PRO A 41 -20.236 -5.679 2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -19.831 -4.066 -0.314 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -21.010 -3.781 0.951 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -18.638 -2.227 0.470 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -19.715 -2.064 1.843 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -17.013 -3.209 1.806 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -18.028 -2.900 3.201 1.00 0.00 H new ATOM 651 N PRO A 42 -18.017 -6.180 -0.223 1.00 0.00 N ATOM 652 CA PRO A 42 -17.598 -7.154 -1.230 1.00 0.00 C ATOM 653 C PRO A 42 -17.302 -8.520 -0.624 1.00 0.00 C ATOM 654 O PRO A 42 -17.370 -8.704 0.576 1.00 0.00 O ATOM 655 CB PRO A 42 -16.304 -6.573 -1.826 1.00 0.00 C ATOM 656 CG PRO A 42 -16.052 -5.201 -1.132 1.00 0.00 C ATOM 657 CD PRO A 42 -17.103 -5.055 -0.026 1.00 0.00 C ATOM 0 HA PRO A 42 -18.387 -7.309 -1.966 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -15.466 -7.249 -1.658 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -16.400 -6.447 -2.904 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -15.046 -5.159 -0.715 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -16.133 -4.385 -1.850 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -16.644 -5.088 0.962 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -17.627 -4.102 -0.103 1.00 0.00 H new ATOM 665 N GLN A 43 -16.977 -9.453 -1.476 1.00 0.00 N ATOM 666 CA GLN A 43 -16.669 -10.821 -0.990 1.00 0.00 C ATOM 667 C GLN A 43 -15.166 -10.997 -0.773 1.00 0.00 C ATOM 668 O GLN A 43 -14.739 -11.519 0.237 1.00 0.00 O ATOM 669 CB GLN A 43 -17.138 -11.822 -2.059 1.00 0.00 C ATOM 670 CG GLN A 43 -17.054 -11.157 -3.437 1.00 0.00 C ATOM 671 CD GLN A 43 -18.353 -10.392 -3.708 1.00 0.00 C ATOM 672 OE1 GLN A 43 -19.427 -10.959 -3.731 1.00 0.00 O ATOM 673 NE2 GLN A 43 -18.297 -9.104 -3.920 1.00 0.00 N ATOM 0 H GLN A 43 -16.912 -9.324 -2.486 1.00 0.00 H new ATOM 0 HA GLN A 43 -17.177 -10.989 -0.040 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.517 -12.717 -2.035 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -18.161 -12.138 -1.855 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -16.203 -10.477 -3.474 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -16.894 -11.910 -4.208 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -17.398 -8.623 -3.902 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.152 -8.580 -4.104 1.00 0.00 H new ATOM 682 N SER A 44 -14.394 -10.548 -1.727 1.00 0.00 N ATOM 683 CA SER A 44 -12.926 -10.669 -1.615 1.00 0.00 C ATOM 684 C SER A 44 -12.287 -10.008 -2.801 1.00 0.00 C ATOM 685 O SER A 44 -11.840 -10.660 -3.717 1.00 0.00 O ATOM 686 CB SER A 44 -12.543 -12.151 -1.589 1.00 0.00 C ATOM 687 OG SER A 44 -12.580 -12.498 -0.211 1.00 0.00 O ATOM 0 H SER A 44 -14.727 -10.101 -2.581 1.00 0.00 H new ATOM 0 HA SER A 44 -12.583 -10.188 -0.699 1.00 0.00 H new ATOM 0 HB2 SER A 44 -13.242 -12.753 -2.170 1.00 0.00 H new ATOM 0 HB3 SER A 44 -11.553 -12.314 -2.014 1.00 0.00 H new ATOM 0 HG SER A 44 -13.508 -12.489 0.104 1.00 0.00 H new ATOM 693 N ILE A 45 -12.265 -8.707 -2.751 1.00 0.00 N ATOM 694 CA ILE A 45 -11.668 -7.922 -3.851 1.00 0.00 C ATOM 695 C ILE A 45 -10.488 -8.610 -4.481 1.00 0.00 C ATOM 696 O ILE A 45 -10.368 -8.653 -5.687 1.00 0.00 O ATOM 697 CB ILE A 45 -11.160 -6.607 -3.281 1.00 0.00 C ATOM 698 CG1 ILE A 45 -12.276 -5.824 -2.603 1.00 0.00 C ATOM 699 CG2 ILE A 45 -10.616 -5.790 -4.440 1.00 0.00 C ATOM 700 CD1 ILE A 45 -13.610 -6.139 -3.267 1.00 0.00 C ATOM 0 H ILE A 45 -12.642 -8.152 -1.982 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.440 -7.788 -4.608 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.394 -6.810 -2.532 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.318 -6.078 -1.544 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -12.072 -4.755 -2.666 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -10.241 -4.836 -4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.805 -6.336 -4.921 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.411 -5.610 -5.163 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.403 -5.575 -2.776 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.566 -5.862 -4.320 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.817 -7.206 -3.180 1.00 0.00 H new ATOM 712 N LEU A 46 -9.635 -9.138 -3.676 1.00 0.00 N ATOM 713 CA LEU A 46 -8.464 -9.817 -4.254 1.00 0.00 C ATOM 714 C LEU A 46 -8.871 -11.121 -4.913 1.00 0.00 C ATOM 715 O LEU A 46 -8.373 -11.467 -5.960 1.00 0.00 O ATOM 716 CB LEU A 46 -7.447 -10.102 -3.131 1.00 0.00 C ATOM 717 CG LEU A 46 -6.147 -10.683 -3.725 1.00 0.00 C ATOM 718 CD1 LEU A 46 -5.752 -9.927 -5.002 1.00 0.00 C ATOM 719 CD2 LEU A 46 -5.031 -10.519 -2.701 1.00 0.00 C ATOM 0 H LEU A 46 -9.693 -9.132 -2.658 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.018 -9.173 -5.012 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.228 -9.183 -2.587 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.873 -10.803 -2.414 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.305 -11.734 -3.968 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.833 -10.351 -5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.549 -10.018 -5.740 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.593 -8.874 -4.767 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.104 -10.925 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.896 -9.461 -2.476 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -5.293 -11.053 -1.788 1.00 0.00 H new ATOM 731 N HIS A 47 -9.783 -11.813 -4.300 1.00 0.00 N ATOM 732 CA HIS A 47 -10.227 -13.098 -4.888 1.00 0.00 C ATOM 733 C HIS A 47 -11.251 -12.877 -5.987 1.00 0.00 C ATOM 734 O HIS A 47 -11.562 -13.782 -6.735 1.00 0.00 O ATOM 735 CB HIS A 47 -10.873 -13.944 -3.782 1.00 0.00 C ATOM 736 CG HIS A 47 -10.852 -15.417 -4.198 1.00 0.00 C ATOM 737 ND1 HIS A 47 -10.654 -15.826 -5.361 1.00 0.00 N ATOM 738 CD2 HIS A 47 -11.031 -16.553 -3.432 1.00 0.00 C ATOM 739 CE1 HIS A 47 -10.686 -17.092 -5.421 1.00 0.00 C ATOM 740 NE2 HIS A 47 -10.924 -17.649 -4.233 1.00 0.00 N ATOM 0 H HIS A 47 -10.236 -11.547 -3.426 1.00 0.00 H new ATOM 0 HA HIS A 47 -9.360 -13.601 -5.317 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -10.334 -13.811 -2.844 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.898 -13.617 -3.609 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -10.487 -15.218 -6.163 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -11.225 -16.569 -2.370 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -10.537 -17.655 -6.331 1.00 0.00 H new ATOM 748 N THR A 48 -11.754 -11.682 -6.070 1.00 0.00 N ATOM 749 CA THR A 48 -12.755 -11.390 -7.115 1.00 0.00 C ATOM 750 C THR A 48 -12.076 -10.791 -8.326 1.00 0.00 C ATOM 751 O THR A 48 -12.299 -11.215 -9.440 1.00 0.00 O ATOM 752 CB THR A 48 -13.761 -10.382 -6.560 1.00 0.00 C ATOM 753 OG1 THR A 48 -14.667 -11.148 -5.791 1.00 0.00 O ATOM 754 CG2 THR A 48 -14.614 -9.791 -7.688 1.00 0.00 C ATOM 0 H THR A 48 -11.514 -10.900 -5.460 1.00 0.00 H new ATOM 0 HA THR A 48 -13.259 -12.312 -7.405 1.00 0.00 H new ATOM 0 HB THR A 48 -13.238 -9.591 -6.022 1.00 0.00 H new ATOM 0 HG1 THR A 48 -15.430 -10.590 -5.533 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.323 -9.076 -7.271 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.968 -9.285 -8.406 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.158 -10.591 -8.190 1.00 0.00 H new ATOM 762 N ALA A 49 -11.248 -9.814 -8.086 1.00 0.00 N ATOM 763 CA ALA A 49 -10.546 -9.178 -9.212 1.00 0.00 C ATOM 764 C ALA A 49 -9.574 -10.161 -9.861 1.00 0.00 C ATOM 765 O ALA A 49 -9.259 -10.038 -11.028 1.00 0.00 O ATOM 766 CB ALA A 49 -9.765 -7.963 -8.683 1.00 0.00 C ATOM 0 H ALA A 49 -11.034 -9.437 -7.163 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.275 -8.865 -9.960 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.239 -7.481 -9.507 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.458 -7.254 -8.231 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.043 -8.292 -7.935 1.00 0.00 H new ATOM 772 N LYS A 50 -9.101 -11.123 -9.093 1.00 0.00 N ATOM 773 CA LYS A 50 -8.148 -12.108 -9.686 1.00 0.00 C ATOM 774 C LYS A 50 -8.858 -13.106 -10.591 1.00 0.00 C ATOM 775 O LYS A 50 -8.290 -13.581 -11.554 1.00 0.00 O ATOM 776 CB LYS A 50 -7.490 -12.903 -8.557 1.00 0.00 C ATOM 777 CG LYS A 50 -6.195 -12.211 -8.142 1.00 0.00 C ATOM 778 CD LYS A 50 -5.529 -13.025 -7.031 1.00 0.00 C ATOM 779 CE LYS A 50 -4.049 -12.645 -6.948 1.00 0.00 C ATOM 780 NZ LYS A 50 -3.218 -13.619 -7.711 1.00 0.00 N ATOM 0 H LYS A 50 -9.329 -11.262 -8.109 1.00 0.00 H new ATOM 0 HA LYS A 50 -7.418 -11.550 -10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.166 -12.975 -7.705 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -7.282 -13.921 -8.886 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -5.525 -12.122 -8.997 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.404 -11.199 -7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.021 -12.832 -6.077 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.632 -14.091 -7.233 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -3.902 -11.641 -7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -3.731 -12.624 -5.