USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 886 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 57 SER OG : rot -140:sc= -0.417 USER MOD Set 1.2: A 60 ASN : amide:sc= -2.07 X(o=-2.5,f=-2.6) USER MOD Set 2.1: A 40 SER OG : rot -113:sc= 1.69 USER MOD Set 2.2: A 42 TYR OH : rot 180:sc= 0.38 USER MOD Single : A 1 GLY N :NH3+ -144:sc= 0.00762 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.117 USER MOD Single : A 9 GLN : amide:sc= -0.42 X(o=-0.42,f=-0.0027) USER MOD Single : A 11 GLN : amide:sc= -0.145 K(o=-0.14,f=-2.6!) USER MOD Single : A 14 TYR OH : rot -13:sc=0.000599 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl -127:sc= -1.9 (180deg=-6.3!) USER MOD Single : A 24 THR OG1 : rot -58:sc= -0.31 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.323 USER MOD Single : A 27 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0251 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.62 X(o=-0.62,f=-0.33) USER MOD Single : A 44 THR OG1 : rot -12:sc= 0.655 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= 0.102 K(o=0.1,f=-4.4!) USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 HIS : no HD1:sc= -0.547 X(o=-0.55,f=-0.075) USER MOD Single : A 59 ASN : amide:sc= -0.355 K(o=-0.35,f=-5.1!) USER MOD Single : A 62 ASN : amide:sc= 0.556 K(o=0.56,f=-1.6!) USER MOD Single : A 65 HIS : no HD1:sc= -4.11! C(o=-4.1!,f=-5.6!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 55:sc= 1.08 USER MOD Single : A 80 THR OG1 : rot 160:sc= -0.956 USER MOD Single : A 91 LYS NZ :NH3+ -154:sc= -1.6 (180deg=-3) USER MOD Single : A 92 GLN : amide:sc= -2.58! C(o=-2.6!,f=-4.4!) USER MOD Single : A 93 THR OG1 : rot 100:sc= -0.192 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -0.345 X(o=-0.34,f=-0.028) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 98 GLN : amide:sc= -11.5! C(o=-11!,f=-10!) USER MOD Single : A 103 HIS : no HD1:sc= -0.304 X(o=-0.3,f=-0.11) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 GLN : amide:sc= -0.612 X(o=-0.61,f=-0.61) USER MOD Single : A 113 SER OG : rot 180:sc= 0.00175 USER MOD Single : A 116 SER OG : rot 180:sc= 0.077 USER MOD Single : A 117 SER OG : rot 18:sc= 0.823 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -43.365 -19.782 -6.984 1.00 0.00 N ATOM 2 CA GLY A 1 -44.201 -19.136 -7.979 1.00 0.00 C ATOM 3 C GLY A 1 -45.077 -18.051 -7.384 1.00 0.00 C ATOM 4 O GLY A 1 -44.640 -17.300 -6.511 1.00 0.00 O ATOM 0 H1 GLY A 1 -42.443 -20.017 -7.404 1.00 0.00 H new ATOM 0 H2 GLY A 1 -43.225 -19.139 -6.178 1.00 0.00 H new ATOM 0 H3 GLY A 1 -43.827 -20.654 -6.655 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -43.569 -18.704 -8.755 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -44.831 -19.884 -8.461 1.00 0.00 H new ATOM 8 N SER A 2 -46.316 -17.966 -7.857 1.00 0.00 N ATOM 9 CA SER A 2 -47.253 -16.960 -7.370 1.00 0.00 C ATOM 10 C SER A 2 -46.745 -15.554 -7.671 1.00 0.00 C ATOM 11 O SER A 2 -46.502 -14.762 -6.761 1.00 0.00 O ATOM 12 CB SER A 2 -47.473 -17.125 -5.865 1.00 0.00 C ATOM 13 OG SER A 2 -48.815 -16.838 -5.512 1.00 0.00 O ATOM 0 H SER A 2 -46.695 -18.581 -8.577 1.00 0.00 H new ATOM 0 HA SER A 2 -48.202 -17.102 -7.886 1.00 0.00 H new ATOM 0 HB2 SER A 2 -47.225 -18.144 -5.568 1.00 0.00 H new ATOM 0 HB3 SER A 2 -46.801 -16.462 -5.321 1.00 0.00 H new ATOM 0 HG SER A 2 -48.931 -16.952 -4.546 1.00 0.00 H new ATOM 19 N SER A 3 -46.587 -15.250 -8.955 1.00 0.00 N ATOM 20 CA SER A 3 -46.104 -13.940 -9.378 1.00 0.00 C ATOM 21 C SER A 3 -44.914 -13.501 -8.531 1.00 0.00 C ATOM 22 O SER A 3 -44.706 -12.310 -8.302 1.00 0.00 O ATOM 23 CB SER A 3 -47.226 -12.904 -9.279 1.00 0.00 C ATOM 24 OG SER A 3 -48.120 -13.014 -10.372 1.00 0.00 O ATOM 0 H SER A 3 -46.786 -15.893 -9.721 1.00 0.00 H new ATOM 0 HA SER A 3 -45.780 -14.016 -10.416 1.00 0.00 H new ATOM 0 HB2 SER A 3 -47.770 -13.041 -8.345 1.00 0.00 H new ATOM 0 HB3 SER A 3 -46.798 -11.902 -9.254 1.00 0.00 H new ATOM 0 HG SER A 3 -48.828 -12.342 -10.284 1.00 0.00 H new ATOM 30 N GLY A 4 -44.135 -14.473 -8.067 1.00 0.00 N ATOM 31 CA GLY A 4 -42.974 -14.168 -7.250 1.00 0.00 C ATOM 32 C GLY A 4 -43.263 -13.108 -6.206 1.00 0.00 C ATOM 33 O GLY A 4 -44.250 -13.199 -5.476 1.00 0.00 O ATOM 0 H GLY A 4 -44.287 -15.466 -8.242 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -42.632 -15.077 -6.755 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -42.161 -13.829 -7.892 1.00 0.00 H new ATOM 37 N SER A 5 -42.400 -12.101 -6.132 1.00 0.00 N ATOM 38 CA SER A 5 -42.564 -11.022 -5.166 1.00 0.00 C ATOM 39 C SER A 5 -41.603 -9.874 -5.463 1.00 0.00 C ATOM 40 O SER A 5 -40.603 -10.052 -6.158 1.00 0.00 O ATOM 41 CB SER A 5 -42.332 -11.541 -3.745 1.00 0.00 C ATOM 42 OG SER A 5 -40.947 -11.655 -3.464 1.00 0.00 O ATOM 0 H SER A 5 -41.579 -12.010 -6.730 1.00 0.00 H new ATOM 0 HA SER A 5 -43.585 -10.648 -5.247 1.00 0.00 H new ATOM 0 HB2 SER A 5 -42.798 -10.866 -3.027 1.00 0.00 H new ATOM 0 HB3 SER A 5 -42.812 -12.513 -3.626 1.00 0.00 H new ATOM 0 HG SER A 5 -40.825 -11.987 -2.550 1.00 0.00 H new ATOM 48 N SER A 6 -41.916 -8.696 -4.933 1.00 0.00 N ATOM 49 CA SER A 6 -41.083 -7.518 -5.144 1.00 0.00 C ATOM 50 C SER A 6 -40.009 -7.412 -4.066 1.00 0.00 C ATOM 51 O SER A 6 -40.145 -7.975 -2.980 1.00 0.00 O ATOM 52 CB SER A 6 -41.944 -6.253 -5.148 1.00 0.00 C ATOM 53 OG SER A 6 -41.215 -5.139 -4.664 1.00 0.00 O ATOM 0 H SER A 6 -42.740 -8.532 -4.355 1.00 0.00 H new ATOM 0 HA SER A 6 -40.593 -7.619 -6.112 1.00 0.00 H new ATOM 0 HB2 SER A 6 -42.294 -6.051 -6.160 1.00 0.00 H new ATOM 0 HB3 SER A 6 -42.828 -6.409 -4.530 1.00 0.00 H new ATOM 0 HG SER A 6 -41.786 -4.343 -4.678 1.00 0.00 H new ATOM 59 N GLY A 7 -38.939 -6.684 -4.374 1.00 0.00 N ATOM 60 CA GLY A 7 -37.857 -6.516 -3.422 1.00 0.00 C ATOM 61 C GLY A 7 -36.671 -5.783 -4.017 1.00 0.00 C ATOM 62 O GLY A 7 -36.510 -5.734 -5.236 1.00 0.00 O ATOM 0 H GLY A 7 -38.803 -6.208 -5.266 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -38.222 -5.966 -2.555 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -37.535 -7.495 -3.066 1.00 0.00 H new ATOM 66 N VAL A 8 -35.838 -5.209 -3.154 1.00 0.00 N ATOM 67 CA VAL A 8 -34.661 -4.474 -3.600 1.00 0.00 C ATOM 68 C VAL A 8 -33.471 -4.734 -2.684 1.00 0.00 C ATOM 69 O VAL A 8 -32.541 -3.930 -2.616 1.00 0.00 O ATOM 70 CB VAL A 8 -34.933 -2.959 -3.655 1.00 0.00 C ATOM 71 CG1 VAL A 8 -34.053 -2.296 -4.704 1.00 0.00 C ATOM 72 CG2 VAL A 8 -36.404 -2.692 -3.934 1.00 0.00 C ATOM 0 H VAL A 8 -35.957 -5.239 -2.141 1.00 0.00 H new ATOM 0 HA VAL A 8 -34.427 -4.830 -4.603 1.00 0.00 H new ATOM 0 HB VAL A 8 -34.687 -2.528 -2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -34.259 -1.226 -4.728 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -33.004 -2.458 -4.454 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -34.264 -2.729 -5.682 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -36.578 -1.617 -3.969 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -36.679 -3.136 -4.891 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -37.010 -3.132 -3.142 1.00 0.00 H new ATOM 82 N GLN A 9 -33.506 -5.861 -1.982 1.00 0.00 N ATOM 83 CA GLN A 9 -32.430 -6.226 -1.069 1.00 0.00 C ATOM 84 C GLN A 9 -31.642 -7.417 -1.604 1.00 0.00 C ATOM 85 O GLN A 9 -32.114 -8.554 -1.567 1.00 0.00 O ATOM 86 CB GLN A 9 -32.995 -6.554 0.315 1.00 0.00 C ATOM 87 CG GLN A 9 -32.027 -6.265 1.451 1.00 0.00 C ATOM 88 CD GLN A 9 -32.577 -6.674 2.803 1.00 0.00 C ATOM 89 OE1 GLN A 9 -32.502 -5.917 3.772 1.00 0.00 O ATOM 90 NE2 GLN A 9 -33.133 -7.878 2.877 1.00 0.00 N ATOM 0 H GLN A 9 -34.268 -6.538 -2.028 1.00 0.00 H new ATOM 0 HA GLN A 9 -31.755 -5.374 -0.986 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -33.908 -5.979 0.471 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -33.273 -7.608 0.345 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -31.091 -6.793 1.269 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -31.795 -5.200 1.464 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -33.174 -8.473 2.049 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -33.519 -8.208 3.762 1.00 0.00 H new ATOM 99 N ASP A 10 -30.440 -7.149 -2.103 1.00 0.00 N ATOM 100 CA ASP A 10 -29.586 -8.199 -2.646 1.00 0.00 C ATOM 101 C ASP A 10 -28.112 -7.856 -2.451 1.00 0.00 C ATOM 102 O ASP A 10 -27.728 -6.688 -2.487 1.00 0.00 O ATOM 103 CB ASP A 10 -29.881 -8.409 -4.131 1.00 0.00 C ATOM 104 CG ASP A 10 -29.432 -9.771 -4.624 1.00 0.00 C ATOM 105 OD1 ASP A 10 -28.239 -9.916 -4.963 1.00 0.00 O ATOM 106 OD2 ASP A 10 -30.274 -10.692 -4.671 1.00 0.00 O ATOM 0 H ASP A 10 -30.035 -6.214 -2.143 1.00 0.00 H new ATOM 0 HA ASP A 10 -29.800 -9.122 -2.107 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -30.951 -8.298 -4.305 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -29.381 -7.633 -4.711 1.00 0.00 H new ATOM 111 N GLN A 11 -27.293 -8.882 -2.243 1.00 0.00 N ATOM 112 CA GLN A 11 -25.863 -8.688 -2.041 1.00 0.00 C ATOM 113 C GLN A 11 -25.062 -9.798 -2.715 1.00 0.00 C ATOM 114 O GLN A 11 -25.176 -10.969 -2.351 1.00 0.00 O ATOM 115 CB GLN A 11 -25.539 -8.645 -0.547 1.00 0.00 C ATOM 116 CG GLN A 11 -24.604 -7.510 -0.159 1.00 0.00 C ATOM 117 CD GLN A 11 -23.142 -7.879 -0.314 1.00 0.00 C ATOM 118 OE1 GLN A 11 -22.804 -9.042 -0.534 1.00 0.00 O ATOM 119 NE2 GLN A 11 -22.266 -6.888 -0.200 1.00 0.00 N ATOM 0 H GLN A 11 -27.596 -9.856 -2.210 1.00 0.00 H new ATOM 0 HA GLN A 11 -25.584 -7.737 -2.494 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -26.468 -8.548 0.015 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -25.087 -9.593 -0.254 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -24.822 -6.638 -0.776 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -24.795 -7.225 0.876 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -22.591 -5.939 -0.017 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -21.268 -7.076 -0.295 1.00 0.00 H new ATOM 128 N LEU A 12 -24.252 -9.422 -3.699 1.00 0.00 N ATOM 129 CA LEU A 12 -23.432 -10.386 -4.424 1.00 0.00 C ATOM 130 C LEU A 12 -22.237 -10.825 -3.585 1.00 0.00 C ATOM 131 O LEU A 12 -21.676 -10.053 -2.807 1.00 0.00 O ATOM 132 CB LEU A 12 -22.948 -9.782 -5.744 1.00 0.00 C ATOM 133 CG LEU A 12 -21.577 -9.107 -5.710 1.00 0.00 C ATOM 134 CD1 LEU A 12 -20.496 -10.068 -6.180 1.00 0.00 C ATOM 135 CD2 LEU A 12 -21.581 -7.848 -6.565 1.00 0.00 C ATOM 0 H LEU A 12 -24.146 -8.457 -4.013 1.00 0.00 H new ATOM 0 HA LEU A 12 -24.046 -11.262 -4.635 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -22.923 -10.572 -6.495 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -23.683 -9.049 -6.077 1.00 0.00 H new ATOM 0 HG LEU A 12 -21.359 -8.823 -4.680 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -19.527 -9.569 -6.149 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -20.476 -10.941 -5.527 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -20.709 -10.384 -7.201 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -20.597 -7.381 -6.529 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -21.821 -8.109 -7.596 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -22.328 -7.152 -6.184 1.00 0.00 H new ATOM 147 N PRO A 13 -21.835 -12.095 -3.745 1.00 0.00 N ATOM 148 CA PRO A 13 -20.700 -12.665 -3.013 1.00 0.00 C ATOM 149 C PRO A 13 -19.366 -12.082 -3.465 1.00 0.00 C ATOM 150 O PRO A 13 -19.137 -11.884 -4.659 1.00 0.00 O ATOM 151 CB PRO A 13 -20.774 -14.156 -3.349 1.00 0.00 C ATOM 152 CG PRO A 13 -21.480 -14.214 -4.660 1.00 0.00 C ATOM 153 CD PRO A 13 -22.457 -13.071 -4.656 1.00 0.00 C ATOM 0 HA PRO A 13 -20.755 -12.451 -1.946 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -19.779 -14.597 -3.415 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -21.317 -14.708 -2.582 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -20.776 -14.122 -5.487 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -21.995 -15.167 -4.784 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -22.596 -12.657 -5.655 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -23.439 -13.383 -4.301 1.00 0.00 H new ATOM 161 N TYR A 14 -18.489 -11.810 -2.506 1.00 0.00 N ATOM 162 CA TYR A 14 -17.177 -11.248 -2.806 1.00 0.00 C ATOM 163 C TYR A 14 -17.281 -9.756 -3.111 1.00 0.00 C ATOM 164 O TYR A 14 -18.061 -9.339 -3.966 1.00 0.00 O ATOM 165 CB TYR A 14 -16.545 -11.979 -3.992 1.00 0.00 C ATOM 166 CG TYR A 14 -15.035 -11.910 -4.010 1.00 0.00 C ATOM 167 CD1 TYR A 14 -14.294 -12.168 -2.863 1.00 0.00 C ATOM 168 CD2 TYR A 14 -14.348 -11.586 -5.174 1.00 0.00 C ATOM 169 CE1 TYR A 14 -12.914 -12.106 -2.875 1.00 0.00 C ATOM 170 CE2 TYR A 14 -12.969 -11.523 -5.195 1.00 0.00 C ATOM 171 CZ TYR A 14 -12.256 -11.783 -4.043 1.00 0.00 C ATOM 172 OH TYR A 14 -10.882 -11.720 -4.060 1.00 0.00 O ATOM 0 H TYR A 14 -18.662 -11.969 -1.514 1.00 0.00 H new ATOM 0 HA TYR A 14 -16.544 -11.378 -1.928 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -16.852 -13.025 -3.969 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -16.931 -11.553 -4.918 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -14.806 -12.421 -1.946 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -14.902 -11.380 -6.078 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.354 -12.309 -1.975 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.451 -11.271 -6.109 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.543 -11.728 -3.141 1.00 0.00 H new ATOM 182 N SER A 15 -16.486 -8.959 -2.404 1.00 0.00 N ATOM 183 CA SER A 15 -16.489 -7.513 -2.595 1.00 0.00 C ATOM 184 C SER A 15 -15.067 -6.983 -2.751 1.00 0.00 C ATOM 185 O SER A 15 -14.099 -7.659 -2.404 1.00 0.00 O ATOM 186 CB SER A 15 -17.177 -6.823 -1.416 1.00 0.00 C ATOM 187 OG SER A 15 -18.068 -7.706 -0.757 1.00 0.00 O ATOM 0 H SER A 15 -15.832 -9.290 -1.694 1.00 0.00 H new ATOM 0 HA