USER MOD reduce.3.24.130724 H: found=0, std=0, add=1384, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1382 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 153 LYS NZ :NH3+ -117:sc= 0.944 (180deg=-0.208) USER MOD Set 1.2: A 154 THR OG1 : rot 119:sc= -0.172 USER MOD Set 2.1: A 148 CYS SG : rot 101:sc= -0.649 USER MOD Set 2.2: A 160 HIS : no HD1:sc= -0.652 K(o=-1.3,f=0.26) USER MOD Set 3.1: A 19 HIS : no HE2:sc= -3.22! X(o=-3.4!,f=-3.5) USER MOD Set 3.2: A 96 THR OG1 : rot -90:sc= -0.224 USER MOD Set 4.1: A 16 HIS : no HD1:sc= -2.91 K(o=-2.6,f=-8.7!) USER MOD Set 4.2: A 93 MET CE :methyl 152:sc= -0.455 (180deg=-1.61!) USER MOD Set 4.3: A 95 GLN : amide:sc= 0.784 X(o=-2.6,f=-2.4) USER MOD Set 5.1: A 49 GLN : amide:sc= 0.239 X(o=0.46,f=0) USER MOD Set 5.2: A 58 THR OG1 : rot -55:sc= 0.218 USER MOD Set 6.1: A 55 LYS NZ :NH3+ -144:sc= 0.787 (180deg=-0.00288) USER MOD Set 6.2: A 169 SER OG : rot 131:sc= 0.717 USER MOD Set 7.1: A 31 SER OG : rot 60:sc= 1.1 USER MOD Set 7.2: A 155 LYS NZ :NH3+ -144:sc= -0.82 (180deg=-2.55!) USER MOD Set 8.1: A 14 MET CE :methyl -108:sc= -0.314 (180deg=-3.61!) USER MOD Set 8.2: A 62 THR OG1 : rot -170:sc= -0.299 USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0527 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0336 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.0068) USER MOD Single : A 4 MET CE :methyl 138:sc= -0.145 (180deg=-0.798) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.669 USER MOD Single : A 21 LYS NZ :NH3+ -130:sc= 0.908 (180deg=-1.84!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HE2:sc= 0.941 K(o=0.94,f=-3.7!) USER MOD Single : A 32 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0505) USER MOD Single : A 34 THR OG1 : rot 171:sc= 0.269 USER MOD Single : A 36 GLN : amide:sc= -2.66! K(o=-2.7!,f=-0.33) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -1.95! K(o=-1.9!,f=-0.2) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot 165:sc= -0.0265 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ -144:sc= 0.509 (180deg=-0.158) USER MOD Single : A 65 HIS : no HD1:sc= -0.415 K(o=-0.41,f=-1.9) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 150:sc= 0 USER MOD Single : A 71 MET CE :methyl 159:sc= -0.163 (180deg=-0.718) USER MOD Single : A 77 GLN : amide:sc= 0.409 X(o=0.41,f=-0.056) USER MOD Single : A 79 THR OG1 : rot 159:sc= 0.0199 USER MOD Single : A 101 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 102 HIS : no HE2:sc= -5.41! C(o=-5.4!,f=-9.9!) USER MOD Single : A 104 LYS NZ :NH3+ -118:sc= 1.27 (180deg=0.115) USER MOD Single : A 107 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.11) USER MOD Single : A 115 ASN : amide:sc= 0.0581 K(o=0.058,f=-4.8!) USER MOD Single : A 116 LYS NZ :NH3+ 165:sc= 0.805 (180deg=0.586) USER MOD Single : A 117 MET CE :methyl -111:sc= -4.05! (180deg=-5.82!) USER MOD Single : A 119 LYS NZ :NH3+ -169:sc= 2.05 (180deg=1.72) USER MOD Single : A 123 ASN : amide:sc= -0.286 K(o=-0.29,f=-3.6!) USER MOD Single : A 128 MET CE :methyl -165:sc= -0.654 (180deg=-1.25) USER MOD Single : A 129 GLN : amide:sc= -0.0166 K(o=-0.017,f=-1.2) USER MOD Single : A 132 MET CE :methyl 155:sc= -2.55! (180deg=-5.71!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 145 THR OG1 : rot -50:sc= -1.64! USER MOD Single : A 149 LYS NZ :NH3+ -118:sc= 0.0627 (180deg=0) USER MOD Single : A 151 SER OG : rot 22:sc= 0.861 USER MOD Single : A 164 MET CE :methyl 141:sc= -2.08! (180deg=-4.47!) USER MOD Single : A 171 MET CE :methyl 159:sc= -0.0682 (180deg=-0.512) USER MOD Single : A 175 LYS NZ :NH3+ 143:sc= 1.31 (180deg=-0.142!) USER MOD Single : A 177 ASN : amide:sc= -0.0997 X(o=-0.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -34.728 3.073 -11.189 1.00 16.35 N ATOM 2 CA GLY A 1 -35.856 4.019 -11.361 1.00 15.80 C ATOM 3 C GLY A 1 -35.528 5.131 -12.332 1.00 15.04 C ATOM 4 O GLY A 1 -34.618 4.999 -13.150 1.00 14.90 O ATOM 0 H1 GLY A 1 -35.074 2.098 -11.291 1.00 16.35 H new ATOM 0 H2 GLY A 1 -34.004 3.261 -11.912 1.00 16.35 H new ATOM 0 H3 GLY A 1 -34.313 3.196 -10.243 1.00 16.35 H new ATOM 0 HA2 GLY A 1 -36.732 3.476 -11.716 1.00 15.80 H new ATOM 0 HA3 GLY A 1 -36.118 4.449 -10.394 1.00 15.80 H new ATOM 10 N SER A 2 -36.260 6.232 -12.239 1.00 14.69 N ATOM 11 CA SER A 2 -36.072 7.354 -13.148 1.00 14.11 C ATOM 12 C SER A 2 -34.874 8.216 -12.746 1.00 13.37 C ATOM 13 O SER A 2 -34.443 9.084 -13.501 1.00 13.12 O ATOM 14 CB SER A 2 -37.349 8.190 -13.212 1.00 14.38 C ATOM 15 OG SER A 2 -37.889 8.401 -11.917 1.00 14.60 O ATOM 0 H SER A 2 -36.991 6.373 -11.542 1.00 14.69 H new ATOM 0 HA SER A 2 -35.859 6.955 -14.140 1.00 14.11 H new ATOM 0 HB2 SER A 2 -37.135 9.151 -13.681 1.00 14.38 H new ATOM 0 HB3 SER A 2 -38.085 7.687 -13.838 1.00 14.38 H new ATOM 0 HG SER A 2 -38.704 8.940 -11.986 1.00 14.60 H new ATOM 21 N HIS A 3 -34.343 7.980 -11.556 1.00 13.19 N ATOM 22 CA HIS A 3 -33.133 8.662 -11.123 1.00 12.67 C ATOM 23 C HIS A 3 -31.966 7.690 -11.131 1.00 11.99 C ATOM 24 O HIS A 3 -31.816 6.869 -10.224 1.00 12.05 O ATOM 25 CB HIS A 3 -33.311 9.285 -9.734 1.00 13.18 C ATOM 26 CG HIS A 3 -34.093 10.564 -9.752 1.00 13.68 C ATOM 27 ND1 HIS A 3 -35.392 10.664 -9.312 1.00 14.14 N ATOM 28 CD2 HIS A 3 -33.744 11.806 -10.165 1.00 13.99 C ATOM 29 CE1 HIS A 3 -35.810 11.907 -9.451 1.00 14.68 C ATOM 30 NE2 HIS A 3 -34.829 12.624 -9.968 1.00 14.60 N ATOM 0 H HIS A 3 -34.728 7.325 -10.876 1.00 13.19 H new ATOM 0 HA HIS A 3 -32.926 9.474 -11.820 1.00 12.67 H new ATOM 0 HB2 HIS A 3 -33.814 8.569 -9.084 1.00 13.18 H new ATOM 0 HB3 HIS A 3 -32.329 9.474 -9.300 1.00 13.18 H new ATOM 0 HD2 HIS A 3 -32.788 12.099 -10.574 1.00 13.99 H new ATOM 0 HE1 HIS A 3 -36.790 12.276 -9.187 1.00 14.68 H new ATOM 0 HE2 HIS A 3 -34.870 13.620 -10.185 1.00 14.60 H new ATOM 39 N MET A 4 -31.151 7.771 -12.173 1.00 11.52 N ATOM 40 CA MET A 4 -30.045 6.840 -12.357 1.00 11.00 C ATOM 41 C MET A 4 -28.853 7.212 -11.484 1.00 10.19 C ATOM 42 O MET A 4 -27.834 7.691 -11.975 1.00 10.08 O ATOM 43 CB MET A 4 -29.615 6.770 -13.829 1.00 11.26 C ATOM 44 CG MET A 4 -30.658 6.159 -14.754 1.00 11.60 C ATOM 45 SD MET A 4 -32.100 7.216 -14.985 1.00 12.31 S ATOM 46 CE MET A 4 -31.350 8.629 -15.789 1.00 12.73 C ATOM 0 H MET A 4 -31.235 8.474 -12.907 1.00 11.52 H new ATOM 0 HA MET A 4 -30.402 5.856 -12.052 1.00 11.00 H new ATOM 0 HB2 MET A 4 -29.382 7.777 -14.176 1.00 11.26 H new ATOM 0 HB3 MET A 4 -28.696 6.188 -13.900 1.00 11.26 H new ATOM 0 HG2 MET A 4 -30.203 5.958 -15.724 1.00 11.60 H new ATOM 0 HG3 MET A 4 -30.979 5.200 -14.348 1.00 11.60 H new ATOM 0 HE1 MET A 4 -31.993 8.969 -16.601 1.00 12.73 H new ATOM 0 HE2 MET A 4 -31.222 9.434 -15.065 1.00 12.73 H new ATOM 0 HE3 MET A 4 -30.377 8.345 -16.191 1.00 12.73 H new ATOM 56 N VAL A 5 -28.988 6.983 -10.185 1.00 9.82 N ATOM 57 CA VAL A 5 -27.882 7.169 -9.252 1.00 9.21 C ATOM 58 C VAL A 5 -27.040 5.900 -9.184 1.00 8.39 C ATOM 59 O VAL A 5 -26.104 5.791 -8.393 1.00 8.39 O ATOM 60 CB VAL A 5 -28.387 7.531 -7.838 1.00 9.62 C ATOM 61 CG1 VAL A 5 -29.126 8.859 -7.859 1.00 10.18 C ATOM 62 CG2 VAL A 5 -29.282 6.429 -7.284 1.00 10.12 C ATOM 0 H VAL A 5 -29.855 6.667 -9.751 1.00 9.82 H new ATOM 0 HA VAL A 5 -27.274 7.997 -9.618 1.00 9.21 H new ATOM 0 HB VAL A 5 -27.522 7.628 -7.182 1.00 9.62 H new ATOM 0 HG11 VAL A 5 -29.474 9.097 -6.854 1.00 10.18 H new ATOM 0 HG12 VAL A 5 -28.454 9.644 -8.206 1.00 10.18 H new ATOM 0 HG13 VAL A 5 -29.980 8.789 -8.532 1.00 10.18 H new ATOM 0 HG21 VAL A 5 -29.626 6.706 -6.287 1.00 10.12 H new ATOM 0 HG22 VAL A 5 -30.142 6.295 -7.940 1.00 10.12 H new ATOM 0 HG23 VAL A 5 -28.719 5.497 -7.228 1.00 10.12 H new ATOM 72 N GLU A 6 -27.372 4.951 -10.052 1.00 7.91 N ATOM 73 CA GLU A 6 -26.741 3.639 -10.064 1.00 7.32 C ATOM 74 C GLU A 6 -25.452 3.654 -10.884 1.00 6.47 C ATOM 75 O GLU A 6 -25.150 2.703 -11.605 1.00 6.49 O ATOM 76 CB GLU A 6 -27.724 2.613 -10.633 1.00 7.80 C ATOM 77 CG GLU A 6 -29.061 2.600 -9.909 1.00 8.31 C ATOM 78 CD GLU A 6 -30.090 1.733 -10.602 1.00 8.82 C ATOM 79 OE1 GLU A 6 -30.764 2.228 -11.532 1.00 9.12 O ATOM 80 OE2 GLU A 6 -30.240 0.557 -10.212 1.00 9.14 O ATOM 0 H GLU A 6 -28.088 5.071 -10.768 1.00 7.91 H new ATOM 0 HA GLU A 6 -26.478 3.366 -9.042 1.00 7.32 H new ATOM 0 HB2 GLU A 6 -27.892 2.827 -11.689 1.00 7.80 H new ATOM 0 HB3 GLU A 6 -27.277 1.620 -10.576 1.00 7.80 H new ATOM 0 HG2 GLU A 6 -28.915 2.240 -8.890 1.00 8.31 H new ATOM 0 HG3 GLU A 6 -29.440 3.619 -9.836 1.00 8.31 H new ATOM 87 N ARG A 7 -24.702 4.743 -10.774 1.00 5.97 N ATOM 88 CA ARG A 7 -23.425 4.872 -11.467 1.00 5.27 C ATOM 89 C ARG A 7 -22.430 5.659 -10.606 1.00 4.71 C ATOM 90 O ARG A 7 -22.049 6.782 -10.943 1.00 4.95 O ATOM 91 CB ARG A 7 -23.623 5.557 -12.827 1.00 5.61 C ATOM 92 CG ARG A 7 -22.357 5.633 -13.669 1.00 5.93 C ATOM 93 CD ARG A 7 -22.574 6.451 -14.930 1.00 6.48 C ATOM 94 NE ARG A 7 -21.325 6.693 -15.651 1.00 6.96 N ATOM 95 CZ ARG A 7 -21.100 7.766 -16.411 1.00 7.68 C ATOM 96 NH1 ARG A 7 -22.034 8.697 -16.552 1.00 7.98 N ATOM 97 NH2 ARG A 7 -19.938 7.911 -17.033 1.00 8.35 N ATOM 0 H ARG A 7 -24.957 5.553 -10.209 1.00 5.97 H new ATOM 0 HA ARG A 7 -23.018 3.876 -11.640 1.00 5.27 H new ATOM 0 HB2 ARG A 7 -24.388 5.018 -13.386 1.00 5.61 H new ATOM 0 HB3 ARG A 7 -24.000 6.567 -12.663 1.00 5.61 H new ATOM 0 HG2 ARG A 7 -21.554 6.076 -13.080 1.00 5.93 H new ATOM 0 HG3 ARG A 7 -22.037 4.626 -13.938 1.00 5.93 H new ATOM 0 HD2 ARG A 7 -23.274 5.930 -15.583 1.00 6.48 H new ATOM 0 HD3 ARG A 7 -23.032 7.405 -14.668 1.00 6.48 H new ATOM 0 HE ARG A 7 -20.581 6.000 -15.568 1.00 6.96 H new ATOM 0 HH11 ARG A 7 -22.931 8.595 -16.078 1.00 7.98 H new ATOM 0 HH12 ARG A 7 -21.855 9.515 -17.135 1.00 7.98 H new ATOM 0 HH21 ARG A 7 -19.213 7.201 -16.931 1.00 8.35 H new ATOM 0 HH22 ARG A 7 -19.769 8.733 -17.613 1.00 8.35 H new ATOM 111 N PRO A 8 -22.019 5.093 -9.463 1.00 4.27 N ATOM 112 CA PRO A 8 -21.050 5.712 -8.582 1.00 3.88 C ATOM 113 C PRO A 8 -19.631 5.214 -8.841 1.00 3.07 C ATOM 114 O PRO A 8 -19.412 4.021 -9.076 1.00 2.74 O ATOM 115 CB PRO A 8 -21.533 5.269 -7.200 1.00 4.13 C ATOM 116 CG PRO A 8 -22.292 3.989 -7.421 1.00 4.60 C ATOM 117 CD PRO A 8 -22.472 3.813 -8.912 1.00 4.51 C ATOM 0 HA PRO A 8 -20.993 6.793 -8.712 1.00 3.88 H new ATOM 0 HB2 PRO A 8 -20.693 5.113 -6.524 1.00 4.13 H new ATOM 0 HB3 PRO A 8 -22.170 6.028 -6.747 1.00 4.13 H new ATOM 0 HG2 PRO A 8 -21.748 3.144 -6.999 1.00 4.60 H new ATOM 0 HG3 PRO A 8 -23.260 4.027 -6.921 1.00 4.60 H new ATOM 0 HD2 PRO A 8 -21.881 2.980 -9.292 1.00 4.51 H new ATOM 0 HD3 PRO A 8 -23.511 3.610 -9.170 1.00 4.51 H new ATOM 125 N PRO A 9 -18.649 6.125 -8.823 1.00 3.13 N ATOM 126 CA PRO A 9 -17.235 5.774 -8.963 1.00 2.76 C ATOM 127 C PRO A 9 -16.707 5.060 -7.721 1.00 1.86 C ATOM 128 O PRO A 9 -15.855 5.582 -7.003 1.00 2.21 O ATOM 129 CB PRO A 9 -16.531 7.127 -9.147 1.00 3.66 C ATOM 130 CG PRO A 9 -17.623 8.116 -9.392 1.00 4.29 C ATOM 131 CD PRO A 9 -18.832 7.575 -8.688 1.00 4.00 C ATOM 0 HA PRO A 9 -17.065 5.088 -9.793 1.00 2.76 H new ATOM 0 HB2 PRO A 9 -15.953 7.392 -8.262 1.00 3.66 H new ATOM 0 HB3 PRO A 9 -15.834 7.096 -9.985 1.00 3.66 H new ATOM 0 HG2 PRO A 9 -17.354 9.099 -9.006 1.00 4.29 H new ATOM 0 HG3 PRO A 9 -17.812 8.233 -10.459 1.00 4.29 H new ATOM 0 HD2 PRO A 9 -18.867 7.885 -7.644 1.00 4.00 H new ATOM 0 HD3 PRO A 9 -19.758 7.913 -9.152 1.00 4.00 H new ATOM 139 N VAL A 10 -17.235 3.870 -7.469 1.00 1.31 N ATOM 140 CA VAL A 10 -16.844 3.078 -6.315 1.00 1.04 C ATOM 141 C VAL A 10 -15.453 2.474 -6.509 1.00 0.88 C ATOM 142 O VAL A 10 -15.189 1.783 -7.490 1.00 1.10 O ATOM 143 CB VAL A 10 -17.882 1.968 -6.013 1.00 1.75 C ATOM 144 CG1 VAL A 10 -18.165 1.127 -7.251 1.00 2.58 C ATOM 145 CG2 VAL A 10 -17.421 1.088 -4.857 1.00 2.47 C ATOM 0 H VAL A 10 -17.943 3.430 -8.057 1.00 1.31 H new ATOM 0 HA VAL A 10 -16.810 3.748 -5.456 1.00 1.04 H new ATOM 0 HB VAL A 10 -18.811 2.456 -5.719 1.00 1.75 H new ATOM 0 HG11 VAL A 10 -18.897 0.357 -7.008 1.00 2.58 H new ATOM 0 HG12 VAL A 10 -18.559 1.765 -8.042 1.00 2.58 H new ATOM 0 HG13 VAL A 10 -17.242 0.657 -7.590 1.00 2.58 H new ATOM 0 HG21 VAL A 10 -18.168 0.317 -4.666 1.00 2.47 H new ATOM 0 HG22 VAL A 10 -16.472 0.618 -5.114 1.00 2.47 H new ATOM 0 HG23 VAL A 10 -17.293 1.699 -3.963 1.00 2.47 H new ATOM 155 N VAL A 11 -14.571 2.758 -5.570 1.00 0.67 N ATOM 156 CA VAL A 11 -13.206 2.292 -5.615 1.00 0.60 C ATOM 157 C VAL A 11 -12.926 1.397 -4.409 1.00 0.56 C ATOM 158 O VAL A 11 -13.395 1.667 -3.301 1.00 0.74 O ATOM 159 CB VAL A 11 -12.240 3.495 -5.644 1.00 0.61 C ATOM 160 CG1 VAL A 11 -10.866 3.110 -5.148 1.00 1.00 C ATOM 161 CG2 VAL A 11 -12.155 4.075 -7.052 1.00 0.98 C ATOM 0 H VAL A 11 -14.787 3.324 -4.749 1.00 0.67 H new ATOM 0 HA VAL A 11 -13.051 1.708 -6.522 1.00 0.60 H new ATOM 0 HB VAL A 11 -12.635 4.257 -4.973 1.00 0.61 H new ATOM 0 HG11 VAL A 11 -10.210 3.980 -5.181 1.00 1.00 H new ATOM 0 HG12 VAL A 11 -10.938 2.749 -4.122 1.00 1.00 H new ATOM 0 HG13 VAL A 11 -10.458 2.323 -5.782 1.00 1.00 H new ATOM 0 HG21 VAL A 11 -11.470 4.923 -7.056 1.00 0.98 H new ATOM 0 HG22 VAL A 11 -11.791 3.311 -7.739 1.00 0.98 H new ATOM 0 HG23 VAL A 11 -13.144 4.406 -7.369 1.00 0.98 H new ATOM 171 N THR A 12 -12.166 0.337 -4.631 1.00 0.46 N ATOM 172 CA THR A 12 -11.924 -0.665 -3.610 1.00 0.45 C ATOM 173 C THR A 12 -10.620 -0.397 -2.862 1.00 0.39 C ATOM 174 O THR A 12 -9.549 -0.327 -3.466 1.00 0.43 O ATOM 175 CB THR A 12 -11.865 -2.069 -4.238 1.00 0.55 C ATOM 176 OG1 THR A 12 -12.970 -2.247 -5.134 1.00 0.66 O ATOM 177 CG2 THR A 12 -11.903 -3.145 -3.166 1.00 0.62 C ATOM 0 H THR A 12 -11.702 0.149 -5.520 1.00 0.46 H new ATOM 0 HA THR A 12 -12.751 -0.613 -2.901 1.00 0.45 H new ATOM 0 HB THR A 12 -10.928 -2.159 -4.787 1.00 0.55 H new ATOM 0 HG1 THR A 12 -12.927 -3.141 -5.533 1.00 0.66 H new ATOM 0 HG21 THR A 12 -11.860 -4.128 -3.635 1.00 0.62 H new ATOM 0 HG22 THR A 12 -11.050 -3.024 -2.499 1.00 0.62 H new ATOM 0 HG23 THR A 12 -12.827 -3.056 -2.594 1.00 0.62 H new ATOM 185 N ILE A 13 -10.716 -0.235 -1.549 1.00 0.39 N ATOM 186 CA ILE A 13 -9.541 -0.088 -0.707 1.00 0.38 C ATOM 187 C ILE A 13 -9.155 -1.430 -0.116 1.00 0.37 C ATOM 188 O ILE A 13 -9.935 -2.064 0.598 1.00 0.51 O ATOM 189 CB ILE A 13 -9.764 0.920 0.440 1.00 0.50 C ATOM 190 CG1 ILE A 13 -10.100 2.299 -0.123 1.00 0.86 C ATOM 191 CG2 ILE A 13 -8.530 0.989 1.337 1.00 0.80 C ATOM 192 CD1 ILE A 13 -10.191 3.373 0.937 1.00 1.03 C ATOM 0 H ILE A 13 -11.602 -0.202 -1.044 1.00 0.39 H new ATOM 0 HA ILE A 13 -8.741 0.293 -1.341 1.00 0.38 H new ATOM 0 HB ILE A 13 -10.606 0.581 1.043 1.00 0.50 H new ATOM 0 HG12 ILE A 13 -9.340 2.581 -0.852 1.00 0.86 H new ATOM 0 HG13 ILE A 13 -11.049 2.244 -0.657 1.00 0.86 H new ATOM 0 HG21 ILE A 13 -8.704 1.704 2.141 1.00 0.80 H new ATOM 0 HG22 ILE A 13 -8.334 0.005 1.763 1.00 0.80 H new ATOM 0 HG23 ILE A 13 -7.670 1.307 0.748 1.00 0.80 H new ATOM 0 HD11 ILE A 13 -10.432 4.327 0.468 1.00 1.03 H new ATOM 0 HD12 ILE A 13 -10.971 3.113 1.653 1.00 1.03 H new ATOM 0 HD13 ILE A 13 -9.235 3.455 1.455 1.00 1.03 H new ATOM 204 N MET A 14 -7.950 -1.864 -0.421 1.00 0.31 N ATOM 205 CA MET A 14 -7.461 -3.147 0.030 1.00 0.35 C ATOM 206 C MET A 14 -6.104 -3.002 0.702 1.00 0.29 C ATOM 207 O MET A 14 -5.362 -2.075 0.413 1.00 0.46 O ATOM 208 CB MET A 14 -7.353 -4.091 -1.159 1.00 0.56 C ATOM 209 CG MET A 14 -8.678 -4.703 -1.583 1.00 0.75 C ATOM 210 SD MET A 14 -8.519 -5.781 -3.019 1.00 1.04 S ATOM 211 CE MET A 14 -10.181 -6.433 -3.135 1.00 0.77 C ATOM 0 H MET A 14 -7.284 -1.338 -0.987 1.00 0.31 H new ATOM 0 HA MET A 14 -8.161 -3.554 0.760 1.00 0.35 H new ATOM 0 HB2 MET A 14 -6.928 -3.548 -2.003 1.00 0.56 H new ATOM 0 HB3 MET A 14 -6.657 -4.892 -0.912 1.00 0.56 H new ATOM 0 HG2 MET A 14 -9.093 -5.272 -0.751 1.00 0.75 H new ATOM 0 HG3 MET A 14 -9.386 -3.906 -1.809 1.00 0.75 H new ATOM 0 HE1 MET A 14 -10.184 -7.479 -2.827 1.00 0.77 H new ATOM 0 HE2 MET A 14 -10.842 -5.861 -2.484 1.00 0.77 H new ATOM 0 HE3 MET A 14 -10.531 -6.357 -4.165 1.00 0.77 H new ATOM 221 N GLY A 15 -5.797 -3.898 1.621 1.00 0.34 N ATOM 222 CA GLY A 15 -4.490 -3.936 2.210 1.00 0.45 C ATOM 223 C GLY A 15 -4.482 -4.850 3.399 1.00 0.62 C ATOM 224 O GLY A 15 -4.707 -6.046 3.276 1.00 1.55 O ATOM 0 H GLY A 15 -6.442 -4.606 1.970 1.00 0.34 H new ATOM 0 HA2 GLY A 15 -3.762 -4.278 1.475 1.00 0.45 H new ATOM 0 HA3 GLY A 15 -4.190 -2.932 2.512 1.00 0.45 H new ATOM 228 N HIS A 16 -4.281 -4.264 4.548 1.00 0.51 N ATOM 229 CA HIS A 16 -4.267 -4.985 5.802 1.00 0.45 C ATOM 230 C HIS A 16 -4.458 -3.998 6.946 1.00 0.49 C ATOM 231 O HIS A 16 -4.034 -2.844 6.839 1.00 0.64 O ATOM 232 CB HIS A 16 -2.956 -5.763 5.960 1.00 0.43 C ATOM 233 CG HIS A 16 -2.825 -6.468 7.276 1.00 0.48 C ATOM 234 ND1 HIS A 16 -3.559 -7.590 7.558 1.00 0.62 N ATOM 235 CD2 HIS A 16 -2.075 -6.152 8.354 1.00 0.50 C ATOM 236 CE1 HIS A 16 -3.245 -7.929 8.792 1.00 0.66 C ATOM 237 NE2 HIS A 16 -2.354 -7.084 9.321 1.00 0.59 N ATOM 0 H HIS A 16 -4.120 -3.262 4.646 1.00 0.51 H new ATOM 0 HA HIS A 16 -5.082 -5.708 5.816 1.00 0.45 H new ATOM 0 HB2 HIS A 16 -2.880 -6.496 5.157 1.00 0.43 H new ATOM 0 HB3 HIS A 16 -2.119 -5.074 5.843 1.00 0.43 H new ATOM 0 HD2 HIS A 16 -1.387 -5.324 8.438 1.00 0.50 H new ATOM 0 HE1 HIS A 16 -3.656 -8.782 9.311 1.00 0.66 H new ATOM 0 HE2 HIS A 16 -1.959 -7.125 10.260 1.00 0.59 H new ATOM 245 N VAL A 17 -5.113 -4.421 8.015 1.00 0.53 N ATOM 246 CA VAL A 17 -5.463 -3.509 9.101 1.00 0.67 C ATOM 247 C VAL A 17 -4.236 -2.800 9.695 1.00 0.64 C ATOM 248 O VAL A 17 -4.208 -1.565 9.762 1.00 0.78 O ATOM 249 CB VAL A 17 -6.255 -4.228 10.221 1.00 0.87 C ATOM 250 CG1 VAL A 17 -7.659 -4.571 9.743 1.00 1.55 C ATOM 251 CG2 VAL A 17 -5.537 -5.488 10.687 1.00 1.62 C ATOM 0 H VAL A 17 -5.414 -5.385 8.157 1.00 0.53 H new ATOM 0 HA VAL A 17 -6.103 -2.747 8.656 1.00 0.67 H new ATOM 0 HB VAL A 17 -6.325 -3.546 11.069 1.00 0.87 H new ATOM 0 HG11 VAL A 17 -8.202 -5.076 10.542 1.00 1.55 H new ATOM 0 HG12 VAL A 17 -8.184 -3.656 9.469 1.00 1.55 H new ATOM 0 HG13 VAL A 17 -7.598 -5.227 8.875 1.00 1.55 H new ATOM 0 HG21 VAL A 17 -6.119 -5.969 11.473 1.00 1.62 H new ATOM 0 HG22 VAL A 17 -5.425 -6.174 9.848 1.00 1.62 H new ATOM 0 HG23 VAL A 17 -4.553 -5.224 11.074 1.00 1.62 H new ATOM 261 N ASP A 18 -3.218 -3.578 10.060 1.00 0.57 N ATOM 262 CA ASP A 18 -2.050 -3.076 10.791 1.00 0.61 C ATOM 263 C ASP A 18 -1.279 -2.015 10.015 1.00 0.56 C ATOM 264 O ASP A 18 -0.648 -1.143 10.610 1.00 0.69 O ATOM 265 CB ASP A 18 -1.106 -4.229 11.140 1.00 0.69 C ATOM 266 CG ASP A 18 -1.680 -5.159 12.189 1.00 1.06 C ATOM 267 OD1 ASP A 18 -2.385 -6.122 11.820 1.00 1.78 O ATOM 268 OD2 ASP A 18 -1.426 -4.933 13.387 1.00 1.17 O ATOM 0 H ASP A 18 -3.178 -4.577 9.858 1.00 0.57 H new ATOM 0 HA ASP A 18 -2.430 -2.610 11.700 1.00 0.61 H new ATOM 0 HB2 ASP A 18 -0.886 -4.799 10.237 1.00 0.69 H new ATOM 0 HB3 ASP A 18 -0.160 -3.823 11.499 1.00 0.69 H new ATOM 273 N HIS A 19 -1.333 -2.072 8.688 1.00 0.46 N ATOM 274 CA HIS A 19 -0.607 -1.115 7.864 1.00 0.48 C ATOM 275 C HIS A 19 -1.179 0.287 8.032 1.00 0.58 C ATOM 276 O HIS A 19 -0.507 1.282 7.754 1.00 0.65 O ATOM 277 CB HIS A 19 -0.642 -1.533 6.395 1.00 0.46 C ATOM 278 CG HIS A 19 0.238 -2.704 6.095 1.00 0.40 C ATOM 279 ND1 HIS A 19 -0.135 -3.674 5.201 1.00 0.60 N ATOM 280 CD2 HIS A 19 1.464 -3.003 6.587 1.00 0.56 C ATOM 281 CE1 HIS A 19 0.864 -4.536 5.167 1.00 0.53 C ATOM 282 NE2 HIS A 19 1.856 -4.172 5.991 1.00 0.48 N ATOM 0 H HIS A 19 -1.868 -2.765 8.165 1.00 0.46 H new ATOM 0 HA HIS A 19 0.432 -1.103 8.195 1.00 0.48 H new ATOM 0 HB2 HIS A 19 -1.668 -1.777 6.118 1.00 0.46 H new ATOM 0 HB3 HIS A 19 -0.337 -0.689 5.776 1.00 0.46 H new ATOM 0 HD1 HIS A 19 -1.005 -3.720 4.671 1.00 0.60 H new ATOM 0 HD2 HIS A 19 2.025 -2.430 7.310 1.00 0.56 H new ATOM 0 HE1 HIS A 19 0.880 -5.424 4.552 1.00 0.53 H new ATOM 290 N GLY A 20 -2.403 0.362 8.531 1.00 0.76 N ATOM 291 CA GLY A 20 -3.039 1.646 8.736 1.00 0.90 C ATOM 292 C GLY A 20 -4.269 1.816 7.877 1.00 0.81 C ATOM 293 O GLY A 20 -4.577 2.919 7.442 1.00 0.93 O ATOM 0 H GLY A 20 -2.968 -0.444 8.798 1.00 0.76 H new ATOM 0 HA2 GLY A 20 -3.314 1.750 9.786 1.00 0.90 H new ATOM 0 HA3 GLY A 20 -2.328 2.442 8.512 1.00 0.90 H new ATOM 297 N LYS A 21 -4.982 0.722 7.648 1.00 0.79 N ATOM 298 CA LYS A 21 -6.160 0.739 6.787 1.00 0.87 C ATOM 299 C LYS A 21 -7.321 1.435 7.483 1.00 0.89 C ATOM 300 O LYS A 21 -7.972 2.310 6.916 1.00 0.93 O ATOM 301 CB LYS A 21 -6.566 -0.689 6.440 1.00 1.09 C ATOM 302 CG LYS A 21 -7.653 -0.783 5.379 1.00 1.20 C ATOM 303 CD LYS A 21 -8.093 -2.224 5.152 1.00 1.39 C ATOM 304 CE LYS A 21 -8.758 -2.808 6.389 1.00 1.73 C ATOM 305 NZ LYS A 21 -10.018 -2.096 6.732 1.00 2.11 N ATOM 0 H LYS A 21 -4.766 -0.192 8.047 1.00 0.79 H new ATOM 0 HA LYS A 21 -5.914 1.285 5.876 1.00 0.87 H new ATOM 0 HB2 LYS A 21 -5.687 -1.232 6.094 1.00 1.09 H new ATOM 0 HB3 LYS A 21 -6.912 -1.188 7.345 1.00 1.09 H new ATOM 0 HG2 LYS A 21 -8.511 -0.184 5.683 1.00 1.20 H new ATOM 0 HG3 LYS A 21 -7.286 -0.362 4.443 1.00 1.20 H new ATOM 0 HD2 LYS A 21 -8.786 -2.265 4.312 1.00 1.39 H new ATOM 0 HD3 LYS A 21 -7.229 -2.831 4.882 1.00 1.39 H new ATOM 0 HE2 LYS A 21 -8.972 -3.864 6.222 1.00 1.73 H new ATOM 0 HE3 LYS A 21 -8.069 -2.752 7.232 1.00 1.73 H new ATOM 0 HZ1 LYS A 21 -10.007 -1.836 7.739 1.00 2.11 H new ATOM 0 HZ2 LYS A 21 -10.099 -1.236 6.153 1.00 2.11 H new ATOM 0 HZ3 LYS A 21 -10.830 -2.718 6.544 1.00 2.11 H new ATOM 319 N THR A 22 -7.571 1.038 8.721 1.00 0.92 N ATOM 320 CA THR A 22 -8.655 1.612 9.501 1.00 1.00 C ATOM 321 C THR A 22 -8.364 3.081 9.801 1.00 0.99 C ATOM 322 O THR A 22 -9.259 3.929 9.773 1.00 1.03 O ATOM 323 CB THR A 22 -8.878 0.812 10.809 1.00 1.10 C ATOM 324 OG1 THR A 22 -9.932 1.393 11.582 1.00 1.80 O ATOM 325 CG2 THR A 22 -7.605 0.743 11.644 1.00 1.65 C ATOM 0 H THR A 22 -7.036 0.319 9.208 1.00 0.92 H new ATOM 0 HA THR A 22 -9.573 1.553 8.917 1.00 1.00 H new ATOM 0 HB THR A 22 -9.158 -0.203 10.527 1.00 1.10 H new ATOM 0 HG1 THR A 22 -10.060 0.874 12.403 1.00 1.80 H new ATOM 0 HG21 THR A 22 -7.797 0.175 12.554 1.00 1.65 H new ATOM 0 HG22 THR A 22 -6.819 0.253 11.069 1.00 1.65 H new ATOM 0 HG23 THR A 22 -7.287 1.752 11.907 1.00 1.65 H new ATOM 333 N THR A 23 -7.093 3.380 10.045 1.00 0.99 N ATOM 334 CA THR A 23 -6.659 4.746 10.270 1.00 1.02 C ATOM 335 C THR A 23 -6.722 5.546 8.971 1.00 0.96 C ATOM 336 O THR A 23 -6.942 6.756 8.991 1.00 0.96 O ATOM 337 CB THR A 23 -5.228 4.783 10.841 1.00 1.12 C ATOM 338 OG1 THR A 23 -5.172 4.006 12.044 1.00 1.77 O ATOM 339 CG2 THR A 23 -4.783 6.208 11.141 1.00 1.41 C ATOM 0 H THR A 23 -6.345 2.688 10.091 1.00 0.99 H new ATOM 0 HA THR A 23 -7.333 5.197 10.998 1.00 1.02 H new ATOM 0 HB THR A 23 -4.555 4.367 10.091 1.00 1.12 H new ATOM 0 HG1 THR A 23 -4.262 4.028 12.406 1.00 1.77 H new ATOM 0 HG21 THR A 23 -3.770 6.196 11.542 1.00 1.41 H new ATOM 0 HG22 THR A 23 -4.803 6.796 10.224 1.00 1.41 H new ATOM 0 HG23 THR A 23 -5.457 6.653 11.872 1.00 1.41 H new ATOM 347 N LEU A 24 -6.550 4.862 7.843 1.00 0.96 N ATOM 348 CA LEU A 24 -6.655 5.509 6.541 1.00 0.96 C ATOM 349 C LEU A 24 -8.070 6.030 6.347 1.00 0.89 C ATOM 350 O LEU A 24 -8.271 7.189 6.006 1.00 0.91 O ATOM 351 CB LEU A 24 -6.296 4.529 5.419 1.00 1.06 C ATOM 352 CG LEU A 24 -6.234 5.134 4.015 1.00 0.88 C ATOM 353 CD1 LEU A 24 -5.110 6.155 3.924 1.00 1.78 C ATOM 354 CD2 LEU A 24 -6.049 4.041 2.975 1.00 1.57 C ATOM 0 H LEU A 24 -6.338 3.865 7.805 1.00 0.96 H new ATOM 0 HA LEU A 24 -5.953 6.342 6.503 1.00 0.96 H new ATOM 0 HB2 LEU A 24 -5.329 4.081 5.646 1.00 1.06 H new ATOM 0 HB3 LEU A 24 -7.028 3.722 5.416 1.00 1.06 H new ATOM 0 HG LEU A 24 -7.177 5.644 3.815 1.00 0.88 H new ATOM 0 HD11 LEU A 24 -5.081 6.575 2.919 1.00 1.78 H new ATOM 0 HD12 LEU A 24 -5.284 6.953 4.646 1.00 1.78 H new ATOM 0 HD13 LEU A 24 -4.159 5.669 4.142 1.00 1.78 H new ATOM 0 HD21 LEU A 24 -6.007 4.487 1.982 1.00 1.57 H new ATOM 0 HD22 LEU A 24 -5.120 3.505 3.172 1.00 1.57 H new ATOM 0 HD23 LEU A 24 -6.887 3.346 3.025 1.00 1.57 H new ATOM 366 N LEU A 25 -9.037 5.162 6.611 1.00 0.88 N ATOM 367 CA LEU A 25 -10.453 5.498 6.488 1.00 0.91 C ATOM 368 C LEU A 25 -10.811 6.655 7.417 1.00 0.89 C ATOM 369 O LEU A 25 -11.512 7.587 7.036 1.00 0.92 O ATOM 370 CB LEU A 25 -11.292 4.263 6.851 1.00 1.02 C ATOM 371 CG LEU A 25 -12.787 4.320 6.504 1.00 1.21 C ATOM 372 CD1 LEU A 25 -13.345 2.916 6.306 1.00 1.76 C ATOM 373 CD2 LEU A 25 -13.572 5.032 7.594 1.00 1.96 C ATOM 0 H LEU A 25 -8.864 4.204 6.917 1.00 0.88 H new ATOM 0 HA LEU A 25 -10.662 5.802 5.462 1.00 0.91 H new ATOM 0 HB2 LEU A 25 -10.859 3.398 6.349 1.00 1.02 H new ATOM 0 HB3 LEU A 25 -11.198 4.090 7.923 1.00 1.02 H new ATOM 0 HG LEU A 25 -12.891 4.880 5.575 1.00 1.21 H new ATOM 0 HD11 LEU A 25 -14.405 2.977 6.061 1.00 1.76 H new ATOM 0 HD12 LEU A 25 -12.812 2.424 5.492 1.00 1.76 H new ATOM 0 HD13 LEU A 25 -13.217 2.341 7.223 1.00 1.76 H new ATOM 0 HD21 LEU A 25 -14.628 5.059 7.324 1.00 1.96 H new ATOM 0 HD22 LEU A 25 -13.452 4.498 8.537 1.00 1.96 H new ATOM 0 HD23 LEU A 25 -13.200 6.051 7.704 1.00 1.96 H new ATOM 385 N ASP A 26 -10.343 6.578 8.649 1.00 0.91 N ATOM 386 CA ASP A 26 -10.639 7.621 9.626 1.00 0.96 C ATOM 387 C ASP A 26 -9.996 8.952 9.250 1.00 0.92 C ATOM 388 O ASP A 26 -10.658 9.986 9.267 1.00 0.95 O ATOM 389 CB ASP A 26 -10.205 7.223 11.022 1.00 1.05 C ATOM 390 CG ASP A 26 -10.605 8.260 12.058 1.00 1.21 C ATOM 391 OD1 ASP A 26 -9.820 9.197 12.312 1.00 1.38 O ATOM 392 OD2 ASP A 26 -11.717 8.150 12.615 1.00 1.35 O ATOM 0 H ASP A 26 -9.763 5.816 8.999 1.00 0.91 H new ATOM 0 HA ASP A 26 -11.722 7.745 9.620 1.00 0.96 H new ATOM 0 HB2 ASP A 26 -10.650 6.262 11.280 1.00 1.05 H new ATOM 0 HB3 ASP A 26 -9.123 7.089 11.041 1.00 1.05 H new ATOM 397 N ALA A 27 -8.712 8.929 8.911 1.00 0.89 N ATOM 398 CA ALA A 27 -8.002 10.141 8.509 1.00 0.89 C ATOM 399 C ALA A 27 -8.614 10.730 7.255 1.00 0.85 C ATOM 400 O ALA A 27 -8.806 11.937 7.150 1.00 0.90 O ATOM 401 CB ALA A 27 -6.535 9.845 8.258 1.00 0.91 C ATOM 0 H ALA A 27 -8.140 8.085 8.906 1.00 0.89 H new ATOM 0 HA ALA A 27 -8.089 10.861 9.323 1.00 0.89 H new ATOM 0 HB1 ALA A 27 -6.025 10.761 7.960 1.00 0.91 H new ATOM 0 HB2 ALA A 27 -6.081 9.457 9.170 1.00 0.91 H new ATOM 0 HB3 ALA A 27 -6.444 9.104 7.464 1.00 0.91 H new ATOM 407 N ILE A 28 -8.924 9.858 6.313 1.00 0.82 N ATOM 408 CA ILE A 28 -9.449 10.262 5.024 1.00 0.83 C ATOM 409 C ILE A 28 -10.843 10.880 5.175 1.00 0.88 C ATOM 410 O ILE A 28 -11.191 11.824 4.467 1.00 0.94 O ATOM 411 CB ILE A 28 -9.479 9.049 4.069 1.00 0.86 C ATOM 412 CG1 ILE A 28 -9.437 9.469 2.612 1.00 0.99 C ATOM 413 CG2 ILE A 28 -10.702 8.189 4.305 1.00 1.56 C ATOM 414 CD1 ILE A 28 -9.323 8.277 1.698 1.00 0.95 C ATOM 0 H ILE A 28 -8.818 8.849 6.421 1.00 0.82 H new ATOM 0 HA ILE A 28 -8.796 11.024 4.598 1.00 0.83 H new ATOM 0 HB ILE A 28 -8.584 8.467 4.288 1.00 0.86 H new ATOM 0 HG12 ILE A 28 -10.338 10.031 2.368 1.00 0.99 H new ATOM 0 HG13 ILE A 28 -8.591 10.137 2.449 1.00 0.99 H new ATOM 0 HG21 ILE A 28 -10.691 7.344 3.616 1.00 1.56 H new ATOM 0 HG22 ILE A 28 -10.695 7.821 5.331 1.00 1.56 H new ATOM 0 HG23 ILE A 28 -11.601 8.782 4.138 1.00 1.56 H new ATOM 0 HD11 ILE A 28 -9.295 8.614 0.662 1.00 0.95 H new ATOM 0 HD12 ILE A 28 -8.408 7.730 1.926 1.00 0.95 H new ATOM 0 HD13 ILE A 28 -10.183 7.623 1.844 1.00 0.95 H new ATOM 426 N ARG A 29 -11.622 10.369 6.122 1.00 0.93 N ATOM 427 CA ARG A 29 -12.946 10.906 6.393 1.00 1.04 C ATOM 428 C ARG A 29 -12.808 12.180 7.213 1.00 1.08 C ATOM 429 O ARG A 29 -13.529 13.154 7.017 1.00 1.17 O ATOM 430 CB ARG A 29 -13.808 9.856 7.107 1.00 1.16 C ATOM 431 CG ARG A 29 -13.551 9.681 8.594 1.00 1.33 C ATOM 432 CD ARG A 29 -14.356 8.510 9.136 1.00 1.58 C ATOM 433 NE ARG A 29 -13.922 8.086 10.467 1.00 2.13 N ATOM 434 CZ ARG A 29 -14.447 7.050 11.124 1.00 2.85 C ATOM 435 NH1 ARG A 29 -15.422 6.332 10.582 1.00 3.29 N ATOM 436 NH2 ARG A 29 -13.975 6.720 12.316 1.00 3.56 N ATOM 0 H ARG A 29 -11.357 9.582 6.715 1.00 0.93 H new ATOM 0 HA ARG A 29 -13.449 11.153 5.458 1.00 1.04 H new ATOM 0 HB2 ARG A 29 -14.856 10.121 6.969 1.00 1.16 H new ATOM 0 HB3 ARG A 29 -13.655 8.895 6.617 1.00 1.16 H new ATOM 0 HG2 ARG A 29 -12.488 9.512 8.769 1.00 1.33 H new ATOM 0 HG3 ARG A 29 -13.820 10.593 9.126 1.00 1.33 H new ATOM 0 HD2 ARG A 29 -15.409 8.787 9.174 1.00 1.58 H new ATOM 0 HD3 ARG A 29 -14.273 7.669 8.448 1.00 1.58 H new ATOM 0 HE ARG A 29 -13.175 8.613 10.919 1.00 2.13 H new ATOM 0 HH11 ARG A 29 -15.776 6.570 9.656 1.00 3.29 H new ATOM 0 HH12 ARG A 29 -15.817 5.542 11.092 1.00 3.29 H new ATOM 0 HH21 ARG A 29 -13.213 7.257 12.729 1.00 3.56 H new ATOM 0 HH22 ARG A 29 -14.374 5.929 12.821 1.00 3.56 H new ATOM 450 N HIS A 30 -11.827 12.165 8.101 1.00 1.05 N ATOM 451 CA HIS A 30 -11.464 13.343 8.889 1.00 1.13 C ATOM 452 C HIS A 30 -10.676 14.355 8.057 1.00 1.15 C ATOM 453 O HIS A 30 -10.058 15.266 8.599 1.00 1.32 O ATOM 454 CB HIS A 30 -10.653 12.948 10.116 1.00 1.23 C ATOM 455 CG HIS A 30 -11.464 12.613 11.311 1.00 1.70 C ATOM 456 ND1 HIS A 30 -11.309 11.465 12.056 1.00 2.44 N ATOM 457 CD2 HIS A 30 -12.431 13.312 11.897 1.00 2.01 C ATOM 458 CE1 HIS A 30 -12.161 11.485 13.063 1.00 2.88 C ATOM 459 NE2 HIS A 30 -12.859 12.602 12.994 1.00 2.60 N ATOM 0 H HIS A 30 -11.259 11.341 8.299 1.00 1.05 H new ATOM 0 HA HIS A 30 -12.394 13.811 9.211 1.00 1.13 H new ATOM 0 HB2 HIS A 30 -10.031 12.089 9.863 1.00 1.23 H new ATOM 0 HB3 HIS A 30 -9.979 13.767 10.369 1.00 1.23 H new ATOM 0 HD1 HIS A 30 -10.642 10.719 11.860 1.00 2.44 H new ATOM 0 HD2 HIS A 30 -12.813 14.268 11.570 1.00 2.01 H new ATOM 0 HE1 HIS A 30 -12.269 10.718 13.815 1.00 2.88 H new ATOM 468 N SER A 31 -10.694 14.185 6.739 1.00 1.07 N ATOM 469 CA SER A 31 -10.034 15.110 5.841 1.00 1.19 C ATOM 470 C SER A 31 -11.059 16.088 5.280 1.00 1.32 C ATOM 471 O SER A 31 -10.793 16.794 4.311 1.00 1.76 O ATOM 472 CB SER A 31 -9.298 14.352 4.726 1.00 1.15 C ATOM 473 OG SER A 31 -8.219 13.604 5.254 1.00 1.50 O ATOM 0 H SER A 31 -11.163 13.409 6.272 1.00 1.07 H new ATOM 0 HA SER A 31 -9.282 15.678 6.390 1.00 1.19 H new ATOM 0 HB2 SER A 31 -9.992 13.686 4.214 1.00 1.15 H new ATOM 0 HB3 SER A 31 -8.928 15.058 3.983 1.00 1.15 H new ATOM 0 HG SER A 31 -8.559 12.954 5.904 1.00 1.50 H new ATOM 479 N LYS A 32 -12.253 16.060 5.901 1.00 1.43 N ATOM 480 CA LYS A 32 -13.320 17.079 5.762 1.00 1.81 C ATOM 481 C LYS A 32 -13.812 17.312 4.326 1.00 1.37 C ATOM 482 O LYS A 32 -14.674 18.157 4.092 1.00 1.78 O ATOM 483 CB LYS A 32 -12.894 18.402 6.413 1.00 2.82 C ATOM 484 CG LYS A 32 -11.749 19.109 5.706 1.00 3.53 C ATOM 485 CD LYS A 32 -10.710 19.634 6.683 1.00 4.33 C ATOM 486 CE LYS A 32 -11.330 20.480 7.782 1.00 5.18 C ATOM 487 NZ LYS A 32 -12.136 21.605 7.239 1.00 5.71 N ATOM 0 H LYS A 32 -12.514 15.305 6.535 1.00 1.43 H new ATOM 0 HA LYS A 32 -14.179 16.665 6.291 1.00 1.81 H new ATOM 0 HB2 LYS A 32 -13.754 19.071 6.445 1.00 2.82 H new ATOM 0 HB3 LYS A 32 -12.603 18.208 7.445 1.00 2.82 H new ATOM 0 HG2 LYS A 32 -11.274 18.420 5.008 1.00 3.53 H new ATOM 0 HG3 LYS A 32 -12.143 19.937 5.117 1.00 3.53 H new