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -2.216 -13.347 -7.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.346 -14.571 -7.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -3.512 -13.619 -8.709 1.00 0.00 H new ATOM 794 N ALA A 51 -10.085 -13.406 -10.270 1.00 0.00 N ATOM 795 CA ALA A 51 -10.841 -14.377 -11.104 1.00 0.00 C ATOM 796 C ALA A 51 -11.698 -13.691 -12.171 1.00 0.00 C ATOM 797 O ALA A 51 -12.167 -14.332 -13.090 1.00 0.00 O ATOM 798 CB ALA A 51 -11.766 -15.171 -10.171 1.00 0.00 C ATOM 0 H ALA A 51 -10.593 -13.024 -9.472 1.00 0.00 H new ATOM 0 HA ALA A 51 -10.125 -15.016 -11.621 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -12.337 -15.894 -10.754 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -11.168 -15.696 -9.426 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -12.451 -14.487 -9.670 1.00 0.00 H new ATOM 804 N ILE A 52 -11.892 -12.411 -12.037 1.00 0.00 N ATOM 805 CA ILE A 52 -12.715 -11.693 -13.038 1.00 0.00 C ATOM 806 C ILE A 52 -11.868 -11.156 -14.194 1.00 0.00 C ATOM 807 O ILE A 52 -12.274 -11.185 -15.337 1.00 0.00 O ATOM 808 CB ILE A 52 -13.360 -10.519 -12.324 1.00 0.00 C ATOM 809 CG1 ILE A 52 -14.590 -10.076 -13.078 1.00 0.00 C ATOM 810 CG2 ILE A 52 -12.353 -9.350 -12.283 1.00 0.00 C ATOM 811 CD1 ILE A 52 -14.918 -8.651 -12.675 1.00 0.00 C ATOM 0 H ILE A 52 -11.518 -11.836 -11.282 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.450 -12.380 -13.458 1.00 0.00 H new ATOM 0 HB ILE A 52 -13.641 -10.816 -11.314 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -14.417 -10.135 -14.153 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -15.429 -10.735 -12.854 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.804 -8.499 -11.772 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -11.456 -9.661 -11.747 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -12.087 -9.063 -13.300 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -15.805 -8.316 -13.212 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -15.106 -8.610 -11.602 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -14.078 -8.001 -12.921 1.00 0.00 H new ATOM 823 N GLU A 53 -10.723 -10.666 -13.856 1.00 0.00 N ATOM 824 CA GLU A 53 -9.800 -10.106 -14.885 1.00 0.00 C ATOM 825 C GLU A 53 -9.847 -10.859 -16.221 1.00 0.00 C ATOM 826 O GLU A 53 -9.852 -10.247 -17.268 1.00 0.00 O ATOM 827 CB GLU A 53 -8.373 -10.213 -14.335 1.00 0.00 C ATOM 828 CG GLU A 53 -7.867 -11.645 -14.547 1.00 0.00 C ATOM 829 CD GLU A 53 -6.574 -11.851 -13.758 1.00 0.00 C ATOM 830 OE1 GLU A 53 -6.676 -11.841 -12.543 1.00 0.00 O ATOM 831 OE2 GLU A 53 -5.560 -12.009 -14.416 1.00 0.00 O ATOM 0 H GLU A 53 -10.373 -10.625 -12.899 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.109 -9.079 -15.080 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -7.719 -9.503 -14.842 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -8.357 -9.960 -13.275 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.622 -12.361 -14.222 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.691 -11.827 -15.607 1.00 0.00 H new ATOM 838 N SER A 54 -9.875 -12.168 -16.165 1.00 0.00 N ATOM 839 CA SER A 54 -9.913 -12.955 -17.440 1.00 0.00 C ATOM 840 C SER A 54 -11.324 -13.369 -17.862 1.00 0.00 C ATOM 841 O SER A 54 -11.519 -13.833 -18.968 1.00 0.00 O ATOM 842 CB SER A 54 -9.083 -14.225 -17.231 1.00 0.00 C ATOM 843 OG SER A 54 -7.812 -13.744 -16.826 1.00 0.00 O ATOM 0 H SER A 54 -9.873 -12.720 -15.307 1.00 0.00 H new ATOM 0 HA SER A 54 -9.519 -12.316 -18.230 1.00 0.00 H new ATOM 0 HB2 SER A 54 -9.526 -14.870 -16.472 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.014 -14.812 -18.147 1.00 0.00 H new ATOM 0 HG SER A 54 -7.211 -14.502 -16.667 1.00 0.00 H new ATOM 849 N GLU A 55 -12.280 -13.206 -16.999 1.00 0.00 N ATOM 850 CA GLU A 55 -13.658 -13.605 -17.388 1.00 0.00 C ATOM 851 C GLU A 55 -14.318 -12.552 -18.252 1.00 0.00 C ATOM 852 O GLU A 55 -14.946 -12.871 -19.243 1.00 0.00 O ATOM 853 CB GLU A 55 -14.492 -13.815 -16.118 1.00 0.00 C ATOM 854 CG GLU A 55 -14.319 -15.261 -15.641 1.00 0.00 C ATOM 855 CD GLU A 55 -15.093 -15.466 -14.336 1.00 0.00 C ATOM 856 OE1 GLU A 55 -15.594 -14.470 -13.841 1.00 0.00 O ATOM 857 OE2 GLU A 55 -15.136 -16.608 -13.906 1.00 0.00 O ATOM 0 H GLU A 55 -12.174 -12.822 -16.060 1.00 0.00 H new ATOM 0 HA GLU A 55 -13.599 -14.527 -17.966 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -14.174 -13.121 -15.340 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.543 -13.608 -16.319 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.681 -15.952 -16.403 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -13.262 -15.480 -15.488 1.00 0.00 H new ATOM 864 N MET A 56 -14.174 -11.322 -17.881 1.00 0.00 N ATOM 865 CA MET A 56 -14.796 -10.270 -18.691 1.00 0.00 C ATOM 866 C MET A 56 -13.941 -10.016 -19.916 1.00 0.00 C ATOM 867 O MET A 56 -14.329 -9.302 -20.820 1.00 0.00 O ATOM 868 CB MET A 56 -14.879 -8.994 -17.852 1.00 0.00 C ATOM 869 CG MET A 56 -13.481 -8.443 -17.658 1.00 0.00 C ATOM 870 SD MET A 56 -12.920 -7.204 -18.841 1.00 0.00 S ATOM 871 CE MET A 56 -11.522 -6.609 -17.878 1.00 0.00 C ATOM 0 H MET A 56 -13.657 -11.006 -17.060 1.00 0.00 H new ATOM 0 HA MET A 56 -15.795 -10.574 -19.004 1.00 0.00 H new ATOM 0 HB2 MET A 56 -15.509 -8.256 -18.349 1.00 0.00 H new ATOM 0 HB3 MET A 56 -15.338 -9.207 -16.886 1.00 0.00 H new ATOM 0 HG2 MET A 56 -13.423 -8.009 -16.660 1.00 0.00 H new ATOM 0 HG3 MET A 56 -12.781 -9.278 -17.684 1.00 0.00 H new ATOM 0 HE1 MET A 56 -11.132 -5.696 -18.329 1.00 0.00 H new ATOM 0 HE2 MET A 56 -11.845 -6.401 -16.858 1.00 0.00 H new ATOM 0 HE3 MET A 56 -10.741 -7.369 -17.863 1.00 0.00 H new ATOM 881 N ASN A 57 -12.775 -10.620 -19.918 1.00 0.00 N ATOM 882 CA ASN A 57 -11.855 -10.442 -21.070 1.00 0.00 C ATOM 883 C ASN A 57 -12.164 -11.448 -22.177 1.00 0.00 C ATOM 884 O ASN A 57 -11.670 -11.319 -23.279 1.00 0.00 O ATOM 885 CB ASN A 57 -10.398 -10.651 -20.565 1.00 0.00 C ATOM 886 CG ASN A 57 -9.771 -11.895 -21.222 1.00 0.00 C ATOM 887 OD1 ASN A 57 -10.244 -13.002 -21.054 1.00 0.00 O ATOM 888 ND2 ASN A 57 -8.709 -11.753 -21.971 1.00 0.00 N ATOM 0 H ASN A 57 -12.429 -11.224 -19.172 1.00 0.00 H new ATOM 0 HA ASN A 57 -11.981 -9.441 -21.482 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -9.798 -9.770 -20.794 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -10.396 -10.765 -19.481 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.282 -12.568 -22.411 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -8.307 -10.827 -22.116 1.00 0.00 H new ATOM 895 N LYS A 58 -12.964 -12.443 -21.855 1.00 0.00 N ATOM 896 CA LYS A 58 -13.315 -13.466 -22.881 1.00 0.00 C ATOM 897 C LYS A 58 -13.528 -12.818 -24.245 1.00 0.00 C ATOM 898 O LYS A 58 -13.376 -13.455 -25.270 1.00 0.00 O ATOM 899 CB LYS A 58 -14.619 -14.153 -22.452 1.00 0.00 C ATOM 900 CG LYS A 58 -15.097 -15.073 -23.577 1.00 0.00 C ATOM 901 CD LYS A 58 -16.271 -15.917 -23.074 1.00 0.00 C ATOM 902 CE LYS A 58 -16.874 -16.686 -24.251 1.00 0.00 C ATOM 903 NZ LYS A 58 -16.970 -15.809 -25.451 1.00 0.00 N ATOM 0 H LYS A 58 -13.381 -12.584 -20.935 1.00 0.00 H new ATOM 0 HA LYS A 58 -12.499 -14.184 -22.960 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -14.458 -14.728 -21.540 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -15.381 -13.406 -22.228 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -15.402 -14.482 -24.441 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -14.283 -15.720 -23.905 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -15.933 -16.611 -22.305 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -17.026 -15.277 -22.617 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -16.259 -17.557 -24.478 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -17.864 -17.056 -23.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -17.677 -16.196 -26.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -17.255 -14.852 -25.