SER A 15 -17.042 -7.293 -3.508 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.426 -6.466 -0.711 1.00 0.00 H new ATOM 0 HB3 SER A 15 -17.723 -5.949 -1.770 1.00 0.00 H new ATOM 0 HG SER A 15 -18.494 -7.241 -0.006 1.00 0.00 H new ATOM 193 N VAL A 16 -14.950 -5.767 -3.276 1.00 0.00 N ATOM 194 CA VAL A 16 -13.647 -5.144 -3.478 1.00 0.00 C ATOM 195 C VAL A 16 -13.694 -3.655 -3.154 1.00 0.00 C ATOM 196 O VAL A 16 -14.719 -2.999 -3.341 1.00 0.00 O ATOM 197 CB VAL A 16 -13.155 -5.328 -4.926 1.00 0.00 C ATOM 198 CG1 VAL A 16 -12.519 -4.045 -5.440 1.00 0.00 C ATOM 199 CG2 VAL A 16 -12.178 -6.490 -5.012 1.00 0.00 C ATOM 0 H VAL A 16 -15.741 -5.194 -3.569 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.951 -5.639 -2.800 1.00 0.00 H new ATOM 0 HB VAL A 16 -14.013 -5.558 -5.558 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -12.177 -4.193 -6.464 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -13.253 -3.240 -5.416 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -11.670 -3.781 -4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -11.840 -6.606 -6.042 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -11.320 -6.293 -4.369 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -12.672 -7.406 -4.687 1.00 0.00 H new ATOM 209 N THR A 17 -12.577 -3.125 -2.666 1.00 0.00 N ATOM 210 CA THR A 17 -12.490 -1.714 -2.315 1.00 0.00 C ATOM 211 C THR A 17 -11.245 -1.072 -2.918 1.00 0.00 C ATOM 212 O THR A 17 -10.185 -1.695 -2.988 1.00 0.00 O ATOM 213 CB THR A 17 -12.466 -1.515 -0.787 1.00 0.00 C ATOM 214 OG1 THR A 17 -13.441 -2.361 -0.168 1.00 0.00 O ATOM 215 CG2 THR A 17 -12.744 -0.064 -0.426 1.00 0.00 C ATOM 0 H THR A 17 -11.719 -3.653 -2.505 1.00 0.00 H new ATOM 0 HA THR A 17 -13.378 -1.232 -2.724 1.00 0.00 H new ATOM 0 HB THR A 17 -11.473 -1.779 -0.424 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.418 -2.230 0.803 1.00 0.00 H new ATOM 0 HG21 THR A 17 -12.722 0.052 0.658 1.00 0.00 H new ATOM 0 HG22 THR A 17 -11.983 0.575 -0.875 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.726 0.223 -0.802 1.00 0.00 H new ATOM 223 N LEU A 18 -11.380 0.175 -3.353 1.00 0.00 N ATOM 224 CA LEU A 18 -10.266 0.902 -3.951 1.00 0.00 C ATOM 225 C LEU A 18 -10.097 2.271 -3.300 1.00 0.00 C ATOM 226 O LEU A 18 -11.071 2.889 -2.868 1.00 0.00 O ATOM 227 CB LEU A 18 -10.485 1.064 -5.456 1.00 0.00 C ATOM 228 CG LEU A 18 -9.328 1.683 -6.241 1.00 0.00 C ATOM 229 CD1 LEU A 18 -8.088 0.807 -6.143 1.00 0.00 C ATOM 230 CD2 LEU A 18 -9.721 1.893 -7.695 1.00 0.00 C ATOM 0 H LEU A 18 -12.250 0.704 -3.303 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.357 0.325 -3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.701 0.083 -5.879 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.372 1.679 -5.610 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.097 2.655 -5.805 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.275 1.263 -6.708 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.794 0.709 -5.098 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.306 -0.179 -6.553 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.885 2.334 -8.238 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.980 0.934 -8.144 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.580 2.561 -7.747 1.00 0.00 H new ATOM 242 N ILE A 19 -8.855 2.741 -3.235 1.00 0.00 N ATOM 243 CA ILE A 19 -8.560 4.038 -2.641 1.00 0.00 C ATOM 244 C ILE A 19 -7.686 4.880 -3.564 1.00 0.00 C ATOM 245 O ILE A 19 -6.751 4.372 -4.184 1.00 0.00 O ATOM 246 CB ILE A 19 -7.853 3.886 -1.281 1.00 0.00 C ATOM 247 CG1 ILE A 19 -7.054 2.582 -1.239 1.00 0.00 C ATOM 248 CG2 ILE A 19 -8.868 3.928 -0.149 1.00 0.00 C ATOM 249 CD1 ILE A 19 -7.888 1.375 -0.870 1.00 0.00 C ATOM 0 H ILE A 19 -8.038 2.242 -3.587 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.515 4.541 -2.491 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.161 4.718 -1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.597 2.414 -2.214 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.242 2.686 -0.520 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.353 3.819 0.806 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.397 4.881 -0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.582 3.114 -0.271 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.257 0.486 -0.860 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.324 1.522 0.118 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.685 1.246 -1.602 1.00 0.00 H new ATOM 261 N SER A 20 -7.995 6.170 -3.649 1.00 0.00 N ATOM 262 CA SER A 20 -7.239 7.083 -4.499 1.00 0.00 C ATOM 263 C SER A 20 -6.925 8.379 -3.758 1.00 0.00 C ATOM 264 O SER A 20 -7.782 9.252 -3.624 1.00 0.00 O ATOM 265 CB SER A 20 -8.020 7.389 -5.778 1.00 0.00 C ATOM 266 OG SER A 20 -9.375 6.992 -5.655 1.00 0.00 O ATOM 0 H SER A 20 -8.763 6.607 -3.140 1.00 0.00 H new ATOM 0 HA SER A 20 -6.299 6.599 -4.764 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.968 8.456 -5.993 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.561 6.872 -6.621 1.00 0.00 H new ATOM 0 HG SER A 20 -9.853 7.200 -6.485 1.00 0.00 H new ATOM 272 N MET A 21 -5.691 8.497 -3.280 1.00 0.00 N ATOM 273 CA MET A 21 -5.263 9.687 -2.555 1.00 0.00 C ATOM 274 C MET A 21 -4.042 10.318 -3.216 1.00 0.00 C ATOM 275 O MET A 21 -3.164 9.630 -3.738 1.00 0.00 O ATOM 276 CB MET A 21 -4.946 9.337 -1.100 1.00 0.00 C ATOM 277 CG MET A 21 -5.346 7.922 -0.714 1.00 0.00 C ATOM 278 SD MET A 21 -4.127 6.693 -1.221 1.00 0.00 S ATOM 279 CE MET A 21 -4.430 5.401 -0.018 1.00 0.00 C ATOM 0 H MET A 21 -4.970 7.783 -3.382 1.00 0.00 H new ATOM 0 HA MET A 21 -6.079 10.409 -2.578 1.00 0.00 H new ATOM 0 HB2 MET A 21 -3.877 9.463 -0.929 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.458 10.042 -0.445 1.00 0.00 H new ATOM 0 HG2 MET A 21 -5.482 7.869 0.366 1.00 0.00 H new ATOM 0 HG3 MET A 21 -6.308 7.684 -1.169 1.00 0.00 H new ATOM 0 HE1 MET A 21 -3.494 5.135 0.473 1.00 0.00 H new ATOM 0 HE2 MET A 21 -5.142 5.757 0.726 1.00 0.00 H new ATOM 0 HE3 MET A 21 -4.838 4.524 -0.521 1.00 0.00 H new ATOM 289 N PRO A 22 -3.982 11.657 -3.195 1.00 0.00 N ATOM 290 CA PRO A 22 -2.872 12.410 -3.789 1.00 0.00 C ATOM 291 C PRO A 22 -1.574 12.242 -3.007 1.00 0.00 C ATOM 292 O PRO A 22 -1.585 11.820 -1.851 1.00 0.00 O ATOM 293 CB PRO A 22 -3.352 13.861 -3.723 1.00 0.00 C ATOM 294 CG PRO A 22 -4.323 13.888 -2.594 1.00 0.00 C ATOM 295 CD PRO A 22 -4.992 12.541 -2.591 1.00 0.00 C ATOM 0 HA PRO A 22 -2.642 12.069 -4.798 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -2.522 14.545 -3.547 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -3.823 14.165 -4.658 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -3.816 14.074 -1.647 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.053 14.686 -2.726 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -5.251 12.223 -1.581 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -5.916 12.550 -3.170 1.00 0.00 H new ATOM 303 N ALA A 23 -0.457 12.574 -3.645 1.00 0.00 N ATOM 304 CA ALA A 23 0.849 12.463 -3.007 1.00 0.00 C ATOM 305 C ALA A 23 1.032 13.534 -1.938 1.00 0.00 C ATOM 306 O ALA A 23 0.061 14.003 -1.342 1.00 0.00 O ATOM 307 CB ALA A 23 1.955 12.560 -4.048 1.00 0.00 C ATOM 0 H ALA A 23 -0.430 12.922 -4.603 1.00 0.00 H new ATOM 0 HA ALA A 23 0.906 11.489 -2.521 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.925 12.476 -3.558 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.844 11.754 -4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.890 13.520 -4.560 1.00 0.00 H new ATOM 313 N THR A 24 2.282 13.918 -1.698 1.00 0.00 N ATOM 314 CA THR A 24 2.591 14.932 -0.698 1.00 0.00 C ATOM 315 C THR A 24 3.854 15.702 -1.069 1.00 0.00 C ATOM 316 O THR A 24 4.441 16.392 -0.235 1.00 0.00 O ATOM 317 CB THR A 24 2.776 14.308 0.698 1.00 0.00 C ATOM 318 OG1 THR A 24 4.164 14.056 0.943 1.00 0.00 O ATOM 319 CG2 THR A 24 1.990 13.011 0.818 1.00 0.00 C ATOM 0 H THR A 24 3.097 13.542 -2.183 1.00 0.00 H new ATOM 0 HA THR A 24 1.744 15.618 -0.671 1.00 0.00 H new ATOM 0 HB THR A 24 2.400 15.013 1.440 1.00 0.00 H new ATOM 0 HG1 THR A 24 4.518 13.466 0.245 1.00 0.00 H new ATOM 0 HG21 THR A 24 2.136 12.588 1.812 1.00 0.00 H new ATOM 0 HG22 THR A 24 0.930 13.212 0.661 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.340 12.302 0.067 1.00 0.00 H new ATOM 327 N THR A 25 4.268 15.580 -2.327 1.00 0.00 N ATOM 328 CA THR A 25 5.462 16.264 -2.808 1.00 0.00 C ATOM 329 C THR A 25 6.726 15.619 -2.252 1.00 0.00 C ATOM 330 O THR A 25 7.506 15.021 -2.993 1.00 0.00 O ATOM 331 CB THR A 25 5.448 17.755 -2.424 1.00 0.00 C ATOM 332 OG1 THR A 25 4.099 18.231 -2.355 1.00 0.00 O ATOM 333 CG2 THR A 25 6.231 18.581 -3.433 1.00 0.00 C ATOM 0 H THR A 25 3.794 15.014 -3.031 1.00 0.00 H new ATOM 0 HA THR A 25 5.461 16.177 -3.894 1.00 0.00 H new ATOM 0 HB THR A 25 5.920 17.860 -1.447 1.00 0.00 H new ATOM 0 HG1 THR A 25 4.099 19.180 -2.109 1.00 0.00 H new ATOM 0 HG21 THR A 25 6.207 19.631 -3.141 1.00 0.00 H new ATOM 0 HG22 THR A 25 7.265 18.236 -3.462 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.783 18.469 -4.421 1.00 0.00 H new ATOM 341 N GLU A 26 6.923 15.745 -0.943 1.00 0.00 N ATOM 342 CA GLU A 26 8.094 15.174 -0.289 1.00 0.00 C ATOM 343 C GLU A 26 7.778 13.797 0.288 1.00 0.00 C ATOM 344 O GLU A 26 6.612 13.429 0.440 1.00 0.00 O ATOM 345 CB GLU A 26 8.590 16.103 0.821 1.00 0.00 C ATOM 346 CG GLU A 26 8.614 17.569 0.423 1.00 0.00 C ATOM 347 CD GLU A 26 9.109 18.469 1.539 1.00 0.00 C ATOM 348 OE1 GLU A 26 10.056 18.069 2.247 1.00 0.00 O ATOM 349 OE2 GLU A 26 8.548 19.572 1.704 1.00 0.00 O ATOM 0 H GLU A 26 6.287 16.237 -0.315 1.00 0.00 H new ATOM 0 HA GLU A 26 8.878 15.064 -1.038 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.951 15.983 1.696 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.594 15.799 1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.254 17.694 -0.450 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.611 17.878 0.130 1.00 0.00 H new ATOM 356 N CYS A 27 8.823 13.042 0.607 1.00 0.00 N ATOM 357 CA CYS A 27 8.658 11.705 1.166 1.00 0.00 C ATOM 358 C CYS A 27 8.020 11.769 2.551 1.00 0.00 C ATOM 359 O CYS A 27 8.672 12.138 3.528 1.00 0.00 O ATOM 360 CB CYS A 27 10.008 10.992 1.246 1.00 0.00 C ATOM 361 SG CYS A 27 10.336 9.875 -0.138 1.00 0.00 S ATOM 0 H CYS A 27 9.793 13.333 0.488 1.00 0.00 H new ATOM 0 HA CYS A 27 7.997 11.142 0.507 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.800 11.740 1.291 1.00 0.00 H new ATOM 0 HB3 CYS A 27 10.053 10.424 2.176 1.00 0.00 H new ATOM 0 HG CYS A 27 11.502 9.321 0.018 1.00 0.00 H new ATOM 367 N ARG A 28 6.743 11.409 2.626 1.00 0.00 N ATOM 368 CA ARG A 28 6.017 11.429 3.890 1.00 0.00 C ATOM 369 C ARG A 28 5.388 10.069 4.177 1.00 0.00 C ATOM 370 O ARG A 28 5.603 9.487 5.240 1.00 0.00 O ATOM 371 CB ARG A 28 4.934 12.508 3.863 1.00 0.00 C ATOM 372 CG ARG A 28 5.413 13.865 4.351 1.00 0.00 C ATOM 373 CD ARG A 28 4.318 14.915 4.245 1.00 0.00 C ATOM 374 NE ARG A 28 4.362 15.866 5.353 1.00 0.00 N ATOM 375 CZ ARG A 28 3.402 16.749 5.601 1.00 0.00 C ATOM 376 NH1 ARG A 28 2.329 16.803 4.825 1.00 0.00 N ATOM 377 NH2 ARG A 28 3.515 17.582 6.629 1.00 0.00 N ATOM 0 H ARG A 28 6.190 11.100 1.827 1.00 0.00 H new ATOM 0 HA ARG A 28 6.727 11.657 4.685 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.560 12.609 2.844 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.096 12.185 4.480 1.00 0.00 H new ATOM 0 HG2 ARG A 28 5.742 13.785 5.387 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.277 14.179 3.766 1.00 0.00 H new ATOM 0 HD2 ARG A 28 4.421 15.452 3.302 1.00 0.00 H new ATOM 0 HD3 ARG A 28 3.345 14.424 4.227 1.00 0.00 H new ATOM 0 HE ARG A 28 5.174 15.851 5.970 1.00 0.00 H new ATOM 0 HH11 ARG A 28 2.239 16.165 4.034 1.00 0.00 H new ATOM 0 HH12 ARG A 28 1.593 17.483 5.018 1.00 0.00 H new ATOM 0 HH21 ARG A 28 4.339 17.544 7.228 1.00 0.00 H new ATOM 0 HH22 ARG A 28 2.777 18.260 6.819 1.00 0.00 H new ATOM 391 N ARG A 29 4.611 9.568 3.222 1.00 0.00 N ATOM 392 CA ARG A 29 3.950 8.278 3.373 1.00 0.00 C ATOM 393 C ARG A 29 2.881 8.339 4.460 1.00 0.00 C ATOM 394 O ARG A 29 3.191 8.355 5.650 1.00 0.00 O ATOM 395 CB ARG A 29 4.974 7.192 3.709 1.00 0.00 C ATOM 396 CG ARG A 29 5.169 6.174 2.598 1.00 0.00 C ATOM 397 CD ARG A 29 6.561 6.270 1.994 1.00 0.00 C ATOM 398 NE ARG A 29 7.603 5.941 2.963 1.00 0.00 N ATOM 399 CZ ARG A 29 8.861 6.356 2.860 1.00 0.00 C ATOM 400 NH1 ARG A 29 9.231 7.112 1.836 1.00 0.00 N ATOM 401 NH2 ARG A 29 9.751 6.015 3.783 1.00 0.00 N ATOM 0 H ARG A 29 4.424 10.036 2.335 1.00 0.00 H new ATOM 0 HA ARG A 29 3.468 8.032 2.427 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.932 7.663 3.930 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.657 6.673 4.614 1.00 0.00 H new ATOM 0 HG2 ARG A 29 5.010 5.170 2.991 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.422 6.334 1.821 1.00 0.00 H new ATOM 0 HD2 ARG A 29 6.633 5.595 1.141 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.723 7.279 1.616 1.00 0.00 H new ATOM 0 HE ARG A 29 7.351 5.361 3.763 1.00 0.00 H new ATOM 0 HH11 ARG A 29 8.549 7.376 1.125 1.00 0.00 H new ATOM 0 HH12 ARG A 29 10.197 7.429 1.759 1.00 0.00 H new ATOM 0 HH21 ARG A 29 9.470 5.434 4.573 1.00 0.00 H new ATOM 0 HH22 ARG A 29 10.716 6.334 3.703 1.00 0.00 H new ATOM 415 N GLY A 30 1.619 8.373 4.041 1.00 0.00 N ATOM 416 CA GLY A 30 0.524 8.432 4.991 1.00 0.00 C ATOM 417 C GLY A 30 0.279 7.103 5.678 1.00 0.00 C ATOM 418 O GLY A 30 -0.447 7.033 6.670 1.00 0.00 O ATOM 0 H GLY A 30 1.336 8.361 3.061 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.740 9.191 5.743 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.384 8.743 4.475 1.00 0.00 H new ATOM 422 N PHE A 31 0.885 6.045 5.149 1.00 0.00 N ATOM 423 CA PHE A 