ATOM 0 HD2 LYS A 32 -10.178 18.795 7.130 1.00 4.33 H new ATOM 0 HD3 LYS A 32 -9.973 20.228 6.142 1.00 4.33 H new ATOM 0 HE2 LYS A 32 -11.963 19.851 8.408 1.00 5.18 H new ATOM 0 HE3 LYS A 32 -10.541 20.876 8.422 1.00 5.18 H new ATOM 0 HZ1 LYS A 32 -12.426 22.231 8.017 1.00 5.71 H new ATOM 0 HZ2 LYS A 32 -11.565 22.143 6.556 1.00 5.71 H new ATOM 0 HZ3 LYS A 32 -12.981 21.229 6.764 1.00 5.71 H new ATOM 501 N VAL A 33 -13.272 16.580 3.371 1.00 1.59 N ATOM 502 CA VAL A 33 -13.792 16.600 2.009 1.00 1.75 C ATOM 503 C VAL A 33 -14.645 15.367 1.782 1.00 1.88 C ATOM 504 O VAL A 33 -15.192 15.153 0.701 1.00 2.52 O ATOM 505 CB VAL A 33 -12.663 16.608 0.954 1.00 2.22 C ATOM 506 CG1 VAL A 33 -11.710 17.770 1.183 1.00 2.95 C ATOM 507 CG2 VAL A 33 -11.921 15.277 0.965 1.00 2.99 C ATOM 0 H VAL A 33 -12.472 15.962 3.509 1.00 1.59 H new ATOM 0 HA VAL A 33 -14.376 17.514 1.896 1.00 1.75 H new ATOM 0 HB VAL A 33 -13.112 16.742 -0.030 1.00 2.22 H new ATOM 0 HG11 VAL A 33 -10.925 17.752 0.427 1.00 2.95 H new ATOM 0 HG12 VAL A 33 -12.258 18.709 1.114 1.00 2.95 H new ATOM 0 HG13 VAL A 33 -11.262 17.683 2.173 1.00 2.95 H new ATOM 0 HG21 VAL A 33 -11.128 15.296 0.217 1.00 2.99 H new ATOM 0 HG22 VAL A 33 -11.486 15.111 1.951 1.00 2.99 H new ATOM 0 HG23 VAL A 33 -12.617 14.470 0.735 1.00 2.99 H new ATOM 517 N THR A 34 -14.758 14.565 2.821 1.00 1.80 N ATOM 518 CA THR A 34 -15.294 13.234 2.685 1.00 2.15 C ATOM 519 C THR A 34 -16.537 13.032 3.530 1.00 1.77 C ATOM 520 O THR A 34 -16.717 13.655 4.580 1.00 2.24 O ATOM 521 CB THR A 34 -14.243 12.200 3.113 1.00 3.04 C ATOM 522 OG1 THR A 34 -12.945 12.618 2.675 1.00 3.73 O ATOM 523 CG2 THR A 34 -14.554 10.829 2.538 1.00 3.93 C ATOM 0 H THR A 34 -14.484 14.817 3.771 1.00 1.80 H new ATOM 0 HA THR A 34 -15.561 13.102 1.636 1.00 2.15 H new ATOM 0 HB THR A 34 -14.262 12.129 4.201 1.00 3.04 H new ATOM 0 HG1 THR A 34 -12.263 12.033 3.067 1.00 3.73 H new ATOM 0 HG21 THR A 34 -13.792 10.119 2.859 1.00 3.93 H new ATOM 0 HG22 THR A 34 -15.530 10.499 2.893 1.00 3.93 H new ATOM 0 HG23 THR A 34 -14.563 10.885 1.449 1.00 3.93 H new ATOM 531 N GLU A 35 -17.384 12.151 3.044 1.00 1.44 N ATOM 532 CA GLU A 35 -18.527 11.669 3.792 1.00 1.66 C ATOM 533 C GLU A 35 -18.071 10.534 4.702 1.00 1.86 C ATOM 534 O GLU A 35 -16.871 10.370 4.926 1.00 2.52 O ATOM 535 CB GLU A 35 -19.614 11.186 2.836 1.00 2.22 C ATOM 536 CG GLU A 35 -20.177 12.279 1.941 1.00 3.01 C ATOM 537 CD GLU A 35 -21.389 11.821 1.158 1.00 3.69 C ATOM 538 OE1 GLU A 35 -21.220 11.305 0.034 1.00 4.12 O ATOM 539 OE2 GLU A 35 -22.522 11.980 1.662 1.00 4.20 O ATOM 0 H GLU A 35 -17.299 11.745 2.112 1.00 1.44 H new ATOM 0 HA GLU A 35 -18.943 12.475 4.396 1.00 1.66 H new ATOM 0 HB2 GLU A 35 -19.207 10.391 2.211 1.00 2.22 H new ATOM 0 HB3 GLU A 35 -20.427 10.750 3.416 1.00 2.22 H new ATOM 0 HG2 GLU A 35 -20.447 13.141 2.552 1.00 3.01 H new ATOM 0 HG3 GLU A 35 -19.404 12.610 1.247 1.00 3.01 H new ATOM 546 N GLN A 36 -19.006 9.734 5.202 1.00 1.82 N ATOM 547 CA GLN A 36 -18.658 8.650 6.114 1.00 2.41 C ATOM 548 C GLN A 36 -19.885 7.847 6.516 1.00 2.32 C ATOM 549 O GLN A 36 -21.012 8.155 6.122 1.00 2.74 O ATOM 550 CB GLN A 36 -17.975 9.174 7.386 1.00 3.30 C ATOM 551 CG GLN A 36 -18.882 10.008 8.279 1.00 3.71 C ATOM 552 CD GLN A 36 -18.307 10.203 9.669 1.00 4.77 C ATOM 553 OE1 GLN A 36 -18.540 11.224 10.313 1.00 5.34 O ATOM 554 NE2 GLN A 36 -17.573 9.212 10.152 1.00 5.38 N ATOM 0 H GLN A 36 -20.001 9.814 4.994 1.00 1.82 H new ATOM 0 HA GLN A 36 -17.963 8.007 5.574 1.00 2.41 H new ATOM 0 HB2 GLN A 36 -17.598 8.327 7.959 1.00 3.30 H new ATOM 0 HB3 GLN A 36 -17.111 9.775 7.101 1.00 3.30 H new ATOM 0 HG2 GLN A 36 -19.046 10.982 7.817 1.00 3.71 H new ATOM 0 HG3 GLN A 36 -19.855 9.524 8.356 1.00 3.71 H new ATOM 0 HE21 GLN A 36 -17.402 8.381 9.586 1.00 5.38 H new ATOM 0 HE22 GLN A 36 -17.178 9.280 11.090 1.00 5.38 H new ATOM 563 N GLU A 37 -19.629 6.823 7.310 1.00 2.52 N ATOM 564 CA GLU A 37 -20.651 5.967 7.873 1.00 2.96 C ATOM 565 C GLU A 37 -20.013 5.245 9.059 1.00 3.08 C ATOM 566 O GLU A 37 -18.845 5.500 9.357 1.00 3.74 O ATOM 567 CB GLU A 37 -21.155 4.983 6.804 1.00 3.77 C ATOM 568 CG GLU A 37 -22.416 4.226 7.187 1.00 4.29 C ATOM 569 CD GLU A 37 -23.540 5.149 7.602 1.00 5.23 C ATOM 570 OE1 GLU A 37 -24.098 5.845 6.731 1.00 5.67 O ATOM 571 OE2 GLU A 37 -23.871 5.177 8.804 1.00 5.79 O ATOM 0 H GLU A 37 -18.683 6.560 7.586 1.00 2.52 H new ATOM 0 HA GLU A 37 -21.519 6.535 8.209 1.00 2.96 H new ATOM 0 HB2 GLU A 37 -21.343 5.533 5.882 1.00 3.77 H new ATOM 0 HB3 GLU A 37 -20.365 4.263 6.590 1.00 3.77 H new ATOM 0 HG2 GLU A 37 -22.742 3.618 6.343 1.00 4.29 H new ATOM 0 HG3 GLU A 37 -22.191 3.541 8.005 1.00 4.29 H new ATOM 578 N ALA A 38 -20.757 4.376 9.739 1.00 2.92 N ATOM 579 CA ALA A 38 -20.206 3.624 10.865 1.00 3.44 C ATOM 580 C ALA A 38 -19.121 2.660 10.390 1.00 3.42 C ATOM 581 O ALA A 38 -19.408 1.518 10.032 1.00 3.69 O ATOM 582 CB ALA A 38 -21.312 2.871 11.595 1.00 4.24 C ATOM 0 H ALA A 38 -21.736 4.176 9.533 1.00 2.92 H new ATOM 0 HA ALA A 38 -19.753 4.330 11.561 1.00 3.44 H new ATOM 0 HB1 ALA A 38 -20.884 2.316 12.430 1.00 4.24 H new ATOM 0 HB2 ALA A 38 -22.049 3.581 11.970 1.00 4.24 H new ATOM 0 HB3 ALA A 38 -21.794 2.176 10.907 1.00 4.24 H new ATOM 588 N GLY A 39 -17.879 3.134 10.383 1.00 3.60 N ATOM 589 CA GLY A 39 -16.779 2.357 9.849 1.00 3.96 C ATOM 590 C GLY A 39 -15.678 2.145 10.869 1.00 4.53 C ATOM 591 O GLY A 39 -15.253 3.087 11.544 1.00 4.95 O ATOM 0 H GLY A 39 -17.615 4.052 10.742 1.00 3.60 H new ATOM 0 HA2 GLY A 39 -17.150 1.389 9.512 1.00 3.96 H new ATOM 0 HA3 GLY A 39 -16.369 2.864 8.975 1.00 3.96 H new ATOM 595 N GLY A 40 -15.222 0.906 10.985 1.00 4.95 N ATOM 596 CA GLY A 40 -14.178 0.568 11.933 1.00 5.80 C ATOM 597 C GLY A 40 -14.433 -0.785 12.557 1.00 6.36 C ATOM 598 O GLY A 40 -14.201 -1.816 11.925 1.00 6.66 O ATOM 0 H GLY A 40 -15.561 0.119 10.432 1.00 4.95 H new ATOM 0 HA2 GLY A 40 -13.211 0.564 11.429 1.00 5.80 H new ATOM 0 HA3 GLY A 40 -14.129 1.329 12.712 1.00 5.80 H new ATOM 602 N ILE A 41 -14.918 -0.781 13.796 1.00 6.77 N ATOM 603 CA ILE A 41 -15.381 -2.007 14.434 1.00 7.49 C ATOM 604 C ILE A 41 -16.579 -2.540 13.662 1.00 7.34 C ATOM 605 O ILE A 41 -16.745 -3.747 13.479 1.00 7.90 O ATOM 606 CB ILE A 41 -15.786 -1.771 15.907 1.00 8.32 C ATOM 607 CG1 ILE A 41 -14.630 -1.142 16.685 1.00 8.45 C ATOM 608 CG2 ILE A 41 -16.211 -3.082 16.557 1.00 9.17 C ATOM 609 CD1 ILE A 41 -14.974 -0.789 18.118 1.00 9.07 C ATOM 0 H ILE A 41 -15.000 0.055 14.375 1.00 6.77 H new ATOM 0 HA ILE A 41 -14.563 -2.727 14.425 1.00 7.49 H new ATOM 0 HB ILE A 41 -16.631 -1.083 15.927 1.00 8.32 H new ATOM 0 HG12 ILE A 41 -13.786 -1.832 16.684 1.00 8.45 H new ATOM 0 HG13 ILE A 41 -14.305 -0.240 16.167 1.00 8.45 H new ATOM 0 HG21 ILE A 41 -16.493 -2.899 17.594 1.00 9.17 H new ATOM 0 HG22 ILE A 41 -17.062 -3.497 16.017 1.00 9.17 H new ATOM 0 HG23 ILE A 41 -15.382 -3.789 16.526 1.00 9.17 H new ATOM 0 HD11 ILE A 41 -14.103 -0.348 18.603 1.00 9.07 H new ATOM 0 HD12 ILE A 41 -15.797 -0.074 18.129 1.00 9.07 H new ATOM 0 HD13 ILE A 41 -15.270 -1.691 18.654 1.00 9.07 H new ATOM 621 N THR A 42 -17.404 -1.614 13.201 1.00 6.77 N ATOM 622 CA THR A 42 -18.523 -1.938 12.344 1.00 6.78 C ATOM 623 C THR A 42 -18.030 -2.140 10.917 1.00 6.26 C ATOM 624 O THR A 42 -17.681 -1.177 10.235 1.00 6.12 O ATOM 625 CB THR A 42 -19.569 -0.811 12.361 1.00 6.87 C ATOM 626 OG1 THR A 42 -19.750 -0.337 13.704 1.00 7.36 O ATOM 627 CG2 THR A 42 -20.899 -1.297 11.807 1.00 7.24 C ATOM 0 H THR A 42 -17.314 -0.620 13.412 1.00 6.77 H new ATOM 0 HA THR A 42 -18.986 -2.853 12.714 1.00 6.78 H new ATOM 0 HB THR A 42 -19.208 0.002 11.731 1.00 6.87 H new ATOM 0 HG1 THR A 42 -20.416 0.382 13.710 1.00 7.36 H new ATOM 0 HG21 THR A 42 -21.622 -0.482 11.830 1.00 7.24 H new ATOM 0 HG22 THR A 42 -20.764 -1.634 10.779 1.00 7.24 H new ATOM 0 HG23 THR A 42 -21.266 -2.124 12.415 1.00 7.24 H new ATOM 635 N GLN A 43 -17.971 -3.385 10.480 1.00 6.30 N ATOM 636 CA GLN A 43 -17.507 -3.684 9.135 1.00 6.20 C ATOM 637 C GLN A 43 -18.623 -4.316 8.309 1.00 5.65 C ATOM 638 O GLN A 43 -18.407 -5.246 7.529 1.00 6.00 O ATOM 639 CB GLN A 43 -16.255 -4.564 9.182 1.00 7.05 C ATOM 640 CG GLN A 43 -16.408 -5.837 9.993 1.00 7.68 C ATOM 641 CD GLN A 43 -15.069 -6.390 10.449 1.00 8.40 C ATOM 642 OE1 GLN A 43 -14.893 -7.602 10.566 1.00 8.83 O ATOM 643 NE2 GLN A 43 -14.125 -5.504 10.733 1.00 8.79 N ATOM 0 H GLN A 43 -18.236 -4.201 11.031 1.00 6.30 H new ATOM 0 HA GLN A 43 -17.230 -2.752 8.642 1.00 6.20 H new ATOM 0 HB2 GLN A 43 -15.975 -4.830 8.163 1.00 7.05 H new ATOM 0 HB3 GLN A 43 -15.433 -3.981 9.597 1.00 7.05 H new ATOM 0 HG2 GLN A 43 -17.033 -5.638 10.864 1.00 7.68 H new ATOM 0 HG3 GLN A 43 -16.925 -6.587 9.395 1.00 7.68 H new ATOM 0 HE21 GLN A 43 -14.311 -4.507 10.622 1.00 8.79 H new ATOM 0 HE22 GLN A 43 -13.212 -5.819 11.062 1.00 8.79 H new ATOM 652 N HIS A 44 -19.829 -3.809 8.522 1.00 5.11 N ATOM 653 CA HIS A 44 -20.973 -4.132 7.674 1.00 4.88 C ATOM 654 C HIS A 44 -21.222 -2.949 6.750 1.00 4.31 C ATOM 655 O HIS A 44 -21.718 -3.092 5.632 1.00 4.61 O ATOM 656 CB HIS A 44 -22.233 -4.392 8.507 1.00 5.23 C ATOM 657 CG HIS A 44 -22.109 -5.485 9.517 1.00 5.70 C ATOM 658 ND1 HIS A 44 -22.590 -6.758 9.321 1.00 6.04 N ATOM 659 CD2 HIS A 44 -21.583 -5.471 10.759 1.00 6.21 C ATOM 660 CE1 HIS A 44 -22.366 -7.480 10.400 1.00 6.66 C ATOM 661 NE2 HIS A 44 -21.753 -6.725 11.293 1.00 6.76 N ATOM 0 H HIS A 44 -20.044 -3.165 9.283 1.00 5.11 H new ATOM 0 HA HIS A 44 -20.752 -5.038 7.109 1.00 4.88 H new ATOM 0 HB2 HIS A 44 -22.506 -3.471 9.022 1.00 5.23 H new ATOM 0 HB3 HIS A 44 -23.053 -4.634 7.831 1.00 5.23 H new ATOM 0 HD2 HIS A 44 -21.114 -4.628 11.245 1.00 6.21 H new ATOM 0 HE1 HIS A 44 -22.638 -8.517 10.532 1.00 6.66 H new ATOM 0 HE2 HIS A 44 -21.456 -7.023 12.222 1.00 6.76 H new ATOM 670 N ILE A 45 -20.862 -1.779 7.259 1.00 3.86 N ATOM 671 CA ILE A 45 -20.990 -0.513 6.554 1.00 3.48 C ATOM 672 C ILE A 45 -19.791 0.352 6.888 1.00 3.02 C ATOM 673 O ILE A 45 -18.793 -0.143 7.403 1.00 3.28 O ATOM 674 CB ILE A 45 -22.281 0.246 6.946 1.00 3.98 C ATOM 675 CG1 ILE A 45 -22.421 0.316 8.471 1.00 4.52 C ATOM 676 CG2 ILE A 45 -23.503 -0.404 6.313 1.00 4.50 C ATOM 677 CD1 ILE A 45 -23.607 1.130 8.933 1.00 5.19 C ATOM 0 H ILE A 45 -20.465 -1.682 8.193 1.00 3.86 H new ATOM 0 HA ILE A 45 -21.040 -0.726 5.486 1.00 3.48 H new ATOM 0 HB ILE A 45 -22.211 1.265 6.565 1.00 3.98 H new ATOM 0 HG12 ILE A 45 -22.509 -0.696 8.866 1.00 4.52 H new ATOM 0 HG13 ILE A 45 -21.511 0.744 8.892 1.00 4.52 H new ATOM 0 HG21 ILE A 45 -24.399 0.146 6.602 1.00 4.50 H new ATOM 0 HG22 ILE A 45 -23.402 -0.389 5.228 1.00 4.50 H new ATOM 0 HG23 ILE A 45 -23.585 -1.436 6.655 1.00 4.50 H new ATOM 0 HD11 ILE A 45 -23.643 1.135 10.022 1.00 5.19 H new ATOM 0 HD12 ILE A 45 -23.511 2.153 8.568 1.00 5.19 H new ATOM 0 HD13 ILE A 45 -24.525 0.690 8.542 1.00 5.19 H new ATOM 689 N GLY A 46 -19.889 1.634 6.598 1.00 2.83 N ATOM 690 CA GLY A 46 -18.825 2.544 6.967 1.00 2.96 C ATOM 691 C GLY A 46 -18.169 3.194 5.774 1.00 2.37 C ATOM 692 O GLY A 46 -17.172 3.900 5.918 1.00 2.97 O ATOM 0 H GLY A 46 -20.679 2.063 6.117 1.00 2.83 H new ATOM 0 HA2 GLY A 46 -19.226 3.318 7.621 1.00 2.96 H new ATOM 0 HA3 GLY A 46 -18.072 2.002 7.539 1.00 2.96 H new ATOM 696 N ALA A 47 -18.733 2.969 4.598 1.00 1.69 N ATOM 697 CA ALA A 47 -18.182 3.532 3.381 1.00 1.33 C ATOM 698 C ALA A 47 -18.437 5.034 3.302 1.00 1.25 C ATOM 699 O ALA A 47 -19.203 5.595 4.090 1.00 1.45 O ATOM 700 CB ALA A 47 -18.745 2.834 2.159 1.00 1.71 C ATOM 0 H ALA A 47 -19.570 2.402 4.463 1.00 1.69 H new ATOM 0 HA ALA A 47 -17.104 3.373 3.403 1.00 1.33 H new ATOM 0 HB1 ALA A 47 -18.316 3.274 1.259 1.00 1.71 H new ATOM 0 HB2 ALA A 47 -18.496 1.774 2.198 1.00 1.71 H new ATOM 0 HB3 ALA A 47 -19.828 2.951 2.140 1.00 1.71 H new ATOM 706 N TYR A 48 -17.802 5.671 2.330 1.00 1.05 N ATOM 707 CA TYR A 48 -17.751 7.120 2.261 1.00 1.04 C ATOM 708 C TYR A 48 -17.352 7.570 0.863 1.00 0.91 C ATOM 709 O TYR A 48 -16.767 6.800 0.099 1.00 0.86 O ATOM 710 CB TYR A 48 -16.744 7.644 3.284 1.00 1.16 C ATOM 711 CG TYR A 48 -15.427 6.904 3.268 1.00 1.12 C ATOM 712 CD1 TYR A 48 -15.335 5.620 3.779 1.00 1.34 C ATOM 713 CD2 TYR A 48 -14.283 7.482 2.748 1.00 1.31 C ATOM 714 CE1 TYR A 48 -14.147 4.932 3.771 1.00 1.77 C ATOM 715 CE2 TYR A 48 -13.084 6.802 2.739 1.00 1.73 C ATOM 716 CZ TYR A 48 -13.019 5.527 3.256 1.00 1.96 C ATOM 717 OH TYR A 48 -11.823 4.847 3.256 1.00 2.54 O ATOM 0 H TYR A 48 -17.310 5.199 1.571 1.00 1.05 H new ATOM 0 HA TYR A 48 -18.739 7.521 2.486 1.00 1.04 H new ATOM 0 HB2 TYR A 48 -16.560 8.701 3.092 1.00 1.16 H new ATOM 0 HB3 TYR A 48 -17.180 7.572 4.280 1.00 1.16 H new ATOM 0 HD1 TYR A 48 -16.216 5.151 4.192 1.00 1.34 H new ATOM 0 HD2 TYR A 48 -14.330 8.482 2.343 1.00 1.31 H new ATOM 0 HE1 TYR A 48 -14.098 3.928 4.167 1.00 1.77 H new ATOM 0 HE2 TYR A 48 -12.200 7.267 2.329 1.00 1.73 H new ATOM 0 HH TYR A 48 -11.192 5.294 2.654 1.00 2.54 H new ATOM 727 N GLN A 49 -17.671 8.813 0.528 1.00 1.01 N ATOM 728 CA GLN A 49 -17.292 9.377 -0.760 1.00 1.00 C ATOM 729 C GLN A 49 -16.520 10.674 -0.558 1.00 1.11 C ATOM 730 O GLN A 49 -16.883 11.495 0.286 1.00 1.34 O ATOM 731 CB GLN A 49 -18.527 9.641 -1.620 1.00 1.16 C ATOM 732 CG GLN A 49 -19.355 8.399 -1.900 1.00 1.18 C ATOM 733 CD GLN A 49 -20.529 8.680 -2.816 1.00 1.42 C ATOM 734 OE1 GLN A 49 -20.416 8.570 -4.036 1.00 1.80 O ATOM 735 NE2 GLN A 49 -21.659 9.053 -2.236 1.00 1.96 N ATOM 0 H GLN A 49 -18.192 9.450 1.131 1.00 1.01 H new ATOM 0 HA GLN A 49 -16.656 8.656 -1.274 1.00 1.00 H new ATOM 0 HB2 GLN A 49 -19.154 10.380 -1.121 1.00 1.16 H new ATOM 0 HB3 GLN A 49 -18.212 10.078 -2.568 1.00 1.16 H new ATOM 0 HG2 GLN A 49 -18.720 7.637 -2.352 1.00 1.18 H new ATOM 0 HG3 GLN A 49 -19.722 7.991 -0.958 1.00 1.18 H new ATOM 0 HE21 GLN A 49 -21.709 9.131 -1.220 1.00 1.96 H new ATOM 0 HE22 GLN A 49 -22.479 9.262 -2.805 1.00 1.96 H new ATOM 744 N VAL A 50 -15.448 10.847 -1.317 1.00 1.04 N ATOM 745 CA VAL A 50 -14.649 12.053 -1.235 1.00 1.18 C ATOM 746 C VAL A 50 -15.096 13.085 -2.255 1.00 1.28 C ATOM 747 O VAL A 50 -15.515 12.746 -3.362 1.00 1.38 O ATOM 748 CB VAL A 50 -13.156 11.764 -1.455 1.00 1.24 C ATOM 749 CG1 VAL A 50 -12.549 11.114 -0.229 1.00 1.93 C ATOM 750 CG2 VAL A 50 -12.946 10.902 -2.689 1.00 1.59 C ATOM 0 H VAL A 50 -15.114 10.164 -1.997 1.00 1.04 H new ATOM 0 HA VAL A 50 -14.794 12.446 -0.229 1.00 1.18 H new ATOM 0 HB VAL A 50 -12.647 12.714 -1.620 1.00 1.24 H new ATOM 0 HG11 VAL A 50 -11.492 10.918 -0.407 1.00 1.93 H new ATOM 0 HG12 VAL A 50 -12.656 11.781 0.627 1.00 1.93 H new ATOM 0 HG13 VAL A 50 -13.062 10.175 -0.023 1.00 1.93 H new ATOM 0 HG21 VAL A 50 -11.881 10.712 -2.823 1.00 1.59 H new ATOM 0 HG22 VAL A 50 -13.471 9.955 -2.565 1.00 1.59 H new ATOM 0 HG23 VAL A 50 -13.335 11.420 -3.565 1.00 1.59 H new ATOM 760 N THR A 51 -15.013 14.341 -1.870 1.00 1.42 N ATOM 761 CA THR A 51 -15.289 15.432 -2.780 1.00 1.57 C ATOM 762 C THR A 51 -13.986 16.108 -3.181 1.00 1.83 C ATOM 763 O THR A 51 -13.577 17.113 -2.600 1.00 2.06 O ATOM 764 CB THR A 51 -16.238 16.465 -2.155 1.00 1.67 C ATOM 765 OG1 THR A 51 -17.389 15.800 -1.617 1.00 1.94 O ATOM 766 CG2 THR A 51 -16.676 17.485 -3.193 1.00 1.88 C ATOM 0 H THR A 51 -14.755 14.633 -0.927 1.00 1.42 H new ATOM 0 HA THR A 51 -15.779 15.018 -3.661 1.00 1.57 H new ATOM 0 HB THR A 51 -15.709 16.985 -1.356 1.00 1.67 H new ATOM 0 HG1 THR A 51 -17.992 16.461 -1.217 1.00 1.94 H new ATOM 0 HG21 THR