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -16.045 -15.766 -25.924 1.00 0.00 H new ATOM 917 N VAL A 59 -13.877 -11.558 -24.225 1.00 0.00 N ATOM 918 CA VAL A 59 -14.110 -10.830 -25.493 1.00 0.00 C ATOM 919 C VAL A 59 -13.479 -9.449 -25.428 1.00 0.00 C ATOM 920 O VAL A 59 -13.832 -8.646 -24.587 1.00 0.00 O ATOM 921 CB VAL A 59 -15.620 -10.671 -25.687 1.00 0.00 C ATOM 922 CG1 VAL A 59 -16.117 -11.731 -26.670 1.00 0.00 C ATOM 923 CG2 VAL A 59 -16.325 -10.856 -24.340 1.00 0.00 C ATOM 0 H VAL A 59 -14.010 -11.005 -23.378 1.00 0.00 H new ATOM 0 HA VAL A 59 -13.667 -11.387 -26.319 1.00 0.00 H new ATOM 0 HB VAL A 59 -15.837 -9.678 -26.080 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -17.192 -11.621 -26.811 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -15.611 -11.605 -27.627 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.903 -12.724 -26.274 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.401 -10.743 -24.474 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -16.110 -11.851 -23.950 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -15.967 -10.105 -23.636 1.00 0.00 H new ATOM 933 N ASN A 60 -12.556 -9.190 -26.312 1.00 0.00 N ATOM 934 CA ASN A 60 -11.905 -7.859 -26.298 1.00 0.00 C ATOM 935 C ASN A 60 -11.460 -7.438 -27.691 1.00 0.00 C ATOM 936 O ASN A 60 -11.275 -8.259 -28.568 1.00 0.00 O ATOM 937 CB ASN A 60 -10.666 -7.937 -25.396 1.00 0.00 C ATOM 938 CG ASN A 60 -9.891 -9.214 -25.722 1.00 0.00 C ATOM 939 OD1 ASN A 60 -10.230 -9.943 -26.632 1.00 0.00 O ATOM 940 ND2 ASN A 60 -8.845 -9.521 -25.006 1.00 0.00 N ATOM 0 H ASN A 60 -12.231 -9.835 -27.032 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.624 -7.127 -25.931 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -10.033 -7.063 -25.550 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -10.963 -7.935 -24.347 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.317 -10.369 -25.212 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -8.555 -8.913 -24.240 1.00 0.00 H new ATOM 947 N ASN A 61 -11.300 -6.161 -27.857 1.00 0.00 N ATOM 948 CA ASN A 61 -10.869 -5.628 -29.168 1.00 0.00 C ATOM 949 C ASN A 61 -9.355 -5.430 -29.198 1.00 0.00 C ATOM 950 O ASN A 61 -8.807 -5.073 -30.203 1.00 0.00 O ATOM 951 CB ASN A 61 -11.554 -4.271 -29.385 1.00 0.00 C ATOM 952 CG ASN A 61 -13.074 -4.463 -29.360 1.00 0.00 C ATOM 953 OD1 ASN A 61 -13.701 -4.678 -30.378 1.00 0.00 O ATOM 954 ND2 ASN A 61 -13.700 -4.395 -28.217 1.00 0.00 N ATOM 0 H ASN A 61 -11.451 -5.458 -27.133 1.00 0.00 H new ATOM 0 HA ASN A 61 -11.143 -6.334 -29.952 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.251 -3.569 -28.608 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.245 -3.843 -30.339 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.711 -4.522 -28.181 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.178 -4.215 -27.360 1.00 0.00 H new ATOM 961 N CYS A 62 -8.733 -5.629 -28.058 1.00 0.00 N ATOM 962 CA CYS A 62 -7.240 -5.468 -27.942 1.00 0.00 C ATOM 963 C CYS A 62 -6.459 -5.927 -29.189 1.00 0.00 C ATOM 964 O CYS A 62 -5.298 -5.596 -29.335 1.00 0.00 O ATOM 965 CB CYS A 62 -6.770 -6.313 -26.752 1.00 0.00 C ATOM 966 SG CYS A 62 -6.936 -8.110 -26.896 1.00 0.00 S ATOM 0 H CYS A 62 -9.199 -5.899 -27.192 1.00 0.00 H new ATOM 0 HA CYS A 62 -7.042 -4.403 -27.819 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -5.720 -6.084 -26.569 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.324 -5.992 -25.870 1.00 0.00 H new ATOM 0 HG CYS A 62 -6.879 -8.452 -28.149 1.00 0.00 H new ATOM 972 N ASP A 63 -7.082 -6.670 -30.056 1.00 0.00 N ATOM 973 CA ASP A 63 -6.345 -7.130 -31.271 1.00 0.00 C ATOM 974 C ASP A 63 -6.465 -6.117 -32.412 1.00 0.00 C ATOM 975 O ASP A 63 -5.981 -6.346 -33.502 1.00 0.00 O ATOM 976 CB ASP A 63 -6.952 -8.466 -31.728 1.00 0.00 C ATOM 977 CG ASP A 63 -6.626 -9.545 -30.692 1.00 0.00 C ATOM 978 OD1 ASP A 63 -6.325 -9.151 -29.577 1.00 0.00 O ATOM 979 OD2 ASP A 63 -6.697 -10.701 -31.074 1.00 0.00 O ATOM 0 H ASP A 63 -8.052 -6.977 -29.983 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.290 -7.240 -31.021 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -8.032 -8.369 -31.843 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.552 -8.747 -32.702 1.00 0.00 H new ATOM 984 N THR A 64 -7.109 -5.021 -32.136 1.00 0.00 N ATOM 985 CA THR A 64 -7.276 -3.981 -33.178 1.00 0.00 C ATOM 986 C THR A 64 -7.406 -2.605 -32.542 1.00 0.00 C ATOM 987 O THR A 64 -6.639 -1.707 -32.833 1.00 0.00 O ATOM 988 CB THR A 64 -8.549 -4.287 -33.970 1.00 0.00 C ATOM 989 OG1 THR A 64 -9.468 -4.785 -33.019 1.00 0.00 O ATOM 990 CG2 THR A 64 -8.322 -5.458 -34.937 1.00 0.00 C ATOM 0 H THR A 64 -7.527 -4.802 -31.232 1.00 0.00 H new ATOM 0 HA THR A 64 -6.404 -3.984 -33.832 1.00 0.00 H new ATOM 0 HB THR A 64 -8.869 -3.399 -34.515 1.00 0.00 H new ATOM 0 HG1 THR A 64 -10.314 -5.002 -33.464 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.241 -5.657 -35.489 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.526 -5.203 -35.637 1.00 0.00 H new ATOM 0 HG23 THR A 64 -8.038 -6.346 -34.373 1.00 0.00 H new ATOM 998 N ASN A 65 -8.387 -2.471 -31.682 1.00 0.00 N ATOM 999 CA ASN A 65 -8.612 -1.172 -30.997 1.00 0.00 C ATOM 1000 C ASN A 65 -8.710 -1.384 -29.494 1.00 0.00 C ATOM 1001 O ASN A 65 -9.785 -1.411 -28.931 1.00 0.00 O ATOM 1002 CB ASN A 65 -9.934 -0.575 -31.507 1.00 0.00 C ATOM 1003 CG ASN A 65 -9.697 0.079 -32.871 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -8.650 0.638 -33.129 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -10.641 0.030 -33.770 1.00 0.00 N ATOM 0 H ASN A 65 -9.041 -3.212 -31.428 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.781 -0.499 -31.207 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.691 -1.355 -31.591 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -10.312 0.161 -30.798 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.498 0.460 -34.684 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.522 -0.438 -33.559 1.00 0.00 H new ATOM 1012 N GLU A 66 -7.575 -1.527 -28.877 1.00 0.00 N ATOM 1013 CA GLU A 66 -7.551 -1.741 -27.407 1.00 0.00 C ATOM 1014 C GLU A 66 -8.218 -0.593 -26.693 1.00 0.00 C ATOM 1015 O GLU A 66 -8.447 -0.642 -25.501 1.00 0.00 O ATOM 1016 CB GLU A 66 -6.087 -1.828 -26.952 1.00 0.00 C ATOM 1017 CG GLU A 66 -5.451 -0.439 -27.037 1.00 0.00 C ATOM 1018 CD GLU A 66 -4.030 -0.565 -27.588 1.00 0.00 C ATOM 1019 OE1 GLU A 66 -3.213 -1.106 -26.860 1.00 0.00 O ATOM 1020 OE2 GLU A 66 -3.840 -0.113 -28.705 1.00 0.00 O ATOM 0 H GLU A 66 -6.660 -1.505 -29.328 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.087 -2.660 -27.169 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.033 -2.204 -25.930 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.540 -2.531 -27.580 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.047 0.207 -27.681 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.431 0.025 -26.051 1.00 0.00 H new ATOM 1027 N ALA A 67 -8.518 0.422 -27.433 1.00 0.00 N ATOM 1028 CA ALA A 67 -9.168 1.588 -26.828 1.00 0.00 C ATOM 1029 C ALA A 67 -10.582 1.231 -26.395 1.00 0.00 C ATOM 1030 O ALA A 67 -11.139 1.840 -25.503 1.00 0.00 O ATOM 1031 CB ALA A 67 -9.224 2.687 -27.889 1.00 0.00 C ATOM 0 H ALA A 67 -8.339 0.491 -28.435 1.00 0.00 H new ATOM 0 HA ALA A 67 -8.611 1.920 -25.952 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.703 3.572 -27.471 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -8.212 2.938 -28.206 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -9.797 2.335 -28.747 1.00 0.00 H new ATOM 1037 N ALA A 68 -11.132 0.238 -27.034 1.00 0.00 N ATOM 1038 CA ALA A 68 -12.504 -0.186 -26.686 1.00 0.00 C ATOM 1039 C ALA A 68 -12.481 -1.140 -25.499 1.00 0.00 C ATOM 1040 O ALA A 68 -13.027 -0.849 -24.455 1.00 0.00 O ATOM 1041 CB ALA A 68 -13.095 -0.915 -27.896 1.00 0.00 C ATOM 0 H ALA A 68 -10.687 -0.295 -27.781 1.00 0.00 H new ATOM 0 HA ALA A 68 -13.101 0.687 -26.422 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.110 -1.239 -27.665 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.115 -0.241 -28.753 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -12.481 -1.784 -28.133 1.00 0.00 H new ATOM 1047 N TYR A 69 -11.847 -2.267 -25.688 1.00 0.00 N ATOM 1048 CA TYR A 69 -11.767 -3.264 -24.589 1.00 0.00 C ATOM 1049 C TYR A 69 -11.499 -2.575 -23.257 1.00 0.00 C ATOM 1050 O TYR A 69 -12.133 -2.869 -22.262 1.00 0.00 O ATOM 1051 CB TYR A 69 -10.596 -4.207 -24.898 1.00 0.00 C ATOM 1052 CG TYR A 69 -10.258 -5.024 -23.656 1.00 0.00 C ATOM 1053 CD1 TYR A 69 -11.254 -5.648 -22.937 1.00 0.00 C ATOM 1054 CD2 TYR A 69 -8.950 -5.152 -23.240 1.00 0.00 C ATOM 1055 CE1 TYR A 69 -10.947 -6.391 -21.816 1.00 0.00 C ATOM 1056 CE2 TYR A 69 -8.643 -5.895 -22.120 1.00 0.00 C ATOM 1057 CZ TYR A 69 -9.639 -6.520 -21.399 1.00 0.00 C ATOM 1058 OH TYR A 69 -9.330 -7.271 -20.284 1.00 0.00 O ATOM 0 H TYR A 69 -11.383 -2.537 -26.555 1.00 0.00 H new ATOM 0 HA TYR A 69 -12.710 -3.806 -24.518 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.858 -4.870 -25.722 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.726 -3.632 -25.215 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -12.282 -5.555 -23.253 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -8.161 -4.667 -23.795 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.737 -6.875 -21.261 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -7.614 -5.988 -21.805 1.00 0.00 H new ATOM 0 HH TYR A 69 -8.361 -7.254 -20.136 1.00 0.00 H new ATOM 1068 N LYS A 70 -10.561 -1.668 -23.264 1.00 0.00 N ATOM 1069 CA LYS A 70 -10.232 -0.947 -22.011 1.00 0.00 C ATOM 1070 C LYS A 70 -11.344 0.021 -21.637 1.00 0.00 C ATOM 1071 O LYS A 70 -11.737 0.105 -20.490 1.00 0.00 O ATOM 1072 CB LYS A 70 -8.942 -0.148 -22.240 1.00 0.00 C ATOM 1073 CG LYS A 70 -8.547 0.554 -20.938 1.00 0.00 C ATOM 1074 CD LYS A 70 -8.086 -0.495 -19.925 1.00 0.00 C ATOM 1075 CE LYS A 70 -7.099 0.148 -18.948 1.00 0.00 C ATOM 1076 NZ LYS A 70 -7.295 1.626 -18.903 1.00 0.00 N ATOM 0 H LYS A 70 -10.013 -1.399 -24.081 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.111 -1.670 -21.204 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.142 -0.812 -22.566 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.090 0.586 -23.032 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.749 1.272 -21.125 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.394 1.114 -20.541 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.943 -0.896 -19.384 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.614 -1.332 -20.440 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.237 -0.273 -17.952 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.077 -0.080 -19.