31 0.727 4.711 5.716 1.00 0.00 C ATOM 424 C PHE A 31 1.886 3.806 5.308 1.00 0.00 C ATOM 425 O PHE A 31 2.412 3.915 4.201 1.00 0.00 O ATOM 426 CB PHE A 31 -0.599 4.095 5.265 1.00 0.00 C ATOM 427 CG PHE A 31 -0.504 3.359 3.959 1.00 0.00 C ATOM 428 CD1 PHE A 31 -0.181 4.030 2.791 1.00 0.00 C ATOM 429 CD2 PHE A 31 -0.738 1.994 3.900 1.00 0.00 C ATOM 430 CE1 PHE A 31 -0.092 3.355 1.588 1.00 0.00 C ATOM 431 CE2 PHE A 31 -0.651 1.314 2.700 1.00 0.00 C ATOM 432 CZ PHE A 31 -0.328 1.995 1.543 1.00 0.00 C ATOM 0 H PHE A 31 1.490 6.086 4.329 1.00 0.00 H new ATOM 0 HA PHE A 31 0.726 4.803 6.802 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.952 3.409 6.035 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -1.345 4.884 5.175 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.004 5.094 2.821 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -0.991 1.456 4.802 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.162 3.890 0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.836 0.250 2.667 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.260 1.465 0.604 1.00 0.00 H new ATOM 442 N SER A 32 2.279 2.914 6.212 1.00 0.00 N ATOM 443 CA SER A 32 3.378 1.993 5.949 1.00 0.00 C ATOM 444 C SER A 32 2.854 0.654 5.438 1.00 0.00 C ATOM 445 O SER A 32 1.650 0.398 5.454 1.00 0.00 O ATOM 446 CB SER A 32 4.206 1.779 7.217 1.00 0.00 C ATOM 447 OG SER A 32 5.268 2.714 7.297 1.00 0.00 O ATOM 0 H SER A 32 1.853 2.810 7.133 1.00 0.00 H new ATOM 0 HA SER A 32 4.012 2.433 5.179 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.566 1.876 8.094 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.608 0.766 7.226 1.00 0.00 H new ATOM 0 HG SER A 32 5.781 2.557 8.117 1.00 0.00 H new ATOM 453 N VAL A 33 3.769 -0.197 4.984 1.00 0.00 N ATOM 454 CA VAL A 33 3.401 -1.511 4.468 1.00 0.00 C ATOM 455 C VAL A 33 4.502 -2.532 4.730 1.00 0.00 C ATOM 456 O VAL A 33 5.603 -2.180 5.155 1.00 0.00 O ATOM 457 CB VAL A 33 3.113 -1.460 2.956 1.00 0.00 C ATOM 458 CG1 VAL A 33 2.023 -0.442 2.654 1.00 0.00 C ATOM 459 CG2 VAL A 33 4.383 -1.139 2.182 1.00 0.00 C ATOM 0 H VAL A 33 4.770 -0.000 4.963 1.00 0.00 H new ATOM 0 HA VAL A 33 2.495 -1.815 4.993 1.00 0.00 H new ATOM 0 HB VAL A 33 2.759 -2.441 2.638 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.833 -0.420 1.581 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.109 -0.721 3.179 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.345 0.545 2.986 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.161 -1.107 1.115 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.769 -0.171 2.501 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.130 -1.909 2.374 1.00 0.00 H new ATOM 469 N THR A 34 4.199 -3.800 4.473 1.00 0.00 N ATOM 470 CA THR A 34 5.162 -4.874 4.681 1.00 0.00 C ATOM 471 C THR A 34 5.369 -5.682 3.406 1.00 0.00 C ATOM 472 O THR A 34 4.409 -6.048 2.728 1.00 0.00 O ATOM 473 CB THR A 34 4.712 -5.822 5.809 1.00 0.00 C ATOM 474 OG1 THR A 34 4.921 -5.202 7.083 1.00 0.00 O ATOM 475 CG2 THR A 34 5.475 -7.137 5.748 1.00 0.00 C ATOM 0 H THR A 34 3.293 -4.109 4.120 1.00 0.00 H new ATOM 0 HA THR A 34 6.103 -4.403 4.966 1.00 0.00 H new ATOM 0 HB THR A 34 3.650 -6.030 5.676 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.631 -5.810 7.794 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.140 -7.790 6.554 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.290 -7.621 4.789 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.542 -6.944 5.857 1.00 0.00 H new ATOM 483 N VAL A 35 6.629 -5.959 3.084 1.00 0.00 N ATOM 484 CA VAL A 35 6.962 -6.727 1.890 1.00 0.00 C ATOM 485 C VAL A 35 7.862 -7.909 2.229 1.00 0.00 C ATOM 486 O VAL A 35 8.949 -7.736 2.778 1.00 0.00 O ATOM 487 CB VAL A 35 7.662 -5.849 0.836 1.00 0.00 C ATOM 488 CG1 VAL A 35 8.252 -6.710 -0.271 1.00 0.00 C ATOM 489 CG2 VAL A 35 6.692 -4.825 0.266 1.00 0.00 C ATOM 0 H VAL A 35 7.436 -5.663 3.633 1.00 0.00 H new ATOM 0 HA VAL A 35 6.022 -7.096 1.479 1.00 0.00 H new ATOM 0 HB VAL A 35 8.478 -5.313 1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 35 8.742 -6.072 -1.006 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.981 -7.400 0.154 1.00 0.00 H new ATOM 0 HG13 VAL A 35 7.456 -7.276 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 35 7.204 -4.213 -0.477 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.853 -5.340 -0.203 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.323 -4.187 1.069 1.00 0.00 H new ATOM 499 N GLU A 36 7.401 -9.111 1.898 1.00 0.00 N ATOM 500 CA GLU A 36 8.165 -10.323 2.169 1.00 0.00 C ATOM 501 C GLU A 36 8.343 -11.150 0.899 1.00 0.00 C ATOM 502 O GLU A 36 7.386 -11.393 0.165 1.00 0.00 O ATOM 503 CB GLU A 36 7.469 -11.163 3.243 1.00 0.00 C ATOM 504 CG GLU A 36 7.880 -10.800 4.660 1.00 0.00 C ATOM 505 CD GLU A 36 9.385 -10.767 4.841 1.00 0.00 C ATOM 506 OE1 GLU A 36 10.033 -11.810 4.615 1.00 0.00 O ATOM 507 OE2 GLU A 36 9.914 -9.697 5.208 1.00 0.00 O ATOM 0 H GLU A 36 6.503 -9.271 1.442 1.00 0.00 H new ATOM 0 HA GLU A 36 9.150 -10.027 2.531 1.00 0.00 H new ATOM 0 HB2 GLU A 36 6.390 -11.042 3.144 1.00 0.00 H new ATOM 0 HB3 GLU A 36 7.689 -12.216 3.068 1.00 0.00 H new ATOM 0 HG2 GLU A 36 7.466 -9.825 4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 36 7.450 -11.521 5.355 1.00 0.00 H new ATOM 514 N SER A 37 9.576 -11.577 0.646 1.00 0.00 N ATOM 515 CA SER A 37 9.882 -12.372 -0.537 1.00 0.00 C ATOM 516 C SER A 37 10.037 -13.846 -0.177 1.00 0.00 C ATOM 517 O SER A 37 11.149 -14.369 -0.118 1.00 0.00 O ATOM 518 CB SER A 37 11.161 -11.861 -1.204 1.00 0.00 C ATOM 519 OG SER A 37 12.100 -11.424 -0.237 1.00 0.00 O ATOM 0 H SER A 37 10.379 -11.386 1.245 1.00 0.00 H new ATOM 0 HA SER A 37 9.051 -12.272 -1.236 1.00 0.00 H new ATOM 0 HB2 SER A 37 11.600 -12.653 -1.810 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.920 -11.040 -1.879 1.00 0.00 H new ATOM 0 HG SER A 37 12.909 -11.104 -0.688 1.00 0.00 H new ATOM 525 N ALA A 38 8.911 -14.511 0.064 1.00 0.00 N ATOM 526 CA ALA A 38 8.920 -15.925 0.418 1.00 0.00 C ATOM 527 C ALA A 38 9.451 -16.775 -0.732 1.00 0.00 C ATOM 528 O ALA A 38 10.065 -17.819 -0.512 1.00 0.00 O ATOM 529 CB ALA A 38 7.522 -16.380 0.810 1.00 0.00 C ATOM 0 H ALA A 38 7.982 -14.093 0.020 1.00 0.00 H new ATOM 0 HA ALA A 38 9.586 -16.056 1.271 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.544 -17.438 1.072 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.178 -15.801 1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 38 6.841 -16.227 -0.028 1.00 0.00 H new ATOM 535 N SER A 39 9.211 -16.321 -1.958 1.00 0.00 N ATOM 536 CA SER A 39 9.661 -17.042 -3.142 1.00 0.00 C ATOM 537 C SER A 39 10.051 -16.072 -4.253 1.00 0.00 C ATOM 538 O SER A 39 9.617 -14.921 -4.268 1.00 0.00 O ATOM 539 CB SER A 39 8.565 -17.988 -3.637 1.00 0.00 C ATOM 540 OG SER A 39 8.998 -19.337 -3.594 1.00 0.00 O ATOM 0 H SER A 39 8.707 -15.457 -2.157 1.00 0.00 H new ATOM 0 HA SER A 39 10.539 -17.627 -2.869 1.00 0.00 H new ATOM 0 HB2 SER A 39 7.673 -17.869 -3.022 1.00 0.00 H new ATOM 0 HB3 SER A 39 8.286 -17.725 -4.657 1.00 0.00 H new ATOM 0 HG SER A 39 8.279 -19.922 -3.914 1.00 0.00 H new ATOM 546 N SER A 40 10.873 -16.548 -5.183 1.00 0.00 N ATOM 547 CA SER A 40 11.326 -15.722 -6.297 1.00 0.00 C ATOM 548 C SER A 40 12.009 -14.455 -5.793 1.00 0.00 C ATOM 549 O SER A 40 11.938 -14.129 -4.608 1.00 0.00 O ATOM 550 CB SER A 40 10.146 -15.355 -7.199 1.00 0.00 C ATOM 551 OG SER A 40 9.896 -16.374 -8.152 1.00 0.00 O ATOM 0 H SER A 40 11.239 -17.500 -5.187 1.00 0.00 H new ATOM 0 HA SER A 40 12.050 -16.298 -6.873 1.00 0.00 H new ATOM 0 HB2 SER A 40 9.256 -15.195 -6.591 1.00 0.00 H new ATOM 0 HB3 SER A 40 10.355 -14.416 -7.712 1.00 0.00 H new ATOM 0 HG SER A 40 10.093 -16.037 -9.051 1.00 0.00 H new ATOM 557 N ASN A 41 12.669 -13.745 -6.701 1.00 0.00 N ATOM 558 CA ASN A 41 13.366 -12.513 -6.349 1.00 0.00 C ATOM 559 C ASN A 41 12.405 -11.328 -6.339 1.00 0.00 C ATOM 560 O ASN A 41 12.808 -10.191 -6.093 1.00 0.00 O ATOM 561 CB ASN A 41 14.509 -12.250 -7.332 1.00 0.00 C ATOM 562 CG ASN A 41 15.573 -11.339 -6.751 1.00 0.00 C ATOM 563 OD1 ASN A 41 15.314 -10.579 -5.818 1.00 0.00 O ATOM 564 ND2 ASN A 41 16.779 -11.412 -7.302 1.00 0.00 N ATOM 0 H ASN A 41 12.736 -14.001 -7.686 1.00 0.00 H new ATOM 0 HA ASN A 41 13.778 -12.632 -5.347 1.00 0.00 H new ATOM 0 HB2 ASN A 41 14.964 -13.198 -7.619 1.00 0.00 H new ATOM 0 HB3 ASN A 41 14.107 -11.802 -8.241 1.00 0.00 H new ATOM 0 HD21 ASN A 41 17.536 -10.823 -6.953 1.00 0.00 H new ATOM 0 HD22 ASN A 41 16.949 -12.057 -8.074 1.00 0.00 H new ATOM 571 N TYR A 42 11.134 -11.602 -6.608 1.00 0.00 N ATOM 572 CA TYR A 42 10.115 -10.559 -6.633 1.00 0.00 C ATOM 573 C TYR A 42 9.169 -10.694 -5.443 1.00 0.00 C ATOM 574 O TYR A 42 9.147 -11.721 -4.766 1.00 0.00 O ATOM 575 CB TYR A 42 9.322 -10.622 -7.939 1.00 0.00 C ATOM 576 CG TYR A 42 9.538 -11.901 -8.717 1.00 0.00 C ATOM 577 CD1 TYR A 42 10.796 -12.239 -9.201 1.00 0.00 C ATOM 578 CD2 TYR A 42 8.484 -12.770 -8.970 1.00 0.00 C ATOM 579 CE1 TYR A 42 10.998 -13.405 -9.913 1.00 0.00 C ATOM 580 CE2 TYR A 42 8.677 -13.939 -9.680 1.00 0.00 C ATOM 581 CZ TYR A 42 9.935 -14.252 -10.150 1.00 0.00 C ATOM 582 OH TYR A 42 10.131 -15.415 -10.858 1.00 0.00 O ATOM 0 H TYR A 42 10.784 -12.538 -6.812 1.00 0.00 H new ATOM 0 HA TYR A 42 10.617 -9.594 -6.568 1.00 0.00 H new ATOM 0 HB2 TYR A 42 8.260 -10.518 -7.715 1.00 0.00 H new ATOM 0 HB3 TYR A 42 9.601 -9.774 -8.565 1.00 0.00 H new ATOM 0 HD1 TYR A 42 11.630 -11.578 -9.017 1.00 0.00 H new ATOM 0 HD2 TYR A 42 7.497 -12.527 -8.605 1.00 0.00 H new ATOM 0 HE1 TYR A 42 11.982 -13.652 -10.282 1.00 0.00 H new ATOM 0 HE2 TYR A 42 7.847 -14.604 -9.866 1.00 0.00 H new ATOM 0 HH TYR A 42 9.282 -15.898 -10.936 1.00 0.00 H new ATOM 592 N ALA A 43 8.388 -9.647 -5.196 1.00 0.00 N ATOM 593 CA ALA A 43 7.438 -9.648 -4.091 1.00 0.00 C ATOM 594 C ALA A 43 6.538 -10.878 -4.141 1.00 0.00 C ATOM 595 O ALA A 43 6.464 -11.565 -5.160 1.00 0.00 O ATOM 596 CB ALA A 43 6.600 -8.378 -4.114 1.00 0.00 C ATOM 0 H ALA A 43 8.395 -8.788 -5.746 1.00 0.00 H new ATOM 0 HA ALA A 43 8.003 -9.681 -3.159 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.895 -8.392 -3.283 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.252 -7.510 -4.021 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.052 -8.321 -5.054 1.00 0.00 H new ATOM 602 N THR A 44 5.855 -11.152 -3.034 1.00 0.00 N ATOM 603 CA THR A 44 4.962 -12.301 -2.951 1.00 0.00 C ATOM 604 C THR A 44 3.783 -12.016 -2.027 1.00 0.00 C ATOM 605 O THR A 44 2.632 -12.288 -2.370 1.00 0.00 O ATOM 606 CB THR A 44 5.703 -13.554 -2.447 1.00 0.00 C ATOM 607 OG1 THR A 44 6.501 -13.225 -1.305 1.00 0.00 O ATOM 608 CG2 THR A 44 6.587 -14.135 -3.540 1.00 0.00 C ATOM 0 H THR A 44 5.903 -10.593 -2.182 1.00 0.00 H new ATOM 0 HA THR A 44 4.593 -12.487 -3.960 1.00 0.00 H new ATOM 0 HB THR A 44 4.960 -14.301 -2.167 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.552 -12.251 -1.211 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.100 -15.019 -3.161 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.972 -14.411 -4.397 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.323 -13.392 -3.846 1.00 0.00 H new ATOM 616 N THR A 45 4.077 -11.465 -0.854 1.00 0.00 N ATOM 617 CA THR A 45 3.042 -11.143 0.120 1.00 0.00 C ATOM 618 C THR A 45 3.149 -9.692 0.578 1.00 0.00 C ATOM 619 O THR A 45 4.248 -9.171 0.768 1.00 0.00 O ATOM 620 CB THR A 45 3.122 -12.065 1.351 1.00 0.00 C ATOM 621 OG1 THR A 45 2.778 -13.405 0.983 1.00 0.00 O ATOM 622 CG2 THR A 45 2.189 -11.581 2.451 1.00 0.00 C ATOM 0 H THR A 45 5.024 -11.232 -0.555 1.00 0.00 H new ATOM 0 HA THR A 45 2.084 -11.295 -0.377 1.00 0.00 H new ATOM 0 HB THR A 45 4.145 -12.043 1.728 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.833 -13.985 1.771 1.00 0.00 H new ATOM 0 HG21 THR A 45 2.263 -12.248 3.310 1.00 0.00 H new ATOM 0 HG22 THR A 45 2.472 -10.572 2.750 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.163 -11.576 2.082 1.00 0.00 H new ATOM 630 N VAL A 46 2.001 -9.046 0.754 1.00 0.00 N ATOM 631 CA VAL A 46 1.966 -7.655 1.191 1.00 0.00 C ATOM 632 C VAL A 46 0.787 -7.402 2.123 1.00 0.00 C ATOM 633 O VAL A 46 -0.331 -7.842 1.858 1.00 0.00 O ATOM 634 CB VAL A 46 1.876 -6.692 -0.007 1.00 0.00 C ATOM 635 CG1 VAL A 46 2.136 -5.261 0.437 1.00 0.00 C ATOM 636 CG2 VAL A 46 2.853 -7.106 -1.098 1.00 0.00 C ATOM 0 H VAL A 46 1.083 -9.463 0.601 1.00 0.00 H new ATOM 0 HA VAL A 46 2.896 -7.468 1.728 1.00 0.00 H new ATOM 0 HB VAL A 46 0.867 -6.742 -0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 46 2.068 -4.595 -0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 46 1.394 -4.970 1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.133 -5.191 0.873 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.776 -6.414 -1.937 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.869 -7.086 -0.703 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.615 -8.115 -1.436 1.00 0.00 H new ATOM 646 N GLN A 47 1.045 -6.688 3.214 1.00 0.00 N ATOM 647 CA GLN A 47 0.003 -6.376 4.186 1.00 0.00 C ATOM 648 C GLN A 47 0.168 -4.958 4.723 1.00 0.00 C ATOM 649 O GLN A 47 1.272 -4.415 4.744 1.00 0.00 O ATOM 650 CB GLN A 47 0.036 -7.379 5.341 1.00 0.00 C ATOM 651 CG GLN A 47 -0.908 -8.555 5.152 1.00 0.00 C ATOM 652 CD GLN A 47 -1.388 -9.135 6.468 1.00 0.00 C ATOM 653 OE1 GLN A 47 -2.590 -9.236 6.713 1.00 0.00 O ATOM 654 NE2 GLN A 47 -0.448 -9.519 7.324 1.00 0.00 N ATOM 0 H GLN A 47 1.965 -6.315 3.447 1.00 0.00 H new ATOM 0 HA GLN A 47 -0.961 -6.445 3.683 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.053 -7.755 5.456 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.220 -6.863 6.267 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.769 -8.234 4.565 