A 51 -17.348 18.208 -2.731 1.00 1.88 H new ATOM 0 HG22 THR A 51 -15.801 18.002 -3.587 1.00 1.88 H new ATOM 0 HG23 THR A 51 -17.194 16.977 -4.007 1.00 1.88 H new ATOM 774 N VAL A 52 -13.331 15.518 -4.158 1.00 2.18 N ATOM 775 CA VAL A 52 -12.120 16.072 -4.726 1.00 2.71 C ATOM 776 C VAL A 52 -12.238 16.034 -6.242 1.00 2.73 C ATOM 777 O VAL A 52 -12.483 14.969 -6.817 1.00 2.83 O ATOM 778 CB VAL A 52 -10.860 15.313 -4.253 1.00 3.49 C ATOM 779 CG1 VAL A 52 -10.966 13.821 -4.546 1.00 4.12 C ATOM 780 CG2 VAL A 52 -9.617 15.901 -4.890 1.00 3.97 C ATOM 0 H VAL A 52 -13.624 14.638 -4.582 1.00 2.18 H new ATOM 0 HA VAL A 52 -12.007 17.101 -4.385 1.00 2.71 H new ATOM 0 HB VAL A 52 -10.784 15.430 -3.172 1.00 3.49 H new ATOM 0 HG11 VAL A 52 -10.063 13.317 -4.201 1.00 4.12 H new ATOM 0 HG12 VAL A 52 -11.832 13.409 -4.028 1.00 4.12 H new ATOM 0 HG13 VAL A 52 -11.079 13.668 -5.619 1.00 4.12 H new ATOM 0 HG21 VAL A 52 -8.739 15.355 -4.546 1.00 3.97 H new ATOM 0 HG22 VAL A 52 -9.692 15.822 -5.975 1.00 3.97 H new ATOM 0 HG23 VAL A 52 -9.525 16.950 -4.608 1.00 3.97 H new ATOM 790 N ASN A 53 -12.163 17.218 -6.870 1.00 2.87 N ATOM 791 CA ASN A 53 -12.414 17.373 -8.314 1.00 2.97 C ATOM 792 C ASN A 53 -13.905 17.215 -8.591 1.00 2.55 C ATOM 793 O ASN A 53 -14.400 17.480 -9.689 1.00 2.91 O ATOM 794 CB ASN A 53 -11.647 16.332 -9.091 1.00 3.48 C ATOM 795 CG ASN A 53 -11.212 16.799 -10.467 1.00 3.97 C ATOM 796 OD1 ASN A 53 -11.971 16.708 -11.435 1.00 4.43 O ATOM 797 ND2 ASN A 53 -9.980 17.274 -10.576 1.00 4.21 N ATOM 0 H ASN A 53 -11.928 18.090 -6.396 1.00 2.87 H new ATOM 0 HA ASN A 53 -12.084 18.364 -8.626 1.00 2.97 H new ATOM 0 HB2 ASN A 53 -10.765 16.041 -8.520 1.00 3.48 H new ATOM 0 HB3 ASN A 53 -12.266 15.441 -9.198 1.00 3.48 H new ATOM 0 HD21 ASN A 53 -9.630 17.580 -11.484 1.00 4.21 H new ATOM 0 HD22 ASN A 53 -9.382 17.334 -9.752 1.00 4.21 H new ATOM 804 N ASP A 54 -14.573 16.767 -7.544 1.00 2.17 N ATOM 805 CA ASP A 54 -15.996 16.418 -7.529 1.00 2.21 C ATOM 806 C ASP A 54 -16.206 15.088 -8.230 1.00 2.44 C ATOM 807 O ASP A 54 -17.258 14.810 -8.803 1.00 3.17 O ATOM 808 CB ASP A 54 -16.890 17.501 -8.106 1.00 2.57 C ATOM 809 CG ASP A 54 -18.355 17.260 -7.782 1.00 3.06 C ATOM 810 OD1 ASP A 54 -18.669 16.978 -6.604 1.00 3.62 O ATOM 811 OD2 ASP A 54 -19.203 17.329 -8.701 1.00 3.37 O ATOM 0 H ASP A 54 -14.126 16.628 -6.638 1.00 2.17 H new ATOM 0 HA ASP A 54 -16.295 16.326 -6.485 1.00 2.21 H new ATOM 0 HB2 ASP A 54 -16.586 18.471 -7.712 1.00 2.57 H new ATOM 0 HB3 ASP A 54 -16.759 17.541 -9.187 1.00 2.57 H new ATOM 816 N LYS A 55 -15.172 14.269 -8.182 1.00 2.26 N ATOM 817 CA LYS A 55 -15.279 12.895 -8.613 1.00 2.71 C ATOM 818 C LYS A 55 -15.592 12.065 -7.381 1.00 2.17 C ATOM 819 O LYS A 55 -14.711 11.804 -6.561 1.00 2.81 O ATOM 820 CB LYS A 55 -13.981 12.420 -9.282 1.00 3.83 C ATOM 821 CG LYS A 55 -14.167 11.202 -10.177 1.00 4.80 C ATOM 822 CD LYS A 55 -15.112 11.512 -11.329 1.00 5.76 C ATOM 823 CE LYS A 55 -15.370 10.294 -12.204 1.00 6.66 C ATOM 824 NZ LYS A 55 -14.165 9.874 -12.968 1.00 7.44 N ATOM 0 H LYS A 55 -14.247 14.536 -7.847 1.00 2.26 H new ATOM 0 HA LYS A 55 -16.067 12.789 -9.358 1.00 2.71 H new ATOM 0 HB2 LYS A 55 -13.568 13.236 -9.875 1.00 3.83 H new ATOM 0 HB3 LYS A 55 -13.249 12.184 -8.509 1.00 3.83 H new ATOM 0 HG2 LYS A 55 -13.201 10.884 -10.570 1.00 4.80 H new ATOM 0 HG3 LYS A 55 -14.562 10.372 -9.591 1.00 4.80 H new ATOM 0 HD2 LYS A 55 -16.058 11.879 -10.932 1.00 5.76 H new ATOM 0 HD3 LYS A 55 -14.690 12.312 -11.938 1.00 5.76 H new ATOM 0 HE2 LYS A 55 -15.706 9.467 -11.579 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -16.178 10.516 -12.901 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -14.452 9.527 -13.905 1.00 7.44 H new ATOM 0 HZ2 LYS A 55 -13.525 10.686 -13.081 1.00 7.44 H new ATOM 0 HZ3 LYS A 55 -13.674 9.115 -12.453 1.00 7.44 H new ATOM 838 N LYS A 56 -16.855 11.699 -7.233 1.00 1.66 N ATOM 839 CA LYS A 56 -17.348 11.114 -5.992 1.00 1.89 C ATOM 840 C LYS A 56 -16.878 9.674 -5.833 1.00 1.55 C ATOM 841 O LYS A 56 -17.630 8.728 -6.060 1.00 1.86 O ATOM 842 CB LYS A 56 -18.875 11.198 -5.944 1.00 2.73 C ATOM 843 CG LYS A 56 -19.405 12.587 -6.268 1.00 3.49 C ATOM 844 CD LYS A 56 -20.901 12.692 -6.029 1.00 4.29 C ATOM 845 CE LYS A 56 -21.453 14.028 -6.509 1.00 4.99 C ATOM 846 NZ LYS A 56 -20.706 15.185 -5.947 1.00 5.43 N ATOM 0 H LYS A 56 -17.563 11.797 -7.961 1.00 1.66 H new ATOM 0 HA LYS A 56 -16.939 11.684 -5.158 1.00 1.89 H new ATOM 0 HB2 LYS A 56 -19.295 10.481 -6.650 1.00 2.73 H new ATOM 0 HB3 LYS A 56 -19.218 10.907 -4.951 1.00 2.73 H new ATOM 0 HG2 LYS A 56 -18.887 13.325 -5.656 1.00 3.49 H new ATOM 0 HG3 LYS A 56 -19.186 12.826 -7.309 1.00 3.49 H new ATOM 0 HD2 LYS A 56 -21.411 11.880 -6.547 1.00 4.29 H new ATOM 0 HD3 LYS A 56 -21.110 12.572 -4.966 1.00 4.29 H new ATOM 0 HE2 LYS A 56 -21.410 14.066 -7.598 1.00 4.99 H new ATOM 0 HE3 LYS A 56 -22.503 14.106 -6.228 1.00 4.99 H new ATOM 0 HZ1 LYS A 56 -21.366 15.966 -5.759 1.00 5.43 H new ATOM 0 HZ2 LYS A 56 -20.244 14.902 -5.060 1.00 5.43 H new ATOM 0 HZ3 LYS A 56 -19.985 15.497 -6.629 1.00 5.43 H new ATOM 860 N ILE A 57 -15.618 9.530 -5.455 1.00 1.14 N ATOM 861 CA ILE A 57 -15.013 8.224 -5.252 1.00 0.88 C ATOM 862 C ILE A 57 -15.652 7.525 -4.059 1.00 0.85 C ATOM 863 O ILE A 57 -15.423 7.905 -2.908 1.00 0.97 O ATOM 864 CB ILE A 57 -13.492 8.340 -5.015 1.00 0.80 C ATOM 865 CG1 ILE A 57 -12.841 9.208 -6.097 1.00 0.86 C ATOM 866 CG2 ILE A 57 -12.857 6.956 -4.996 1.00 0.87 C ATOM 867 CD1 ILE A 57 -11.389 9.544 -5.818 1.00 0.86 C ATOM 0 H ILE A 57 -14.988 10.313 -5.281 1.00 1.14 H new ATOM 0 HA ILE A 57 -15.183 7.640 -6.157 1.00 0.88 H new ATOM 0 HB ILE A 57 -13.328 8.816 -4.048 1.00 0.80 H new ATOM 0 HG12 ILE A 57 -12.907 8.690 -7.054 1.00 0.86 H new ATOM 0 HG13 ILE A 57 -13.407 10.135 -6.196 1.00 0.86 H new ATOM 0 HG21 ILE A 57 -11.784 7.050 -4.828 1.00 0.87 H new ATOM 0 HG22 ILE A 57 -13.299 6.364 -4.195 1.00 0.87 H new ATOM 0 HG23 ILE A 57 -13.033 6.462 -5.952 1.00 0.87 H new ATOM 0 HD11 ILE A 57 -10.996 10.160 -6.627 1.00 0.86 H new ATOM 0 HD12 ILE A 57 -11.316 10.090 -4.877 1.00 0.86 H new ATOM 0 HD13 ILE A 57 -10.809 8.624 -5.749 1.00 0.86 H new ATOM 879 N THR A 58 -16.466 6.524 -4.341 1.00 0.80 N ATOM 880 CA THR A 58 -17.109 5.746 -3.299 1.00 0.80 C ATOM 881 C THR A 58 -16.133 4.703 -2.765 1.00 0.73 C ATOM 882 O THR A 58 -15.919 3.670 -3.393 1.00 0.85 O ATOM 883 CB THR A 58 -18.366 5.039 -3.837 1.00 0.88 C ATOM 884 OG1 THR A 58 -19.119 5.936 -4.666 1.00 1.11 O ATOM 885 CG2 THR A 58 -19.242 4.549 -2.693 1.00 1.28 C ATOM 0 H THR A 58 -16.698 6.230 -5.290 1.00 0.80 H new ATOM 0 HA THR A 58 -17.406 6.423 -2.498 1.00 0.80 H new ATOM 0 HB THR A 58 -18.046 4.180 -4.427 1.00 0.88 H new ATOM 0 HG1 THR A 58 -19.318 6.755 -4.165 1.00 1.11 H new ATOM 0 HG21 THR A 58 -20.124 4.053 -3.097 1.00 1.28 H new ATOM 0 HG22 THR A 58 -18.679 3.846 -2.079 1.00 1.28 H new ATOM 0 HG23 THR A 58 -19.551 5.397 -2.082 1.00 1.28 H new ATOM 893 N PHE A 59 -15.532 4.977 -1.622 1.00 0.65 N ATOM 894 CA PHE A 59 -14.509 4.095 -1.081 1.00 0.64 C ATOM 895 C PHE A 59 -15.113 2.885 -0.376 1.00 0.73 C ATOM 896 O PHE A 59 -15.856 3.023 0.597 1.00 0.83 O ATOM 897 CB PHE A 59 -13.589 4.854 -0.129 1.00 0.64 C ATOM 898 CG PHE A 59 -12.656 5.803 -0.823 1.00 0.60 C ATOM 899 CD1 PHE A 59 -11.621 5.320 -1.605 1.00 0.75 C ATOM 900 CD2 PHE A 59 -12.806 7.171 -0.685 1.00 0.80 C ATOM 901 CE1 PHE A 59 -10.752 6.186 -2.236 1.00 0.79 C ATOM 902 CE2 PHE A 59 -11.940 8.041 -1.317 1.00 0.84 C ATOM 903 CZ PHE A 59 -10.913 7.548 -2.093 1.00 0.70 C ATOM 0 H PHE A 59 -15.732 5.798 -1.051 1.00 0.65 H new ATOM 0 HA PHE A 59 -13.923 3.729 -1.924 1.00 0.64 H new ATOM 0 HB2 PHE A 59 -14.197 5.412 0.583 1.00 0.64 H new ATOM 0 HB3 PHE A 59 -13.003 4.137 0.445 1.00 0.64 H new ATOM 0 HD1 PHE A 59 -11.492 4.254 -1.722 1.00 0.75 H new ATOM 0 HD2 PHE A 59 -13.608 7.562 -0.077 1.00 0.80 H new ATOM 0 HE1 PHE A 59 -9.946 5.798 -2.841 1.00 0.79 H new ATOM 0 HE2 PHE A 59 -12.067 9.107 -1.203 1.00 0.84 H new ATOM 0 HZ PHE A 59 -10.235 8.228 -2.588 1.00 0.70 H new ATOM 913 N LEU A 60 -14.794 1.705 -0.893 1.00 0.85 N ATOM 914 CA LEU A 60 -15.214 0.446 -0.292 1.00 1.00 C ATOM 915 C LEU A 60 -14.031 -0.197 0.420 1.00 1.96 C ATOM 916 O LEU A 60 -12.924 -0.203 -0.107 1.00 2.78 O ATOM 917 CB LEU A 60 -15.749 -0.497 -1.376 1.00 1.51 C ATOM 918 CG LEU A 60 -16.186 -1.881 -0.891 1.00 2.10 C ATOM 919 CD1 LEU A 60 -17.409 -1.778 0.011 1.00 2.68 C ATOM 920 CD2 LEU A 60 -16.467 -2.792 -2.078 1.00 3.00 C ATOM 0 H LEU A 60 -14.237 1.594 -1.740 1.00 0.85 H new ATOM 0 HA LEU A 60 -16.007 0.638 0.430 1.00 1.00 H new ATOM 0 HB2 LEU A 60 -16.598 -0.017 -1.863 1.00 1.51 H new ATOM 0 HB3 LEU A 60 -14.977 -0.625 -2.135 1.00 1.51 H new ATOM 0 HG LEU A 60 -15.374 -2.314 -0.307 1.00 2.10 H new ATOM 0 HD11 LEU A 60 -17.701 -2.774 0.343 1.00 2.68 H new ATOM 0 HD12 LEU A 60 -17.171 -1.162 0.878 1.00 2.68 H new ATOM 0 HD13 LEU A 60 -18.232 -1.324 -0.542 1.00 2.68 H new ATOM 0 HD21 LEU A 60 -16.777 -3.773 -1.718 1.00 3.00 H new ATOM 0 HD22 LEU A 60 -17.262 -2.361 -2.687 1.00 3.00 H new ATOM 0 HD23 LEU A 60 -15.564 -2.895 -2.680 1.00 3.00 H new ATOM 932 N ASP A 61 -14.258 -0.730 1.610 1.00 2.55 N ATOM 933 CA ASP A 61 -13.180 -1.332 2.390 1.00 3.74 C ATOM 934 C ASP A 61 -13.229 -2.853 2.287 1.00 3.82 C ATOM 935 O ASP A 61 -14.299 -3.456 2.377 1.00 3.97 O ATOM 936 CB ASP A 61 -13.276 -0.904 3.855 1.00 4.77 C ATOM 937 CG ASP A 61 -12.093 -1.379 4.680 1.00 5.89 C ATOM 938 OD1 ASP A 61 -12.147 -2.497 5.236 1.00 6.37 O ATOM 939 OD2 ASP A 61 -11.100 -0.630 4.788 1.00 6.48 O ATOM 0 H ASP A 61 -15.174 -0.760 2.058 1.00 2.55 H new ATOM 0 HA ASP A 61 -12.230 -0.984 1.984 1.00 3.74 H new ATOM 0 HB2 ASP A 61 -13.339 0.183 3.909 1.00 4.77 H new ATOM 0 HB3 ASP A 61 -14.196 -1.298 4.286 1.00 4.77 H new ATOM 944 N THR A 62 -12.072 -3.468 2.074 1.00 4.12 N ATOM 945 CA THR A 62 -11.982 -4.918 2.002 1.00 4.33 C ATOM 946 C THR A 62 -11.008 -5.467 3.046 1.00 4.42 C ATOM 947 O THR A 62 -9.797 -5.508 2.823 1.00 4.82 O ATOM 948 CB THR A 62 -11.545 -5.378 0.599 1.00 5.07 C ATOM 949 OG1 THR A 62 -12.418 -4.808 -0.382 1.00 5.52 O ATOM 950 CG2 THR A 62 -11.570 -6.896 0.487 1.00 5.57 C ATOM 0 H THR A 62 -11.183 -2.983 1.948 1.00 4.12 H new ATOM 0 HA THR A 62 -12.977 -5.311 2.210 1.00 4.33 H new ATOM 0 HB THR A 62 -10.523 -5.041 0.428 1.00 5.07 H new ATOM 0 HG1 THR A 62 -12.244 -5.220 -1.254 1.00 5.52 H new ATOM 0 HG21 THR A 62 -11.257 -7.192 -0.514 1.00 5.57 H new ATOM 0 HG22 THR A 62 -10.890 -7.326 1.222 1.00 5.57 H new ATOM 0 HG23 THR A 62 -12.581 -7.258 0.673 1.00 5.57 H new ATOM 958 N PRO A 63 -11.526 -5.870 4.217 1.00 4.51 N ATOM 959 CA PRO A 63 -10.730 -6.488 5.267 1.00 5.03 C ATOM 960 C PRO A 63 -10.760 -8.015 5.201 1.00 5.20 C ATOM 961 O PRO A 63 -10.345 -8.700 6.140 1.00 5.77 O ATOM 962 CB PRO A 63 -11.431 -5.988 6.527 1.00 5.50 C ATOM 963 CG PRO A 63 -12.876 -5.866 6.143 1.00 5.27 C ATOM 964 CD PRO A 63 -12.929 -5.711 4.637 1.00 4.66 C ATOM 0 HA PRO A 63 -9.672 -6.234 5.204 1.00 5.03 H new ATOM 0 HB2 PRO A 63 -11.300 -6.685 7.355 1.00 5.50 H new ATOM 0 HB3 PRO A 63 -11.026 -5.029 6.850 1.00 5.50 H new ATOM 0 HG2 PRO A 63 -13.433 -6.748 6.459 1.00 5.27 H new ATOM 0 HG3 PRO A 63 -13.333 -5.007 6.634 1.00 5.27 H new ATOM 0 HD2 PRO A 63 -13.571 -6.464 4.180 1.00 4.66 H new ATOM 0 HD3 PRO A 63 -13.325 -4.737 4.349 1.00 4.66 H new ATOM 972 N GLY A 64 -11.251 -8.542 4.087 1.00 5.00 N ATOM 973 CA GLY A 64 -11.379 -9.979 3.937 1.00 5.40 C ATOM 974 C GLY A 64 -10.600 -10.508 2.752 1.00 5.25 C ATOM 975 O GLY A 64 -9.723 -9.826 2.227 1.00 5.54 O ATOM 0 H GLY A 64 -11.564 -7.999 3.282 1.00 5.00 H new ATOM 0 HA2 GLY A 64 -11.029 -10.469 4.846 1.00 5.40 H new ATOM 0 HA3 GLY A 64 -12.432 -10.237 3.821 1.00 5.40 H new ATOM 979 N HIS A 65 -10.913 -11.727 2.333 1.00 5.14 N ATOM 980 CA HIS A 65 -10.218 -12.343 1.210 1.00 5.24 C ATOM 981 C HIS A 65 -11.020 -12.226 -0.083 1.00 4.67 C ATOM 982 O HIS A 65 -10.748 -11.365 -0.919 1.00 4.91 O ATOM 983 CB HIS A 65 -9.907 -13.814 1.498 1.00 5.90 C ATOM 984 CG HIS A 65 -8.866 -14.010 2.552 1.00 6.66 C ATOM 985 ND1 HIS A 65 -9.010 -14.885 3.603 1.00 7.35 N ATOM 986 CD2 HIS A 65 -7.642 -13.454 2.696 1.00 7.14 C ATOM 987 CE1 HIS A 65 -7.923 -14.860 4.347 1.00 8.09 C ATOM 988 NE2 HIS A 65 -7.071 -14.002 3.819 1.00 7.99 N ATOM 0 H HIS A 65 -11.640 -12.307 2.752 1.00 5.14 H new ATOM 0 HA HIS A 65 -9.281 -11.802 1.079 1.00 5.24 H new ATOM 0 HB2 HIS A 65 -10.824 -14.317 1.806 1.00 5.90 H new ATOM 0 HB3 HIS A 65 -9.575 -14.293 0.577 1.00 5.90 H new ATOM 0 HD2 HIS A 65 -7.195 -12.715 2.047 1.00 7.14 H new ATOM 0 HE1 HIS A 65 -7.757 -15.444 5.240 1.00 8.09 H new ATOM 0 HE2 HIS A 65 -6.144 -13.782 4.183 1.00 7.99 H new ATOM 997 N GLU A 66 -12.023 -13.080 -0.239 1.00 4.31 N ATOM 998 CA GLU A 66 -12.781 -13.144 -1.481 1.00 4.06 C ATOM 999 C GLU A 66 -13.936 -12.143 -1.489 1.00 3.33 C ATOM 1000 O GLU A 66 -15.101 -12.513 -1.642 1.00 3.69 O ATOM 1001 CB GLU A 66 -13.293 -14.567 -1.723 1.00 4.70 C ATOM 1002 CG GLU A 66 -12.173 -15.583 -1.914 1.00 5.39 C ATOM 1003 CD GLU A 66 -11.252 -15.218 -3.061 1.00 5.92 C ATOM 1004 OE1 GLU A 66 -11.527 -15.623 -4.207 1.00 6.21 O ATOM 1005 OE2 GLU A 66 -10.255 -14.495 -2.830 1.00 6.36 O ATOM 0 H GLU A 66 -12.330 -13.737 0.478 1.00 4.31 H new ATOM 0 HA GLU A 66 -12.109 -12.872 -2.295 1.00 4.06 H new ATOM 0 HB2 GLU A 66 -13.912 -14.872 -0.879 1.00 4.70 H new ATOM 0 HB3 GLU A 66 -13.933 -14.571 -2.605 1.00 4.70 H new ATOM 0 HG2 GLU A 66 -11.592 -15.657 -0.995 1.00 5.39 H new ATOM 0 HG3 GLU A 66 -12.606 -16.566 -2.098 1.00 5.39 H new ATOM 1012 N ALA A 67 -13.599 -10.873 -1.338 1.00 2.88 N ATOM 1013 CA ALA A 67 -14.589 -9.810 -1.374 1.00 2.74 C ATOM 1014 C ALA A 67 -14.251 -8.812 -2.474 1.00 2.07 C ATOM 1015 O ALA A 67 -13.204 -8.165 -2.434 1.00 2.63 O ATOM 1016 CB ALA A 67 -14.667 -9.116 -0.022 1.00 3.51 C ATOM 0 H ALA A 67 -12.642 -10.552 -1.189 1.00 2.88 H new ATOM 0 HA ALA A 67 -15.564 -10.245 -1.593 1.00 2.74 H new ATOM 0 HB1 ALA A 67 -15.412 -8.322 -0.063 1.00 3.51 H new ATOM 0 HB2 ALA A 67 -14.949 -9.840 0.743 1.00 3.51 H new ATOM 0 HB3 ALA A 67 -13.695 -8.689 0.224 1.00 3.51 H new ATOM 1022 N PHE A 68 -15.121 -8.716 -3.470 1.00 1.52 N ATOM 1023 CA PHE A 68 -14.928 -7.779 -4.568 1.00 1.22 C ATOM 1024 C PHE A 68 -16.268 -7.472 -5.226 1.00 1.89 C ATOM 1025 O PHE A 68 -16.657 -6.314 -5.360 1.00 2.61 O ATOM 1026 CB PHE A 68 -13.965 -8.370 -5.606 1.00 1.13 C ATOM 1027 CG PHE A 68 -13.242 -7.350 -6.447 1.00 0.93 C ATOM 1028 CD1 PHE A 68 -13.940 -6.393 -7.168 1.00 1.43 C ATOM 1029 CD2 PHE A 68 -11.855 -7.356 -6.516 1.00 0.87 C ATOM 1030 CE1 PHE A 68 -13.270 -5.463 -7.941 1.00 1.62 C ATOM 1031 CE2 PHE A 68 -11.181 -6.429 -7.289 1.00 1.14 C ATOM 1032 CZ PHE A 68 -11.891 -5.480 -8.000 1.00 1.40 C ATOM 0 H PHE A 68 -15.970 -9.277 -3.540 1.00 1.52 H new ATOM 0 HA PHE A 68 -14.500 -6.857 -4.173 1.00 1.22 H new ATOM 0 HB2 PHE A 68 -13.227 -8.983 -5.089 1.00 1.13 H new ATOM 0 HB3 PHE A 68 -14.525 -9.033 -6.265 1.00 1.13 H new ATOM 0 HD1 PHE A 68 -15.019 -6.374 -7.125 1.00 1.43 H new ATOM 0 HD2 PHE A 68 -11.296 -8.094 -5.959 1.00 0.87 H new ATOM 0 HE1 PHE A 68 -13.825 -4.723 -8.499 1.00 1.62 H new ATOM 0 HE2 PHE A 68 -10.102 -6.446 -7.337 1.00 1.14 H new ATOM 0 HZ PHE A 68 -11.367 -4.752 -8.602 1.00 1.40 H new ATOM 1042 N THR A 69 -16.974 -8.528 -5.617 1.00 2.35 N ATOM 1043 CA THR A 69 -18.238 -8.388 -6.323 1.00 3.23 C ATOM 1044 C THR