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.898 2.002 -18.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.813 2.065 -19.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.311 1.843 -18.946 1.00 0.00 H new ATOM 1090 N ALA A 71 -11.832 0.735 -22.609 1.00 0.00 N ATOM 1091 CA ALA A 71 -12.919 1.704 -22.328 1.00 0.00 C ATOM 1092 C ALA A 71 -14.139 1.007 -21.734 1.00 0.00 C ATOM 1093 O ALA A 71 -14.502 1.249 -20.600 1.00 0.00 O ATOM 1094 CB ALA A 71 -13.328 2.367 -23.648 1.00 0.00 C ATOM 0 H ALA A 71 -11.526 0.689 -23.581 1.00 0.00 H new ATOM 0 HA ALA A 71 -12.557 2.440 -21.610 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -14.128 3.084 -23.463 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -12.469 2.884 -24.077 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -13.678 1.605 -24.345 1.00 0.00 H new ATOM 1100 N ARG A 72 -14.754 0.157 -22.512 1.00 0.00 N ATOM 1101 CA ARG A 72 -15.950 -0.557 -22.005 1.00 0.00 C ATOM 1102 C ARG A 72 -15.687 -1.140 -20.612 1.00 0.00 C ATOM 1103 O ARG A 72 -16.454 -0.931 -19.694 1.00 0.00 O ATOM 1104 CB ARG A 72 -16.276 -1.703 -22.975 1.00 0.00 C ATOM 1105 CG ARG A 72 -17.114 -1.153 -24.138 1.00 0.00 C ATOM 1106 CD ARG A 72 -16.413 0.072 -24.736 1.00 0.00 C ATOM 1107 NE ARG A 72 -17.123 0.469 -25.988 1.00 0.00 N ATOM 1108 CZ ARG A 72 -16.766 1.558 -26.615 1.00 0.00 C ATOM 1109 NH1 ARG A 72 -15.643 1.564 -27.282 1.00 0.00 N ATOM 1110 NH2 ARG A 72 -17.544 2.605 -26.555 1.00 0.00 N ATOM 0 H ARG A 72 -14.479 -0.069 -23.468 1.00 0.00 H new ATOM 0 HA ARG A 72 -16.782 0.143 -21.935 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.356 -2.149 -23.352 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.823 -2.490 -22.457 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.244 -1.920 -24.901 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -18.109 -0.881 -23.787 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.418 0.896 -24.022 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -15.369 -0.158 -24.951 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.882 -0.107 -26.352 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -15.060 0.727 -27.307 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -15.349 2.406 -27.778 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -18.414 2.564 -26.025 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -17.281 3.464 -27.038 1.00 0.00 H new ATOM 1124 N TYR A 73 -14.605 -1.861 -20.487 1.00 0.00 N ATOM 1125 CA TYR A 73 -14.265 -2.469 -19.167 1.00 0.00 C ATOM 1126 C TYR A 73 -14.527 -1.493 -18.011 1.00 0.00 C ATOM 1127 O TYR A 73 -15.376 -1.728 -17.169 1.00 0.00 O ATOM 1128 CB TYR A 73 -12.760 -2.821 -19.180 1.00 0.00 C ATOM 1129 CG TYR A 73 -12.220 -2.808 -17.743 1.00 0.00 C ATOM 1130 CD1 TYR A 73 -12.558 -3.812 -16.859 1.00 0.00 C ATOM 1131 CD2 TYR A 73 -11.406 -1.780 -17.311 1.00 0.00 C ATOM 1132 CE1 TYR A 73 -12.091 -3.786 -15.561 1.00 0.00 C ATOM 1133 CE2 TYR A 73 -10.940 -1.757 -16.013 1.00 0.00 C ATOM 1134 CZ TYR A 73 -11.279 -2.757 -15.128 1.00 0.00 C ATOM 1135 OH TYR A 73 -10.820 -2.726 -13.829 1.00 0.00 O ATOM 0 H TYR A 73 -13.944 -2.055 -21.239 1.00 0.00 H new ATOM 0 HA TYR A 73 -14.887 -3.351 -19.016 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -12.609 -3.803 -19.628 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -12.213 -2.104 -19.792 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -13.192 -4.623 -17.185 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -11.132 -0.989 -17.994 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -12.363 -4.577 -14.878 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -10.303 -0.948 -15.687 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.524 -2.379 -13.242 1.00 0.00 H new ATOM 1145 N ARG A 74 -13.795 -0.415 -18.001 1.00 0.00 N ATOM 1146 CA ARG A 74 -13.969 0.596 -16.915 1.00 0.00 C ATOM 1147 C ARG A 74 -15.339 1.279 -16.955 1.00 0.00 C ATOM 1148 O ARG A 74 -15.733 1.915 -15.999 1.00 0.00 O ATOM 1149 CB ARG A 74 -12.884 1.672 -17.085 1.00 0.00 C ATOM 1150 CG ARG A 74 -12.503 2.224 -15.710 1.00 0.00 C ATOM 1151 CD ARG A 74 -11.478 3.343 -15.889 1.00 0.00 C ATOM 1152 NE ARG A 74 -10.515 2.949 -16.956 1.00 0.00 N ATOM 1153 CZ ARG A 74 -9.921 3.873 -17.661 1.00 0.00 C ATOM 1154 NH1 ARG A 74 -9.134 4.721 -17.059 1.00 0.00 N ATOM 1155 NH2 ARG A 74 -10.136 3.918 -18.948 1.00 0.00 N ATOM 0 H ARG A 74 -13.084 -0.188 -18.696 1.00 0.00 H new ATOM 0 HA ARG A 74 -13.889 0.077 -15.960 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -12.008 1.248 -17.575 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.249 2.476 -17.724 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.388 2.602 -15.198 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.089 1.431 -15.087 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.979 4.273 -16.158 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.950 3.524 -14.953 1.00 0.00 H new ATOM 0 HE ARG A 74 -10.321 1.964 -17.134 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.990 4.656 -16.051 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -8.662 5.449 -17.596 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -10.759 3.239 -19.385 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.681 4.633 -19.516 1.00 0.00 H new ATOM 1169 N ILE A 75 -16.041 1.146 -18.044 1.00 0.00 N ATOM 1170 CA ILE A 75 -17.377 1.799 -18.117 1.00 0.00 C ATOM 1171 C ILE A 75 -18.456 0.935 -17.471 1.00 0.00 C ATOM 1172 O ILE A 75 -19.078 1.337 -16.508 1.00 0.00 O ATOM 1173 CB ILE A 75 -17.729 2.028 -19.585 1.00 0.00 C ATOM 1174 CG1 ILE A 75 -16.904 3.193 -20.139 1.00 0.00 C ATOM 1175 CG2 ILE A 75 -19.225 2.377 -19.687 1.00 0.00 C ATOM 1176 CD1 ILE A 75 -17.574 4.527 -19.775 1.00 0.00 C ATOM 0 H ILE A 75 -15.756 0.624 -18.872 1.00 0.00 H new ATOM 0 HA ILE A 75 -17.332 2.744 -17.576 1.00 0.00 H new ATOM 0 HB ILE A 75 -17.511 1.127 -20.159 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -15.893 3.160 -19.732 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -16.815 3.104 -21.222 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -19.489 2.543 -20.731 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -19.819 1.554 -19.289 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -19.428 3.281 -19.113 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -16.982 5.352 -20.172 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -18.576 4.560 -20.204 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -17.640 4.617 -18.691 1.00 0.00 H new ATOM 1188 N ILE A 76 -18.664 -0.233 -18.010 1.00 0.00 N ATOM 1189 CA ILE A 76 -19.702 -1.125 -17.429 1.00 0.00 C ATOM 1190 C ILE A 76 -19.255 -1.678 -16.081 1.00 0.00 C ATOM 1191 O ILE A 76 -20.028 -2.305 -15.382 1.00 0.00 O ATOM 1192 CB ILE A 76 -19.940 -2.288 -18.380 1.00 0.00 C ATOM 1193 CG1 ILE A 76 -20.163 -1.754 -19.791 1.00 0.00 C ATOM 1194 CG2 ILE A 76 -21.212 -3.034 -17.931 1.00 0.00 C ATOM 1195 CD1 ILE A 76 -19.200 -2.445 -20.735 1.00 0.00 C ATOM 0 H ILE A 76 -18.166 -0.605 -18.819 1.00 0.00 H new ATOM 0 HA ILE A 76 -20.615 -0.548 -17.285 1.00 0.00 H new ATOM 0 HB ILE A 76 -19.078 -2.955 -18.371 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -21.192 -1.934 -20.104 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -20.006 -0.676 -19.815 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -21.398 -3.872 -18.602 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -21.076 -3.406 -16.915 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -22.062 -2.352 -17.957 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -19.351 -2.070 -21.747 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -18.176 -2.243 -20.422 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -19.380 -3.520 -20.715 1.00 0.00 H new ATOM 1207 N TYR A 77 -18.007 -1.442 -15.749 1.00 0.00 N ATOM 1208 CA TYR A 77 -17.468 -1.942 -14.449 1.00 0.00 C ATOM 1209 C TYR A 77 -18.519 -1.925 -13.341 1.00 0.00 C ATOM 1210 O TYR A 77 -18.633 -2.861 -12.582 1.00 0.00 O ATOM 1211 CB TYR A 77 -16.310 -1.028 -14.024 1.00 0.00 C ATOM 1212 CG TYR A 77 -15.809 -1.454 -12.637 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -15.378 -2.748 -12.410 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -15.764 -0.547 -11.596 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -14.910 -3.120 -11.171 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -15.296 -0.925 -10.360 1.00 0.00 C ATOM 1217 CZ TYR A 77 -14.864 -2.212 -10.139 1.00 0.00 C ATOM 1218 OH TYR A 77 -14.386 -2.581 -8.906 1.00 0.00 O ATOM 0 H TYR A 77 -17.341 -0.925 -16.323 1.00 0.00 H new ATOM 0 HA TYR A 77 -17.145 -2.973 -14.593 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -15.499 -1.088 -14.750 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -16.641 0.010 -14.001 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -15.409 -3.472 -13.211 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -16.099 0.467 -11.755 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -14.576 -4.134 -11.007 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -15.267 -0.205 -9.555 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.420 -2.422 -8.869 1.00 0.00 H new ATOM 1228 N SER A 78 -19.269 -0.871 -13.266 1.00 0.00 N ATOM 1229 CA SER A 78 -20.307 -0.801 -12.206 1.00 0.00 C ATOM 1230 C SER A 78 -21.242 -2.000 -12.259 1.00 0.00 C ATOM 1231 O SER A 78 -21.418 -2.694 -11.278 1.00 0.00 O ATOM 1232 CB SER A 78 -21.134 0.481 -12.410 1.00 0.00 C ATOM 1233 OG SER A 78 -20.160 1.499 -12.596 1.00 0.00 O ATOM 0 H SER A 78 -19.212 -0.061 -13.884 1.00 0.00 H new ATOM 0 HA SER A 78 -19.809 -0.798 -11.237 1.00 0.00 H new ATOM 0 HB2 SER A 78 -21.792 0.397 -13.275 1.00 0.00 H new ATOM 0 HB3 SER A 78 -21.767 0.688 -11.547 1.00 0.00 H new ATOM 0 HG SER A 78 -20.608 2.359 -12.736 1.00 0.00 H new ATOM 1239 N ASN A 79 -21.820 -2.227 -13.395 1.00 0.00 N ATOM 1240 CA ASN A 79 -22.746 -3.378 -13.517 1.00 0.00 C ATOM 1241 C ASN A 79 -21.991 -4.700 -13.492 1.00 0.00 C ATOM 1242 O ASN A 79 -22.582 -5.746 -13.314 1.00 0.00 O ATOM 1243 CB ASN A 79 -23.494 -3.254 -14.847 1.00 0.00 C ATOM 1244 CG ASN A 79 -24.169 -1.882 -14.911 1.00 0.00 C ATOM 1245 OD1 ASN A 79 -24.564 -1.421 -15.963 1.00 0.00 O ATOM 1246 ND2 ASN A 79 -24.318 -1.197 -13.808 1.00 0.00 N ATOM 0 H ASN A 79 -21.694 -1.671 -14.241 1.00 0.00 H new ATOM 0 HA ASN A 79 -23.437 -3.366 -12.674 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -22.802 -3.373 -15.681 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -24.239 -4.045 -14.936 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -24.764 -0.280 -13.833 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -23.988 -1.579 -12.922 1.00 0.00 H new ATOM 1253 N VAL A 80 -20.703 -4.640 -13.673 1.00 0.00 N ATOM 1254 CA VAL A 80 -19.919 -5.896 -13.656 1.00 0.00 C ATOM 1255 C VAL A 80 -19.724 -6.375 -12.227 1.00 0.00 C ATOM 1256 O VAL A 80 -19.713 -7.561 -11.967 1.00 0.00 O ATOM 1257 CB VAL A 80 -18.542 -5.630 -14.287 1.00 0.00 C ATOM 1258 CG1 VAL A 80 -17.599 -6.795 -13.968 1.00 0.00 C ATOM 1259 CG2 VAL A 80 -18.695 -5.511 -15.802 1.00 0.00 C ATOM 0 H VAL A 80 -20.168 -3.786 -13.830 1.00 0.00 H new ATOM 0 HA VAL A 80 -20.455 -6.661 -14.218 1.00 0.00 H new ATOM 0 HB VAL A 80 -18.131 -4.705 -13.883 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.623 -6.606 -14.415 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -17.491 -6.890 -12.888 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -18.012 -7.719 -14.374 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -17.721 -5.322 -16.252 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -19.105 -6.439 -16.200 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -19.369 -4.687 -16.036 1.00 0.00 H new ATOM 1269 N ILE A 81 -19.573 -5.444 -11.316 1.00 0.00 N ATOM 1270 CA ILE A 81 -19.377 -5.847 -9.905 1.00 0.00 C ATOM 1271 C ILE A 81 -20.678 -6.397 -9.324 1.00 0.00 C ATOM 1272 O ILE A 81 -20.704 -6.905 -8.221 1.00 0.00 O ATOM 1273 CB ILE A 81 -18.946 -4.614 -9.100 1.00 0.00 C ATOM 1274 CG1 ILE A 81 -17.615 -4.086 -9.626 1.00 0.00 C ATOM 1275 CG2 ILE A 81 -18.761 -5.016 -7.626 1.00 0.00 C ATOM 1276 CD1 ILE A 81 -16.536 -5.172 -9.505 1.00 0.00 C ATOM 0 H ILE A 81 -19.578 -4.439 -11.492 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.614 -6.624 -9.853 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.710 -3.842 -9.195 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.721 -3.781 -10.667 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -17.317 -3.201 -9.063 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -18.455 -4.145 -7.047 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -19.702 -5.400 -7.233 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.995 -5.788 -7.553 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.589 -4.787 -9.883 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -16.421 -5.456 -8.459 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -16.831 -6.045 -10.087 1.00 0.00 H new ATOM 1288 N SER A 82 -21.742 -6.291 -10.081 1.00 0.00 N ATOM 1289 CA SER A 82 -23.039 -6.806 -9.579 1.00 0.00 C ATOM 1290 C SER A 82 -22.989 -8.325 -9.441 1.00 0.00 C ATOM 1291 O SER A 82 -22.970 -8.847 -8.346 1.00 0.00 O ATOM 1292 CB SER A 82 -24.150 -6.423 -10.577 1.00 0.00 C ATOM 1293 OG SER A 82 -23.827 -7.133 -11.760 1.00 0.00 O ATOM 0 H SER A 82 -21.763 -5.875 -11.012 1.00 0.00 H new ATOM 0 HA SER A 82 -23.243 -6.370 -8.601 1.00 0.00 H new ATOM 0 HB2 SER A 82 -25.134 -6.704 -10.202 1.00 0.00 H new ATOM 0 HB3 SER A 82 -24.171 -5.348 -10.753 1.00 0.00 H new ATOM 0 HG SER A 82 -23.051 -6.717 -12.190 1.00 0.00 H new ATOM 1299 N LYS A 83 -22.955 -9.007 -10.562 1.00 0.00 N ATOM 1300 CA LYS A 83 -22.906 -10.491 -10.520 1.00 0.00 C ATOM 1301 C LYS A 83 -22.741 -11.068 -11.924 1.00 0.00 C ATOM 1302 O LYS A 83 -21.914 -11.928 -12.151 1.00 0.00 O ATOM 1303 CB LYS A 83 -24.227 -11.022 -9.934 1.00 0.00 C ATOM 1304 CG LYS A 83 -24.018 -12.466 -9.474 1.00 0.00 C ATOM 1305 CD LYS A 83 -25.092 -12.832 -8.448 1.00 0.00 C ATOM 1306 CE LYS A 83 -24.466 -12.850 -7.051 1.00 0.00 C ATOM 1307 NZ LYS A 83 -25.405 -13.457 -6.067 1.00 0.00 N ATOM 0 H LYS A 83 -22.959 -8.597 -11.496 1.00 0.00 H new ATOM 0 HA LYS A 83 -22.057 -10.790 -9.905 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -24.544 -10.401 -9.096 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -25.018 -10.975 -10.683 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -24.069 -13.142 -10.327 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -23.027 -12.580 -9.036 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -25.908 -12.111 -8.485 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -25.518 -13.808 -8.682 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -23.535 -13.416 -7.071 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -24.216 -11.834 -6.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -24.965 -13.462 -5.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -26.283 -12.901 -6.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -25.623 -14.433 -6.352 1.00 0.00 H new ATOM 1321 N ASN A 84 -23.533 -10.580 -12.839 1.00 0.00 N ATOM 1322 CA ASN A 84 -23.442 -11.086 -14.233 1.00 0.00 C ATOM 1323 C ASN A 84 -22.206 -10.544 -14.949 1.00 0.00 C ATOM 1324 O ASN A 84 -21.369 -9.894 -14.353 1.00 0.00 O ATOM 1325 CB ASN A 84 -24.695 -10.623 -14.991 1.00 0.00 C ATOM 1326 CG ASN A 84 -25.940 -11.119 -14.254 1.00 0.00 C ATOM 1327 OD1 ASN A 84 -26.701 -11.917 -14.764 1.00 0.00 O ATOM 1328 ND2 ASN A 84 -26.184 -10.672 -13.052 1.00 0.00 N ATOM 0 H ASN A 84 -24.235 -9.857 -12.681 1.00 0.00 H new ATOM 0 HA ASN A 84 -23.368 -12.173 -14.207 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -24.710 -9.536 -15.064 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -24.682 -11.010 -16.010 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -27.010 -10.993 -12.546 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -25.549 -10.002 -12.618 1.00 0.00 H new ATOM 1335 N ASN A 85 -22.120 -10.826 -16.226 1.00 0.00 N ATOM 1336 CA ASN A 85 -20.956 -10.347 -17.018 1.00 0.00 C ATOM 1337 C ASN A 85 -21.293 -9.048 -17.738 1.00 0.00 C ATOM 1338 O ASN A 85 -22.440 -8.779 -18.033 1.00 0.00 O ATOM 1339 CB ASN A 85 -20.629 -11.420 -18.073 1.00 0.00 C ATOM 1340 CG ASN A 85 -21.934 -11.976 -18.649 1.00 0.00 C ATOM 1341 OD1 ASN A 85 -22.350 -11.612 -19.732 1.00 0.00 O ATOM 1342 ND2 ASN A 85 -22.608 -12.858 -17.962 1.00 0.00 N ATOM 0 H ASN A 85 -22.808 -11.367 -16.750 1.00 0.00 H new ATOM 0 HA ASN A 85 -20.112 -10.170 -16.351 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -20.020 -10.991 -18.869 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -20.045 -12.223 -17.623 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -23.478 -13.238 -18.334 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -22.264 -13.167 -17.053 1.00 0.00 H new ATOM 1349 N PRO A 86 -20.273 -8.255 -18.014 1.00 0.00 N ATOM 1350 CA PRO A 86 -20.469 -6.991 -18.698 1.00 0.00 C ATOM 1351 C PRO A 86 -21.086 -7.240 -20.055 1.00 0.00 C ATOM 1352 O PRO A 86 -21.524 -6.329 -20.729 1.00 0.00 O ATOM 1353 CB PRO A 86 -19.052 -6.407 -18.874 1.00 0.00 C ATOM 1354 CG PRO A 86 -18.049 -7.473 -18.342 1.00 0.00 C ATOM 1355 CD PRO A 86 -18.880 -8.585 -17.689 