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -0.403 -9.333 4.579 1.00 0.00 H new ATOM 0 HE21 GLN A 47 0.537 -9.417 7.079 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -0.711 -9.916 8.226 1.00 0.00 H new ATOM 663 N VAL A 48 -0.939 -4.363 5.158 1.00 0.00 N ATOM 664 CA VAL A 48 -0.918 -3.008 5.696 1.00 0.00 C ATOM 665 C VAL A 48 -0.531 -3.009 7.171 1.00 0.00 C ATOM 666 O VAL A 48 -1.326 -3.387 8.032 1.00 0.00 O ATOM 667 CB VAL A 48 -2.286 -2.319 5.535 1.00 0.00 C ATOM 668 CG1 VAL A 48 -2.139 -0.809 5.647 1.00 0.00 C ATOM 669 CG2 VAL A 48 -2.923 -2.704 4.209 1.00 0.00 C ATOM 0 H VAL A 48 -1.861 -4.798 5.148 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.172 -2.453 5.128 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.941 -2.657 6.338 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.115 -0.339 5.531 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.728 -0.555 6.624 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.468 -0.450 4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.889 -2.208 4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.273 -2.396 3.390 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.064 -3.784 4.173 1.00 0.00 H new ATOM 679 N LYS A 49 0.695 -2.583 7.456 1.00 0.00 N ATOM 680 CA LYS A 49 1.188 -2.532 8.827 1.00 0.00 C ATOM 681 C LYS A 49 0.355 -1.570 9.669 1.00 0.00 C ATOM 682 O LYS A 49 -0.269 -1.972 10.650 1.00 0.00 O ATOM 683 CB LYS A 49 2.657 -2.103 8.846 1.00 0.00 C ATOM 684 CG LYS A 49 3.247 -2.017 10.244 1.00 0.00 C ATOM 685 CD LYS A 49 3.918 -0.675 10.484 1.00 0.00 C ATOM 686 CE LYS A 49 5.077 -0.798 11.461 1.00 0.00 C ATOM 687 NZ LYS A 49 6.393 -0.651 10.781 1.00 0.00 N ATOM 0 H LYS A 49 1.366 -2.268 6.755 1.00 0.00 H new ATOM 0 HA LYS A 49 1.102 -3.530 9.256 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.241 -2.810 8.257 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.749 -1.131 8.361 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.459 -2.168 10.982 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.973 -2.818 10.384 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.280 -0.274 9.537 1.00 0.00 H new ATOM 0 HD3 LYS A 49 3.187 0.034 10.872 1.00 0.00 H new ATOM 0 HE2 LYS A 49 4.981 -0.037 12.236 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.031 -1.767 11.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 7.157 -0.741 11.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.495 -1.393 10.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.447 0.283 10.328 1.00 0.00 H new ATOM 701 N GLU A 50 0.351 -0.300 9.278 1.00 0.00 N ATOM 702 CA GLU A 50 -0.406 0.718 9.998 1.00 0.00 C ATOM 703 C GLU A 50 -0.976 1.755 9.035 1.00 0.00 C ATOM 704 O GLU A 50 -0.580 1.822 7.871 1.00 0.00 O ATOM 705 CB GLU A 50 0.481 1.404 11.038 1.00 0.00 C ATOM 706 CG GLU A 50 0.513 0.688 12.378 1.00 0.00 C ATOM 707 CD GLU A 50 -0.493 1.250 13.364 1.00 0.00 C ATOM 708 OE1 GLU A 50 -1.680 1.370 12.996 1.00 0.00 O ATOM 709 OE2 GLU A 50 -0.093 1.570 14.503 1.00 0.00 O ATOM 0 H GLU A 50 0.863 0.049 8.468 1.00 0.00 H new ATOM 0 HA GLU A 50 -1.235 0.226 10.506 1.00 0.00 H new ATOM 0 HB2 GLU A 50 1.497 1.473 10.648 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.127 2.424 11.189 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.312 -0.372 12.224 1.00 0.00 H new ATOM 0 HG3 GLU A 50 1.514 0.764 12.803 1.00 0.00 H new ATOM 716 N VAL A 51 -1.908 2.564 9.529 1.00 0.00 N ATOM 717 CA VAL A 51 -2.532 3.599 8.713 1.00 0.00 C ATOM 718 C VAL A 51 -2.797 4.858 9.532 1.00 0.00 C ATOM 719 O VAL A 51 -3.322 4.789 10.642 1.00 0.00 O ATOM 720 CB VAL A 51 -3.858 3.109 8.102 1.00 0.00 C ATOM 721 CG1 VAL A 51 -4.370 4.102 7.070 1.00 0.00 C ATOM 722 CG2 VAL A 51 -3.681 1.730 7.484 1.00 0.00 C ATOM 0 H VAL A 51 -2.247 2.523 10.490 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.834 3.832 7.908 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.599 3.034 8.898 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.308 3.739 6.649 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.536 5.068 7.546 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.634 4.212 6.274 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.627 1.399 7.057 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.926 1.777 6.700 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.363 1.025 8.252 1.00 0.00 H new ATOM 732 N ASN A 52 -2.431 6.008 8.975 1.00 0.00 N ATOM 733 CA ASN A 52 -2.630 7.283 9.653 1.00 0.00 C ATOM 734 C ASN A 52 -3.705 8.110 8.954 1.00 0.00 C ATOM 735 O ASN A 52 -3.679 8.275 7.734 1.00 0.00 O ATOM 736 CB ASN A 52 -1.318 8.069 9.701 1.00 0.00 C ATOM 737 CG ASN A 52 -1.282 9.065 10.844 1.00 0.00 C ATOM 738 OD1 ASN A 52 -2.310 9.372 11.447 1.00 0.00 O ATOM 739 ND2 ASN A 52 -0.094 9.576 11.146 1.00 0.00 N ATOM 0 H ASN A 52 -1.995 6.083 8.056 1.00 0.00 H new ATOM 0 HA ASN A 52 -2.960 7.076 10.671 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -0.485 7.374 9.802 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -1.180 8.597 8.758 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -0.008 10.252 11.905 1.00 0.00 H new ATOM 0 HD22 ASN A 52 0.732 9.292 10.619 1.00 0.00 H new ATOM 746 N ARG A 53 -4.647 8.627 9.735 1.00 0.00 N ATOM 747 CA ARG A 53 -5.732 9.435 9.191 1.00 0.00 C ATOM 748 C ARG A 53 -5.306 10.895 9.055 1.00 0.00 C ATOM 749 O ARG A 53 -5.873 11.645 8.262 1.00 0.00 O ATOM 750 CB ARG A 53 -6.969 9.335 10.085 1.00 0.00 C ATOM 751 CG ARG A 53 -7.224 7.935 10.618 1.00 0.00 C ATOM 752 CD ARG A 53 -6.832 7.816 12.082 1.00 0.00 C ATOM 753 NE ARG A 53 -7.873 8.324 12.971 1.00 0.00 N ATOM 754 CZ ARG A 53 -9.005 7.676 13.223 1.00 0.00 C ATOM 755 NH1 ARG A 53 -9.240 6.500 12.657 1.00 0.00 N ATOM 756 NH2 ARG A 53 -9.905 8.203 14.043 1.00 0.00 N ATOM 0 H ARG A 53 -4.681 8.501 10.747 1.00 0.00 H new ATOM 0 HA ARG A 53 -5.976 9.051 8.201 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -6.855 10.019 10.926 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -7.842 9.664 9.521 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.279 7.687 10.501 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -6.659 7.212 10.029 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.631 6.771 12.319 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -5.907 8.366 12.255 1.00 0.00 H new ATOM 0 HE ARG A 53 -7.723 9.226 13.423 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.551 6.091 12.026 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -10.110 6.005 12.852 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -9.728 9.107 14.481 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -10.774 7.704 14.235 1.00 0.00 H new ATOM 770 N MET A 54 -4.305 11.289 9.835 1.00 0.00 N ATOM 771 CA MET A 54 -3.803 12.657 9.801 1.00 0.00 C ATOM 772 C MET A 54 -3.172 12.971 8.448 1.00 0.00 C ATOM 773 O MET A 54 -3.223 14.108 7.977 1.00 0.00 O ATOM 774 CB MET A 54 -2.780 12.876 10.917 1.00 0.00 C ATOM 775 CG MET A 54 -3.332 13.646 12.106 1.00 0.00 C ATOM 776 SD MET A 54 -4.147 12.577 13.307 1.00 0.00 S ATOM 777 CE MET A 54 -5.869 12.908 12.943 1.00 0.00 C ATOM 0 H MET A 54 -3.826 10.680 10.498 1.00 0.00 H new ATOM 0 HA MET A 54 -4.646 13.331 9.954 1.00 0.00 H new ATOM 0 HB2 MET A 54 -2.415 11.908 11.259 1.00 0.00 H new ATOM 0 HB3 MET A 54 -1.923 13.414 10.512 1.00 0.00 H new ATOM 0 HG2 MET A 54 -2.519 14.183 12.596 1.00 0.00 H new ATOM 0 HG3 MET A 54 -4.041 14.395 11.752 1.00 0.00 H new ATOM 0 HE1 MET A 54 -6.501 12.318 13.607 1.00 0.00 H new ATOM 0 HE2 MET A 54 -6.075 13.968 13.093 1.00 0.00 H new ATOM 0 HE3 MET A 54 -6.080 12.640 11.908 1.00 0.00 H new ATOM 787 N HIS A 55 -2.577 11.957 7.828 1.00 0.00 N ATOM 788 CA HIS A 55 -1.937 12.126 6.528 1.00 0.00 C ATOM 789 C HIS A 55 -2.892 11.751 5.399 1.00 0.00 C ATOM 790 O HIS A 55 -2.963 12.439 4.380 1.00 0.00 O ATOM 791 CB HIS A 55 -0.671 11.273 6.446 1.00 0.00 C ATOM 792 CG HIS A 55 0.389 11.678 7.423 1.00 0.00 C ATOM 793 ND1 HIS A 55 1.730 11.418 7.231 1.00 0.00 N ATOM 794 CD2 HIS A 55 0.300 12.329 8.607 1.00 0.00 C ATOM 795 CE1 HIS A 55 2.419 11.890 8.254 1.00 0.00 C ATOM 796 NE2 HIS A 55 1.575 12.448 9.103 1.00 0.00 N ATOM 0 H HIS A 55 -2.525 11.010 8.204 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.667 13.176 6.417 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.934 10.230 6.620 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -0.266 11.336 5.436 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.605 12.688 9.074 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.490 11.830 8.376 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.829 12.895 9.984 1.00 0.00 H new ATOM 805 N ILE A 56 -3.622 10.657 5.587 1.00 0.00 N ATOM 806 CA ILE A 56 -4.572 10.192 4.584 1.00 0.00 C ATOM 807 C ILE A 56 -5.898 10.937 4.696 1.00 0.00 C ATOM 808 O ILE A 56 -6.291 11.367 5.780 1.00 0.00 O ATOM 809 CB ILE A 56 -4.833 8.680 4.715 1.00 0.00 C ATOM 810 CG1 ILE A 56 -3.560 7.891 4.400 1.00 0.00 C ATOM 811 CG2 ILE A 56 -5.967 8.256 3.793 1.00 0.00 C ATOM 812 CD1 ILE A 56 -3.517 6.528 5.054 1.00 0.00 C ATOM 0 H ILE A 56 -3.574 10.076 6.424 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.126 10.393 3.610 1.00 0.00 H new ATOM 0 HB ILE A 56 -5.126 8.465 5.742 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -3.475 7.770 3.320 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -2.695 8.468 4.725 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.139 7.185 3.897 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.875 8.797 4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.700 8.482 2.761 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.587 6.026 4.787 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -3.570 6.642 6.137 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.363 5.933 4.710 1.00 0.00 H new ATOM 824 N SER A 57 -6.585 11.084 3.567 1.00 0.00 N ATOM 825 CA SER A 57 -7.867 11.779 3.538 1.00 0.00 C ATOM 826 C SER A 57 -8.873 11.101 4.463 1.00 0.00 C ATOM 827 O SER A 57 -8.825 9.894 4.697 1.00 0.00 O ATOM 828 CB SER A 57 -8.415 11.819 2.110 1.00 0.00 C ATOM 829 OG SER A 57 -7.681 10.959 1.257 1.00 0.00 O ATOM 0 H SER A 57 -6.276 10.731 2.661 1.00 0.00 H new ATOM 0 HA SER A 57 -7.709 12.799 3.888 1.00 0.00 H new ATOM 0 HB2 SER A 57 -9.465 11.525 2.112 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.370 12.839 1.729 1.00 0.00 H new ATOM 0 HG SER A 57 -7.556 11.391 0.386 1.00 0.00 H new ATOM 835 N PRO A 58 -9.808 11.897 5.002 1.00 0.00 N ATOM 836 CA PRO A 58 -10.845 11.398 5.910 1.00 0.00 C ATOM 837 C PRO A 58 -11.866 10.518 5.196 1.00 0.00 C ATOM 838 O PRO A 58 -12.686 9.861 5.835 1.00 0.00 O ATOM 839 CB PRO A 58 -11.509 12.676 6.428 1.00 0.00 C ATOM 840 CG PRO A 58 -11.263 13.689 5.363 1.00 0.00 C ATOM 841 CD PRO A 58 -9.925 13.346 4.768 1.00 0.00 C ATOM 0 HA PRO A 58 -10.429 10.769 6.697 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.576 12.528 6.595 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -11.078 12.989 7.379 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.047 13.658 4.606 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.259 14.697 5.777 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -9.885 13.586 3.705 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.118 13.897 5.250 1.00 0.00 H new ATOM 849 N ASN A 59 -11.809 10.512 3.869 1.00 0.00 N ATOM 850 CA ASN A 59 -12.729 9.713 3.068 1.00 0.00 C ATOM 851 C ASN A 59 -12.042 8.457 2.541 1.00 0.00 C ATOM 852 O ASN A 59 -12.581 7.355 2.640 1.00 0.00 O ATOM 853 CB ASN A 59 -13.272 10.539 1.900 1.00 0.00 C ATOM 854 CG ASN A 59 -14.017 11.776 2.364 1.00 0.00 C ATOM 855 OD1 ASN A 59 -13.924 12.171 3.526 1.00 0.00 O ATOM 856 ND2 ASN A 59 -14.763 12.393 1.454 1.00 0.00 N ATOM 0 H ASN A 59 -11.135 11.051 3.325 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.559 9.411 3.707 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -12.446 10.837 1.254 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -13.939 9.920 1.300 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -15.288 13.230 1.707 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -14.810 12.030 0.502 1.00 0.00 H new ATOM 863 N ASN A 60 -10.850 8.632 1.981 1.00 0.00 N ATOM 864 CA ASN A 60 -10.089 7.512 1.438 1.00 0.00 C ATOM 865 C ASN A 60 -9.701 6.532 2.541 1.00 0.00 C ATOM 866 O ASN A 60 -9.608 5.327 2.310 1.00 0.00 O ATOM 867 CB ASN A 60 -8.833 8.020 0.727 1.00 0.00 C ATOM 868 CG ASN A 60 -9.152 8.725 -0.577 1.00 0.00 C ATOM 869 OD1 ASN A 60 -10.270 8.638 -1.085 1.00 0.00 O ATOM 870 ND2 ASN A 60 -8.167 9.427 -1.126 1.00 0.00 N ATOM 0 H ASN A 60 -10.390 9.538 1.891 1.00 0.00 H new ATOM 0 HA ASN A 60 -10.720 6.990 0.719 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -8.298 8.704 1.385 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.166 7.181 0.529 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.322 9.922 -2.004 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.256 9.471 -0.669 1.00 0.00 H new ATOM 877 N ARG A 61 -9.476 7.059 3.741 1.00 0.00 N ATOM 878 CA ARG A 61 -9.098 6.231 4.880 1.00 0.00 C ATOM 879 C ARG A 61 -10.240 5.300 5.278 1.00 0.00 C ATOM 880 O ARG A 61 -10.042 4.343 6.025 1.00 0.00 O ATOM 881 CB ARG A 61 -8.704 7.110 6.068 1.00 0.00 C ATOM 882 CG ARG A 61 -9.875 7.851 6.693 1.00 0.00 C ATOM 883 CD ARG A 61 -9.534 8.358 8.085 1.00 0.00 C ATOM 884 NE ARG A 61 -10.366 7.737 9.113 1.00 0.00 N ATOM 885 CZ ARG A 61 -11.674 7.939 9.221 1.00 0.00 C ATOM 886 NH1 ARG A 61 -12.297 8.742 8.369 1.00 0.00 N ATOM 887 NH2 ARG A 61 -12.363 7.338 10.183 1.00 0.00 N ATOM 0 H ARG A 61 -9.549 8.055 3.949 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.242 5.623 4.587 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -8.231 6.488 6.828 