A 69 -19.337 -7.879 -5.394 1.00 3.47 C ATOM 1045 O THR A 69 -20.031 -8.658 -4.741 1.00 3.95 O ATOM 1046 CB THR A 69 -18.667 -9.734 -6.936 1.00 4.06 C ATOM 1047 OG1 THR A 69 -17.550 -10.338 -7.604 1.00 4.44 O ATOM 1048 CG2 THR A 69 -19.810 -9.545 -7.923 1.00 4.74 C ATOM 0 H THR A 69 -16.688 -9.494 -5.455 1.00 2.35 H new ATOM 0 HA THR A 69 -18.090 -7.659 -7.120 1.00 3.23 H new ATOM 0 HB THR A 69 -19.011 -10.383 -6.131 1.00 4.06 H new ATOM 0 HG1 THR A 69 -17.825 -11.195 -7.992 1.00 4.44 H new ATOM 0 HG21 THR A 69 -20.093 -10.511 -8.341 1.00 4.74 H new ATOM 0 HG22 THR A 69 -20.666 -9.107 -7.409 1.00 4.74 H new ATOM 0 HG23 THR A 69 -19.491 -8.881 -8.727 1.00 4.74 H new ATOM 1056 N THR A 70 -19.477 -6.566 -5.330 1.00 3.68 N ATOM 1057 CA THR A 70 -20.514 -5.947 -4.523 1.00 4.33 C ATOM 1058 C THR A 70 -21.533 -5.238 -5.408 1.00 4.42 C ATOM 1059 O THR A 70 -22.496 -4.642 -4.921 1.00 5.01 O ATOM 1060 CB THR A 70 -19.905 -4.945 -3.525 1.00 5.25 C ATOM 1061 OG1 THR A 70 -18.974 -4.091 -4.201 1.00 5.60 O ATOM 1062 CG2 THR A 70 -19.204 -5.669 -2.383 1.00 5.89 C ATOM 0 H THR A 70 -18.882 -5.905 -5.830 1.00 3.68 H new ATOM 0 HA THR A 70 -21.018 -6.736 -3.965 1.00 4.33 H new ATOM 0 HB THR A 70 -20.713 -4.345 -3.106 1.00 5.25 H new ATOM 0 HG1 THR A 70 -18.954 -3.216 -3.761 1.00 5.60 H new ATOM 0 HG21 THR A 70 -18.783 -4.938 -1.693 1.00 5.89 H new ATOM 0 HG22 THR A 70 -19.922 -6.296 -1.854 1.00 5.89 H new ATOM 0 HG23 THR A 70 -18.405 -6.292 -2.784 1.00 5.89 H new ATOM 1070 N MET A 71 -21.311 -5.314 -6.713 1.00 4.24 N ATOM 1071 CA MET A 71 -22.174 -4.658 -7.684 1.00 4.73 C ATOM 1072 C MET A 71 -23.424 -5.491 -7.932 1.00 5.29 C ATOM 1073 O MET A 71 -23.364 -6.721 -7.969 1.00 5.64 O ATOM 1074 CB MET A 71 -21.436 -4.434 -9.011 1.00 4.83 C ATOM 1075 CG MET A 71 -20.091 -3.732 -8.867 1.00 4.67 C ATOM 1076 SD MET A 71 -18.791 -4.822 -8.241 1.00 4.68 S ATOM 1077 CE MET A 71 -18.612 -5.963 -9.612 1.00 4.52 C ATOM 0 H MET A 71 -20.533 -5.829 -7.126 1.00 4.24 H new ATOM 0 HA MET A 71 -22.461 -3.690 -7.274 1.00 4.73 H new ATOM 0 HB2 MET A 71 -21.280 -5.398 -9.494 1.00 4.83 H new ATOM 0 HB3 MET A 71 -22.072 -3.845 -9.672 1.00 4.83 H new ATOM 0 HG2 MET A 71 -19.789 -3.334 -9.836 1.00 4.67 H new ATOM 0 HG3 MET A 71 -20.201 -2.882 -8.194 1.00 4.67 H new ATOM 0 HE1 MET A 71 -17.636 -6.446 -9.559 1.00 4.52 H new ATOM 0 HE2 MET A 71 -19.395 -6.720 -9.560 1.00 4.52 H new ATOM 0 HE3 MET A 71 -18.696 -5.418 -10.552 1.00 4.52 H new ATOM 1087 N ARG A 72 -24.553 -4.819 -8.118 1.00 5.68 N ATOM 1088 CA ARG A 72 -25.820 -5.501 -8.366 1.00 6.44 C ATOM 1089 C ARG A 72 -26.004 -5.737 -9.868 1.00 6.64 C ATOM 1090 O ARG A 72 -27.074 -5.493 -10.435 1.00 7.15 O ATOM 1091 CB ARG A 72 -26.978 -4.679 -7.794 1.00 7.03 C ATOM 1092 CG ARG A 72 -28.292 -5.437 -7.722 1.00 7.56 C ATOM 1093 CD ARG A 72 -29.367 -4.619 -7.031 1.00 8.19 C ATOM 1094 NE ARG A 72 -29.008 -4.304 -5.648 1.00 8.54 N ATOM 1095 CZ ARG A 72 -29.896 -4.057 -4.685 1.00 9.20 C ATOM 1096 NH1 ARG A 72 -31.194 -4.143 -4.936 1.00 9.56 N ATOM 1097 NH2 ARG A 72 -29.484 -3.736 -3.466 1.00 9.71 N ATOM 0 H ARG A 72 -24.619 -3.801 -8.102 1.00 5.68 H new ATOM 0 HA ARG A 72 -25.810 -6.470 -7.867 1.00 6.44 H new ATOM 0 HB2 ARG A 72 -26.710 -4.339 -6.794 1.00 7.03 H new ATOM 0 HB3 ARG A 72 -27.116 -3.788 -8.407 1.00 7.03 H new ATOM 0 HG2 ARG A 72 -28.620 -5.695 -8.729 1.00 7.56 H new ATOM 0 HG3 ARG A 72 -28.144 -6.374 -7.185 1.00 7.56 H new ATOM 0 HD2 ARG A 72 -29.530 -3.694 -7.583 1.00 8.19 H new ATOM 0 HD3 ARG A 72 -30.308 -5.169 -7.046 1.00 8.19 H new ATOM 0 HE ARG A 72 -28.018 -4.271 -5.406 1.00 8.54 H new ATOM 0 HH11 ARG A 72 -31.517 -4.399 -5.869 1.00 9.56 H new ATOM 0 HH12 ARG A 72 -31.870 -3.953 -4.196 1.00 9.56 H new ATOM 0 HH21 ARG A 72 -28.486 -3.678 -3.264 1.00 9.71 H new ATOM 0 HH22 ARG A 72 -30.165 -3.547 -2.731 1.00 9.71 H new ATOM 1111 N ALA A 73 -24.934 -6.209 -10.498 1.00 6.52 N ATOM 1112 CA ALA A 73 -24.905 -6.490 -11.926 1.00 6.92 C ATOM 1113 C ALA A 73 -23.545 -7.057 -12.296 1.00 6.65 C ATOM 1114 O ALA A 73 -22.618 -7.031 -11.484 1.00 6.71 O ATOM 1115 CB ALA A 73 -25.177 -5.223 -12.734 1.00 7.52 C ATOM 0 H ALA A 73 -24.053 -6.409 -10.025 1.00 6.52 H new ATOM 0 HA ALA A 73 -25.684 -7.216 -12.159 1.00 6.92 H new ATOM 0 HB1 ALA A 73 -25.150 -5.457 -13.798 1.00 7.52 H new ATOM 0 HB2 ALA A 73 -26.160 -4.829 -12.474 1.00 7.52 H new ATOM 0 HB3 ALA A 73 -24.416 -4.477 -12.508 1.00 7.52 H new ATOM 1121 N ARG A 74 -23.422 -7.566 -13.512 1.00 6.69 N ATOM 1122 CA ARG A 74 -22.144 -8.051 -14.011 1.00 6.76 C ATOM 1123 C ARG A 74 -21.672 -7.141 -15.138 1.00 6.62 C ATOM 1124 O ARG A 74 -21.301 -7.590 -16.223 1.00 6.89 O ATOM 1125 CB ARG A 74 -22.245 -9.513 -14.472 1.00 7.36 C ATOM 1126 CG ARG A 74 -23.348 -9.778 -15.481 1.00 7.67 C ATOM 1127 CD ARG A 74 -23.415 -11.247 -15.855 1.00 8.48 C ATOM 1128 NE ARG A 74 -24.491 -11.515 -16.801 1.00 8.99 N ATOM 1129 CZ ARG A 74 -24.821 -12.725 -17.239 1.00 9.80 C ATOM 1130 NH1 ARG A 74 -24.175 -13.800 -16.804 1.00 10.19 N ATOM 1131 NH2 ARG A 74 -25.810 -12.849 -18.113 1.00 10.42 N ATOM 0 H ARG A 74 -24.194 -7.654 -14.173 1.00 6.69 H new ATOM 0 HA ARG A 74 -21.411 -8.027 -13.205 1.00 6.76 H new ATOM 0 HB2 ARG A 74 -21.291 -9.810 -14.908 1.00 7.36 H new ATOM 0 HB3 ARG A 74 -22.408 -10.146 -13.600 1.00 7.36 H new ATOM 0 HG2 ARG A 74 -24.306 -9.462 -15.067 1.00 7.67 H new ATOM 0 HG3 ARG A 74 -23.175 -9.181 -16.376 1.00 7.67 H new ATOM 0 HD2 ARG A 74 -22.464 -11.556 -16.289 1.00 8.48 H new ATOM 0 HD3 ARG A 74 -23.564 -11.845 -14.956 1.00 8.48 H new ATOM 0 HE ARG A 74 -25.027 -10.720 -17.150 1.00 8.99 H new ATOM 0 HH11 ARG A 74 -23.418 -13.701 -16.128 1.00 10.19 H new ATOM 0 HH12 ARG A 74 -24.436 -14.725 -17.146 1.00 10.19 H new ATOM 0 HH21 ARG A 74 -26.307 -12.021 -18.441 1.00 10.42 H new ATOM 0 HH22 ARG A 74 -26.073 -13.772 -18.457 1.00 10.42 H new ATOM 1145 N GLY A 75 -21.717 -5.850 -14.859 1.00 6.47 N ATOM 1146 CA GLY A 75 -21.324 -4.840 -15.815 1.00 6.51 C ATOM 1147 C GLY A 75 -21.439 -3.471 -15.195 1.00 6.34 C ATOM 1148 O GLY A 75 -21.779 -3.371 -14.014 1.00 6.75 O ATOM 0 H GLY A 75 -22.028 -5.476 -13.962 1.00 6.47 H new ATOM 0 HA2 GLY A 75 -20.299 -5.016 -16.141 1.00 6.51 H new ATOM 0 HA3 GLY A 75 -21.955 -4.901 -16.701 1.00 6.51 H new ATOM 1152 N ALA A 76 -21.163 -2.426 -15.975 1.00 6.08 N ATOM 1153 CA ALA A 76 -21.175 -1.057 -15.464 1.00 6.24 C ATOM 1154 C ALA A 76 -20.219 -0.934 -14.288 1.00 5.83 C ATOM 1155 O ALA A 76 -20.477 -0.222 -13.317 1.00 6.16 O ATOM 1156 CB ALA A 76 -22.584 -0.637 -15.061 1.00 6.69 C ATOM 0 H ALA A 76 -20.928 -2.503 -16.965 1.00 6.08 H new ATOM 0 HA ALA A 76 -20.844 -0.387 -16.258 1.00 6.24 H new ATOM 0 HB1 ALA A 76 -22.565 0.386 -14.684 1.00 6.69 H new ATOM 0 HB2 ALA A 76 -23.242 -0.692 -15.928 1.00 6.69 H new ATOM 0 HB3 ALA A 76 -22.954 -1.304 -14.282 1.00 6.69 H new ATOM 1162 N GLN A 77 -19.107 -1.644 -14.396 1.00 5.40 N ATOM 1163 CA GLN A 77 -18.155 -1.754 -13.311 1.00 5.18 C ATOM 1164 C GLN A 77 -17.138 -0.623 -13.354 1.00 4.21 C ATOM 1165 O GLN A 77 -16.422 -0.441 -14.337 1.00 4.21 O ATOM 1166 CB GLN A 77 -17.457 -3.119 -13.370 1.00 5.87 C ATOM 1167 CG GLN A 77 -16.822 -3.429 -14.717 1.00 6.56 C ATOM 1168 CD GLN A 77 -16.248 -4.829 -14.789 1.00 7.26 C ATOM 1169 OE1 GLN A 77 -16.925 -5.773 -15.202 1.00 7.65 O ATOM 1170 NE2 GLN A 77 -15.002 -4.976 -14.384 1.00 7.72 N ATOM 0 H GLN A 77 -18.843 -2.157 -15.237 1.00 5.40 H new ATOM 0 HA GLN A 77 -18.694 -1.673 -12.367 1.00 5.18 H new ATOM 0 HB2 GLN A 77 -16.687 -3.156 -12.599 1.00 5.87 H new ATOM 0 HB3 GLN A 77 -18.182 -3.898 -13.134 1.00 5.87 H new ATOM 0 HG2 GLN A 77 -17.569 -3.307 -15.502 1.00 6.56 H new ATOM 0 HG3 GLN A 77 -16.030 -2.706 -14.915 1.00 6.56 H new ATOM 0 HE21 GLN A 77 -14.476 -4.169 -14.049 1.00 7.72 H new ATOM 0 HE22 GLN A 77 -14.564 -5.897 -14.405 1.00 7.72 H new ATOM 1179 N VAL A 78 -17.118 0.161 -12.290 1.00 3.82 N ATOM 1180 CA VAL A 78 -16.114 1.199 -12.115 1.00 3.25 C ATOM 1181 C VAL A 78 -15.266 0.844 -10.894 1.00 3.06 C ATOM 1182 O VAL A 78 -14.407 1.603 -10.455 1.00 3.67 O ATOM 1183 CB VAL A 78 -16.766 2.591 -11.918 1.00 3.79 C ATOM 1184 CG1 VAL A 78 -15.741 3.706 -12.070 1.00 4.27 C ATOM 1185 CG2 VAL A 78 -17.918 2.791 -12.893 1.00 4.38 C ATOM 0 H VAL A 78 -17.792 0.098 -11.527 1.00 3.82 H new ATOM 0 HA VAL A 78 -15.496 1.252 -13.011 1.00 3.25 H new ATOM 0 HB VAL A 78 -17.161 2.631 -10.903 1.00 3.79 H new ATOM 0 HG11 VAL A 78 -16.228 4.670 -11.926 1.00 4.27 H new ATOM 0 HG12 VAL A 78 -14.955 3.582 -11.325 1.00 4.27 H new ATOM 0 HG13 VAL A 78 -15.304 3.665 -13.068 1.00 4.27 H new ATOM 0 HG21 VAL A 78 -18.361 3.775 -12.736 1.00 4.38 H new ATOM 0 HG22 VAL A 78 -17.546 2.719 -13.915 1.00 4.38 H new ATOM 0 HG23 VAL A 78 -18.673 2.023 -12.726 1.00 4.38 H new ATOM 1195 N THR A 79 -15.511 -0.357 -10.384 1.00 2.63 N ATOM 1196 CA THR A 79 -14.912 -0.823 -9.143 1.00 2.70 C ATOM 1197 C THR A 79 -13.525 -1.421 -9.380 1.00 1.92 C ATOM 1198 O THR A 79 -12.894 -1.940 -8.458 1.00 2.39 O ATOM 1199 CB THR A 79 -15.824 -1.882 -8.494 1.00 3.62 C ATOM 1200 OG1 THR A 79 -17.195 -1.568 -8.781 1.00 4.18 O ATOM 1201 CG2 THR A 79 -15.627 -1.928 -6.984 1.00 4.13 C ATOM 0 H THR A 79 -16.133 -1.036 -10.822 1.00 2.63 H new ATOM 0 HA THR A 79 -14.803 0.035 -8.479 1.00 2.70 H new ATOM 0 HB THR A 79 -15.564 -2.857 -8.906 1.00 3.62 H new ATOM 0 HG1 THR A 79 -17.744 -2.372 -8.673 1.00 4.18 H new ATOM 0 HG21 THR A 79 -16.284 -2.684 -6.554 1.00 4.13 H new ATOM 0 HG22 THR A 79 -14.590 -2.178 -6.760 1.00 4.13 H new ATOM 0 HG23 THR A 79 -15.866 -0.954 -6.556 1.00 4.13 H new ATOM 1209 N ASP A 80 -13.044 -1.324 -10.616 1.00 1.32 N ATOM 1210 CA ASP A 80 -11.757 -1.904 -10.998 1.00 1.15 C ATOM 1211 C ASP A 80 -10.598 -1.010 -10.572 1.00 0.93 C ATOM 1212 O ASP A 80 -9.608 -0.865 -11.288 1.00 1.30 O ATOM 1213 CB ASP A 80 -11.698 -2.137 -12.509 1.00 1.82 C ATOM 1214 CG ASP A 80 -12.727 -3.138 -12.984 1.00 2.56 C ATOM 1215 OD1 ASP A 80 -12.483 -4.357 -12.866 1.00 3.12 O ATOM 1216 OD2 ASP A 80 -13.791 -2.708 -13.478 1.00 3.06 O ATOM 0 H ASP A 80 -13.529 -0.846 -11.376 1.00 1.32 H new ATOM 0 HA ASP A 80 -11.664 -2.860 -10.483 1.00 1.15 H new ATOM 0 HB2 ASP A 80 -11.853 -1.190 -13.025 1.00 1.82 H new ATOM 0 HB3 ASP A 80 -10.702 -2.489 -12.780 1.00 1.82 H new ATOM 1221 N ILE A 81 -10.729 -0.412 -9.401 1.00 0.74 N ATOM 1222 CA ILE A 81 -9.681 0.412 -8.833 1.00 0.55 C ATOM 1223 C ILE A 81 -9.337 -0.098 -7.451 1.00 0.47 C ATOM 1224 O ILE A 81 -10.105 0.084 -6.506 1.00 0.63 O ATOM 1225 CB ILE A 81 -10.094 1.898 -8.750 1.00 0.63 C ATOM 1226 CG1 ILE A 81 -10.340 2.449 -10.150 1.00 0.72 C ATOM 1227 CG2 ILE A 81 -9.017 2.719 -8.046 1.00 0.67 C ATOM 1228 CD1 ILE A 81 -9.093 2.453 -10.997 1.00 0.73 C ATOM 0 H ILE A 81 -11.564 -0.485 -8.819 1.00 0.74 H new ATOM 0 HA ILE A 81 -8.812 0.348 -9.488 1.00 0.55 H new ATOM 0 HB ILE A 81 -11.015 1.969 -8.171 1.00 0.63 H new ATOM 0 HG12 ILE A 81 -11.108 1.852 -10.642 1.00 0.72 H new ATOM 0 HG13 ILE A 81 -10.727 3.465 -10.074 1.00 0.72 H new ATOM 0 HG21 ILE A 81 -9.328 3.763 -7.998 1.00 0.67 H new ATOM 0 HG22 ILE A 81 -8.871 2.337 -7.035 1.00 0.67 H new ATOM 0 HG23 ILE A 81 -8.082 2.644 -8.601 1.00 0.67 H new ATOM 0 HD11 ILE A 81 -9.324 2.855 -11.983 1.00 0.73 H new ATOM 0 HD12 ILE A 81 -8.332 3.073 -10.522 1.00 0.73 H new ATOM 0 HD13 ILE A 81 -8.719 1.434 -11.099 1.00 0.73 H new ATOM 1240 N VAL A 82 -8.204 -0.767 -7.342 1.00 0.32 N ATOM 1241 CA VAL A 82 -7.798 -1.365 -6.093 1.00 0.30 C ATOM 1242 C VAL A 82 -6.660 -0.593 -5.454 1.00 0.25 C ATOM 1243 O VAL A 82 -5.525 -0.670 -5.907 1.00 0.28 O ATOM 1244 CB VAL A 82 -7.346 -2.811 -6.315 1.00 0.39 C ATOM 1245 CG1 VAL A 82 -6.815 -3.400 -5.030 1.00 0.97 C ATOM 1246 CG2 VAL A 82 -8.496 -3.645 -6.855 1.00 1.19 C ATOM 0 H VAL A 82 -7.548 -0.908 -8.111 1.00 0.32 H new ATOM 0 HA VAL A 82 -8.661 -1.341 -5.428 1.00 0.30 H new ATOM 0 HB VAL A 82 -6.542 -2.817 -7.051 1.00 0.39 H new ATOM 0 HG11 VAL A 82 -6.498 -4.428 -5.205 1.00 0.97 H new ATOM 0 HG12 VAL A 82 -5.965 -2.812 -4.684 1.00 0.97 H new ATOM 0 HG13 VAL A 82 -7.598 -3.386 -4.272 1.00 0.97 H new ATOM 0 HG21 VAL A 82 -8.161 -4.671 -7.008 1.00 1.19 H new ATOM 0 HG22 VAL A 82 -9.319 -3.635 -6.141 1.00 1.19 H new ATOM 0 HG23 VAL A 82 -8.834 -3.228 -7.804 1.00 1.19 H new ATOM 1256 N ILE A 83 -6.962 0.147 -4.406 1.00 0.25 N ATOM 1257 CA ILE A 83 -5.920 0.833 -3.666 1.00 0.25 C ATOM 1258 C ILE A 83 -5.377 -0.091 -2.612 1.00 0.27 C ATOM 1259 O ILE A 83 -6.041 -0.374 -1.622 1.00 0.45 O ATOM 1260 CB ILE A 83 -6.405 2.119 -2.970 1.00 0.34 C ATOM 1261 CG1 ILE A 83 -7.848 2.422 -3.349 1.00 0.48 C ATOM 1262 CG2 ILE A 83 -5.493 3.288 -3.310 1.00 0.84 C ATOM 1263 CD1 ILE A 83 -8.333 3.770 -2.863 1.00 1.32 C ATOM 0 H ILE A 83 -7.907 0.288 -4.050 1.00 0.25 H new ATOM 0 HA ILE A 83 -5.160 1.119 -4.393 1.00 0.25 H new ATOM 0 HB ILE A 83 -6.366 1.964 -1.892 1.00 0.34 H new ATOM 0 HG12 ILE A 83 -7.946 2.380 -4.434 1.00 0.48 H new ATOM 0 HG13 ILE A 83 -8.493 1.644 -2.940 1.00 0.48 H new ATOM 0 HG21 ILE A 83 -5.852 4.187 -2.809 1.00 0.84 H new ATOM 0 HG22 ILE A 83 -4.479 3.067 -2.977 1.00 0.84 H new ATOM 0 HG23 ILE A 83 -5.494 3.448 -4.388 1.00 0.84 H new ATOM 0 HD11 ILE A 83 -9.369 3.916 -3.170 1.00 1.32 H new ATOM 0 HD12 ILE A 83 -8.268 3.810 -1.776 1.00 1.32 H new ATOM 0 HD13 ILE A 83 -7.713 4.556 -3.293 1.00 1.32 H new ATOM 1275 N LEU A 84 -4.181 -0.556 -2.843 1.00 0.22 N ATOM 1276 CA LEU A 84 -3.555 -1.524 -1.956 1.00 0.27 C ATOM 1277 C LEU A 84 -2.631 -0.807 -0.971 1.00 0.27 C ATOM 1278 O LEU A 84 -1.633 -0.208 -1.360 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.812 -2.573 -2.802 1.00 0.35 C ATOM 1280 CG LEU A 84 -2.129 -3.713 -2.051 1.00 0.49 C ATOM 1281 CD1 LEU A 84 -0.785 -3.266 -1.511 1.00 1.33 C ATOM 1282 CD2 LEU A 84 -3.023 -4.226 -0.938 1.00 1.33 C ATOM 0 H LEU A 84 -3.608 -0.284 -3.642 1.00 0.22 H new ATOM 0 HA LEU A 84 -4.309 -2.044 -1.364 1.00 0.27 H new ATOM 0 HB2 LEU A 84 -3.524 -3.008 -3.503 1.00 0.35 H new ATOM 0 HB3 LEU A 84 -2.056 -2.057 -3.394 1.00 0.35 H new ATOM 0 HG LEU A 84 -1.954 -4.533 -2.748 1.00 0.49 H new ATOM 0 HD11 LEU A 84 -0.314 -4.092 -0.979 1.00 1.33 H new ATOM 0 HD12 LEU A 84 -0.146 -2.955 -2.337 1.00 1.33 H new ATOM 0 HD13 LEU A 84 -0.928 -2.429 -0.828 1.00 1.33 H new ATOM 0 HD21 LEU A 84 -2.521 -5.038 -0.413 1.00 1.33 H new ATOM 0 HD22 LEU A 84 -3.233 -3.417 -0.238 1.00 1.33 H new ATOM 0 HD23 LEU A 84 -3.958 -4.592 -1.362 1.00 1.33 H new ATOM 1294 N VAL A 85 -2.974 -0.859 0.305 1.00 0.28 N ATOM 1295 CA VAL A 85 -2.214 -0.151 1.323 1.00 0.28 C ATOM 1296 C VAL A 85 -1.065 -1.006 1.854 1.00 0.27 C ATOM 1297 O VAL A 85 -1.193 -2.222 2.016 1.00 0.34 O ATOM 1298 CB VAL A 85 -3.115 0.309 2.496 1.00 0.32 C ATOM 1299 CG1 VAL A 85 -3.558 -0.862 3.359 1.00 1.17 C ATOM 1300 CG2 VAL A 85 -2.412 1.370 3.336 1.00 1.20 C ATOM 0 H VAL A 85 -3.773 -1.383 0.661 1.00 0.28 H new ATOM 0 HA VAL A 85 -1.798 0.735 0.844 1.00 0.28 H new ATOM 0 HB VAL A 85 -4.012 0.753 2.065 1.00 0.32 H new ATOM 0 HG11 VAL A 85 -4.188 -0.498 4.171 1.00 1.17 H new ATOM 0 HG12 VAL A 85 -4.122 -1.569 2.751 1.00 1.17 H new ATOM 0 HG13 VAL A 85 -2.682 -1.359 3.775 1.00 1.17 H new ATOM 0 HG21 VAL A 85 -3.064 1.678 4.154 1.00 1.20 H new ATOM 0 HG22 VAL A 85 -1.489 0.959 3.743 1.00 1.20 H new ATOM 0 HG23 VAL A 85 -2.180 2.233 2.712 1.00 1.20 H new ATOM 1310 N VAL A 86 0.059 -0.352 2.098 1.00 0.25 N ATOM 1311 CA VAL A 86 1.226 -0.978 2.694 1.00 0.27 C ATOM 1312 C VAL A 86 1.823 -0.021 3.714 