1.00 0.00 C ATOM 0 HA PRO A 86 -21.128 -6.320 -18.147 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -18.855 -6.182 -19.922 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -18.949 -5.472 -18.323 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -17.443 -7.872 -19.155 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -17.363 -7.030 -17.620 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -18.605 -9.565 -18.079 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -18.722 -8.615 -16.611 1.00 0.00 H new ATOM 1363 N ASP A 87 -21.107 -8.490 -20.429 1.00 0.00 N ATOM 1364 CA ASP A 87 -21.688 -8.849 -21.738 1.00 0.00 C ATOM 1365 C ASP A 87 -20.952 -8.131 -22.852 1.00 0.00 C ATOM 1366 O ASP A 87 -21.533 -7.787 -23.861 1.00 0.00 O ATOM 1367 CB ASP A 87 -23.162 -8.414 -21.750 1.00 0.00 C ATOM 1368 CG ASP A 87 -23.950 -9.327 -22.690 1.00 0.00 C ATOM 1369 OD1 ASP A 87 -23.562 -9.382 -23.844 1.00 0.00 O ATOM 1370 OD2 ASP A 87 -24.897 -9.921 -22.198 1.00 0.00 O ATOM 0 H ASP A 87 -20.746 -9.271 -19.881 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.602 -9.925 -21.893 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -23.576 -8.465 -20.743 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -23.245 -7.377 -22.077 1.00 0.00 H new ATOM 1375 N LEU A 88 -19.678 -7.916 -22.654 1.00 0.00 N ATOM 1376 CA LEU A 88 -18.895 -7.221 -23.699 1.00 0.00 C ATOM 1377 C LEU A 88 -19.152 -7.838 -25.069 1.00 0.00 C ATOM 1378 O LEU A 88 -18.767 -7.290 -26.082 1.00 0.00 O ATOM 1379 CB LEU A 88 -17.396 -7.347 -23.365 1.00 0.00 C ATOM 1380 CG LEU A 88 -16.766 -5.953 -23.344 1.00 0.00 C ATOM 1381 CD1 LEU A 88 -15.319 -6.064 -22.859 1.00 0.00 C ATOM 1382 CD2 LEU A 88 -16.778 -5.369 -24.759 1.00 0.00 C ATOM 0 H LEU A 88 -19.157 -8.191 -21.821 1.00 0.00 H new ATOM 0 HA LEU A 88 -19.196 -6.174 -23.726 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.266 -7.832 -22.398 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.898 -7.973 -24.105 1.00 0.00 H new ATOM 0 HG LEU A 88 -17.332 -5.305 -22.675 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.864 -5.074 -22.842 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.303 -6.488 -21.855 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.757 -6.709 -23.534 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.330 -4.376 -24.746 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -16.207 -6.016 -25.425 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -17.806 -5.299 -25.115 1.00 0.00 H new ATOM 1394 N LYS A 89 -19.804 -8.972 -25.074 1.00 0.00 N ATOM 1395 CA LYS A 89 -20.097 -9.643 -26.364 1.00 0.00 C ATOM 1396 C LYS A 89 -21.172 -8.882 -27.135 1.00 0.00 C ATOM 1397 O LYS A 89 -21.100 -8.751 -28.341 1.00 0.00 O ATOM 1398 CB LYS A 89 -20.610 -11.062 -26.066 1.00 0.00 C ATOM 1399 CG LYS A 89 -20.773 -11.824 -27.381 1.00 0.00 C ATOM 1400 CD LYS A 89 -21.810 -12.934 -27.194 1.00 0.00 C ATOM 1401 CE LYS A 89 -21.359 -13.856 -26.060 1.00 0.00 C ATOM 1402 NZ LYS A 89 -22.317 -14.985 -25.890 1.00 0.00 N ATOM 0 H LYS A 89 -20.142 -9.456 -24.242 1.00 0.00 H new ATOM 0 HA LYS A 89 -19.189 -9.674 -26.967 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -19.911 -11.585 -25.413 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.563 -11.014 -25.539 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.089 -11.144 -28.172 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -19.818 -12.250 -27.689 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -22.784 -12.503 -26.963 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -21.923 -13.502 -28.117 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.364 -14.245 -26.275 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.286 -13.290 -25.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -21.995 -15.600 -25.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -23.260 -14.609 -25.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -22.366 -15.535 -26.772 1.00 0.00 H new ATOM 1416 N HIS A 90 -22.150 -8.395 -26.422 1.00 0.00 N ATOM 1417 CA HIS A 90 -23.239 -7.640 -27.091 1.00 0.00 C ATOM 1418 C HIS A 90 -22.869 -6.173 -27.227 1.00 0.00 C ATOM 1419 O HIS A 90 -22.969 -5.600 -28.295 1.00 0.00 O ATOM 1420 CB HIS A 90 -24.502 -7.753 -26.226 1.00 0.00 C ATOM 1421 CG HIS A 90 -25.701 -7.200 -27.002 1.00 0.00 C ATOM 1422 ND1 HIS A 90 -26.463 -6.298 -26.592 1.00 0.00 N ATOM 1423 CD2 HIS A 90 -26.184 -7.548 -28.249 1.00 0.00 C ATOM 1424 CE1 HIS A 90 -27.372 -6.037 -27.435 1.00 0.00 C ATOM 1425 NE2 HIS A 90 -27.277 -6.787 -28.532 1.00 0.00 N ATOM 0 H HIS A 90 -22.240 -8.488 -25.410 1.00 0.00 H new ATOM 0 HA HIS A 90 -23.405 -8.053 -28.086 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -24.679 -8.794 -25.955 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -24.370 -7.200 -25.296 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -25.762 -8.303 -28.896 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -28.138 -5.291 -27.282 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -27.867 -6.790 -29.364 1.00 0.00 H new ATOM 1433 N LYS A 91 -22.449 -5.587 -26.144 1.00 0.00 N ATOM 1434 CA LYS A 91 -22.069 -4.159 -26.197 1.00 0.00 C ATOM 1435 C LYS A 91 -21.079 -3.918 -27.327 1.00 0.00 C ATOM 1436 O LYS A 91 -20.856 -2.796 -27.735 1.00 0.00 O ATOM 1437 CB LYS A 91 -21.419 -3.778 -24.859 1.00 0.00 C ATOM 1438 CG LYS A 91 -22.426 -2.966 -24.034 1.00 0.00 C ATOM 1439 CD LYS A 91 -22.122 -3.136 -22.543 1.00 0.00 C ATOM 1440 CE LYS A 91 -23.353 -2.721 -21.733 1.00 0.00 C ATOM 1441 NZ LYS A 91 -23.601 -1.259 -21.874 1.00 0.00 N ATOM 0 H LYS A 91 -22.354 -6.034 -25.232 1.00 0.00 H new ATOM 0 HA LYS A 91 -22.956 -3.552 -26.376 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -21.121 -4.674 -24.315 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -20.515 -3.195 -25.031 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -22.372 -1.913 -24.309 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -23.441 -3.300 -24.249 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -21.861 -4.172 -22.328 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -21.263 -2.526 -22.262 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -24.225 -3.278 -22.074 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -23.206 -2.971 -20.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -24.340 -0.966 -21.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -22.724 -0.737 -21.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -23.912 -1.052 -22.845 1.00 0.00 H new ATOM 1455 N ILE A 92 -20.497 -4.982 -27.812 1.00 0.00 N ATOM 1456 CA ILE A 92 -19.520 -4.838 -28.915 1.00 0.00 C ATOM 1457 C ILE A 92 -20.218 -4.276 -30.149 1.00 0.00 C ATOM 1458 O ILE A 92 -19.716 -3.380 -30.801 1.00 0.00 O ATOM 1459 CB ILE A 92 -18.944 -6.239 -29.229 1.00 0.00 C ATOM 1460 CG1 ILE A 92 -17.477 -6.291 -28.832 1.00 0.00 C ATOM 1461 CG2 ILE A 92 -19.043 -6.524 -30.746 1.00 0.00 C ATOM 1462 CD1 ILE A 92 -17.066 -7.751 -28.631 1.00 0.00 C ATOM 0 H ILE A 92 -20.658 -5.937 -27.491 1.00 0.00 H new ATOM 0 HA ILE A 92 -18.719 -4.156 -28.628 1.00 0.00 H new ATOM 0 HB ILE A 92 -19.515 -6.981 -28.671 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -16.862 -5.830 -29.604 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -17.315 -5.725 -27.915 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -18.635 -7.512 -30.958 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -20.088 -6.488 -31.055 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -18.476 -5.772 -31.295 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -16.015 -7.797 -28.346 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -17.675 -8.195 -27.844 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -17.215 -8.302 -29.560 1.00 0.00 H new ATOM 1474 N ALA A 93 -21.366 -4.818 -30.441 1.00 0.00 N ATOM 1475 CA ALA A 93 -22.118 -4.338 -31.621 1.00 0.00 C ATOM 1476 C ALA A 93 -22.635 -2.927 -31.388 1.00 0.00 C ATOM 1477 O ALA A 93 -22.811 -2.169 -32.315 1.00 0.00 O ATOM 1478 CB ALA A 93 -23.318 -5.271 -31.843 1.00 0.00 C ATOM 0 H ALA A 93 -21.811 -5.569 -29.913 1.00 0.00 H new ATOM 0 HA ALA A 93 -21.459 -4.334 -32.489 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -23.886 -4.933 -32.710 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -22.962 -6.287 -32.016 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -23.959 -5.256 -30.961 1.00 0.00 H new ATOM 1484 N ASN A 94 -22.861 -2.600 -30.147 1.00 0.00 N ATOM 1485 CA ASN A 94 -23.369 -1.242 -29.824 1.00 0.00 C ATOM 1486 C ASN A 94 -22.669 -0.163 -30.646 1.00 0.00 C ATOM 1487 O ASN A 94 -23.310 0.633 -31.303 1.00 0.00 O ATOM 1488 CB ASN A 94 -23.096 -0.970 -28.338 1.00 0.00 C ATOM 1489 CG ASN A 94 -23.862 0.279 -27.905 1.00 0.00 C ATOM 1490 OD1 ASN A 94 -24.951 0.199 -27.373 1.00 0.00 O ATOM 1491 ND2 ASN A 94 -23.328 1.452 -28.111 1.00 0.00 N ATOM 0 H ASN A 94 -22.716 -3.214 -29.345 1.00 0.00 H new ATOM 0 HA ASN A 94 -24.434 -1.209 -30.055 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -23.404 -1.826 -27.737 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -22.028 -0.831 -28.172 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -23.825 2.296 -27.826 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -22.414 1.525 -28.557 1.00 0.00 H new ATOM 1498 N GLY A 95 -21.368 -0.159 -30.599 1.00 0.00 N ATOM 1499 CA GLY A 95 -20.607 0.870 -31.376 1.00 0.00 C ATOM 1500 C GLY A 95 -20.221 0.358 -32.770 1.00 0.00 C ATOM 1501 O GLY A 95 -20.046 1.136 -33.689 1.00 0.00 O ATOM 0 H GLY A 95 -20.798 -0.814 -30.064 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -21.211 1.772 -31.474 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -19.707 1.147 -30.828 1.00 0.00 H new ATOM 1505 N ASP A 96 -20.097 -0.931 -32.905 1.00 0.00 N ATOM 1506 CA ASP A 96 -19.724 -1.491 -34.231 1.00 0.00 C ATOM 1507 C ASP A 96 -20.936 -1.589 -35.155 1.00 0.00 C ATOM 1508 O ASP A 96 -20.800 -1.906 -36.321 1.00 0.00 O ATOM 1509 CB ASP A 96 -19.134 -2.900 -34.033 1.00 0.00 C ATOM 1510 CG ASP A 96 -18.104 -2.872 -32.898 1.00 0.00 C ATOM 1511 OD1 ASP A 96 -18.155 -1.919 -32.140 1.00 0.00 O ATOM 1512 OD2 ASP A 96 -17.323 -3.808 -32.856 1.00 0.00 O ATOM 0 H ASP A 96 -20.236 -1.616 -32.162 1.00 0.00 H new ATOM 0 HA ASP A 96 -18.993 -0.825 -34.690 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -19.929 -3.608 -33.799 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -18.664 -3.241 -34.955 1.00 0.00 H new ATOM 1517 N ILE A 97 -22.101 -1.328 -34.624 1.00 0.00 N ATOM 1518 CA ILE A 97 -23.317 -1.410 -35.478 1.00 0.00 C ATOM 1519 C ILE A 97 -23.607 -0.078 -36.168 1.00 0.00 C ATOM 1520 O ILE A 97 -24.363 -0.026 -37.118 1.00 0.00 O ATOM 1521 CB ILE A 97 -24.511 -1.772 -34.588 1.00 0.00 C ATOM 1522 CG1 ILE A 97 -24.488 -3.266 -34.260 1.00 0.00 C ATOM 1523 CG2 ILE A 97 -25.812 -1.448 -35.347 1.00 0.00 C ATOM 1524 CD1 ILE A 97 -25.080 -4.064 -35.428 1.00 0.00 C ATOM 0 H ILE A 97 -22.261 -1.066 -33.651 1.00 0.00 H new ATOM 0 HA ILE A 97 -23.151 -2.165 -36.246 1.00 0.00 H new ATOM 0 HB ILE A 97 -24.457 -1.200 -33.662 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -23.465 -3.590 -34.068 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -25.059 -3.457 -33.351 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -26.670 -1.701 -34.724 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -25.839 -0.385 -35.586 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -25.849 -2.028 -36.269 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -25.061 -5.127 -35.189 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -26.109 -3.749 -35.599 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -24.491 -3.884 -36.327 1.00 0.00 H new ATOM 1536 N THR A 98 -23.008 0.977 -35.686 1.00 0.00 N ATOM 1537 CA THR A 98 -23.255 2.292 -36.320 1.00 0.00 C ATOM 1538 C THR A 98 -22.867 2.278 -37.810 1.00 0.00 C ATOM 1539 O THR A 98 -23.633 2.700 -38.653 1.00 0.00 O ATOM 1540 CB THR A 98 -22.437 3.359 -35.589 1.00 0.00 C ATOM 1541 OG1 THR A 98 -21.749 2.673 -34.562 1.00 0.00 O ATOM 1542 CG2 THR A 98 -23.360 4.337 -34.847 1.00 0.00 C ATOM 0 H THR A 98 -22.368 0.982 -34.892 1.00 0.00 H new ATOM 0 HA THR A 98 -24.320 2.515 -36.251 1.00 0.00 H new ATOM 0 HB THR A 98 -21.806 3.890 -36.301 1.00 0.00 H new ATOM 0 HG1 THR A 98 -20.907 3.135 -34.367 1.00 0.00 H new ATOM 0 HG21 THR A 98 -22.758 5.087 -34.334 1.00 0.00 H new ATOM 0 HG22 THR A 98 -24.020 4.828 -35.562 1.00 0.00 H new ATOM 0 HG23 THR A 98 -23.958 3.791 -34.117 1.00 0.00 H new ATOM 1550 N PRO A 99 -21.670 1.789 -38.104 1.00 0.00 N ATOM 1551 CA PRO A 99 -21.188 1.721 -39.486 1.00 0.00 C ATOM 1552 C PRO A 99 -21.885 0.605 -40.267 1.00 0.00 C ATOM 1553 O PRO A 99 -21.500 0.287 -41.374 1.00 0.00 O ATOM 1554 CB PRO A 99 -19.690 1.376 -39.357 1.00 0.00 C ATOM 1555 CG PRO A 99 -19.427 1.010 -37.863 1.00 0.00 C ATOM 1556 CD PRO A 99 -20.722 1.303 -37.088 1.00 0.00 C ATOM 0 HA PRO A 99 -21.380 2.653 -40.017 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -19.430 0.542 -40.009 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.073 2.222 -39.660 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -19.151 -0.040 -37.767 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -18.599 1.595 -37.464 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -21.098 0.407 -36.594 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -20.557 2.050 -36.312 1.00 0.00 H new ATOM 1564 N GLU A 100 -22.896 0.032 -39.675 1.00 0.00 N ATOM 1565 CA GLU A 100 -23.625 -1.061 -40.369 1.00 0.00 C ATOM 1566 C GLU A 100 -24.812 -0.528 -41.168 1.00 0.00 C ATOM 1567 O GLU A 100 -24.801 -0.545 -42.382 1.00 0.00 O ATOM 1568 CB GLU A 100 -24.145 -2.040 -39.306 1.00 0.00 C ATOM 1569 CG GLU A 100 -23.902 -3.472 -39.780 1.00 0.00 C ATOM 1570 CD GLU A 100 -24.787 -3.759 -40.995 1.00 0.00 C ATOM 1571 OE1 GLU A 100 -24.453 -3.234 -42.044 1.00 0.00 O ATOM 1572 OE2 GLU A 100 -25.747 -4.488 -40.805 1.00 0.00 O ATOM 0 H GLU A 100 -23.246 0.272 -38.747 1.00 0.00 H new ATOM 0 HA GLU A 100 -22.942 -1.550 -41.064 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -23.638 -1.868 -38.357 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -25.209 -1.877 -39.134 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -22.852 -3.608 -40.040 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -24.126 -4.176 -38.978 1.00 0.00 H new ATOM 1579 N PHE A 101 -25.817 -0.068 -40.475 1.00 0.00 N ATOM 1580 CA PHE A 101 -27.006 0.465 -41.189 1.00 0.00 C ATOM 1581 C PHE A 101 -26.711 1.821 -41.804 1.00 0.00 C ATOM 1582 O PHE A 101 -26.790 1.997 -43.003 1.00 0.00 O ATOM 1583 CB PHE A 101 -28.147 0.631 -40.176 1.00 0.00 C ATOM 1584 CG PHE A 101 -28.065 -0.481 -39.138 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -27.624 -1.742 -39.497 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -28.446 -0.249 -37.829 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -27.564 -2.751 -38.561 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -28.386 -1.260 -36.895 1.00 0.00 C ATOM 1589 CZ PHE A 101 -27.946 -2.510 -37.261 1.00 0.00 C ATOM 0 H PHE A 101 -25.865 -0.039 -39.457 1.00 0.00 H new ATOM 0 HA PHE A 101 -27.277 -0.230 -41.984 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -28.078 1.604 -39.690 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -29.110 0.597 -40.686 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -27.325 -1.937 -40.516 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -28.793 0.731 -37.537 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -27.217 -3.733 -38.848 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -28.685 -1.070 -35.875 1.00 0.00 H new ATOM 0 HZ PHE A 101 -27.900 -3.302 -36.529 1.00 0.00 H new ATOM 1599 N LEU A 102 -26.377 2.754 -40.968 1.00 0.00 N ATOM 1600 CA LEU A 102 -26.069 4.114 -41.469 1.00 0.00 C ATOM 1601 C LEU A 102 -25.094 4.067 -42.641 1.00 0.00 C ATOM 1602 O LEU A 102 -24.860 5.062 -43.297 1.00 0.00 O ATOM 1603 CB LEU A 102 -25.434 4.912 -40.326 1.00 0.00 C ATOM 1604 CG LEU A 102 -26.133 4.538 -39.023 1.00 0.00 C ATOM 1605 CD1 LEU A 102 -25.678 5.484 -37.911 1.00 0.00 C ATOM 1606 CD2 LEU A 102 -27.647 4.661 -39.208 1.00 0.00 C ATOM 0 H LEU A 102 -26.304 2.634 -39.958 1.00 0.00 H new ATOM 0 HA LEU A 102 -26.992 4.581 -41.814 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -24.368 4.694 -40.259 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -25.530 5.982 -40.513 1.00 0.00 H new ATOM 0 HG LEU A 102 -25.879 3.513 -38.754 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -26.177 5.217 -36.979 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -24.599 5.401 -37.781 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -25.933 6.509 -38.179 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -28.150 4.394 -38.278 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -27.899 5.687 -39.475 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -27.972 3.989 -40.002 1.00 0.00 H new ATOM 1618 N ALA A 103 -24.543 2.911 -42.884 1.00 0.00 N ATOM 1619 CA ALA A 103 -23.583 2.783 -44.008 1.00 0.00 C ATOM 1620 C ALA A 103 -24.098 3.491 -45.255 1.00 0.00 C ATOM 1621 O ALA A 103 -23.330 4.039 -46.018 1.00 0.00 O ATOM 1622 CB ALA A 103 -23.404 1.292 -44.330 1.00 0.00 C ATOM 0 H ALA A 103 -24.716 2.056 -42.355 1.00 0.00 H new ATOM 0 HA ALA A 103 -22.638 3.240 -43.714 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -22.701 1.180 -45.155 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -23.019 0.774 -43.452 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -24.365 0.863 -44.612 1.00 0.00 H new ATOM 1628 N THR A 104 -25.393 3.469 -45.439 1.00 0.00 N ATOM 1629 CA THR A 104 -25.970 4.136 -46.630 1.00 0.00 C ATOM 1630 C THR A 104 -27.325 4.747 -46.304 1.00 0.00 C ATOM 1631 O THR A 104 -27.652 5.823 -46.765 1.00 0.00 O ATOM 1632 CB THR A 104 -26.155 3.080 -47.727 1.00 0.00 C ATOM 1633 OG1 THR A 104 -26.446 1.878 -47.042 1.00 0.00 O ATOM 1634 CG2 THR A 104 -24.828 2.801 -48.449 1.00 0.00 C ATOM 0 H THR A 104 -26.066 3.020 -44.818 1.00 0.00 H new ATOM 0 HA THR A 104 -25.299 4.931 -46.956 1.00 0.00 H new ATOM 0 HB THR A 104 -26.912 3.414 -48.437 1.00 0.00 H new ATOM 0 HG1 THR A 104 -26.579 1.156 -47.691 1.00 0.00 H new ATOM 0 HG21 THR A 104 -24.986 2.049 -49.222 1.00 0.00 H new ATOM 0 HG22 THR A 104 -24.462 3.720 -48.906 1.00 0.00 H new ATOM 0 HG23 THR A 104 -24.093 2.435 -47.732 1.00 0.00 H new ATOM 1642 N CYS A 105 -28.092 4.050 -45.512 1.00 0.00 N ATOM 1643 CA CYS A 105 -29.429 4.576 -45.144 1.00 0.00 C ATOM 1644 C CYS A 105 -29.350 6.048 -44.766 1.00 0.00 C ATOM 1645 O CYS A 105 -30.217 6.827 -45.110 1.00 0.00 O ATOM 1646 CB CYS A 105 -29.945 3.786 -43.931 1.00 0.00 C ATOM 1647 SG CYS A 105 -29.764 1.984 -43.971 1.00 0.00 S ATOM 0 H CYS A 105 -27.850 3.145 -45.108 1.00 0.00 H new ATOM 0 HA CYS A 105 -30.097 4.469 -45.998 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -29.431 4.157 -43.044 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -31.003 4.015 -43.805 1.00 0.00 H new ATOM 0 HG CYS A 105 -28.561 1.660 -43.600 1.00 0.00 H new ATOM 1653 N ASP A 106 -28.310 6.407 -44.065 1.00 0.00 N ATOM 1654 CA ASP A 106 -28.164 7.827 -43.660 1.00 0.00 C ATOM 1655 C ASP A 106 -27.399 8.615 -44.708 1.00 0.00 C ATOM 1656 O ASP A 106 -27.840 9.657 -45.147 1.00 0.00 O ATOM 1657 CB ASP A 106 -27.393 7.884 -42.335 1.00 0.00 C ATOM 1658 CG ASP A 106 -27.227 9.345 -41.912 1.00 0.00 C ATOM 1659 OD1 ASP A 106 -28.244 9.928 -41.571 1.00 0.00 O ATOM 1660 OD2 ASP A 106 -26.095 9.796 -41.955 1.00 0.00 O ATOM 0 H ASP A 106 -27.563 5.783 -43.759 1.00 0.00 H new ATOM 0 HA ASP A 106 -29.156 8.265 -43.551 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -27.928 7.329 -41.565 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -26.417 7.412 -42.448 1.00 0.00 H new ATOM 1665 N ALA A 107 -26.263 8.111 -45.090 1.00 0.00 N ATOM 1666 CA ALA A 107 -25.465 8.828 -46.111 1.00 0.00 C ATOM 1667 C ALA A 107 -26.265 8.982 -47.389 1.00 0.00 C ATOM 1668 O ALA A 107 -25.881 9.710 -48.283 1.00 0.00 O ATOM 1669 CB ALA A 107 -24.202 8.010 -46.412 1.00 0.00 C ATOM 0 H ALA A 107 -25.857 7.242 -44.742 1.00 0.00 H new ATOM 0 HA ALA A 107 -25.202 9.816 -45.733 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -23.604 8.527 -47.163 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -23.617 7.894 -45.499 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -24.486 7.027 -46.788 1.00 0.00 H new ATOM 1675 N LYS A 108 -27.368 8.293 -47.454 1.00 0.00 N ATOM 1676 CA LYS A 108 -28.208 8.388 -48.664 1.00 0.00 C ATOM 1677 C LYS A 108 -28.855 9.754 -48.737 1.00 0.00 C ATOM 1678 O LYS A 108 -29.253 10.201 -49.795 1.00 0.00 O ATOM 1679 CB LYS A 108 -29.300 7.304 -48.589 1.00 0.00 C ATOM 1680 CG LYS A 108 -30.512 7.745 -49.414 1.00 0.00 C ATOM 1681 CD LYS A 108 -31.474 6.564 -49.565 1.00 0.00 C ATOM 1682 CE LYS A 108 -32.735 7.033 -50.294 1.00 0.00 C ATOM 1683 NZ LYS A 108 -33.729 7.568 -49.322 1.00 0.00 N ATOM 0 H LYS A 108 -27.718 7.673 -46.723 1.00 0.00 H new ATOM 0 HA LYS A 108 -27.594 8.242 -49.552 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -28.914 6.357 -48.967 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -29.593 7.138 -47.552 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -31.015 8.579 -48.926 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -30.191 8.096 -50.395 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -30.996 5.759 -50.122 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -31.734 6.163 -48.585 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -32.477 7.803 -51.021 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -33.171 6.203 -50.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -34.579 7.882 -49.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -33.988 6.823 -48.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -33.315 8.373 -48.810 1.00 0.00 H new ATOM 1697 N ASP A 109 -28.955 10.403 -47.607 1.00 0.00 N ATOM 1698 CA ASP A 109 -29.570 11.739 -47.612 1.00 0.00 C ATOM 1699 C ASP A 109 -28.715 12.630 -48.463 1.00 0.00 C ATOM 1700 O ASP A 109 -29.187 13.547 -49.105 1.00 0.00 O ATOM 1701 CB ASP A 109 -29.613 12.278 -46.175 1.00 0.00 C ATOM 1702 CG ASP A 109 -30.809 11.665 -45.443 1.00 0.00 C ATOM 1703 OD1 ASP A 109 -30.831 10.447 -45.368 1.00 0.00 O ATOM 1704 OD2 ASP A 109 -31.632 12.449 -45.000 1.00 0.00 O ATOM 0 H ASP A 109 -28.639 10.063 -46.699 1.00 0.00 H new ATOM 0 HA ASP A 109 -30.586 11.700 -48.005 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -28.688 12.032 -45.654 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -29.695 13.365 -46.184 1.00 0.00 H new ATOM 1709 N LEU A 110 -27.453 12.335 -48.441 1.00 0.00 N ATOM 1710 CA LEU A 110 -26.504 13.114 -49.228 1.00 0.00 C ATOM 1711 C LEU A 110 -25.308 12.243 -49.549 1.00 0.00 C ATOM 1712 O LEU A 110 -24.298 12.286 -48.876 1.00 0.00 O ATOM 1713 CB LEU A 110 -26.040 14.323 -48.405 1.00 0.00 C ATOM 1714 CG LEU A 110 -25.795 13.880 -46.965 1.00 0.00 C ATOM 1715 CD1 LEU A 110 -24.404 14.344 -46.521 1.00 0.00 C ATOM 1716 CD2 LEU A 110 -26.852 14.512 -46.054 1.00 0.00 C ATOM 0 H LEU A 110 -27.044 11.574 -47.899 1.00 0.00 H new ATOM 0 HA LEU A 110 -26.975 13.457 -50.149 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -25.128 14.740 -48.831 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -26.794 15.110 -48.434 1.00 0.00 H new ATOM 0 HG LEU A 110 -25.857 12.794 -46.901 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -24.226 14.029 -45.493 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -23.649 13.903 -47.171 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -24.346 15.431 -46.583 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -26.680 14.198 -45.025 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -26.785 15.598 -46.118 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -27.844 14.191 -46.371 1.00 0.00 H new ATOM 1728 N ALA A 111 -25.452 11.464 -50.581 1.00 0.00 N ATOM 1729 CA ALA A 111 -24.343 10.569 -50.988 1.00 0.00 C ATOM 1730 C ALA A 111 -23.178 11.350 -51.619 1.00 0.00 C ATOM 1731 O ALA A 111 -22.036 11.167 -51.247 1.00 0.00 O ATOM 1732 CB ALA A 111 -24.886 9.561 -52.016 1.00 0.00 C ATOM 0 H ALA A 111 -26.291 11.410 -51.159 1.00 0.00 H new ATOM 0 HA ALA A 111 -23.963 10.064 -50.100 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -24.084 8.892 -52.329 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -25.689 8.978 -51.565 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -25.270 10.097 -52.884 1.00 0.00 H new ATOM 1738 N PRO A 112 -23.493 12.215 -52.573 1.00 0.00 N ATOM 1739 CA PRO A 112 -22.467 13.013 -53.246 1.00 0.00 C ATOM 1740 C PRO A 112 -21.742 13.932 -52.264 1.00 0.00 C ATOM 1741 O PRO A 112 -22.235 14.203 -51.186 1.00 0.00 O ATOM 1742 CB PRO A 112 -23.239 13.857 -54.285 1.00 0.00 C ATOM 1743 CG PRO A 112 -24.741 13.444 -54.197 1.00 0.00 C ATOM 1744 CD PRO A 112 -24.873 12.452 -53.030 1.00 0.00 C ATOM 0 HA PRO A 112 -21.704 12.380 -53.698 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -23.121 14.921 -54.080 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -22.850 13.681 -55.288 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -25.371 14.318 -54.032 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -25.069 12.986 -55.130 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -25.488 12.863 -52.230 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -25.347 11.525 -53.352 1.00 0.00 H new ATOM 1752 N ALA A 113 -20.582 14.396 -52.652 1.00 0.00 N ATOM 1753 CA ALA A 113 -19.820 15.296 -51.748 1.00 0.00 C ATOM 1754 C ALA A 113 -18.605 15.893 -52.457 1.00 0.00 C ATOM 1755 O ALA A 113 -17.474 15.614 -52.111 1.00 0.00 O ATOM 1756 CB ALA A 113 -19.326 14.467 -50.552 1.00 0.00 C ATOM 0 H ALA A 113 -20.137 14.191 -53.546 1.00 0.00 H new ATOM 0 HA ALA A 113 -20.471 16.110 -51.431 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -18.763 15.107 -49.873 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -20.181 14.043 -50.025 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -18.683 13.662 -50.908 1.00 0.00 H new ATOM 1762 N PRO A 114 -18.876 16.709 -53.442 1.00 0.00 N ATOM 1763 CA PRO A 114 -17.824 17.360 -54.216 1.00 0.00 C ATOM 1764 C PRO A 114 -16.970 18.269 -53.336 1.00 0.00 C ATOM 1765 O PRO A 114 -17.562 19.139 -52.719 1.00 0.00 O ATOM 1766 CB PRO A 114 -18.575 18.206 -55.268 1.00 0.00 C ATOM 1767 CG PRO A 114 -20.102 17.968 -55.051 1.00 0.00 C ATOM 1768 CD PRO A 114 -20.248 17.024 -53.846 1.00 0.00 C ATOM 1769 OXT PRO A 114 -15.771 18.044 -53.330 1.00 0.00 O ATOM 0 HA PRO A 114 -17.147 16.631 -54.661 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.331 19.263 -55.157 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.280 17.915 -56.276 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -20.616 18.911 -54.865 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -20.553 17.529 -55.941 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -20.798 17.501 -53.035 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -20.797 16.122 -54.116 1.00 0.00 H new TER 1777 PRO A 114