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -7.959 7.835 5.741 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -10.157 8.691 6.058 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -10.739 7.189 6.747 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -8.484 8.156 8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -9.663 9.440 8.119 1.00 0.00 H new ATOM 0 HE ARG A 61 -9.917 7.114 9.785 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -11.771 9.206 7.628 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -13.302 8.895 8.454 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -11.888 6.720 10.841 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.368 7.494 10.265 1.00 0.00 H new ATOM 901 N ASN A 62 -11.436 5.590 4.775 1.00 0.00 N ATOM 902 CA ASN A 62 -12.610 4.780 5.080 1.00 0.00 C ATOM 903 C ASN A 62 -12.599 3.483 4.277 1.00 0.00 C ATOM 904 O ASN A 62 -13.485 2.642 4.426 1.00 0.00 O ATOM 905 CB ASN A 62 -13.888 5.567 4.783 1.00 0.00 C ATOM 906 CG ASN A 62 -14.724 4.922 3.693 1.00 0.00 C ATOM 907 OD1 ASN A 62 -15.523 4.025 3.958 1.00 0.00 O ATOM 908 ND2 ASN A 62 -14.541 5.379 2.460 1.00 0.00 N ATOM 0 H ASN A 62 -11.617 6.379 4.155 1.00 0.00 H new ATOM 0 HA ASN A 62 -12.584 4.530 6.141 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -14.482 5.647 5.693 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -13.625 6.582 4.483 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -15.074 4.984 1.685 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -13.867 6.125 2.287 1.00 0.00 H new ATOM 915 N ALA A 63 -11.590 3.329 3.425 1.00 0.00 N ATOM 916 CA ALA A 63 -11.462 2.134 2.601 1.00 0.00 C ATOM 917 C ALA A 63 -10.313 1.256 3.082 1.00 0.00 C ATOM 918 O ALA A 63 -10.438 0.032 3.143 1.00 0.00 O ATOM 919 CB ALA A 63 -11.261 2.518 1.142 1.00 0.00 C ATOM 0 H ALA A 63 -10.850 4.017 3.288 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.385 1.560 2.691 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.167 1.616 0.538 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.117 3.098 0.797 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -10.355 3.116 1.045 1.00 0.00 H new ATOM 925 N ILE A 64 -9.194 1.887 3.422 1.00 0.00 N ATOM 926 CA ILE A 64 -8.023 1.162 3.898 1.00 0.00 C ATOM 927 C ILE A 64 -7.996 1.100 5.421 1.00 0.00 C ATOM 928 O ILE A 64 -8.542 1.971 6.098 1.00 0.00 O ATOM 929 CB ILE A 64 -6.718 1.810 3.399 1.00 0.00 C ATOM 930 CG1 ILE A 64 -5.529 0.885 3.667 1.00 0.00 C ATOM 931 CG2 ILE A 64 -6.508 3.160 4.068 1.00 0.00 C ATOM 932 CD1 ILE A 64 -4.457 0.955 2.601 1.00 0.00 C ATOM 0 H ILE A 64 -9.074 2.899 3.377 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.094 0.151 3.497 1.00 0.00 H new ATOM 0 HB ILE A 64 -6.796 1.968 2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.089 1.142 4.631 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.888 -0.141 3.744 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -5.582 3.606 3.705 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.344 3.818 3.831 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -6.447 3.025 5.148 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.645 0.274 2.856 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.882 0.669 1.639 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.071 1.972 2.540 1.00 0.00 H new ATOM 944 N HIS A 65 -7.356 0.064 5.955 1.00 0.00 N ATOM 945 CA HIS A 65 -7.255 -0.111 7.400 1.00 0.00 C ATOM 946 C HIS A 65 -6.083 -1.020 7.757 1.00 0.00 C ATOM 947 O HIS A 65 -5.660 -1.866 6.969 1.00 0.00 O ATOM 948 CB HIS A 65 -8.555 -0.692 7.956 1.00 0.00 C ATOM 949 CG HIS A 65 -9.681 -0.695 6.968 1.00 0.00 C ATOM 950 ND1 HIS A 65 -9.848 -1.682 6.020 1.00 0.00 N ATOM 951 CD2 HIS A 65 -10.701 0.176 6.786 1.00 0.00 C ATOM 952 CE1 HIS A 65 -10.921 -1.417 5.296 1.00 0.00 C ATOM 953 NE2 HIS A 65 -11.457 -0.295 5.741 1.00 0.00 N ATOM 0 H HIS A 65 -6.900 -0.667 5.409 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.082 0.867 7.849 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -8.373 -1.713 8.290 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -8.854 -0.118 8.833 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -10.886 1.074 7.357 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -11.296 -2.016 4.479 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -12.296 0.149 5.369 1.00 0.00 H new ATOM 962 N PRO A 66 -5.545 -0.843 8.972 1.00 0.00 N ATOM 963 CA PRO A 66 -4.415 -1.638 9.461 1.00 0.00 C ATOM 964 C PRO A 66 -4.801 -3.087 9.736 1.00 0.00 C ATOM 965 O PRO A 66 -5.378 -3.400 10.776 1.00 0.00 O ATOM 966 CB PRO A 66 -4.022 -0.934 10.762 1.00 0.00 C ATOM 967 CG PRO A 66 -5.267 -0.253 11.215 1.00 0.00 C ATOM 968 CD PRO A 66 -5.999 0.147 9.964 1.00 0.00 C ATOM 0 HA PRO A 66 -3.609 -1.693 8.729 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -3.667 -1.647 11.506 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.217 -0.218 10.597 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.875 -0.919 11.827 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.035 0.619 11.827 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.080 0.111 10.102 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.750 1.164 9.660 1.00 0.00 H new ATOM 976 N GLY A 67 -4.479 -3.970 8.794 1.00 0.00 N ATOM 977 CA GLY A 67 -4.800 -5.376 8.954 1.00 0.00 C ATOM 978 C GLY A 67 -5.254 -6.018 7.658 1.00 0.00 C ATOM 979 O GLY A 67 -5.355 -7.242 7.566 1.00 0.00 O ATOM 0 H GLY A 67 -4.002 -3.736 7.923 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -3.924 -5.905 9.331 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -5.584 -5.484 9.703 1.00 0.00 H new ATOM 983 N ASP A 68 -5.529 -5.192 6.655 1.00 0.00 N ATOM 984 CA ASP A 68 -5.974 -5.687 5.358 1.00 0.00 C ATOM 985 C ASP A 68 -4.792 -6.175 4.527 1.00 0.00 C ATOM 986 O ASP A 68 -3.648 -6.149 4.981 1.00 0.00 O ATOM 987 CB ASP A 68 -6.728 -4.591 4.602 1.00 0.00 C ATOM 988 CG ASP A 68 -8.138 -4.394 5.122 1.00 0.00 C ATOM 989 OD1 ASP A 68 -8.299 -4.227 6.349 1.00 0.00 O ATOM 990 OD2 ASP A 68 -9.080 -4.407 4.302 1.00 0.00 O ATOM 0 H ASP A 68 -5.452 -4.177 6.715 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.646 -6.528 5.529 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -6.179 -3.653 4.685 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.767 -4.845 3.543 1.00 0.00 H new ATOM 995 N ARG A 69 -5.076 -6.619 3.307 1.00 0.00 N ATOM 996 CA ARG A 69 -4.036 -7.115 2.413 1.00 0.00 C ATOM 997 C ARG A 69 -4.168 -6.491 1.027 1.00 0.00 C ATOM 998 O ARG A 69 -5.194 -6.643 0.362 1.00 0.00 O ATOM 999 CB ARG A 69 -4.109 -8.640 2.307 1.00 0.00 C ATOM 1000 CG ARG A 69 -5.520 -9.169 2.105 1.00 0.00 C ATOM 1001 CD ARG A 69 -5.546 -10.689 2.078 1.00 0.00 C ATOM 1002 NE ARG A 69 -4.671 -11.233 1.043 1.00 0.00 N ATOM 1003 CZ ARG A 69 -4.236 -12.489 1.033 1.00 0.00 C ATOM 1004 NH1 ARG A 69 -4.595 -13.325 1.997 1.00 0.00 N ATOM 1005 NH2 ARG A 69 -3.443 -12.909 0.056 1.00 0.00 N ATOM 0 H ARG A 69 -6.017 -6.645 2.915 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.069 -6.833 2.829 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.484 -8.968 1.476 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.691 -9.079 3.213 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -6.164 -8.807 2.907 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.925 -8.780 1.171 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -5.240 -11.074 3.051 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -6.567 -11.031 1.907 1.00 0.00 H new ATOM 0 HE ARG A 69 -4.378 -10.615 0.286 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.206 -13.005 2.748 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -4.260 -14.288 1.987 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.167 -12.268 -0.688 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.109 -13.873 0.049 1.00 0.00 H new ATOM 1019 N ILE A 70 -3.124 -5.790 0.598 1.00 0.00 N ATOM 1020 CA ILE A 70 -3.123 -5.144 -0.709 1.00 0.00 C ATOM 1021 C ILE A 70 -2.999 -6.171 -1.830 1.00 0.00 C ATOM 1022 O ILE A 70 -2.150 -7.062 -1.779 1.00 0.00 O ATOM 1023 CB ILE A 70 -1.976 -4.125 -0.833 1.00 0.00 C ATOM 1024 CG1 ILE A 70 -2.119 -3.032 0.228 1.00 0.00 C ATOM 1025 CG2 ILE A 70 -1.954 -3.518 -2.227 1.00 0.00 C ATOM 1026 CD1 ILE A 70 -0.839 -2.752 0.984 1.00 0.00 C ATOM 0 H ILE A 70 -2.268 -5.655 1.136 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.074 -4.620 -0.802 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.031 -4.643 -0.669 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.456 -2.113 -0.252 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.894 -3.324 0.937 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.137 -2.800 -2.298 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.809 -4.307 -2.965 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.900 -3.012 -2.418 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.015 -1.967 1.719 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.511 -3.659 1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.067 -2.429 0.286 1.00 0.00 H new ATOM 1038 N LEU A 71 -3.849 -6.040 -2.842 1.00 0.00 N ATOM 1039 CA LEU A 71 -3.834 -6.955 -3.978 1.00 0.00 C ATOM 1040 C LEU A 71 -3.053 -6.361 -5.145 1.00 0.00 C ATOM 1041 O LEU A 71 -2.329 -7.069 -5.844 1.00 0.00 O ATOM 1042 CB LEU A 71 -5.264 -7.278 -4.417 1.00 0.00 C ATOM 1043 CG LEU A 71 -6.222 -7.718 -3.310 1.00 0.00 C ATOM 1044 CD1 LEU A 71 -7.450 -8.391 -3.904 1.00 0.00 C ATOM 1045 CD2 LEU A 71 -5.519 -8.652 -2.336 1.00 0.00 C ATOM 0 H LEU A 71 -4.558 -5.309 -2.899 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.340 -7.875 -3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.682 -6.396 -4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.223 -8.066 -5.169 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.546 -6.833 -2.763 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.121 -8.698 -3.101 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.966 -7.691 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.144 -9.267 -4.476 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.216 -8.955 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.165 -9.535 -2.869 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.671 -8.136 -1.885 1.00 0.00 H new ATOM 1057 N GLU A 72 -3.204 -5.056 -5.349 1.00 0.00 N ATOM 1058 CA GLU A 72 -2.511 -4.367 -6.431 1.00 0.00 C ATOM 1059 C GLU A 72 -2.079 -2.969 -5.998 1.00 0.00 C ATOM 1060 O GLU A 72 -2.417 -2.515 -4.905 1.00 0.00 O ATOM 1061 CB GLU A 72 -3.411 -4.275 -7.666 1.00 0.00 C ATOM 1062 CG GLU A 72 -3.713 -5.623 -8.300 1.00 0.00 C ATOM 1063 CD GLU A 72 -3.434 -5.642 -9.790 1.00 0.00 C ATOM 1064 OE1 GLU A 72 -3.679 -4.612 -10.452 1.00 0.00 O ATOM 1065 OE2 GLU A 72 -2.970 -6.687 -10.293 1.00 0.00 O ATOM 0 H GLU A 72 -3.800 -4.455 -4.779 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.620 -4.942 -6.681 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.349 -3.796 -7.387 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.933 -3.633 -8.406 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -3.114 -6.392 -7.812 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.759 -5.876 -8.127 1.00 0.00 H new ATOM 1072 N ILE A 73 -1.330 -2.293 -6.863 1.00 0.00 N ATOM 1073 CA ILE A 73 -0.852 -0.948 -6.571 1.00 0.00 C ATOM 1074 C ILE A 73 -0.686 -0.133 -7.849 1.00 0.00 C ATOM 1075 O ILE A 73 0.176 -0.427 -8.676 1.00 0.00 O ATOM 1076 CB ILE A 73 0.490 -0.978 -5.816 1.00 0.00 C ATOM 1077 CG1 ILE A 73 0.283 -1.470 -4.382 1.00 0.00 C ATOM 1078 CG2 ILE A 73 1.132 0.401 -5.821 1.00 0.00 C ATOM 1079 CD1 ILE A 73 1.544 -1.446 -3.547 1.00 0.00 C ATOM 0 H ILE A 73 -1.041 -2.655 -7.772 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.604 -0.477 -5.938 1.00 0.00 H new ATOM 0 HB ILE A 73 1.160 -1.671 -6.325 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -0.474 -0.851 -3.900 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -0.106 -2.488 -4.408 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.080 0.363 -5.284 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.310 0.716 -6.849 1.00 0.00 H new ATOM 0 HG23 ILE A 73 0.467 1.114 -5.334 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.322 -1.808 -2.543 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.297 -2.087 -4.006 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.923 -0.426 -3.490 1.00 0.00 H new ATOM 1091 N ASN A 74 -1.517 0.893 -8.003 1.00 0.00 N ATOM 1092 CA ASN A 74 -1.460 1.751 -9.181 1.00 0.00 C ATOM 1093 C ASN A 74 -1.937 1.003 -10.423 1.00 0.00 C ATOM 1094 O ASN A 74 -1.682 1.425 -11.550 1.00 0.00 O ATOM 1095 CB ASN A 74 -0.035 2.264 -9.396 1.00 0.00 C ATOM 1096 CG ASN A 74 0.086 3.756 -9.150 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -0.172 4.566 -10.041 1.00 0.00 O ATOM 1098 ND2 ASN A 74 0.480 4.125 -7.937 1.00 0.00 N ATOM 0 H ASN A 74 -2.237 1.150 -7.328 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.123 2.600 -9.014 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.644 1.732 -8.729 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.279 2.040 -10.416 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.580 5.115 -7.712 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.683 3.419 -7.230 1.00 0.00 H new ATOM 1105 N GLY A 75 -2.630 -0.111 -10.206 1.00 0.00 N ATOM 1106 CA GLY A 75 -3.132 -0.900 -11.316 1.00 0.00 C ATOM 1107 C GLY A 75 -2.157 -1.977 -11.749 1.00 0.00 C ATOM 1108 O GLY A 75 -2.047 -2.286 -12.936 1.00 0.00 O ATOM 0 H GLY A 75 -2.853 -0.481 -9.282 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.077 -1.363 -11.031 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.341 -0.243 -12.160 1.00 0.00 H new ATOM 1112 N THR A 76 -1.444 -2.550 -10.785 1.00 0.00 N ATOM 1113 CA THR A 76 -0.472 -3.597 -11.072 1.00 0.00 C ATOM 1114 C THR A 76 -0.484 -4.671 -9.991 1.00 0.00 C ATOM 1115 O THR A 76 -0.683 -4.393 -8.808 1.00 0.00 O ATOM 1116 CB THR A 76 0.952 -3.022 -11.192 1.00 0.00 C ATOM 1117 OG1 THR A 76 0.976 -1.670 -10.723 1.00 0.00 O ATOM 1118 CG2 THR A 76 1.436 -3.074 -12.634 1.00 0.00 C ATOM 0 H THR A 76 -1.522 -2.306 -9.798 1.00 0.00 H new ATOM 0 HA THR A 76 -0.759 -4.042 -12.025 1.00 0.00 H new ATOM 0 HB THR A 76 1.619 -3.629 -10.579 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.626 -1.635 -9.808 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.444 -2.663 -12.695 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.445 -4.108 -12.978 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.767 -2.488 -13.264 1.00 0.00 H new ATOM 1126 N PRO A 77 -0.266 -5.929 -10.403 1.00 0.00 N ATOM 1127 CA PRO A 77 -0.247 -7.071 -9.483 1.00 0.00 C ATOM 1128 C PRO A 77 0.972 -7.056 -8.567 1.00 0.00 C ATOM 1129 O PRO A 77 2.103 -6.886 -9.023 1.00 0.00 O ATOM 1130 CB PRO A 77 -0.196 -8.280 -10.421 1.00 0.00 C ATOM 1131 CG PRO A 77 0.426 -7.763 -11.672 1.00 0.00 C ATOM 1132 CD PRO A 77 -0.022 -6.333 -11.797 1.00 0.00 C ATOM 0 HA PRO A 77 -1.107 -7.070 -8.813 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.393 -9.090 -9.991 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.193 -8.677 -10.610 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.513 -7.829 -11.623 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.110 -8.348 -12.536 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.741 -5.713 -12.267 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.923 -6.246 -12.404 1.00 0.00 H new ATOM 1140 N VAL A 78 0.734 -7.235 -7.271 1.00 0.00 N ATOM 1141 CA VAL A 78 1.813 -7.244 -6.290 1.00 0.00 C ATOM 1142 C VAL A 78 2.403 -8.641 -6.134 1.00 0.00 C ATOM 1143 O VAL A 78 3.442 -8.820 -5.499 1.00 0.00 O ATOM 1144 CB VAL A 78 1.326 -6.748 -4.916 1.00 0.00 C ATOM 1145 CG1 VAL A 78 0.625 -5.405 -5.050 1.00 0.00 C ATOM 1146 CG2 VAL A 78 0.406 -7.777 -4.274 1.00 0.00 C ATOM 0 H VAL A 78 -0.196 -7.376 -6.876 1.00 0.00 H new ATOM 0 HA VAL A 78 2.583 -6.567 -6.660 1.00 0.00 H new ATOM 0 HB VAL A 78 2.193 -6.615 -4.269 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.288 -5.071 -4.069 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.318 -4.673 -5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.234 -5.508 -5.713 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.071 -7.410 -3.304 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.458 -7.944 -4.917 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.946 -8.715 -4.141 1.00 0.00 H new ATOM 1156 N ARG A 79 1.733 -9.629 -6.719 1.00 0.00 N ATOM 1157 CA ARG A 79 2.190 -11.011 -6.645 1.00 0.00 C ATOM 1158 C ARG A 79 3.277 -11.280 -7.681 1.00 0.00 C ATOM 1159 O ARG A 79 3.898 -12.344 -7.684 1.00 0.00 O ATOM 1160 CB ARG A 79 1.018 -11.971 -6.858 1.00 0.00 C ATOM 1161 CG ARG A 79 0.336 -11.808 -8.207 1.00 0.00 C ATOM 1162 CD ARG A 79 -1.106 -12.288 -8.162 1.00 0.00 C ATOM 1163 NE ARG A 79 -1.200 -13.717 -7.877 1.00 0.00 N ATOM 1164 CZ ARG A 79 -2.317 -14.422 -8.011 1.00 0.00 C ATOM 1165 NH1 ARG A 79 -3.431 -13.833 -8.425 1.00 0.00 N ATOM 1166 NH2 ARG A 79 -2.323 -15.719 -7.731 1.00 0.00 N ATOM 0 H ARG A 79 0.872 -9.498 -7.249 1.00 0.00 H new ATOM 0 HA ARG A 79 2.609 -11.176 -5.652 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.377 -12.996 -6.763 1.00 0.00 H new ATOM 0 HB3 ARG A 79 0.284 -11.816 -6.068 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.363 -10.760 -8.506 1.00 0.00 H new ATOM 0 HG3 ARG A 79 0.884 -12.369 -8.964 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.650 -11.730 -7.400 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -1.588 -12.077 -9.116 1.00 0.00 H new ATOM 0 HE ARG A 79 -0.361 -14.201 -7.557 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -3.431 -12.836 -8.641 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -4.288 -14.377 -8.527 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -1.469 -16.176 -7.412 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -3.182 -16.259 -7.834 1.00 0.00 H new ATOM 1180 N THR A 80 3.502 -10.310 -8.561 1.00 0.00 N ATOM 1181 CA THR A 80 4.512 -10.442 -9.604 1.00 0.00 C ATOM 1182 C THR A 80 5.510 -9.291 -9.552 1.00 0.00 C ATOM 1183 O THR A 80 6.702 -9.477 -9.800 1.00 0.00 O ATOM 1184 CB THR A 80 3.872 -10.488 -11.004 1.00 0.00 C ATOM 1185 OG1 THR A 80 3.206 -9.251 -11.279 1.00 0.00 O ATOM 1186 CG2 THR A 80 2.880 -11.637 -11.107 1.00 0.00 C ATOM 0 H THR A 80 2.998 -9.423 -8.572 1.00 0.00 H new ATOM 0 HA THR A 80 5.034 -11.381 -9.420 1.00 0.00 H new ATOM 0 HB THR A 80 4.664 -10.645 -11.737 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.085 -9.153 -12.246 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.440 -11.650 -12.104 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.395 -12.580 -10.925 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.092 -11.505 -10.365 1.00 0.00 H new ATOM 1194 N LEU A 81 5.017 -8.101 -9.227 1.00 0.00 N ATOM 1195 CA LEU A 81 5.866 -6.918 -9.142 1.00 0.00 C ATOM 1196 C LEU A 81 7.144 -7.220 -8.366 1.00 0.00 C ATOM 1197 O LEU A 81 7.195 -8.164 -7.578 1.00 0.00 O ATOM 1198 CB LEU A 81 5.109 -5.769 -8.474 1.00 0.00 C ATOM 1199 CG LEU A 81 4.475 -4.745 -9.415 1.00 0.00 C ATOM 1200 CD1 LEU A 81 3.952 -3.551 -8.632 1.00 0.00 C ATOM 1201 CD2 LEU A 81 5.478 -4.296 -10.469 1.00 0.00 C ATOM 0 H LEU A 81 4.033 -7.930 -9.018 1.00 0.00 H new ATOM 0 HA LEU A 81 6.139 -6.624 -10.155 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.323 -6.193 -7.849 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.797 -5.245 -7.810 1.00 0.00 H new ATOM 0 HG LEU A 81 3.633 -5.218 -9.921 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.504 -2.833 -9.319 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.201 -3.886 -7.917 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.776 -3.077 -8.098 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.009 -3.567 -11.130 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.340 -3.841 -9.981 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.804 -5.158 -11.052 1.00 0.00 H new ATOM 1213 N ARG A 82 8.173 -6.410 -8.592 1.00 0.00 N ATOM 1214 CA ARG A 82 9.451 -6.590 -7.913 1.00 0.00 C ATOM 1215 C ARG A 82 9.378 -6.086 -6.474 1.00 0.00 C ATOM 1216 O ARG A 82 8.584 -5.202 -6.155 1.00 0.00 O ATOM 1217 CB ARG A 82 10.561 -5.855 -8.666 1.00 0.00 C ATOM 1218 CG ARG A 82 10.612 -6.184 -10.149 1.00 0.00 C ATOM 1219 CD ARG A 82 11.991 -5.918 -10.731 1.00 0.00 C ATOM 1220 NE ARG A 82 11.918 -5.354 -12.077 1.00 0.00 N ATOM 1221 CZ ARG A 82 12.986 -5.035 -12.799 1.00 0.00 C ATOM 1222 NH1 ARG A 82 14.203 -5.224 -12.309 1.00 0.00 N ATOM 1223 NH2 ARG A 82 12.837 -4.527 -14.016 1.00 0.00 N ATOM 0 H ARG A 82 8.147 -5.623 -9.240 1.00 0.00 H new ATOM 0 HA ARG A 82 9.677 -7.656 -7.896 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.421 -4.781 -8.545 1.00 0.00 H new ATOM 0 HB3 ARG A 82 11.521 -6.104 -8.214 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.348 -7.231 -10.300 1.00 0.00 H new ATOM 0 HG3 ARG A 82 9.870 -5.588 -10.681 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.533 -5.233 -10.080 1.00 0.00 H new ATOM 0 HD3 ARG A 82 12.559 -6.848 -10.758 1.00 0.00 H new ATOM 0 HE ARG A 82 10.996 -5.197 -12.484 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.321 -5.616 -11.375 1.00 0.00 H new ATOM 0 HH12 ARG A 82 15.021 -4.978 -12.866 1.00 0.00 H new ATOM 0 HH21 ARG A 82 11.902 -4.381 -14.397 1.00 0.00 H new ATOM 0 HH22 ARG A 82 13.657 -4.282 -14.570 1.00 0.00 H new ATOM 1237 N VAL A 83 10.211 -6.657 -5.610 1.00 0.00 N ATOM 1238 CA VAL A 83 10.242 -6.266 -4.206 1.00 0.00 C ATOM 1239 C VAL A 83 10.530 -4.776 -4.056 1.00 0.00 C ATOM 1240 O VAL A 83 9.938 -4.101 -3.214 1.00 0.00 O ATOM 1241 CB VAL A 83 11.302 -7.063 -3.424 1.00 0.00 C ATOM 1242 CG1 VAL A 83 11.315 -6.644 -1.962 1.00 0.00 C ATOM 1243 CG2 VAL A 83 11.049 -8.557 -3.556 1.00 0.00 C ATOM 0 H VAL A 83 10.873 -7.392 -5.858 1.00 0.00 H new ATOM 0 HA VAL A 83 9.257 -6.486 -3.795 1.00 0.00 H new ATOM 0 HB VAL A 83 12.282 -6.844 -3.848 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.070 -7.218 -1.426 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.548 -5.582 -1.890 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.336 -6.831 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.807 -9.105 -2.997 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.062 -8.795 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 83 11.096 -8.842 -4.607 1.00 0.00 H new ATOM 1253 N GLU A 84 11.442 -4.269 -4.880 1.00 0.00 N ATOM 1254 CA GLU A 84 11.808 -2.859 -4.839 1.00 0.00 C ATOM 1255 C GLU A 84 10.739 -1.999 -5.507 1.00 0.00 C ATOM 1256 O GLU A 84 10.662 -0.794 -5.273 1.00 0.00 O ATOM 1257 CB GLU A 84 13.157 -2.639 -5.526 1.00 0.00 C ATOM 1258 CG GLU A 84 13.054 -2.478 -7.033 1.00 0.00 C ATOM 1259 CD GLU A 84 14.391 -2.171 -7.680 1.00 0.00 C ATOM 1260 OE1 GLU A 84 15.411 -2.734 -7.231 1.00 0.00 O ATOM 1261 OE2 GLU A 84 14.416 -1.368 -8.636 1.00 0.00 O ATOM 0 H GLU A 84 11.940 -4.814 -5.584 1.00 0.00 H new ATOM 0 HA GLU A 84 11.888 -2.562 -3.793 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.629 -1.751 -5.106 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.810 -3.482 -5.303 1.00 0.00 H new ATOM 0 HG2 GLU A 84 12.647 -3.392 -7.465 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.351 -1.677 -7.262 1.00 0.00 H new ATOM 1268 N GLU A 85 9.917 -2.629 -6.340 1.00 0.00 N ATOM 1269 CA GLU A 85 8.853 -1.922 -7.044 1.00 0.00 C ATOM 1270 C GLU A 85 7.656 -1.687 -6.126 1.00 0.00 C ATOM 1271 O GLU A 85 7.161 -0.567 -6.008 1.00 0.00 O ATOM 1272 CB GLU A 85 8.415 -2.711 -8.279 1.00 0.00 C ATOM 1273 CG GLU A 85 9.085 -2.252 -9.563 1.00 0.00 C ATOM 1274 CD GLU A 85 8.151 -1.460 -10.457 1.00 0.00 C ATOM 1275 OE1 GLU A 85 7.309 -0.711 -9.919 1.00 0.00 O ATOM 1276 OE2 GLU A 85 8.262 -1.588 -11.694 1.00 0.00 O ATOM 0 H GLU A 85 9.967 -3.627 -6.544 1.00 0.00 H new ATOM 0 HA GLU A 85 9.243 -0.954 -7.360 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.635 -3.767 -8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.334 -2.623 -8.391 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.953 -1.640 -9.317 1.00 0.00 H new ATOM 0 HG3 GLU A 85 9.453 -3.122 -10.108 1.00 0.00 H new ATOM 1283 N VAL A 86 7.196 -2.753 -5.479 1.00 0.00 N ATOM 1284 CA VAL A 86 6.059 -2.665 -4.571 1.00 0.00 C ATOM 1285 C VAL A 86 6.291 -1.604 -3.501 1.00 0.00 C ATOM 1286 O VAL A 86 5.360 -0.918 -3.082 1.00 0.00 O ATOM 1287 CB VAL A 86 5.780 -4.017 -3.887 1.00 0.00 C ATOM 1288 CG1 VAL A 86 4.514 -3.939 -3.047 1.00 0.00 C ATOM 1289 CG2 VAL A 86 5.675 -5.126 -4.923 1.00 0.00 C ATOM 0 H VAL A 86 7.594 -3.688 -5.567 1.00 0.00 H new ATOM 0 HA VAL A 86 5.194 -2.386 -5.173 1.00 0.00 H new ATOM 0 HB VAL A 86 6.614 -4.248 -3.224 1.00 0.00 H new ATOM 0 HG11 VAL A 86 4.333 -4.903 -2.572 1.00 0.00 H new ATOM 0 HG12 VAL A 86 4.632 -3.173 -2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.668 -3.685 -3.686 1.00 0.00 H new ATOM 0 HG21 VAL A 86 5.478 -6.074 -4.422 1.00 0.00 H new ATOM 0 HG22 VAL A 86 4.861 -4.904 -5.613 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.611 -5.196 -5.477 1.00 0.00 H new ATOM 1299 N GLU A 87 7.539 -1.477 -3.063 1.00 0.00 N ATOM 1300 CA GLU A 87 7.893 -0.499 -2.040 1.00 0.00 C ATOM 1301 C GLU A 87 7.986 0.902 -2.636 1.00 0.00 C ATOM 1302 O GLU A 87 7.359 1.840 -2.144 1.00 0.00 O ATOM 1303 CB GLU A 87 9.223 -0.875 -1.383 1.00 0.00 C ATOM 1304 CG GLU A 87 9.067 -1.746 -0.148 1.00 0.00 C ATOM 1305 CD GLU A 87 8.687 -0.949 1.084 1.00 0.00 C ATOM 1306 OE1 GLU A 87 8.054 0.117 0.929 1.00 0.00 O ATOM 1307 OE2 GLU A 87 9.023 -1.390 2.203 1.00 0.00 O ATOM 0 H GLU A 87 8.321 -2.038 -3.400 1.00 0.00 H new ATOM 0 HA GLU A 87 7.108 -0.502 -1.284 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.843 -1.399 -2.111 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.754 0.037 -1.110 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.305 -2.503 -0.336 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.002 -2.274 0.040 1.00 0.00 H new ATOM 1314 N ASP A 88 8.772 1.036 -3.698 1.00 0.00 N ATOM 1315 CA ASP A 88 8.947 2.323 -4.363 1.00 0.00 C ATOM 1316 C ASP A 88 7.600 2.991 -4.617 1.00 0.00 C ATOM 1317 O ASP A 88 7.462 4.205 -4.476 1.00 0.00 O ATOM 1318 CB ASP A 88 9.698 2.141 -5.683 1.00 0.00 C ATOM 1319 CG ASP A 88 11.201 2.107 -5.495 1.00 0.00 C ATOM 1320 OD1 ASP A 88 11.708 2.854 -4.630 1.00 0.00 O ATOM 1321 OD2 ASP A 88 11.872 1.335 -6.211 1.00 0.00 O ATOM 0 H ASP A 88 9.298 0.270 -4.117 1.00 0.00 H new ATOM 0 HA ASP A 88 9.533 2.967 -3.707 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.373 1.215 -6.157 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.438 2.954 -6.360 1.00 0.00 H new ATOM 1326 N ALA A 89 6.609 2.189 -4.993 1.00 0.00 N ATOM 1327 CA ALA A 89 5.272 2.702 -5.266 1.00 0.00 C ATOM 1328 C ALA A 89 4.705 3.430 -4.052 1.00 0.00 C ATOM 1329 O ALA A 89 3.924 4.372 -4.191 1.00 0.00 O ATOM 1330 CB ALA A 89 4.347 1.569 -5.684 1.00 0.00 C ATOM 0 H ALA A 89 6.707 1.181 -5.115 1.00 0.00 H new ATOM 0 HA ALA A 89 5.345 3.418 -6.085 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.352 1.967 -5.885 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.737 1.095 -6.585 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.288 0.833 -4.883 1.00 0.00 H new ATOM 1336 N ILE A 90 5.103 2.988 -2.864 1.00 0.00 N ATOM 1337 CA ILE A 90 4.634 3.599 -1.626 1.00 0.00 C ATOM 1338 C ILE A 90 5.449 4.842 -1.284 1.00 0.00 C ATOM 1339 O ILE A 90 4.975 5.733 -0.578 1.00 0.00 O ATOM 1340 CB ILE A 90 4.708 2.610 -0.448 1.00 0.00 C ATOM 1341 CG1 ILE A 90 4.300 1.208 -0.904 1.00 0.00 C ATOM 1342 CG2 ILE A 90 3.819 3.081 0.694 1.00 0.00 C ATOM 1343 CD1 ILE A 90 2.933 1.155 -1.548 1.00 0.00 C ATOM 0 H ILE A 90 5.749 2.209 -2.732 1.00 0.00 H new ATOM 0 HA ILE A 90 3.594 3.882 -1.787 1.00 0.00 H new ATOM 0 HB ILE A 90 5.737 2.570 -0.090 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.041 0.835 -1.612 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.314 0.537 -0.045 1.00 0.00 H new ATOM 0 HG21 ILE A 90 3.881 2.372 1.520 1.00 0.00 H new ATOM 0 HG22 ILE A 90 4.151 4.063 1.032 1.00 0.00 H new ATOM 0 HG23 ILE A 90 2.787 3.146 0.349 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.711 0.130 -1.846 1.00 0.00 H new ATOM 0 HD12 ILE A 90 2.182 1.497 -0.836 1.00 0.00 H new ATOM 0 HD13 ILE A 90 2.920 1.800 -2.427 1.00 0.00 H new ATOM 1355 N LYS A 91 6.676 4.897 -1.790 1.00 0.00 N ATOM 1356 CA LYS A 91 7.557 6.032 -1.542 1.00 0.00 C ATOM 1357 C LYS A 91 7.512 7.020 -2.704 1.00 0.00 C ATOM 1358 O LYS A 91 8.232 8.018 -2.708 1.00 0.00 O ATOM 1359 CB LYS A 91 8.993 5.551 -1.322 1.00 0.00 C ATOM 1360 CG LYS A 91 9.083 4.198 -0.638 1.00 0.00 C ATOM 1361 CD LYS A 91 10.477 3.943 -0.089 1.00 0.00 C ATOM 1362 CE LYS A 91 10.885 2.488 -0.258 1.00 0.00 C ATOM 1363 NZ LYS A 91 10.130 1.590 0.659 1.00 0.00 N ATOM 0 H LYS A 91 7.084 4.168 -2.375 1.00 0.00 H new ATOM 0 HA LYS A 91 7.209 6.540 -0.643 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.501 5.496 -2.285 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.526 6.288 -0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 91 8.357 4.150 0.174 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.821 3.413 -1.347 1.00 0.00 H new ATOM 0 HD2 LYS A 91 11.194 4.585 -0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.508 4.210 0.967 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.714 2.180 -1.290 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.953 2.386 -0.