1.00 0.24 C ATOM 1313 O VAL A 86 1.227 1.006 4.029 1.00 0.26 O ATOM 1314 CB VAL A 86 2.309 -1.333 1.644 1.00 0.36 C ATOM 1315 CG1 VAL A 86 1.811 -2.396 0.680 1.00 1.12 C ATOM 1316 CG2 VAL A 86 2.757 -0.096 0.883 1.00 0.95 C ATOM 0 H VAL A 86 0.187 0.637 1.886 1.00 0.25 H new ATOM 0 HA VAL A 86 0.904 -1.909 3.161 1.00 0.27 H new ATOM 0 HB VAL A 86 3.168 -1.736 2.181 1.00 0.36 H new ATOM 0 HG11 VAL A 86 2.592 -2.624 -0.045 1.00 1.12 H new ATOM 0 HG12 VAL A 86 1.555 -3.299 1.234 1.00 1.12 H new ATOM 0 HG13 VAL A 86 0.928 -2.028 0.158 1.00 1.12 H new ATOM 0 HG21 VAL A 86 3.517 -0.374 0.153 1.00 0.95 H new ATOM 0 HG22 VAL A 86 1.903 0.344 0.368 1.00 0.95 H new ATOM 0 HG23 VAL A 86 3.173 0.630 1.581 1.00 0.95 H new ATOM 1326 N ALA A 87 2.992 -0.346 4.225 1.00 0.28 N ATOM 1327 CA ALA A 87 3.668 0.540 5.150 1.00 0.32 C ATOM 1328 C ALA A 87 5.169 0.476 4.947 1.00 0.46 C ATOM 1329 O ALA A 87 5.733 -0.609 4.769 1.00 0.75 O ATOM 1330 CB ALA A 87 3.297 0.199 6.582 1.00 0.42 C ATOM 0 H ALA A 87 3.491 -1.211 4.018 1.00 0.28 H new ATOM 0 HA ALA A 87 3.344 1.562 4.952 1.00 0.32 H new ATOM 0 HB1 ALA A 87 3.814 0.875 7.263 1.00 0.42 H new ATOM 0 HB2 ALA A 87 2.220 0.305 6.714 1.00 0.42 H new ATOM 0 HB3 ALA A 87 3.590 -0.828 6.799 1.00 0.42 H new ATOM 1336 N ALA A 88 5.806 1.640 4.963 1.00 0.37 N ATOM 1337 CA ALA A 88 7.255 1.738 4.783 1.00 0.59 C ATOM 1338 C ALA A 88 7.996 1.307 6.038 1.00 0.53 C ATOM 1339 O ALA A 88 8.772 2.067 6.627 1.00 1.14 O ATOM 1340 CB ALA A 88 7.650 3.142 4.404 1.00 1.18 C ATOM 0 H ALA A 88 5.341 2.537 5.100 1.00 0.37 H new ATOM 0 HA ALA A 88 7.534 1.063 3.974 1.00 0.59 H new ATOM 0 HB1 ALA A 88 8.731 3.194 4.275 1.00 1.18 H new ATOM 0 HB2 ALA A 88 7.160 3.419 3.471 1.00 1.18 H new ATOM 0 HB3 ALA A 88 7.345 3.831 5.192 1.00 1.18 H new ATOM 1346 N ASP A 89 7.749 0.073 6.413 1.00 0.56 N ATOM 1347 CA ASP A 89 8.307 -0.529 7.613 1.00 0.93 C ATOM 1348 C ASP A 89 7.964 -2.012 7.649 1.00 0.85 C ATOM 1349 O ASP A 89 8.728 -2.825 8.172 1.00 1.24 O ATOM 1350 CB ASP A 89 7.786 0.166 8.881 1.00 1.44 C ATOM 1351 CG ASP A 89 6.282 0.369 8.878 1.00 1.68 C ATOM 1352 OD1 ASP A 89 5.542 -0.584 9.197 1.00 2.01 O ATOM 1353 OD2 ASP A 89 5.839 1.493 8.554 1.00 1.90 O ATOM 0 H ASP A 89 7.144 -0.557 5.886 1.00 0.56 H new ATOM 0 HA ASP A 89 9.390 -0.406 7.586 1.00 0.93 H new ATOM 0 HB2 ASP A 89 8.064 -0.427 9.752 1.00 1.44 H new ATOM 0 HB3 ASP A 89 8.276 1.134 8.984 1.00 1.44 H new ATOM 1358 N ASP A 90 6.817 -2.364 7.081 1.00 0.48 N ATOM 1359 CA ASP A 90 6.406 -3.761 7.028 1.00 0.46 C ATOM 1360 C ASP A 90 6.492 -4.301 5.608 1.00 0.45 C ATOM 1361 O ASP A 90 7.118 -5.331 5.356 1.00 0.69 O ATOM 1362 CB ASP A 90 4.976 -3.939 7.545 1.00 0.52 C ATOM 1363 CG ASP A 90 4.686 -5.376 7.906 1.00 0.74 C ATOM 1364 OD1 ASP A 90 4.967 -5.777 9.055 1.00 0.93 O ATOM 1365 OD2 ASP A 90 4.190 -6.109 7.036 1.00 1.09 O ATOM 0 H ASP A 90 6.161 -1.709 6.655 1.00 0.48 H new ATOM 0 HA ASP A 90 7.088 -4.320 7.669 1.00 0.46 H new ATOM 0 HB2 ASP A 90 4.824 -3.307 8.420 1.00 0.52 H new ATOM 0 HB3 ASP A 90 4.270 -3.606 6.784 1.00 0.52 H new ATOM 1370 N GLY A 91 5.867 -3.592 4.685 1.00 0.36 N ATOM 1371 CA GLY A 91 5.783 -4.053 3.315 1.00 0.36 C ATOM 1372 C GLY A 91 4.421 -4.634 3.006 1.00 0.35 C ATOM 1373 O GLY A 91 3.422 -3.919 3.028 1.00 0.52 O ATOM 0 H GLY A 91 5.412 -2.696 4.861 1.00 0.36 H new ATOM 0 HA2 GLY A 91 5.988 -3.223 2.638 1.00 0.36 H new ATOM 0 HA3 GLY A 91 6.550 -4.807 3.136 1.00 0.36 H new ATOM 1377 N VAL A 92 4.379 -5.931 2.754 1.00 0.38 N ATOM 1378 CA VAL A 92 3.169 -6.603 2.341 1.00 0.37 C ATOM 1379 C VAL A 92 2.863 -7.791 3.258 1.00 0.36 C ATOM 1380 O VAL A 92 3.604 -8.776 3.289 1.00 0.47 O ATOM 1381 CB VAL A 92 3.338 -7.089 0.891 1.00 0.47 C ATOM 1382 CG1 VAL A 92 2.246 -8.060 0.527 1.00 1.08 C ATOM 1383 CG2 VAL A 92 3.354 -5.915 -0.072 1.00 1.06 C ATOM 0 H VAL A 92 5.189 -6.546 2.832 1.00 0.38 H new ATOM 0 HA VAL A 92 2.335 -5.904 2.405 1.00 0.37 H new ATOM 0 HB VAL A 92 4.295 -7.605 0.814 1.00 0.47 H new ATOM 0 HG11 VAL A 92 2.383 -8.392 -0.502 1.00 1.08 H new ATOM 0 HG12 VAL A 92 2.287 -8.921 1.195 1.00 1.08 H new ATOM 0 HG13 VAL A 92 1.277 -7.571 0.625 1.00 1.08 H new ATOM 0 HG21 VAL A 92 3.474 -6.282 -1.091 1.00 1.06 H new ATOM 0 HG22 VAL A 92 2.416 -5.366 0.008 1.00 1.06 H new ATOM 0 HG23 VAL A 92 4.184 -5.253 0.175 1.00 1.06 H new ATOM 1393 N MET A 93 1.787 -7.680 4.025 1.00 0.29 N ATOM 1394 CA MET A 93 1.322 -8.780 4.867 1.00 0.31 C ATOM 1395 C MET A 93 0.366 -9.688 4.083 1.00 0.31 C ATOM 1396 O MET A 93 0.007 -9.363 2.954 1.00 0.31 O ATOM 1397 CB MET A 93 0.653 -8.220 6.121 1.00 0.36 C ATOM 1398 CG MET A 93 1.629 -7.502 7.032 1.00 0.67 C ATOM 1399 SD MET A 93 0.937 -7.129 8.649 1.00 1.32 S ATOM 1400 CE MET A 93 0.542 -8.784 9.195 1.00 0.65 C ATOM 0 H MET A 93 1.216 -6.837 4.083 1.00 0.29 H new ATOM 0 HA MET A 93 2.175 -9.386 5.173 1.00 0.31 H new ATOM 0 HB2 MET A 93 -0.139 -7.531 5.829 1.00 0.36 H new ATOM 0 HB3 MET A 93 0.181 -9.034 6.671 1.00 0.36 H new ATOM 0 HG2 MET A 93 2.520 -8.117 7.157 1.00 0.67 H new ATOM 0 HG3 MET A 93 1.946 -6.574 6.556 1.00 0.67 H new ATOM 0 HE1 MET A 93 0.580 -8.827 10.283 1.00 0.65 H new ATOM 0 HE2 MET A 93 -0.459 -9.050 8.856 1.00 0.65 H new ATOM 0 HE3 MET A 93 1.264 -9.486 8.779 1.00 0.65 H new ATOM 1410 N PRO A 94 -0.036 -10.852 4.643 1.00 0.38 N ATOM 1411 CA PRO A 94 -0.942 -11.797 3.961 1.00 0.42 C ATOM 1412 C PRO A 94 -2.170 -11.140 3.330 1.00 0.39 C ATOM 1413 O PRO A 94 -2.485 -11.406 2.174 1.00 0.42 O ATOM 1414 CB PRO A 94 -1.357 -12.744 5.082 1.00 0.52 C ATOM 1415 CG PRO A 94 -0.193 -12.755 6.008 1.00 0.61 C ATOM 1416 CD PRO A 94 0.381 -11.365 5.967 1.00 0.46 C ATOM 0 HA PRO A 94 -0.446 -12.279 3.118 1.00 0.42 H new ATOM 0 HB2 PRO A 94 -2.260 -12.395 5.583 1.00 0.52 H new ATOM 0 HB3 PRO A 94 -1.570 -13.742 4.700 1.00 0.52 H new ATOM 0 HG2 PRO A 94 -0.501 -13.020 7.019 1.00 0.61 H new ATOM 0 HG3 PRO A 94 0.547 -13.492 5.696 1.00 0.61 H new ATOM 0 HD2 PRO A 94 -0.008 -10.747 6.776 1.00 0.46 H new ATOM 0 HD3 PRO A 94 1.466 -11.377 6.068 1.00 0.46 H new ATOM 1424 N GLN A 95 -2.863 -10.294 4.081 1.00 0.40 N ATOM 1425 CA GLN A 95 -4.025 -9.602 3.551 1.00 0.43 C ATOM 1426 C GLN A 95 -3.637 -8.704 2.381 1.00 0.36 C ATOM 1427 O GLN A 95 -4.366 -8.620 1.394 1.00 0.39 O ATOM 1428 CB GLN A 95 -4.723 -8.796 4.639 1.00 0.53 C ATOM 1429 CG GLN A 95 -5.204 -9.652 5.791 1.00 0.64 C ATOM 1430 CD GLN A 95 -6.520 -9.162 6.366 1.00 0.88 C ATOM 1431 OE1 GLN A 95 -6.548 -8.368 7.307 1.00 1.41 O ATOM 1432 NE2 GLN A 95 -7.624 -9.626 5.801 1.00 1.47 N ATOM 0 H GLN A 95 -2.641 -10.073 5.052 1.00 0.40 H new ATOM 0 HA GLN A 95 -4.724 -10.354 3.185 1.00 0.43 H new ATOM 0 HB2 GLN A 95 -4.038 -8.038 5.018 1.00 0.53 H new ATOM 0 HB3 GLN A 95 -5.573 -8.269 4.205 1.00 0.53 H new ATOM 0 HG2 GLN A 95 -5.320 -10.681 5.452 1.00 0.64 H new ATOM 0 HG3 GLN A 95 -4.448 -9.658 6.576 1.00 0.64 H new ATOM 0 HE21 GLN A 95 -7.562 -10.283 5.023 1.00 1.47 H new ATOM 0 HE22 GLN A 95 -8.537 -9.327 6.144 1.00 1.47 H new ATOM 1441 N THR A 96 -2.476 -8.060 2.485 1.00 0.33 N ATOM 1442 CA THR A 96 -1.955 -7.235 1.409 1.00 0.31 C ATOM 1443 C THR A 96 -1.787 -8.071 0.140 1.00 0.29 C ATOM 1444 O THR A 96 -1.989 -7.599 -0.979 1.00 0.34 O ATOM 1445 CB THR A 96 -0.602 -6.645 1.816 1.00 0.34 C ATOM 1446 OG1 THR A 96 -0.675 -6.155 3.158 1.00 0.37 O ATOM 1447 CG2 THR A 96 -0.211 -5.519 0.888 1.00 0.46 C ATOM 0 H THR A 96 -1.879 -8.098 3.311 1.00 0.33 H new ATOM 0 HA THR A 96 -2.659 -6.426 1.213 1.00 0.31 H new ATOM 0 HB THR A 96 0.152 -7.429 1.751 1.00 0.34 H new ATOM 0 HG1 THR A 96 -0.956 -5.216 3.149 1.00 0.37 H new ATOM 0 HG21 THR A 96 0.753 -5.113 1.194 1.00 0.46 H new ATOM 0 HG22 THR A 96 -0.138 -5.897 -0.132 1.00 0.46 H new ATOM 0 HG23 THR A 96 -0.965 -4.733 0.931 1.00 0.46 H new ATOM 1455 N VAL A 97 -1.449 -9.332 0.350 1.00 0.33 N ATOM 1456 CA VAL A 97 -1.223 -10.285 -0.713 1.00 0.39 C ATOM 1457 C VAL A 97 -2.539 -10.782 -1.310 1.00 0.34 C ATOM 1458 O VAL A 97 -2.796 -10.622 -2.502 1.00 0.37 O ATOM 1459 CB VAL A 97 -0.431 -11.485 -0.143 1.00 0.60 C ATOM 1460 CG1 VAL A 97 -0.501 -12.695 -1.044 1.00 1.00 C ATOM 1461 CG2 VAL A 97 1.011 -11.098 0.104 1.00 1.05 C ATOM 0 H VAL A 97 -1.323 -9.725 1.283 1.00 0.33 H new ATOM 0 HA VAL A 97 -0.661 -9.793 -1.507 1.00 0.39 H new ATOM 0 HB VAL A 97 -0.897 -11.757 0.804 1.00 0.60 H new ATOM 0 HG11 VAL A 97 0.070 -13.511 -0.602 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -1.540 -13.001 -1.162 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -0.083 -12.447 -2.020 1.00 1.00 H new ATOM 0 HG21 VAL A 97 1.554 -11.954 0.505 1.00 1.05 H new ATOM 0 HG22 VAL A 97 1.469 -10.785 -0.834 1.00 1.05 H new ATOM 0 HG23 VAL A 97 1.050 -10.276 0.819 1.00 1.05 H new ATOM 1471 N GLU A 98 -3.380 -11.358 -0.459 1.00 0.35 N ATOM 1472 CA GLU A 98 -4.571 -12.075 -0.907 1.00 0.40 C ATOM 1473 C GLU A 98 -5.667 -11.138 -1.396 1.00 0.34 C ATOM 1474 O GLU A 98 -6.665 -11.583 -1.963 1.00 0.45 O ATOM 1475 CB GLU A 98 -5.092 -12.955 0.221 1.00 0.54 C ATOM 1476 CG GLU A 98 -4.040 -13.906 0.754 1.00 0.72 C ATOM 1477 CD GLU A 98 -4.584 -14.866 1.787 1.00 1.14 C ATOM 1478 OE1 GLU A 98 -5.058 -15.953 1.400 1.00 1.55 O ATOM 1479 OE2 GLU A 98 -4.549 -14.531 2.991 1.00 1.62 O ATOM 0 H GLU A 98 -3.259 -11.343 0.554 1.00 0.35 H new ATOM 0 HA GLU A 98 -4.282 -12.693 -1.757 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -5.450 -12.323 1.034 1.00 0.54 H new ATOM 0 HB3 GLU A 98 -5.947 -13.529 -0.137 1.00 0.54 H new ATOM 0 HG2 GLU A 98 -3.617 -14.474 -0.075 1.00 0.72 H new ATOM 0 HG3 GLU A 98 -3.226 -13.330 1.194 1.00 0.72 H new ATOM 1486 N ALA A 99 -5.476 -9.848 -1.191 1.00 0.28 N ATOM 1487 CA ALA A 99 -6.420 -8.863 -1.694 1.00 0.27 C ATOM 1488 C ALA A 99 -6.064 -8.565 -3.134 1.00 0.25 C ATOM 1489 O ALA A 99 -6.915 -8.534 -4.022 1.00 0.34 O ATOM 1490 CB ALA A 99 -6.376 -7.599 -0.848 1.00 0.31 C ATOM 0 H ALA A 99 -4.682 -9.458 -0.683 1.00 0.28 H new ATOM 0 HA ALA A 99 -7.436 -9.253 -1.639 1.00 0.27 H new ATOM 0 HB1 ALA A 99 -7.089 -6.874 -1.240 1.00 0.31 H new ATOM 0 HB2 ALA A 99 -6.635 -7.842 0.183 1.00 0.31 H new ATOM 0 HB3 ALA A 99 -5.373 -7.175 -0.880 1.00 0.31 H new ATOM 1496 N ILE A 100 -4.773 -8.391 -3.347 1.00 0.25 N ATOM 1497 CA ILE A 100 -4.210 -8.227 -4.670 1.00 0.24 C ATOM 1498 C ILE A 100 -4.434 -9.470 -5.517 1.00 0.28 C ATOM 1499 O ILE A 100 -4.830 -9.374 -6.668 1.00 0.34 O ATOM 1500 CB ILE A 100 -2.711 -7.935 -4.553 1.00 0.25 C ATOM 1501 CG1 ILE A 100 -2.494 -6.443 -4.317 1.00 0.36 C ATOM 1502 CG2 ILE A 100 -1.941 -8.429 -5.765 1.00 0.37 C ATOM 1503 CD1 ILE A 100 -1.046 -6.060 -4.136 1.00 0.38 C ATOM 0 H ILE A 100 -4.081 -8.360 -2.598 1.00 0.25 H new ATOM 0 HA ILE A 100 -4.710 -7.391 -5.160 1.00 0.24 H new ATOM 0 HB ILE A 100 -2.319 -8.484 -3.697 1.00 0.25 H new ATOM 0 HG12 ILE A 100 -2.904 -5.888 -5.160 1.00 0.36 H new ATOM 0 HG13 ILE A 100 -3.054 -6.139 -3.433 1.00 0.36 H new ATOM 0 HG21 ILE A 100 -0.882 -8.202 -5.641 1.00 0.37 H new ATOM 0 HG22 ILE A 100 -2.072 -9.507 -5.865 1.00 0.37 H new ATOM 0 HG23 ILE A 100 -2.316 -7.934 -6.661 1.00 0.37 H new ATOM 0 HD11 ILE A 100 -0.972 -4.985 -3.973 1.00 0.38 H new ATOM 0 HD12 ILE A 100 -0.635 -6.587 -3.275 1.00 0.38 H new ATOM 0 HD13 ILE A 100 -0.483 -6.331 -5.029 1.00 0.38 H new ATOM 1515 N ASN A 101 -4.172 -10.631 -4.938 1.00 0.31 N ATOM 1516 CA ASN A 101 -4.413 -11.908 -5.600 1.00 0.38 C ATOM 1517 C ASN A 101 -5.857 -12.016 -6.077 1.00 0.37 C ATOM 1518 O ASN A 101 -6.142 -12.679 -7.073 1.00 0.46 O ATOM 1519 CB ASN A 101 -4.080 -13.065 -4.657 1.00 0.46 C ATOM 1520 CG ASN A 101 -2.587 -13.309 -4.533 1.00 1.08 C ATOM 1521 OD1 ASN A 101 -1.781 -12.386 -4.637 1.00 1.85 O ATOM 1522 ND2 ASN A 101 -2.207 -14.558 -4.324 1.00 1.55 N ATOM 0 H ASN A 101 -3.787 -10.717 -3.997 1.00 0.31 H new ATOM 0 HA ASN A 101 -3.763 -11.964 -6.473 1.00 0.38 H new ATOM 0 HB2 ASN A 101 -4.493 -12.854 -3.670 1.00 0.46 H new ATOM 0 HB3 ASN A 101 -4.564 -13.973 -5.018 1.00 0.46 H new ATOM 0 HD21 ASN A 101 -1.215 -14.783 -4.244 1.00 1.55 H new ATOM 0 HD22 ASN A 101 -2.906 -15.297 -4.243 1.00 1.55 H new ATOM 1529 N HIS A 102 -6.760 -11.344 -5.376 1.00 0.33 N ATOM 1530 CA HIS A 102 -8.159 -11.324 -5.765 1.00 0.38 C ATOM 1531 C HIS A 102 -8.404 -10.232 -6.805 1.00 0.38 C ATOM 1532 O HIS A 102 -9.291 -10.353 -7.649 1.00 0.47 O ATOM 1533 CB HIS A 102 -9.057 -11.107 -4.542 1.00 0.43 C ATOM 1534 CG HIS A 102 -10.505 -11.365 -4.824 1.00 0.55 C ATOM 1535 ND1 HIS A 102 -11.145 -12.523 -4.461 1.00 0.75 N ATOM 1536 CD2 HIS A 102 -11.429 -10.616 -5.466 1.00 0.61 C ATOM 1537 CE1 HIS A 102 -12.397 -12.480 -4.872 1.00 0.85 C ATOM 1538 NE2 HIS A 102 -12.600 -11.334 -5.486 1.00 0.77 N ATOM 0 H HIS A 102 -6.547 -10.806 -4.536 1.00 0.33 H new ATOM 0 HA HIS A 102 -8.408 -12.289 -6.206 1.00 0.38 H new ATOM 0 HB2 HIS A 102 -8.728 -11.762 -3.736 1.00 0.43 H new ATOM 0 HB3 HIS A 102 -8.939 -10.083 -4.189 1.00 0.43 H new ATOM 0 HD1 HIS A 102 -10.718 -13.297 -3.952 1.00 0.75 H new ATOM 0 HD2 HIS A 102 -11.275 -9.633 -5.886 1.00 0.61 H new ATOM 0 HE1 HIS A 102 -13.134 -13.257 -4.729 1.00 0.85 H new ATOM 1547 N ALA A 103 -7.604 -9.177 -6.751 1.00 0.32 N ATOM 1548 CA ALA A 103 -7.791 -8.034 -7.636 1.00 0.38 C ATOM 1549 C ALA A 103 -7.128 -8.256 -8.991 1.00 0.40 C ATOM 1550 O ALA A 103 -7.731 -8.027 -10.040 1.00 0.48 O ATOM 1551 CB ALA A 103 -7.227 -6.784 -6.983 1.00 0.43 C ATOM 0 H ALA A 103 -6.820 -9.088 -6.105 1.00 0.32 H new ATOM 0 HA ALA A 103 -8.861 -7.912 -7.806 1.00 0.38 H new ATOM 0 HB1 ALA A 103 -7.368 -5.931 -7.647 1.00 0.43 H new ATOM 0 HB2 ALA A 103 -7.744 -6.600 -6.041 1.00 0.43 H new ATOM 0 HB3 ALA A 103 -6.163 -6.922 -6.791 1.00 0.43 H new ATOM 1557 N LYS A 104 -5.894 -8.733 -8.947 1.00 0.40 N ATOM 1558 CA LYS A 104 -5.036 -8.832 -10.114 1.00 0.51 C ATOM 1559 C LYS A 104 -5.681 -9.620 -11.253 1.00 0.50 C ATOM 1560 O LYS A 104 -5.523 -9.276 -12.422 1.00 0.60 O ATOM 1561 CB LYS A 104 -3.730 -9.499 -9.688 1.00 0.64 C ATOM 1562 CG LYS A 104 -3.907 -10.940 -9.239 1.00 1.11 C ATOM 1563 CD LYS A 104 -2.651 -11.465 -8.585 1.00 1.57 C ATOM 1564 CE LYS A 104 -1.552 -11.702 -9.606 1.00 1.92 C ATOM 1565 NZ LYS A 104 -0.325 -12.268 -8.990 1.00 2.56 N ATOM 0 H LYS A 104 -5.456 -9.066 -8.088 1.00 0.40 H new ATOM 0 HA LYS A 104 -4.857 -7.827 -10.497 1.00 0.51 H new ATOM 0 HB2 LYS A 104 -3.027 -9.469 -10.521 1.00 0.64 H new ATOM 0 HB3 LYS A 104 -3.286 -8.925 -8.875 1.00 0.64 H new ATOM 0 HG2 LYS A 104 -4.740 -11.006 -8.539 1.00 1.11 H new ATOM 0 HG3 LYS A 104 -4.161 -11.563 -10.097 1.00 1.11 H new ATOM 0 HD2 LYS A 104 -2.305 -10.754 -7.835 1.00 1.57 H new ATOM 0 HD3 LYS A 104 -2.872 -12.396 -8.064 1.00 1.57 H new ATOM 0 HE2 LYS A 104 -1.916 -12.381 -10.377 1.00 1.92 H new ATOM 0 HE3 LYS A 104 -1.308 -10.761 -10.099 1.00 1.92 H new ATOM 0 HZ1 LYS A 104 0.466 -11.606 -9.121 1.00 2.56 H new ATOM 0 HZ2 LYS A 104 -0.485 -12.420 -7.974 1.00 2.56 H new ATOM 0 HZ3 LYS A 104 -0.096 -13.175 -9.443 1.00 2.56 H new ATOM 1579 N ALA A 105 -6.422 -10.661 -10.909 1.00 0.51 N ATOM 1580 CA ALA A 105 -6.852 -11.629 -11.901 1.00 0.61 C ATOM 1581 C ALA A 105 -8.247 -11.369 -12.440 1.00 0.66 C ATOM 1582 O ALA A 105 -8.820 -12.221 -13.119 1.00 0.76 O ATOM 1583 CB ALA A 105 -6.744 -13.036 -11.349 1.00 0.72 C ATOM 0 H ALA A 105 -6.735 -10.855 -9.958 1.00 0.51 H new ATOM 0 HA ALA A 105 -6.177 -11.518 -12.749 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -7.070 -13.750 -12.106 1.00 0.72 H new ATOM 0 HB2 ALA A 105 -5.708 -13.242 -11.078 1.00 