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 10.692 0.736 0.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 9.941 2.086 1.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 9.229 1.320 0.216 1.00 0.00 H new ATOM 1377 N GLN A 92 6.662 6.734 -3.685 1.00 0.00 N ATOM 1378 CA GLN A 92 6.524 7.599 -4.851 1.00 0.00 C ATOM 1379 C GLN A 92 5.603 8.777 -4.549 1.00 0.00 C ATOM 1380 O GLN A 92 4.582 8.966 -5.211 1.00 0.00 O ATOM 1381 CB GLN A 92 5.983 6.804 -6.040 1.00 0.00 C ATOM 1382 CG GLN A 92 4.513 6.440 -5.910 1.00 0.00 C ATOM 1383 CD GLN A 92 3.630 7.226 -6.859 1.00 0.00 C ATOM 1384 OE1 GLN A 92 4.096 7.737 -7.878 1.00 0.00 O ATOM 1385 NE2 GLN A 92 2.348 7.328 -6.529 1.00 0.00 N ATOM 0 H GLN A 92 6.059 5.911 -3.696 1.00 0.00 H new ATOM 0 HA GLN A 92 7.510 7.989 -5.102 1.00 0.00 H new ATOM 0 HB2 GLN A 92 6.125 7.386 -6.951 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.567 5.890 -6.151 1.00 0.00 H new ATOM 0 HG2 GLN A 92 4.388 5.374 -6.103 1.00 0.00 H new ATOM 0 HG3 GLN A 92 4.188 6.619 -4.885 1.00 0.00 H new ATOM 0 HE21 GLN A 92 2.005 6.889 -5.675 1.00 0.00 H new ATOM 0 HE22 GLN A 92 1.706 7.846 -7.130 1.00 0.00 H new ATOM 1394 N THR A 93 5.970 9.567 -3.545 1.00 0.00 N ATOM 1395 CA THR A 93 5.176 10.725 -3.155 1.00 0.00 C ATOM 1396 C THR A 93 5.251 11.824 -4.209 1.00 0.00 C ATOM 1397 O THR A 93 5.895 12.852 -4.003 1.00 0.00 O ATOM 1398 CB THR A 93 5.642 11.295 -1.802 1.00 0.00 C ATOM 1399 OG1 THR A 93 7.071 11.256 -1.719 1.00 0.00 O ATOM 1400 CG2 THR A 93 5.040 10.509 -0.647 1.00 0.00 C ATOM 0 H THR A 93 6.812 9.426 -2.987 1.00 0.00 H new ATOM 0 HA THR A 93 4.145 10.384 -3.062 1.00 0.00 H new ATOM 0 HB THR A 93 5.303 12.329 -1.733 1.00 0.00 H new ATOM 0 HG1 THR A 93 7.435 12.143 -1.921 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.384 10.930 0.298 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.953 10.566 -0.696 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.352 9.467 -0.714 1.00 0.00 H new ATOM 1408 N SER A 94 4.589 11.599 -5.340 1.00 0.00 N ATOM 1409 CA SER A 94 4.583 12.569 -6.428 1.00 0.00 C ATOM 1410 C SER A 94 3.179 12.734 -7.002 1.00 0.00 C ATOM 1411 O SER A 94 2.686 13.851 -7.152 1.00 0.00 O ATOM 1412 CB SER A 94 5.550 12.135 -7.532 1.00 0.00 C ATOM 1413 OG SER A 94 5.987 10.802 -7.331 1.00 0.00 O ATOM 0 H SER A 94 4.050 10.753 -5.526 1.00 0.00 H new ATOM 0 HA SER A 94 4.908 13.529 -6.027 1.00 0.00 H new ATOM 0 HB2 SER A 94 5.060 12.218 -8.502 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.410 12.804 -7.550 1.00 0.00 H new ATOM 0 HG SER A 94 6.602 10.548 -8.050 1.00 0.00 H new ATOM 1419 N GLN A 95 2.542 11.612 -7.322 1.00 0.00 N ATOM 1420 CA GLN A 95 1.195 11.631 -7.880 1.00 0.00 C ATOM 1421 C GLN A 95 0.233 10.833 -7.007 1.00 0.00 C ATOM 1422 O GLN A 95 0.606 10.339 -5.943 1.00 0.00 O ATOM 1423 CB GLN A 95 1.202 11.066 -9.302 1.00 0.00 C ATOM 1424 CG GLN A 95 2.302 11.640 -10.179 1.00 0.00 C ATOM 1425 CD GLN A 95 1.958 13.011 -10.726 1.00 0.00 C ATOM 1426 OE1 GLN A 95 2.742 13.954 -10.610 1.00 0.00 O ATOM 1427 NE2 GLN A 95 0.779 13.131 -11.327 1.00 0.00 N ATOM 0 H GLN A 95 2.937 10.679 -7.204 1.00 0.00 H new ATOM 0 HA GLN A 95 0.855 12.666 -7.910 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.316 9.983 -9.253 1.00 0.00 H new ATOM 0 HB3 GLN A 95 0.237 11.265 -9.768 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.225 11.704 -9.602 1.00 0.00 H new ATOM 0 HG3 GLN A 95 2.492 10.959 -11.009 1.00 0.00 H new ATOM 0 HE21 GLN A 95 0.160 12.324 -11.401 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.493 14.030 -11.714 1.00 0.00 H new ATOM 1436 N THR A 96 -1.010 10.710 -7.464 1.00 0.00 N ATOM 1437 CA THR A 96 -2.027 9.973 -6.725 1.00 0.00 C ATOM 1438 C THR A 96 -1.633 8.509 -6.558 1.00 0.00 C ATOM 1439 O THR A 96 -1.311 7.828 -7.532 1.00 0.00 O ATOM 1440 CB THR A 96 -3.396 10.047 -7.426 1.00 0.00 C ATOM 1441 OG1 THR A 96 -3.341 10.982 -8.510 1.00 0.00 O ATOM 1442 CG2 THR A 96 -4.484 10.462 -6.447 1.00 0.00 C ATOM 0 H THR A 96 -1.336 11.112 -8.343 1.00 0.00 H new ATOM 0 HA THR A 96 -2.104 10.440 -5.743 1.00 0.00 H new ATOM 0 HB THR A 96 -3.636 9.056 -7.812 1.00 0.00 H new ATOM 0 HG1 THR A 96 -4.215 11.022 -8.952 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.442 10.507 -6.965 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.543 9.733 -5.638 1.00 0.00 H new ATOM 0 HG23 THR A 96 -4.248 11.443 -6.035 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.661 8.032 -5.319 1.00 0.00 N ATOM 1451 CA LEU A 97 -1.308 6.647 -5.024 1.00 0.00 C ATOM 1452 C LEU A 97 -2.558 5.793 -4.844 1.00 0.00 C ATOM 1453 O LEU A 97 -3.322 5.985 -3.898 1.00 0.00 O ATOM 1454 CB LEU A 97 -0.443 6.578 -3.764 1.00 0.00 C ATOM 1455 CG LEU A 97 -0.343 5.208 -3.093 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -0.015 4.134 -4.119 1.00 0.00 C ATOM 1457 CD2 LEU A 97 0.703 5.230 -1.988 1.00 0.00 C ATOM 0 H LEU A 97 -1.924 8.583 -4.502 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.741 6.255 -5.868 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.563 6.909 -4.020 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.837 7.288 -3.037 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.309 4.972 -2.646 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.052 3.166 -3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.800 4.101 -4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.938 4.365 -4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.760 4.246 -1.522 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.674 5.488 -2.411 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.425 5.971 -1.239 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.760 4.848 -5.756 1.00 0.00 N ATOM 1470 CA GLN A 98 -3.917 3.963 -5.696 1.00 0.00 C ATOM 1471 C GLN A 98 -3.574 2.667 -4.968 1.00 0.00 C ATOM 1472 O GLN A 98 -2.442 2.186 -5.034 1.00 0.00 O ATOM 1473 CB GLN A 98 -4.420 3.651 -7.107 1.00 0.00 C ATOM 1474 CG GLN A 98 -5.922 3.427 -7.181 1.00 0.00 C ATOM 1475 CD GLN A 98 -6.299 2.304 -8.127 1.00 0.00 C ATOM 1476 OE1 GLN A 98 -5.744 1.207 -8.059 1.00 0.00 O ATOM 1477 NE2 GLN A 98 -7.246 2.573 -9.018 1.00 0.00 N ATOM 0 H GLN A 98 -2.137 4.675 -6.545 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.705 4.473 -5.141 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -4.150 4.473 -7.770 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.910 2.762 -7.478 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -6.301 3.200 -6.185 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -6.407 4.348 -7.505 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -7.679 3.496 -9.039 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -7.540 1.856 -9.682 1.00 0.00 H new ATOM 1486 N LEU A 99 -4.559 2.107 -4.273 1.00 0.00 N ATOM 1487 CA LEU A 99 -4.362 0.866 -3.531 1.00 0.00 C ATOM 1488 C LEU A 99 -5.615 -0.002 -3.580 1.00 0.00 C ATOM 1489 O LEU A 99 -6.736 0.501 -3.495 1.00 0.00 O ATOM 1490 CB LEU A 99 -3.995 1.171 -2.078 1.00 0.00 C ATOM 1491 CG LEU A 99 -2.710 1.971 -1.864 1.00 0.00 C ATOM 1492 CD1 LEU A 99 -2.632 2.484 -0.434 1.00 0.00 C ATOM 1493 CD2 LEU A 99 -1.491 1.122 -2.194 1.00 0.00 C ATOM 0 H LEU A 99 -5.501 2.492 -4.208 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.544 0.317 -3.998 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.820 1.719 -1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.905 0.227 -1.541 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.724 2.829 -2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.711 3.051 -0.301 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.487 3.129 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.642 1.640 0.256 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.586 1.708 -2.036 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.473 0.245 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.540 0.804 -3.235 1.00 0.00 H new ATOM 1505 N LEU A 100 -5.418 -1.309 -3.716 1.00 0.00 N ATOM 1506 CA LEU A 100 -6.532 -2.249 -3.774 1.00 0.00 C ATOM 1507 C LEU A 100 -6.704 -2.972 -2.442 1.00 0.00 C ATOM 1508 O LEU A 100 -5.744 -3.146 -1.691 1.00 0.00 O ATOM 1509 CB LEU A 100 -6.309 -3.266 -4.894 1.00 0.00 C ATOM 1510 CG LEU A 100 -7.561 -3.965 -5.425 1.00 0.00 C ATOM 1511 CD1 LEU A 100 -8.064 -4.992 -4.421 1.00 0.00 C ATOM 1512 CD2 LEU A 100 -8.648 -2.948 -5.739 1.00 0.00 C ATOM 0 H LEU A 100 -4.497 -1.742 -3.788 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.441 -1.684 -3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.820 -2.759 -5.726 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.617 -4.027 -4.534 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.300 -4.484 -6.347 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.955 -5.480 -4.815 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -7.290 -5.739 -4.245 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.308 -4.494 -3.482 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.531 -3.464 -6.116 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.907 -2.400 -4.833 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.286 -2.250 -6.494 1.00 0.00 H new ATOM 1524 N ILE A 101 -7.931 -3.392 -2.157 1.00 0.00 N ATOM 1525 CA ILE A 101 -8.228 -4.100 -0.918 1.00 0.00 C ATOM 1526 C ILE A 101 -9.183 -5.263 -1.163 1.00 0.00 C ATOM 1527 O ILE A 101 -10.096 -5.166 -1.983 1.00 0.00 O ATOM 1528 CB ILE A 101 -8.842 -3.159 0.135 1.00 0.00 C ATOM 1529 CG1 ILE A 101 -8.325 -1.732 -0.061 1.00 0.00 C ATOM 1530 CG2 ILE A 101 -8.527 -3.655 1.538 1.00 0.00 C ATOM 1531 CD1 ILE A 101 -6.839 -1.590 0.184 1.00 0.00 C ATOM 0 H ILE A 101 -8.736 -3.254 -2.767 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.281 -4.485 -0.541 1.00 0.00 H new ATOM 0 HB ILE A 101 -9.925 -3.154 0.008 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -8.550 -1.409 -1.077 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.862 -1.064 0.612 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.968 -2.979 2.270 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.940 -4.655 1.672 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.447 -3.687 1.678 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.542 -0.553 0.027 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.610 -1.882 1.209 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -6.293 -2.232 -0.507 1.00 0.00 H new ATOM 1543 N GLU A 102 -8.967 -6.361 -0.446 1.00 0.00 N ATOM 1544 CA GLU A 102 -9.810 -7.542 -0.586 1.00 0.00 C ATOM 1545 C GLU A 102 -10.757 -7.679 0.603 1.00 0.00 C ATOM 1546 O GLU A 102 -10.328 -7.663 1.757 1.00 0.00 O ATOM 1547 CB GLU A 102 -8.948 -8.800 -0.713 1.00 0.00 C ATOM 1548 CG GLU A 102 -9.681 -10.080 -0.349 1.00 0.00 C ATOM 1549 CD GLU A 102 -8.828 -11.318 -0.548 1.00 0.00 C ATOM 1550 OE1 GLU A 102 -8.634 -11.722 -1.714 1.00 0.00 O ATOM 1551 OE2 GLU A 102 -8.355 -11.881 0.460 1.00 0.00 O ATOM 0 H GLU A 102 -8.216 -6.457 0.237 1.00 0.00 H new ATOM 0 HA GLU A 102 -10.406 -7.426 -1.491 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -8.584 -8.879 -1.737 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -8.073 -8.697 -0.071 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -10.001 -10.027 0.692 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -10.582 -10.163 -0.956 1.00 0.00 H new ATOM 1558 N HIS A 103 -12.047 -7.814 0.313 1.00 0.00 N ATOM 1559 CA HIS A 103 -13.055 -7.954 1.358 1.00 0.00 C ATOM 1560 C HIS A 103 -13.938 -9.172 1.102 1.00 0.00 C ATOM 1561 O HIS A 103 -14.720 -9.194 0.151 1.00 0.00 O ATOM 1562 CB HIS A 103 -13.916 -6.693 1.437 1.00 0.00 C ATOM 1563 CG HIS A 103 -14.142 -6.209 2.837 1.00 0.00 C ATOM 1564 ND1 HIS A 103 -14.686 -4.976 3.128 1.00 0.00 N ATOM 1565 CD2 HIS A 103 -13.896 -6.801 4.029 1.00 0.00 C ATOM 1566 CE1 HIS A 103 -14.763 -4.830 4.439 1.00 0.00 C ATOM 1567 NE2 HIS A 103 -14.290 -5.924 5.009 1.00 0.00 N ATOM 0 H HIS A 103 -12.419 -7.829 -0.637 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.540 -8.094 2.309 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -13.439 -5.901 0.860 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -14.881 -6.892 0.970 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -13.469 -7.781 4.181 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -15.147 -3.964 4.957 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -14.228 -6.090 6.013 1.00 0.00 H new ATOM 1576 N ASP A 104 -13.806 -10.182 1.954 1.00 0.00 N ATOM 1577 CA ASP A 104 -14.592 -11.403 1.820 1.00 0.00 C ATOM 1578 C ASP A 104 -15.837 -11.347 2.699 1.00 0.00 C ATOM 1579 O ASP A 104 -15.863 -10.690 3.740 1.00 0.00 O ATOM 1580 CB ASP A 104 -13.746 -12.622 2.191 1.00 0.00 C ATOM 1581 CG ASP A 104 -12.505 -12.749 1.329 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -12.150 -11.763 0.649 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -11.887 -13.834 1.335 1.00 0.00 O ATOM 0 H ASP A 104 -13.162 -10.180 2.745 1.00 0.00 H new ATOM 0 HA ASP A 104 -14.907 -11.491 0.780 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -13.452 -12.551 3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -14.349 -13.524 2.089 1.00 0.00 H new ATOM 1588 N PRO A 105 -16.896 -12.050 2.271 1.00 0.00 N ATOM 1589 CA PRO A 105 -18.165 -12.096 3.004 1.00 0.00 C ATOM 1590 C PRO A 105 -18.052 -12.874 4.310 1.00 0.00 C ATOM 1591 O PRO A 105 -18.676 -12.521 5.311 1.00 0.00 O ATOM 1592 CB PRO A 105 -19.109 -12.812 2.035 1.00 0.00 C ATOM 1593 CG PRO A 105 -18.214 -13.636 1.174 1.00 0.00 C ATOM 1594 CD PRO A 105 -16.936 -12.856 1.039 1.00 0.00 C ATOM 0 HA PRO A 105 -18.504 -11.102 3.294 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -19.827 -13.434 2.569 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -19.683 -12.100 1.442 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.030 -14.612 1.624 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -18.667 -13.815 0.199 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -16.070 -13.514 0.961 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -16.941 -12.228 0.148 1.00 0.00 H new ATOM 1602 N VAL A 106 -17.251 -13.935 4.295 1.00 0.00 N ATOM 1603 CA VAL A 106 -17.055 -14.763 5.479 1.00 0.00 C ATOM 1604 C VAL A 106 -15.903 -14.241 6.330 1.00 0.00 C ATOM 1605 O VAL A 106 -14.880 -13.782 5.820 1.00 0.00 O ATOM 1606 CB VAL A 106 -16.775 -16.229 5.099 1.00 0.00 C ATOM 1607 CG1 VAL A 106 -17.591 -17.172 5.971 1.00 0.00 C ATOM 1608 CG2 VAL A 106 -17.072 -16.463 3.625 1.00 0.00 C ATOM 0 H VAL A 106 -16.727 -14.241 3.475 1.00 0.00 H new ATOM 0 HA VAL A 106 -17.979 -14.715 6.055 1.00 0.00 H new ATOM 0 HB VAL A 106 -15.719 -16.435 5.271 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -17.380 -18.203 5.688 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -17.325 -17.021 7.017 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -18.653 -16.968 5.833 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -16.869 -17.504 3.374 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -18.120 -16.239 3.425 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -16.440 -15.813 3.019 1.00 0.00 H new ATOM 1618 N PRO A 107 -16.069 -14.311 7.659 1.00 0.00 N ATOM 1619 CA PRO A 107 -15.053 -13.852 8.609 1.00 0.00 C ATOM 1620 C PRO A 107 -13.819 -14.748 8.618 1.00 0.00 C ATOM 1621 O PRO A 107 -13.918 -15.957 8.409 1.00 0.00 O ATOM 1622 CB PRO A 107 -15.772 -13.920 9.959 1.00 0.00 C ATOM 1623 CG PRO A 107 -16.830 -14.952 9.772 1.00 0.00 C ATOM 1624 CD PRO A 107 -17.263 -14.846 8.336 1.00 0.00 C ATOM 0 HA PRO A 107 -14.681 -12.859 8.358 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -15.086 -14.197 10.760 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -16.203 -12.955 10.227 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -16.446 -15.948 9.991 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -17.669 -14.778 10.446 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -17.554 -15.815 7.931 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -18.120 -14.183 8.223 1.00 0.00 H new ATOM 1632 N GLN A 108 -12.658 -14.147 8.860 1.00 0.00 N ATOM 1633 CA GLN A 108 -11.406 -14.893 8.895 1.00 0.00 C ATOM 1634 C GLN A 108 -11.378 -15.855 10.078 1.00 0.00 C ATOM 1635 O GLN A 108 -10.885 -15.517 11.154 1.00 0.00 O ATOM 1636 CB GLN A 108 -10.218 -13.932 8.976 1.00 0.00 C ATOM 1637 CG GLN A 108 -8.868 -14.631 8.962 1.00 0.00 C ATOM 1638 CD GLN A 108 -7.708 -13.657 8.911 1.00 0.00 C ATOM 1639 OE1 GLN A 108 -7.198 -13.226 9.946 1.00 0.00 O ATOM 1640 NE2 GLN A 108 -7.282 -13.305 7.703 1.00 0.00 N ATOM 0 H GLN A 108 -12.559 -13.147 9.034 1.00 0.00 H new ATOM 0 HA GLN A 108 -11.333 -15.474 7.976 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -10.266 -13.236 8.138 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.302 -13.340 9.887 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -8.776 -15.254 9.852 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -8.817 -15.297 8.101 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -7.734 -13.686 6.872 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -6.503 -12.653 7.607 1.00 0.00 H new ATOM 1649 N ARG A 109 -11.910 -17.055 9.871 1.00 0.00 N ATOM 1650 CA ARG A 109 -11.947 -18.066 10.921 1.00 0.00 C ATOM 1651 C ARG A 109 -12.215 -19.449 10.335 1.00 0.00 C ATOM 1652 O ARG A 109 -12.535 -19.583 9.153 1.00 0.00 O ATOM 1653 CB ARG A 109 -13.022 -17.720 11.953 1.00 0.00 C ATOM 1654 CG ARG A 109 -12.469 -17.461 13.345 1.00 0.00 C ATOM 1655 CD ARG A 109 -13.325 -18.120 14.416 1.00 0.00 C ATOM 1656 NE ARG A 109 -12.551 -18.445 15.611 1.00 0.00 N ATOM 1657 CZ ARG A 109 -12.987 -19.253 16.571 1.00 0.00 C ATOM 1658 NH1 ARG A 109 -14.184 -19.815 16.477 1.00 0.00 N ATOM 1659 NH2 ARG A 109 -12.225 -19.500 17.629 1.00 0.00 N ATOM 0 H ARG A 109 -12.321 -17.351 8.986 1.00 0.00 H new ATOM 0 HA ARG A 109 -10.974 -18.081 11.411 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -13.565 -16.837 11.617 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -13.742 -18.537 12.003 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -11.449 -17.840 13.409 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -12.422 -16.387 13.525 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -14.145 -17.454 14.685 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -13.771 -19.030 14.015 1.00 0.00 H new ATOM 0 HE ARG A 109 -11.625 -18.029 15.714 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -14.773 -19.627 15.666 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -14.516 -20.435 17.216 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.304 -19.069 17.706 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.561 -20.121 18.366 1.00 0.00 H new ATOM 1673 N LEU A 110 -12.083 -20.475 11.168 1.00 0.00 N ATOM 1674 CA LEU A 110 -12.310 -21.848 10.733 1.00 0.00 C ATOM 1675 C LEU A 110 -13.534 -21.937 9.827 1.00 0.00 C ATOM 1676 O LEU A 110 -14.384 -21.047 9.827 1.00 0.00 O ATOM 1677 CB LEU A 110 -12.492 -22.764 11.945 1.00 0.00 C ATOM 1678 CG LEU A 110 -11.528 -23.947 12.042 1.00 0.00 C ATOM 1679 CD1 LEU A 110 -11.028 -24.113 13.469 1.00 0.00 C ATOM 1680 CD2 LEU A 110 -12.200 -25.224 11.559 1.00 0.00 C ATOM 0 H LEU A 110 -11.820 -20.382 12.149 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.437 -22.173 10.167 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -12.390 -22.163 12.848 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -13.511 -23.151 11.933 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.671 -23.746 11.399 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -10.343 -24.960 13.518 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -10.508 -23.207 13.780 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -11.874 -24.291 14.133 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -11.499 -26.055 11.635 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -13.075 -25.430 12.175 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -12.508 -25.103 10.520 1.00 0.00 H new ATOM 1692 N ASP A 111 -13.617 -23.017 9.058 1.00 0.00 N ATOM 1693 CA ASP A 111 -14.738 -23.224 8.149 1.00 0.00 C ATOM 1694 C ASP A 111 -15.801 -24.110 8.790 1.00 0.00 C ATOM 1695 O ASP A 111 -16.847 -23.626 9.223 1.00 0.00 O ATOM 1696 CB ASP A 111 -14.253 -23.853 6.842 1.00 0.00 C ATOM 1697 CG ASP A 111 -14.690 -23.065 5.623 1.00 0.00 C ATOM 1698 OD1 ASP A 111 -15.589 -22.209 5.761 1.00 0.00 O ATOM 1699 OD2 ASP A 111 -14.135 -23.305 4.530 1.00 0.00 O ATOM 0 H ASP A 111 -12.921 -23.763 9.046 1.00 0.00 H new ATOM 0 HA ASP A 111 -15.182 -22.252 7.933 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -13.165 -23.921 6.856 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -14.635 -24.871 6.769 1.00 0.00 H new ATOM 1704 N GLN A 112 -15.526 -25.409 8.847 1.00 0.00 N ATOM 1705 CA GLN A 112 -16.460 -26.363 9.434 1.00 0.00 C ATOM 1706 C GLN A 112 -17.752 -26.426 8.626 1.00 0.00 C ATOM 1707 O GLN A 112 -18.396 -25.405 8.384 1.00 0.00 O ATOM 1708 CB GLN A 112 -16.769 -25.980 10.883 1.00 0.00 C ATOM 1709 CG GLN A 112 -17.102 -27.170 11.768 1.00 0.00 C ATOM 1710 CD GLN A 112 -16.114 -28.310 11.610 1.00 0.00 C ATOM 1711 OE1 GLN A 112 -14.933 -28.172 11.928 1.00 0.00 O ATOM 1712 NE2 GLN A 112 -16.594 -29.445 11.115 1.00 0.00 N ATOM 0 H GLN A 112 -14.664 -25.825 8.494 1.00 0.00 H new ATOM 0 HA GLN A 112 -15.994 -27.348 9.417 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -15.911 -25.455 11.302 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -17.607 -25.283 10.895 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -17.118 -26.850 12.810 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -18.104 -27.527 11.529 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -17.580 -29.515 10.865 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -15.976 -30.246 10.985 1.00 0.00 H new ATOM 1721 N SER A 113 -18.126 -27.632 8.211 1.00 0.00 N ATOM 1722 CA SER A 113 -19.340 -27.829 7.427 1.00 0.00 C ATOM 1723 C SER A 113 -20.563 -27.311 8.179 1.00 0.00 C ATOM 1724 O SER A 113 -21.304 -28.082 8.787 1.00 0.00 O ATOM 1725 CB SER A 113 -19.522 -29.310 7.093 1.00 0.00 C ATOM 1726 OG SER A 113 -18.319 -29.874 6.599 1.00 0.00 O ATOM 0 H SER A 113 -17.606 -28.488 8.405 1.00 0.00 H new ATOM 0 HA SER A 113 -19.240 -27.265 6.500 1.00 0.00 H new ATOM 0 HB2 SER A 113 -19.841 -29.850 7.984 1.00 0.00 H new ATOM 0 HB3 SER A 113 -20.312 -29.424 6.351 1.00 0.00 H new ATOM 0 HG SER A 113 -18.462 -30.822 6.395 1.00 0.00 H new ATOM 1732 N GLY A 114 -20.766 -25.998 8.133 1.00 0.00 N ATOM 1733 CA GLY A 114 -21.899 -25.398 8.813 1.00 0.00 C ATOM 1734 C GLY A 114 -22.724 -24.515 7.898 1.00 0.00 C ATOM 1735 O GLY A 114 -22.902 -23.323 8.146 1.00 0.00 O ATOM 0 H GLY A 114 -20.166 -25.339 7.637 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -22.533 -26.186 9.221 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -21.541 -24.808 9.657 1.00 0.00 H new ATOM 1739 N PRO A 115 -23.243 -25.105 6.811 1.00 0.00 N ATOM 1740 CA PRO A 115 -24.061 -24.381 5.833 1.00 0.00 C ATOM 1741 C PRO A 115 -25.425 -23.991 6.393 1.00 0.00 C ATOM 1742 O PRO A 115 -25.655 -24.065 7.600 1.00 0.00 O ATOM 1743 CB PRO A 115 -24.220 -25.387 4.690 1.00 0.00 C ATOM 1744 CG PRO A 115 -24.057 -26.720 5.333 1.00 0.00 C ATOM 1745 CD PRO A 115 -23.072 -26.522 6.452 1.00 0.00 C ATOM 0 HA PRO A 115 -23.599 -23.441 5.531 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -25.196 -25.294 4.214 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -23.471 -25.227 3.915 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -25.010 -27.089 5.712 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -23.692 -27.457 4.617 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -23.285 -27.179 7.296 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -22.052 -26.735 6.132 1.00 0.00 H new ATOM 1753 N SER A 116 -26.326 -23.577 5.508 1.00 0.00 N ATOM 1754 CA SER A 116 -27.667 -23.172 5.915 1.00 0.00 C ATOM 1755 C SER A 116 -28.201 -24.088 7.012 1.00 0.00 C ATOM 1756 O SER A 116 -28.996 -23.669 7.854 1.00 0.00 O ATOM 1757 CB SER A 116 -28.614 -23.189 4.714 1.00 0.00 C ATOM 1758 OG SER A 116 -27.920 -22.903 3.513 1.00 0.00 O ATOM 0 H SER A 116 -26.152 -23.513 4.505 1.00 0.00 H new ATOM 0 HA SER A 116 -27.610 -22.157 6.309 1.00 0.00 H new ATOM 0 HB2 SER A 116 -29.092 -24.166 4.638 1.00 0.00 H new ATOM 0 HB3 SER A 116 -29.408 -22.457 4.862 1.00 0.00 H new ATOM 0 HG SER A 116 -28.547 -22.922 2.760 1.00 0.00 H new ATOM 1764 N SER A 117 -27.758 -25.341 6.996 1.00 0.00 N ATOM 1765 CA SER A 117 -28.194 -26.319 7.986 1.00 0.00 C ATOM 1766 C SER A 117 -27.186 -27.458 8.105 1.00 0.00 C ATOM 1767 O SER A 117 -26.895 -28.148 7.129 1.00 0.00 O ATOM 1768 CB SER A 117 -29.569 -26.876 7.613 1.00 0.00 C ATOM 1769 OG SER A 117 -30.591 -25.931 7.878 1.00 0.00 O ATOM 0 H SER A 117 -27.097 -25.703 6.308 1.00 0.00 H new ATOM 0 HA SER A 117 -28.263 -25.816 8.951 1.00 0.00 H new ATOM 0 HB2 SER A 117 -29.582 -27.144 6.556 1.00 0.00 H new ATOM 0 HB3 SER A 117 -29.760 -27.790 8.176 1.00 0.00 H new ATOM 0 HG SER A 117 -30.195 -25.040 7.974 1.00 0.00 H new ATOM 1775 N GLY A 118 -26.656 -27.649 9.309 1.00 0.00 N ATOM 1776 CA GLY A 118 -25.687 -28.705 9.535 1.00 0.00 C ATOM 1777 C GLY A 118 -26.331 -29.993 10.007 1.00 0.00 C ATOM 1778 O GLY A 118 -27.501 -30.004 10.392 1.00 0.00 O ATOM 0 H GLY A 118 -26.881 -27.091 10.133 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -25.139 -28.894 8.612 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -24.960 -28.374 10.276 1.00 0.00 H new TER 1782 GLY A 118