0.72 H new ATOM 0 HB3 ALA A 105 -7.375 -13.130 -10.466 1.00 0.72 H new ATOM 1589 N ALA A 106 -8.804 -10.214 -12.146 1.00 0.62 N ATOM 1590 CA ALA A 106 -10.064 -9.848 -12.740 1.00 0.70 C ATOM 1591 C ALA A 106 -9.754 -9.186 -14.062 1.00 0.72 C ATOM 1592 O ALA A 106 -10.259 -9.604 -15.104 1.00 0.90 O ATOM 1593 CB ALA A 106 -10.852 -8.927 -11.821 1.00 0.75 C ATOM 0 H ALA A 106 -8.408 -9.523 -11.508 1.00 0.62 H new ATOM 0 HA ALA A 106 -10.689 -10.727 -12.897 1.00 0.70 H new ATOM 0 HB1 ALA A 106 -11.799 -8.666 -12.293 1.00 0.75 H new ATOM 0 HB2 ALA A 106 -11.045 -9.435 -10.876 1.00 0.75 H new ATOM 0 HB3 ALA A 106 -10.277 -8.020 -11.635 1.00 0.75 H new ATOM 1599 N ASN A 107 -8.856 -8.196 -13.967 1.00 0.67 N ATOM 1600 CA ASN A 107 -8.304 -7.439 -15.102 1.00 0.73 C ATOM 1601 C ASN A 107 -7.971 -6.030 -14.637 1.00 0.67 C ATOM 1602 O ASN A 107 -7.704 -5.134 -15.436 1.00 0.80 O ATOM 1603 CB ASN A 107 -9.276 -7.376 -16.289 1.00 0.92 C ATOM 1604 CG ASN A 107 -10.425 -6.392 -16.106 1.00 1.44 C ATOM 1605 OD1 ASN A 107 -11.457 -6.730 -15.532 1.00 1.99 O ATOM 1606 ND2 ASN A 107 -10.273 -5.183 -16.628 1.00 2.06 N ATOM 0 H ASN A 107 -8.481 -7.889 -13.070 1.00 0.67 H new ATOM 0 HA ASN A 107 -7.407 -7.954 -15.447 1.00 0.73 H new ATOM 0 HB2 ASN A 107 -8.719 -7.104 -17.186 1.00 0.92 H new ATOM 0 HB3 ASN A 107 -9.688 -8.371 -16.459 1.00 0.92 H new ATOM 0 HD21 ASN A 107 -11.027 -4.500 -16.560 1.00 2.06 H new ATOM 0 HD22 ASN A 107 -9.402 -4.936 -17.098 1.00 2.06 H new ATOM 1613 N VAL A 108 -7.941 -5.855 -13.326 1.00 0.55 N ATOM 1614 CA VAL A 108 -7.926 -4.518 -12.744 1.00 0.49 C ATOM 1615 C VAL A 108 -6.534 -4.109 -12.276 1.00 0.40 C ATOM 1616 O VAL A 108 -5.755 -4.933 -11.793 1.00 0.42 O ATOM 1617 CB VAL A 108 -8.938 -4.391 -11.569 1.00 0.54 C ATOM 1618 CG1 VAL A 108 -9.521 -5.742 -11.187 1.00 1.00 C ATOM 1619 CG2 VAL A 108 -8.290 -3.737 -10.356 1.00 1.08 C ATOM 0 H VAL A 108 -7.927 -6.615 -12.646 1.00 0.55 H new ATOM 0 HA VAL A 108 -8.229 -3.838 -13.540 1.00 0.49 H new ATOM 0 HB VAL A 108 -9.753 -3.754 -11.913 1.00 0.54 H new ATOM 0 HG11 VAL A 108 -10.224 -5.615 -10.363 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -10.040 -6.170 -12.044 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -8.718 -6.411 -10.879 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -9.020 -3.661 -9.550 1.00 1.08 H new ATOM 0 HG22 VAL A 108 -7.445 -4.341 -10.025 1.00 1.08 H new ATOM 0 HG23 VAL A 108 -7.940 -2.740 -10.624 1.00 1.08 H new ATOM 1629 N PRO A 109 -6.211 -2.816 -12.441 1.00 0.39 N ATOM 1630 CA PRO A 109 -4.982 -2.228 -11.924 1.00 0.35 C ATOM 1631 C PRO A 109 -4.998 -2.056 -10.413 1.00 0.30 C ATOM 1632 O PRO A 109 -6.052 -1.920 -9.784 1.00 0.34 O ATOM 1633 CB PRO A 109 -4.915 -0.852 -12.578 1.00 0.43 C ATOM 1634 CG PRO A 109 -5.974 -0.842 -13.620 1.00 0.51 C ATOM 1635 CD PRO A 109 -7.009 -1.828 -13.175 1.00 0.48 C ATOM 0 HA PRO A 109 -4.130 -2.871 -12.145 1.00 0.35 H new ATOM 0 HB2 PRO A 109 -5.082 -0.063 -11.845 1.00 0.43 H new ATOM 0 HB3 PRO A 109 -3.933 -0.676 -13.018 1.00 0.43 H new ATOM 0 HG2 PRO A 109 -6.405 0.153 -13.727 1.00 0.51 H new ATOM 0 HG3 PRO A 109 -5.566 -1.118 -14.592 1.00 0.51 H new ATOM 0 HD2 PRO A 109 -7.765 -1.365 -12.541 1.00 0.48 H new ATOM 0 HD3 PRO A 109 -7.533 -2.276 -14.020 1.00 0.48 H new ATOM 1643 N ILE A 110 -3.815 -1.991 -9.846 1.00 0.27 N ATOM 1644 CA ILE A 110 -3.663 -1.962 -8.404 1.00 0.25 C ATOM 1645 C ILE A 110 -2.820 -0.760 -7.991 1.00 0.23 C ATOM 1646 O ILE A 110 -1.964 -0.301 -8.745 1.00 0.26 O ATOM 1647 CB ILE A 110 -3.034 -3.280 -7.883 1.00 0.30 C ATOM 1648 CG1 ILE A 110 -3.909 -4.476 -8.279 1.00 0.46 C ATOM 1649 CG2 ILE A 110 -2.863 -3.240 -6.369 1.00 0.45 C ATOM 1650 CD1 ILE A 110 -3.283 -5.819 -7.974 1.00 0.96 C ATOM 0 H ILE A 110 -2.937 -1.957 -10.363 1.00 0.27 H new ATOM 0 HA ILE A 110 -4.652 -1.867 -7.955 1.00 0.25 H new ATOM 0 HB ILE A 110 -2.050 -3.390 -8.338 1.00 0.30 H new ATOM 0 HG12 ILE A 110 -4.864 -4.404 -7.758 1.00 0.46 H new ATOM 0 HG13 ILE A 110 -4.123 -4.420 -9.346 1.00 0.46 H new ATOM 0 HG21 ILE A 110 -2.420 -4.176 -6.028 1.00 0.45 H new ATOM 0 HG22 ILE A 110 -2.211 -2.410 -6.098 1.00 0.45 H new ATOM 0 HG23 ILE A 110 -3.836 -3.106 -5.896 1.00 0.45 H new ATOM 0 HD11 ILE A 110 -3.961 -6.615 -8.282 1.00 0.96 H new ATOM 0 HD12 ILE A 110 -2.342 -5.914 -8.516 1.00 0.96 H new ATOM 0 HD13 ILE A 110 -3.094 -5.898 -6.903 1.00 0.96 H new ATOM 1662 N ILE A 111 -3.090 -0.234 -6.807 1.00 0.23 N ATOM 1663 CA ILE A 111 -2.405 0.946 -6.308 1.00 0.25 C ATOM 1664 C ILE A 111 -1.706 0.591 -5.024 1.00 0.32 C ATOM 1665 O ILE A 111 -2.024 -0.412 -4.421 1.00 0.71 O ATOM 1666 CB ILE A 111 -3.410 2.078 -6.029 1.00 0.29 C ATOM 1667 CG1 ILE A 111 -4.291 2.319 -7.241 1.00 0.35 C ATOM 1668 CG2 ILE A 111 -2.711 3.359 -5.614 1.00 0.34 C ATOM 1669 CD1 ILE A 111 -5.722 2.534 -6.847 1.00 0.53 C ATOM 0 H ILE A 111 -3.788 -0.612 -6.167 1.00 0.23 H new ATOM 0 HA ILE A 111 -1.690 1.285 -7.057 1.00 0.25 H new ATOM 0 HB ILE A 111 -4.039 1.762 -5.196 1.00 0.29 H new ATOM 0 HG12 ILE A 111 -3.929 3.189 -7.788 1.00 0.35 H new ATOM 0 HG13 ILE A 111 -4.223 1.467 -7.917 1.00 0.35 H new ATOM 0 HG21 ILE A 111 -3.454 4.134 -5.426 1.00 0.34 H new ATOM 0 HG22 ILE A 111 -2.134 3.181 -4.706 1.00 0.34 H new ATOM 0 HG23 ILE A 111 -2.042 3.683 -6.411 1.00 0.34 H new ATOM 0 HD11 ILE A 111 -6.324 2.703 -7.740 1.00 0.53 H new ATOM 0 HD12 ILE A 111 -6.091 1.653 -6.322 1.00 0.53 H new ATOM 0 HD13 ILE A 111 -5.792 3.402 -6.192 1.00 0.53 H new ATOM 1681 N VAL A 112 -0.744 1.384 -4.624 1.00 0.21 N ATOM 1682 CA VAL A 112 -0.104 1.186 -3.368 1.00 0.20 C ATOM 1683 C VAL A 112 -0.195 2.428 -2.524 1.00 0.20 C ATOM 1684 O VAL A 112 -0.063 3.544 -3.022 1.00 0.23 O ATOM 1685 CB VAL A 112 1.361 0.838 -3.550 1.00 0.20 C ATOM 1686 CG1 VAL A 112 1.765 -0.166 -2.533 1.00 0.20 C ATOM 1687 CG2 VAL A 112 1.609 0.288 -4.929 1.00 0.22 C ATOM 0 H VAL A 112 -0.392 2.176 -5.162 1.00 0.21 H new ATOM 0 HA VAL A 112 -0.616 0.361 -2.873 1.00 0.20 H new ATOM 0 HB VAL A 112 1.952 1.745 -3.426 1.00 0.20 H new ATOM 0 HG11 VAL A 112 2.818 -0.415 -2.666 1.00 0.20 H new ATOM 0 HG12 VAL A 112 1.612 0.245 -1.535 1.00 0.20 H new ATOM 0 HG13 VAL A 112 1.162 -1.066 -2.651 1.00 0.20 H new ATOM 0 HG21 VAL A 112 2.666 0.045 -5.039 1.00 0.22 H new ATOM 0 HG22 VAL A 112 1.012 -0.613 -5.074 1.00 0.22 H new ATOM 0 HG23 VAL A 112 1.329 1.033 -5.674 1.00 0.22 H new ATOM 1697 N ALA A 113 -0.409 2.225 -1.251 1.00 0.19 N ATOM 1698 CA ALA A 113 -0.417 3.299 -0.310 1.00 0.21 C ATOM 1699 C ALA A 113 0.623 3.007 0.740 1.00 0.21 C ATOM 1700 O ALA A 113 0.344 2.371 1.751 1.00 0.23 O ATOM 1701 CB ALA A 113 -1.794 3.460 0.310 1.00 0.25 C ATOM 0 H ALA A 113 -0.582 1.307 -0.843 1.00 0.19 H new ATOM 0 HA ALA A 113 -0.181 4.239 -0.809 1.00 0.21 H new ATOM 0 HB1 ALA A 113 -1.778 4.284 1.024 1.00 0.25 H new ATOM 0 HB2 ALA A 113 -2.523 3.672 -0.472 1.00 0.25 H new ATOM 0 HB3 ALA A 113 -2.071 2.540 0.824 1.00 0.25 H new ATOM 1707 N ILE A 114 1.829 3.449 0.466 1.00 0.21 N ATOM 1708 CA ILE A 114 2.929 3.314 1.388 1.00 0.24 C ATOM 1709 C ILE A 114 2.705 4.227 2.585 1.00 0.25 C ATOM 1710 O ILE A 114 3.013 5.417 2.535 1.00 0.30 O ATOM 1711 CB ILE A 114 4.257 3.672 0.697 1.00 0.28 C ATOM 1712 CG1 ILE A 114 4.402 2.899 -0.618 1.00 0.32 C ATOM 1713 CG2 ILE A 114 5.412 3.369 1.617 1.00 0.36 C ATOM 1714 CD1 ILE A 114 5.644 3.258 -1.406 1.00 0.85 C ATOM 0 H ILE A 114 2.074 3.915 -0.408 1.00 0.21 H new ATOM 0 HA ILE A 114 2.982 2.279 1.726 1.00 0.24 H new ATOM 0 HB ILE A 114 4.259 4.738 0.469 1.00 0.28 H new ATOM 0 HG12 ILE A 114 4.417 1.831 -0.401 1.00 0.32 H new ATOM 0 HG13 ILE A 114 3.524 3.086 -1.237 1.00 0.32 H new ATOM 0 HG21 ILE A 114 6.349 3.625 1.122 1.00 0.36 H new ATOM 0 HG22 ILE A 114 5.313 3.955 2.531 1.00 0.36 H new ATOM 0 HG23 ILE A 114 5.411 2.308 1.865 1.00 0.36 H new ATOM 0 HD11 ILE A 114 5.676 2.670 -2.323 1.00 0.85 H new ATOM 0 HD12 ILE A 114 5.622 4.319 -1.656 1.00 0.85 H new ATOM 0 HD13 ILE A 114 6.529 3.044 -0.807 1.00 0.85 H new ATOM 1726 N ASN A 115 2.153 3.670 3.651 1.00 0.26 N ATOM 1727 CA ASN A 115 1.747 4.463 4.796 1.00 0.31 C ATOM 1728 C ASN A 115 2.854 4.499 5.847 1.00 0.37 C ATOM 1729 O ASN A 115 3.808 3.717 5.784 1.00 0.39 O ATOM 1730 CB ASN A 115 0.461 3.880 5.392 1.00 0.39 C ATOM 1731 CG ASN A 115 -0.154 4.750 6.474 1.00 0.47 C ATOM 1732 OD1 ASN A 115 -0.037 5.980 6.450 1.00 0.60 O ATOM 1733 ND2 ASN A 115 -0.808 4.117 7.433 1.00 0.69 N ATOM 0 H ASN A 115 1.976 2.670 3.745 1.00 0.26 H new ATOM 0 HA ASN A 115 1.559 5.486 4.470 1.00 0.31 H new ATOM 0 HB2 ASN A 115 -0.268 3.737 4.594 1.00 0.39 H new ATOM 0 HB3 ASN A 115 0.676 2.895 5.807 1.00 0.39 H new ATOM 0 HD21 ASN A 115 -1.240 4.646 8.191 1.00 0.69 H new ATOM 0 HD22 ASN A 115 -0.881 3.100 7.415 1.00 0.69 H new ATOM 1740 N LYS A 116 2.722 5.430 6.793 1.00 0.49 N ATOM 1741 CA LYS A 116 3.646 5.572 7.920 1.00 0.62 C ATOM 1742 C LYS A 116 5.053 5.961 7.480 1.00 0.57 C ATOM 1743 O LYS A 116 5.986 5.873 8.273 1.00 0.67 O ATOM 1744 CB LYS A 116 3.749 4.281 8.745 1.00 0.78 C ATOM 1745 CG LYS A 116 2.477 3.855 9.455 1.00 1.15 C ATOM 1746 CD LYS A 116 2.800 2.854 10.557 1.00 1.50 C ATOM 1747 CE LYS A 116 1.553 2.263 11.189 1.00 2.05 C ATOM 1748 NZ LYS A 116 0.906 1.254 10.311 1.00 2.61 N ATOM 0 H LYS A 116 1.964 6.113 6.799 1.00 0.49 H new ATOM 0 HA LYS A 116 3.226 6.371 8.530 1.00 0.62 H new ATOM 0 HB2 LYS A 116 4.064 3.473 8.085 1.00 0.78 H new ATOM 0 HB3 LYS A 116 4.535 4.408 9.490 1.00 0.78 H new ATOM 0 HG2 LYS A 116 1.980 4.727 9.880 1.00 1.15 H new ATOM 0 HG3 LYS A 116 1.785 3.410 8.741 1.00 1.15 H new ATOM 0 HD2 LYS A 116 3.411 2.050 10.146 1.00 1.50 H new ATOM 0 HD3 LYS A 116 3.396 3.345 11.327 1.00 1.50 H new ATOM 0 HE2 LYS A 116 1.814 1.801 12.141 1.00 2.05 H new ATOM 0 HE3 LYS A 116 0.844 3.062 11.406 1.00 2.05 H new ATOM 0 HZ1 LYS A 116 0.223 0.699 10.865 1.00 2.61 H new ATOM 0 HZ2 LYS A 116 0.411 1.736 9.534 1.00 2.61 H new ATOM 0 HZ3 LYS A 116 1.631 0.620 9.919 1.00 2.61 H new ATOM 1762 N MET A 117 5.228 6.399 6.243 1.00 0.58 N ATOM 1763 CA MET A 117 6.574 6.682 5.763 1.00 0.69 C ATOM 1764 C MET A 117 7.015 8.095 6.139 1.00 0.81 C ATOM 1765 O MET A 117 8.065 8.571 5.697 1.00 1.03 O ATOM 1766 CB MET A 117 6.707 6.440 4.265 1.00 0.85 C ATOM 1767 CG MET A 117 6.300 7.599 3.375 1.00 0.81 C ATOM 1768 SD MET A 117 7.482 7.818 2.037 1.00 1.37 S ATOM 1769 CE MET A 117 7.858 6.103 1.677 1.00 0.65 C ATOM 0 H MET A 117 4.480 6.563 5.569 1.00 0.58 H new ATOM 0 HA MET A 117 7.244 5.982 6.262 1.00 0.69 H new ATOM 0 HB2 MET A 117 7.744 6.185 4.047 1.00 0.85 H new ATOM 0 HB3 MET A 117 6.103 5.572 4.000 1.00 0.85 H new ATOM 0 HG2 MET A 117 5.307 7.417 2.964 1.00 0.81 H new ATOM 0 HG3 MET A 117 6.238 8.513 3.965 1.00 0.81 H new ATOM 0 HE1 MET A 117 8.883 5.885 1.976 1.00 0.65 H new ATOM 0 HE2 MET A 117 7.174 5.457 2.228 1.00 0.65 H new ATOM 0 HE3 MET A 117 7.746 5.923 0.608 1.00 0.65 H new ATOM 1779 N ASP A 118 6.220 8.754 6.977 1.00 0.84 N ATOM 1780 CA ASP A 118 6.612 10.035 7.562 1.00 1.06 C ATOM 1781 C ASP A 118 7.608 9.782 8.696 1.00 1.10 C ATOM 1782 O ASP A 118 7.383 10.136 9.857 1.00 1.49 O ATOM 1783 CB ASP A 118 5.384 10.794 8.072 1.00 1.25 C ATOM 1784 CG ASP A 118 5.701 12.222 8.460 1.00 1.61 C ATOM 1785 OD1 ASP A 118 6.108 13.001 7.576 1.00 2.45 O ATOM 1786 OD2 ASP A 118 5.495 12.580 9.638 1.00 1.73 O ATOM 0 H ASP A 118 5.300 8.423 7.267 1.00 0.84 H new ATOM 0 HA ASP A 118 7.087 10.653 6.799 1.00 1.06 H new ATOM 0 HB2 ASP A 118 4.615 10.794 7.300 1.00 1.25 H new ATOM 0 HB3 ASP A 118 4.970 10.271 8.934 1.00 1.25 H new ATOM 1791 N LYS A 119 8.696 9.126 8.328 1.00 1.11 N ATOM 1792 CA LYS A 119 9.754 8.729 9.240 1.00 1.34 C ATOM 1793 C LYS A 119 10.975 8.351 8.390 1.00 1.43 C ATOM 1794 O LYS A 119 10.944 8.605 7.186 1.00 1.78 O ATOM 1795 CB LYS A 119 9.284 7.557 10.132 1.00 1.81 C ATOM 1796 CG LYS A 119 8.914 6.282 9.382 1.00 1.99 C ATOM 1797 CD LYS A 119 8.864 5.089 10.331 1.00 2.61 C ATOM 1798 CE LYS A 119 8.432 3.809 9.626 1.00 3.15 C ATOM 1799 NZ LYS A 119 6.955 3.711 9.496 1.00 3.70 N ATOM 0 H LYS A 119 8.872 8.848 7.362 1.00 1.11 H new ATOM 0 HA LYS A 119 10.018 9.544 9.914 1.00 1.34 H new ATOM 0 HB2 LYS A 119 10.074 7.324 10.845 1.00 1.81 H new ATOM 0 HB3 LYS A 119 8.419 7.884 10.710 1.00 1.81 H new ATOM 0 HG2 LYS A 119 7.946 6.408 8.898 1.00 1.99 H new ATOM 0 HG3 LYS A 119 9.643 6.094 8.593 1.00 1.99 H new ATOM 0 HD2 LYS A 119 9.847 4.941 10.778 1.00 2.61 H new ATOM 0 HD3 LYS A 119 8.172 5.304 11.146 1.00 2.61 H new ATOM 0 HE2 LYS A 119 8.886 3.771 8.636 1.00 3.15 H new ATOM 0 HE3 LYS A 119 8.804 2.947 10.180 1.00 3.15 H new ATOM 0 HZ1 LYS A 119 6.697 2.753 9.184 1.00 3.70 H new ATOM 0 HZ2 LYS A 119 6.512 3.907 10.416 1.00 3.70 H new ATOM 0 HZ3 LYS A 119 6.621 4.405 8.797 1.00 3.70 H new ATOM 1813 N PRO A 120 12.064 7.773 8.956 1.00 1.71 N ATOM 1814 CA PRO A 120 13.231 7.314 8.170 1.00 2.15 C ATOM 1815 C PRO A 120 12.863 6.509 6.912 1.00 2.06 C ATOM 1816 O PRO A 120 13.679 6.411 5.999 1.00 2.57 O ATOM 1817 CB PRO A 120 14.009 6.425 9.156 1.00 2.65 C ATOM 1818 CG PRO A 120 13.180 6.350 10.398 1.00 2.67 C ATOM 1819 CD PRO A 120 12.307 7.567 10.391 1.00 2.11 C ATOM 0 HA PRO A 120 13.794 8.166 7.789 1.00 2.15 H new ATOM 0 HB2 PRO A 120 14.173 5.432 8.738 1.00 2.65 H new ATOM 0 HB3 PRO A 120 14.991 6.848 9.369 1.00 2.65 H new ATOM 0 HG2 PRO A 120 12.580 5.440 10.411 1.00 2.67 H new ATOM 0 HG3 PRO A 120 13.811 6.328 11.287 1.00 2.67 H new ATOM 0 HD2 PRO A 120 11.380 7.405 10.941 1.00 2.11 H new ATOM 0 HD3 PRO A 120 12.802 8.425 10.846 1.00 2.11 H new ATOM 1827 N GLU A 121 11.646 5.942 6.888 1.00 1.72 N ATOM 1828 CA GLU A 121 11.092 5.206 5.743 1.00 1.80 C ATOM 1829 C GLU A 121 12.030 4.097 5.275 1.00 1.43 C ATOM 1830 O GLU A 121 13.022 4.331 4.573 1.00 2.12 O ATOM 1831 CB GLU A 121 10.676 6.134 4.578 1.00 2.45 C ATOM 1832 CG GLU A 121 11.822 6.750 3.799 1.00 2.79 C ATOM 1833 CD GLU A 121 11.360 7.649 2.671 1.00 3.60 C ATOM 1834 OE1 GLU A 121 10.991 7.124 1.601 1.00 4.03 O ATOM 1835 OE2 GLU A 121 11.377 8.887 2.843 1.00 3.92 O ATOM 0 H GLU A 121 11.007 5.984 7.682 1.00 1.72 H new ATOM 0 HA GLU A 121 10.177 4.732 6.099 1.00 1.80 H new ATOM 0 HB2 GLU A 121 10.053 5.566 3.887 1.00 2.45 H new ATOM 0 HB3 GLU A 121 10.057 6.937 4.978 1.00 2.45 H new ATOM 0 HG2 GLU A 121 12.448 7.325 4.481 1.00 2.79 H new ATOM 0 HG3 GLU A 121 12.444 5.954 3.389 1.00 2.79 H new ATOM 1842 N ALA A 122 11.689 2.890 5.700 1.00 0.99 N ATOM 1843 CA ALA A 122 12.534 1.711 5.505 1.00 1.09 C ATOM 1844 C ALA A 122 13.153 1.693 4.116 1.00 0.90 C ATOM 1845 O ALA A 122 14.367 1.843 3.974 1.00 1.24 O ATOM 1846 CB ALA A 122 11.745 0.434 5.748 1.00 1.47 C ATOM 0 H ALA A 122 10.817 2.695 6.192 1.00 0.99 H new ATOM 0 HA ALA A 122 13.343 1.765 6.233 1.00 1.09 H new ATOM 0 HB1 ALA A 122 12.394 -0.429 5.597 1.00 1.47 H new ATOM 0 HB2 ALA A 122 11.366 0.429 6.770 1.00 1.47 H new ATOM 0 HB3 ALA A 122 10.908 0.385 5.051 1.00 1.47 H new ATOM 1852 N ASN A 123 12.295 1.525 3.112 1.00 0.59 N ATOM 1853 CA ASN A 123 12.676 1.631 1.704 1.00 0.57 C ATOM 1854 C ASN A 123 11.524 1.150 0.836 1.00 0.46 C ATOM 1855 O ASN A 123 11.251 -0.049 0.771 1.00 0.52 O ATOM 1856 CB ASN A 123 13.917 0.789 1.382 1.00 0.85 C ATOM 1857 CG ASN A 123 14.540 1.161 0.047 1.00 1.28 C ATOM 1858 OD1 ASN A 123 13.865 1.661 -0.857 1.00 1.77 O ATOM 1859 ND2 ASN A 123 15.833 0.919 -0.088 1.00 1.84 N ATOM 0 H ASN A 123 11.308 1.310 3.253 1.00 0.59 H new ATOM 0 HA ASN A 123 12.909 2.676 1.501 1.00 0.57 H new ATOM 0 HB2 ASN A 123 14.656 0.919 2.173 1.00 0.85 H new ATOM 0 HB3 ASN A 123 13.644 -0.266 1.371 1.00 0.85 H new ATOM 0 HD21 ASN A 123 16.306 1.147 -0.963 1.00 1.84 H new ATOM 0 HD22 ASN A 123 16.357 0.504 0.682 1.00 1.84 H new ATOM 1866 N PRO A 124 10.797 2.093 0.209 1.00 0.41 N ATOM 1867 CA PRO A 124 9.782 1.788 -0.794 1.00 0.47 C ATOM 1868 C PRO A 124 10.168 0.643 -1.732 1.00 0.42 C ATOM 1869 O PRO A 124 9.440 -0.328 -1.820 1.00 0.40 O ATOM 1870 CB PRO A 124 9.678 3.098 -1.563 1.00 0.66 C ATOM 1871 CG PRO A 124 9.907 4.143 -0.529 1.00 0.70 C ATOM 1872 CD PRO A 124 10.858 3.548 0.479 1.00 0.46 C ATOM 0 HA PRO A 124 8.852 1.449 -0.338 1.00 0.47 H new ATOM 0 HB2 PRO A 124 10.421 3.154 -2.358 1.00 0.66 H new ATOM 0 HB3 PRO A 124 8.700 3.209 -2.032 1.00 0.66 H new ATOM 0 HG2 PRO A 124 10.328 5.044 -0.975 1.00 0.70 H new ATOM 0 HG3 PRO A 124 8.969 4.431 -0.054 1.00 0.70 H new ATOM 0 HD2 PRO A 124 11.869 3.936 0.352 1.00 0.46 H new ATOM 0 HD3 PRO A 124 10.554 3.778 1.500 1.00 0.46 H new ATOM 1880 N ASP A 125 11.319 0.760 -2.401 1.00 0.45 N ATOM 1881 CA ASP A 125 11.780 -0.238 -3.394 1.00 0.45 C ATOM 1882 C ASP A 125 11.664 -1.662 -2.880 1.00 0.38 C ATOM 1883 O ASP A 125 11.137 -2.523 -3.580 1.00 0.33 O ATOM 1884 CB ASP A 125 13.231 0.035 -3.752 1.00 0.56 C ATOM 1885 CG ASP A 125 13.845 -1.064 -4.599 1.00 1.16 C ATOM 1886 OD1 ASP A 125 13.556 -1.127 -5.811 1.00 1.28 O ATOM 1887 OD2 ASP A 125 14.636 -1.860 -4.052 1.00 2.00 O ATOM 0 H ASP A 125 11.961 1.543 -2.276 1.00 0.45 H new ATOM 0 HA ASP A 125 11.138 -0.142 -4.269 1.00 0.45 H new ATOM 0 HB2 ASP A 125 13.296 0.981 -4.290 1.00 0.56 H new ATOM 0 HB3 ASP A 125 13.811 0.149 -2.836 1.00 0.56 H new ATOM 1892 N ARG A 126 12.166 -1.905 -1.676 1.00 0.40 N ATOM 1893 CA ARG A 126 12.047 -3.217 -1.054 1.00 0.40 C ATOM 1894 C ARG A 126 10.615 -3.694 -1.135 1.00 0.34 C ATOM 1895 O ARG A 126 10.314 -4.724 -1.734 1.00 0.32 O ATOM 1896 CB ARG A 126 12.467 -3.158 0.412 1.00 0.47 C ATOM 1897 CG ARG A 126 12.207 -4.456 1.155 1.00 0.58 C ATOM 1898 CD ARG A 126 12.990 -5.600 0.544 1.00 1.25 C ATOM 1899 NE ARG A 126 12.871 -6.837 1.317 1.00 1.38 N ATOM 1900 CZ ARG A 126 13.682 -7.885 1.163 1.00 2.08 C ATOM 1901 NH1 ARG A 126 14.669 -7.838 0.279 1.00 2.99 N ATOM 1902 NH2 ARG A 126 13.506 -8.983 1.884 1.00 2.15 N ATOM 0 H ARG A 126 12.658 -1.212 -1.112 1.00 0.40 H new ATOM 0 HA ARG A 126 12.701 -3.908 -1.586 1.00 0.40 H new ATOM 0 HB2 ARG A 126 13.529 -2.918 0.471 1.00 0.47 H new ATOM 0 HB3 ARG A 126 11.929 -2.349 0.906 1.00 0.47 H new ATOM 0 HG2 ARG A 126 12.484 -4.341 2.203 1.00 0.58 H new ATOM 0 HG3 ARG A 126 11.142 -4.686 1.130 1.00 0.58 H new ATOM 0 HD2 ARG A 126 12.637 -5.775 -0.472 1.00 1.25 H new ATOM 0 HD3 ARG A 126 14.041 -5.320 0.473 1.00 1.25 H new ATOM 0 HE ARG A 126 12.127 -6.901 2.012 1.00 1.38 H new ATOM 0 HH11 ARG A 126 14.809 -7.000 -0.285 1.00 2.99 H new ATOM 0 HH12 ARG A 126 15.288 -8.640 0.163 1.00 2.99 H new ATOM 0 HH21 ARG A 126 12.746 -9.031 2.563 1.00 2.15 H new ATOM 0 HH22 ARG A 126 14.130 -9.780 1.760 1.00 2.15 H new ATOM 1916 N VAL A 127 9.751 -2.897 -0.540 1.00 0.34 N ATOM 1917 CA VAL A 127 8.312 -3.149 -0.535 1.00 0.34 C ATOM 1918 C VAL A 127 7.788 -3.282 -1.969 1.00 0.31 C ATOM 1919 O VAL A 127 7.053 -4.207 -2.295 1.00 0.33 O ATOM 1920 CB VAL A 127 7.557 -2.000 0.169 1.00 0.37 C ATOM 1921 CG1 VAL A 127 6.063 -2.284 0.228 1.00 0.39 C ATOM 1922 CG2 VAL A 127 8.114 -1.769 1.567 1.00 0.40 C ATOM 0 H VAL A 127 10.022 -2.049 -0.042 1.00 0.34 H new ATOM 0 HA VAL A 127 8.139 -4.079 0.007 1.00 0.34 H new ATOM 0 HB VAL A 127 7.705 -1.092 -0.415 1.00 0.37 H new ATOM 0 HG11 VAL A 127 5.555 -1.459 0.729 1.00 0.39 H new ATOM 0 HG12 VAL A 127 5.672 -2.390 -0.784 1.00 0.39 H new ATOM 0 HG13 VAL A 127 5.890 -3.207 0.782 1.00 0.39 H new ATOM 0 HG21 VAL A 127 7.569 -0.956 2.046 1.00 0.40 H new ATOM 0 HG22 VAL A 127 8.003 -2.678 2.158 1.00 0.40 H new ATOM 0 HG23 VAL A 127 9.170 -1.507 1.499 1.00 0.40 H new ATOM 1932 N MET A 128 8.210 -2.362 -2.826 1.00 0.28 N ATOM 1933 CA MET A 128 7.762 -2.307 -4.214 1.00 0.26 C ATOM 1934 C MET A 128 8.121 -3.584 -4.967 1.00 0.25 C ATOM 1935 O MET A 128 7.373 -4.033 -5.839 1.00 0.25 O ATOM 1936 CB MET A 128 8.378 -1.097 -4.923 1.00 0.25 C ATOM 1937 CG MET A 128 8.032 0.236 -4.279 1.00 0.27 C ATOM 1938 SD MET A 128 8.904 1.637 -5.011 1.00 0.30 S ATOM 1939 CE MET A 128 8.108 1.748 -6.609 1.00 0.29 C ATOM 0 H MET A 128 8.875 -1.629 -2.579 1.00 0.28 H new ATOM 0 HA MET A 128 6.676 -2.209 -4.208 1.00 0.26 H new ATOM 0 HB2 MET A 128 9.462 -1.211 -4.940 1.00 0.25 H new ATOM 0 HB3 MET A 128 8.043 -1.086 -5.960 1.00 0.25 H new ATOM 0 HG2 MET A 128 6.958 0.403 -4.362 1.00 0.27 H new ATOM 0 HG3 MET A 128 8.266 0.188 -3.215 1.00 0.27 H new ATOM 0 HE1 MET A 128 8.704 2.378 -7.269 1.00 0.29 H new ATOM 0 HE2 MET A 128 8.019 0.751 -7.041 1.00 0.29 H new ATOM 0 HE3 MET A 128 7.115 2.183 -6.492 1.00 0.29 H new ATOM 1949 N GLN A 129 9.262 -4.174 -4.628 1.00 0.25 N ATOM 1950 CA GLN A 129 9.700 -5.401 -5.277 1.00 0.26 C ATOM 1951 C GLN A 129 8.874 -6.578 -4.793 1.00 0.29 C ATOM 1952 O GLN A 129 8.767 -7.595 -5.475 1.00 0.31 O ATOM 1953 CB GLN A 129 11.186 -5.652 -5.035 1.00 0.29 C ATOM 1954 CG GLN A 129 12.085 -4.708 -5.813 1.00 0.31 C ATOM 1955 CD GLN A 129 13.533 -4.798 -5.385 1.00 0.46 C ATOM 1956 OE1 GLN A 129 13.836 -5.139 -4.241 1.00 1.16 O ATOM 1957 NE2 GLN A 129 14.439 -4.477 -6.294 1.00 1.28 N ATOM 0 H GLN A 129 9.897 -3.823 -3.911 1.00 0.25 H new ATOM 0 HA GLN A 129 9.551 -5.288 -6.351 1.00 0.26 H new ATOM 0 HB2 GLN A 129 11.397 -5.550 -3.970 1.00 0.29 H new ATOM 0 HB3 GLN A 129 11.424 -6.680 -5.310 1.00 0.29 H new ATOM 0 HG2 GLN A 129 12.010 -4.935 -6.877 1.00 0.31 H new ATOM 0 HG3 GLN A 129 11.733 -3.685 -5.679 1.00 0.31 H new ATOM 0 HE21 GLN A 129 14.146 -4.200 -7.231 1.00 1.28 H new ATOM 0 HE22 GLN A 129 15.431 -4.507 -6.058 1.00 1.28 H new ATOM 1966 N GLU A 130 8.279 -6.430 -3.621 1.00 0.33 N ATOM 1967 CA GLU A 130 7.368 -7.436 -3.110 1.00 0.38 C ATOM 1968 C GLU A 130 6.053 -7.328 -3.852 1.00 0.33 C ATOM 1969 O GLU A 130 5.393 -8.326 -4.107 1.00 0.36 O ATOM 1970 CB GLU A 130 7.145 -7.263 -1.608 1.00 0.48 C ATOM 1971 CG GLU A 130 8.379 -6.763 -0.896 1.00 0.71 C ATOM 1972 CD GLU A 130 8.257 -6.776 0.611 1.00 1.18 C ATOM 1973 OE1 GLU A 130 7.627 -5.863 1.178 1.00 2.02 O ATOM 1974 OE2 GLU A 130 8.805 -7.705 1.242 1.00 1.46 O ATOM 0 H GLU A 130 8.411 -5.625 -3.009 1.00 0.33 H new ATOM 0 HA GLU A 130 7.802 -8.423 -3.268 1.00 0.38 H new ATOM 0 HB2 GLU A 130 6.326 -6.563 -1.443 1.00 0.48 H new ATOM 0 HB3 GLU A 130 6.841 -8.217 -1.176 1.00 0.48 H new ATOM 0 HG2 GLU A 130 9.231 -7.377 -1.188 1.00 0.71 H new ATOM 0 HG3 GLU A 130 8.591 -5.746 -1.226 1.00 0.71 H new ATOM 1981 N LEU A 131 5.691 -6.111 -4.245 1.00 0.29 N ATOM 1982 CA LEU A 131 4.468 -5.918 -5.010 1.00 0.29 C ATOM 1983 C LEU A 131 4.633 -6.519 -6.379 1.00 0.24 C ATOM 1984 O LEU A 131 3.783 -7.258 -6.863 1.00 0.25 O ATOM 1985 CB LEU A 131 4.102 -4.442 -5.139 1.00 0.32 C ATOM 1986 CG LEU A 131 3.314 -3.876 -3.965 1.00 0.48 C ATOM 1987 CD1 LEU A 131 2.116 -4.748 -3.665 1.00 0.34 C ATOM 1988 CD2 LEU A 131 4.193 -3.785 -2.754 1.00 1.06 C ATOM 0 H LEU A 131 6.217 -5.259 -4.050 1.00 0.29 H new ATOM 0 HA LEU A 131 3.658 -6.414 -4.475 1.00 0.29 H new ATOM 0 HB2 LEU A 131 5.018 -3.864 -5.256 1.00 0.32 H new ATOM 0 HB3 LEU A 131 3.519 -4.305 -6.050 1.00 0.32 H new ATOM 0 HG LEU A 131 2.964 -2.878 -4.230 1.00 0.48 H new ATOM 0 HD11 LEU A 131 1.563 -4.330 -2.824 1.00 0.34 H new ATOM 0 HD12 LEU A 131 1.468 -4.789 -4.540 1.00 0.34 H new ATOM 0 HD13 LEU A 131 2.452 -5.754 -3.414 1.00 0.34 H new ATOM 0 HD21 LEU A 131 3.621 -3.379 -1.919 1.00 1.06 H new ATOM 0 HD22 LEU A 131 4.559 -4.778 -2.494 1.00 1.06 H new ATOM 0 HD23 LEU A 131 5.039 -3.131 -2.967 1.00 1.06 H new ATOM 2000 N MET A 132 5.761 -6.242 -6.986 1.00 0.21 N ATOM 2001 CA MET A 132 6.048 -6.789 -8.286 1.00 0.22 C ATOM 2002 C MET A 132 6.378 -8.274 -8.171 1.00 0.26 C ATOM 2003 O MET A 132 6.516 -8.969 -9.176 1.00 0.32 O ATOM 2004 CB MET A 132 7.174 -6.009 -8.943 1.00 0.23 C ATOM 2005 CG MET A 132 8.565 -6.359 -8.447 1.00 0.26 C ATOM 2006 SD MET A 132 9.403 -7.476 -9.573 1.00 0.35 S ATOM 2007 CE MET A 132 8.813 -6.786 -11.113 1.00 0.32 C ATOM 0 H MET A 132 6.492 -5.643 -6.601 1.00 0.21 H new ATOM 0 HA MET A 132 5.167 -6.696 -8.921 1.00 0.22 H new ATOM 0 HB2 MET A 132 7.134 -6.178 -10.019 1.00 0.23 H new ATOM 0 HB3 MET A 132 7.003 -4.945 -8.781 1.00 0.23 H new ATOM 0 HG2 MET A 132 9.152 -5.448 -8.333 1.00 0.26 H new ATOM 0 HG3 MET A 132 8.496 -6.819 -7.461 1.00 0.26 H new ATOM 0 HE1 MET A 132 9.520 -7.017 -11.910 1.00 0.32 H new ATOM 0 HE2 MET A 132 7.841 -7.215 -11.355 1.00 0.32 H new ATOM 0 HE3 MET A 132 8.718 -5.705 -11.015 1.00 0.32 H new ATOM 2017 N GLU A 133 6.465 -8.766 -6.932 1.00 0.27 N ATOM 2018 CA GLU A 133 6.594 -10.190 -6.692 1.00 0.35 C ATOM 2019 C GLU A 133 5.226 -10.823 -6.894 1.00 0.34 C ATOM 2020 O GLU A 133 5.117 -11.982 -7.299 1.00 0.40 O ATOM 2021 CB GLU A 133 7.120 -10.463 -5.277 1.00 0.44 C ATOM 2022 CG GLU A 133 7.390 -11.929 -4.977 1.00 0.67 C ATOM 2023 CD GLU A 133 8.492 -12.516 -5.834 1.00 1.30 C ATOM 2024 OE1 GLU A 133 9.606 -11.949 -5.854 1.00 1.55 O ATOM 2025 OE2 GLU A 133 8.260 -13.566 -6.472 1.00 2.18 O ATOM 0 H GLU A 133 6.448 -8.194 -6.088 1.00 0.27 H new ATOM 0 HA GLU A 133 7.313 -10.622 -7.387 1.00 0.35 H new ATOM 0 HB2 GLU A 133 8.041 -9.899 -5.130 1.00 0.44 H new ATOM 0 HB3 GLU A 133 6.397 -10.085 -4.555 1.00 0.44 H new ATOM 0 HG2 GLU A 133 7.659 -12.035 -3.926 1.00 0.67 H new ATOM 0 HG3 GLU A 133 6.474 -12.500 -5.131 1.00 0.67 H new ATOM 2032 N TYR A 134 4.169 -10.050 -6.627 1.00 0.30 N ATOM 2033 CA TYR A 134 2.826 -10.496 -6.955 1.00 0.34 C ATOM 2034 C TYR A 134 2.445 -9.998 -8.349 1.00 0.36 C ATOM 2035 O TYR A 134 1.301 -10.128 -8.787 1.00 0.44 O ATOM 2036 CB TYR A 134 1.853 -10.051 -5.879 1.00 0.32 C ATOM 2037 CG TYR A 134 2.399 -10.328 -4.499 1.00 0.37 C ATOM 2038 CD1 TYR A 134 2.677 -11.627 -4.094 1.00 0.51 C ATOM 2039 CD2 TYR A 134 2.704 -9.293 -3.634 1.00 0.37 C ATOM 2040 CE1 TYR A 134 3.230 -11.885 -2.858 1.00 0.61 C ATOM 2041 CE2 TYR A 134 3.271 -9.540 -2.401 1.00 0.49 C ATOM 2042 CZ TYR A 134 3.532 -10.840 -2.017 1.00 0.57 C ATOM 2043 OH TYR A 134 4.103 -11.095 -0.790 1.00 0.74 O ATOM 0 H TYR A 134 4.222 -9.129 -6.192 1.00 0.30 H new ATOM 0 HA TYR A 134 2.786 -11.585 -6.982 1.00 0.34 H new ATOM 0 HB2 TYR A 134 1.652 -8.985 -5.986 1.00 0.32 H new ATOM 0 HB3 TYR A 134 0.903 -10.569 -6.008 1.00 0.32 H new ATOM 0 HD1 TYR A 134 2.456 -12.449 -4.759 1.00 0.51 H new ATOM 0 HD2 TYR A 134 2.495 -8.275 -3.929 1.00 0.37 H new ATOM 0 HE1 TYR A 134 3.425 -12.902 -2.552 1.00 0.61 H new ATOM 0 HE2 TYR A 134 3.510 -8.720 -1.739 1.00 0.49 H new ATOM 0 HH TYR A 134 4.255 -10.250 -0.318 1.00 0.74 H new ATOM 2053 N ASN A 135 3.443 -9.401 -9.012 1.00 0.35 N ATOM 2054 CA ASN A 135 3.422 -9.100 -10.449 1.00 0.38 C ATOM 2055 C ASN A 135 2.598 -7.870 -10.747 1.00 0.42 C ATOM 2056 O ASN A 135 2.102 -7.691 -11.856 1.00 0.59 O ATOM 2057 CB ASN A 135 2.910 -10.288 -11.276 1.00 0.47 C ATOM 2058 CG ASN A 135 3.843 -11.478 -11.243 1.00 1.19 C ATOM 2059 OD1 ASN A 135 3.737 -12.345 -10.375 1.00 1.94 O ATOM 2060 ND2 ASN A 135 4.754 -11.539 -12.200 1.00 1.89 N ATOM 0 H ASN A 135 4.306 -9.107 -8.555 1.00 0.35 H new ATOM 0 HA ASN A 135 4.454 -8.904 -10.739 1.00 0.38 H new ATOM 0 HB2 ASN A 135 1.932 -10.590 -10.901 1.00 0.47 H new ATOM 0 HB3 ASN A 135 2.771 -9.971 -12.310 1.00 0.47 H new ATOM 0 HD21 ASN A 135 5.402 -12.326 -12.238 1.00 1.89 H new ATOM 0 HD22 ASN A 135 4.808 -10.799 -12.900 1.00 1.89 H new ATOM 2067 N LEU A 136 2.469 -7.017 -9.761 1.00 0.38 N ATOM 2068 CA LEU A 136 1.842 -5.743 -9.963 1.00 0.46 C ATOM 2069 C LEU A 136 2.933 -4.691 -9.973 1.00 0.39 C ATOM 2070 O LEU A 136 3.230 -4.034 -8.974 1.00 0.43 O ATOM 2071 CB LEU A 136 0.761 -5.475 -8.912 1.00 0.62 C ATOM 2072 CG LEU A 136 1.212 -5.474 -7.459 1.00 0.89 C ATOM 2073 CD1 LEU A 136 0.512 -4.361 -6.702 1.00 1.68 C ATOM 2074 CD2 LEU A 136 0.902 -6.815 -6.823 1.00 1.44 C ATOM 0 H LEU A 136 2.793 -7.187 -8.809 1.00 0.38 H new ATOM 0 HA LEU A 136 1.317 -5.721 -10.918 1.00 0.46 H new ATOM 0 HB2 LEU A 136 0.307 -4.508 -9.129 1.00 0.62 H new ATOM 0 HB3 LEU A 136 -0.020 -6.227 -9.026 1.00 0.62 H new ATOM 0 HG LEU A 136 2.288 -5.305 -7.418 1.00 0.89 H new ATOM 0 HD11 LEU A 136 0.840 -4.366 -5.662 1.00 1.68 H new ATOM 0 HD12 LEU A 136 0.759 -3.401 -7.156 1.00 1.68 H new ATOM 0 HD13 LEU A 136 -0.566 -4.515 -6.743 1.00 1.68 H new ATOM 0 HD21 LEU A 136 1.227 -6.808 -5.783 1.00 1.44 H new ATOM 0 HD22 LEU A 136 -0.172 -6.999 -6.866 1.00 1.44 H new ATOM 0 HD23 LEU A 136 1.427 -7.603 -7.362 1.00 1.44 H new ATOM 2086 N VAL A 137 3.585 -4.620 -11.114 1.00 0.33 N ATOM 2087 CA VAL A 137 4.716 -3.736 -11.316 1.00 0.27 C ATOM 2088 C VAL A 137 4.309 -2.283 -11.244 1.00 0.26 C ATOM 2089 O VAL A 137 3.342 -1.862 -11.872 1.00 0.27 O ATOM 2090 CB VAL A 137 5.405 -3.964 -12.670 1.00 0.27 C ATOM 2091 CG1 VAL A 137 6.837 -4.429 -12.457 1.00 0.61 C ATOM 2092 CG2 VAL A 137 4.623 -4.950 -13.526 1.00 0.49 C ATOM 0 H VAL A 137 3.344 -5.177 -11.934 1.00 0.33 H new ATOM 0 HA VAL A 137 5.413 -3.972 -10.511 1.00 0.27 H new ATOM 0 HB VAL A 137 5.429 -3.017 -13.210 1.00 0.27 H new ATOM 0 HG11 VAL A 137 7.316 -4.587 -13.423 1.00 0.61 H new ATOM 0 HG12 VAL A 137 7.387 -3.670 -11.900 1.00 0.61 H new ATOM 0 HG13 VAL A 137 6.836 -5.363 -11.895 1.00 0.61 H new ATOM 0 HG21 VAL A 137 5.135 -5.091 -14.478 1.00 0.49 H new ATOM 0 HG22 VAL A 137 4.552 -5.906 -13.007 1.00 0.49 H new ATOM 0 HG23 VAL A 137 3.621 -4.560 -13.707 1.00 0.49 H new ATOM 2102 N PRO A 138 5.054 -1.510 -10.459 1.00 0.25 N ATOM 2103 CA PRO A 138 4.894 -0.062 -10.368 1.00 0.27 C ATOM 2104 C PRO A 138 4.851 0.625 -11.720 1.00 0.30 C ATOM 2105 O PRO A 138 5.382 0.135 -12.717 1.00 0.29 O ATOM 2106 CB PRO A 138 6.149 0.385 -9.643 1.00 0.30 C ATOM 2107 CG PRO A 138 6.549 -0.775 -8.820 1.00 0.29 C ATOM 2108 CD PRO A 138 6.094 -2.013 -9.547 1.00 0.27 C ATOM 0 HA PRO A 138 3.955 0.191 -9.876 1.00 0.27 H new ATOM 0 HB2 PRO A 138 6.935 0.659 -10.347 1.00 0.30 H new ATOM 0 HB3 PRO A 138 5.956 1.261 -9.023 1.00 0.30 H new ATOM 0 HG2 PRO A 138 7.629 -0.789 -8.674 1.00 0.29 H new ATOM 0 HG3 PRO A 138 6.094 -0.720 -7.831 1.00 0.29 H new ATOM 0 HD2 PRO A 138 6.913 -2.483 -10.092 1.00 0.27 H new ATOM 0 HD3 PRO A 138 5.698 -2.760 -8.859 1.00 0.27 H new ATOM 2116 N GLU A 139 4.254 1.796 -11.713 1.00 0.35 N ATOM 2117 CA GLU A 139 4.167 2.642 -12.894 1.00 0.40 C ATOM 2118 C GLU A 139 5.531 3.239 -13.191 1.00 0.42 C ATOM 2119 O GLU A 139 5.841 3.576 -14.330 1.00 0.50 O ATOM 2120 CB GLU A 139 3.146 3.753 -12.677 1.00 0.47 C ATOM 2121 CG GLU A 139 1.702 3.310 -12.807 1.00 0.80 C ATOM 2122 CD GLU A 139 1.290 3.128 -14.251 1.00 1.49 C ATOM 2123 OE1 GLU A 139 1.476 4.076 -15.048 1.00 1.98 O ATOM 2124 OE2 GLU A 139 0.798 2.041 -14.598 1.00 2.01 O ATOM 0 H GLU A 139 3.811 2.195 -10.885 1.00 0.35 H new ATOM 0 HA GLU A 139 3.845 2.037 -13.742 1.00 0.40 H new ATOM 0 HB2 GLU A 139 3.295 4.178 -11.684 1.00 0.47 H new ATOM 0 HB3 GLU A 139 3.335 4.550 -13.397 1.00 0.47 H new ATOM 0 HG2 GLU A 139 1.561 2.372 -12.269 1.00 0.80 H new ATOM 0 HG3 GLU A 139 1.053 4.048 -12.336 1.00 0.80 H new ATOM 2131 N GLU A 140 6.338 3.367 -12.138 1.00 0.42 N ATOM 2132 CA GLU A 140 7.737 3.756 -12.270 1.00 0.44 C ATOM 2133 C GLU A 140 8.438 2.751 -13.156 1.00 0.43 C ATOM 2134 O GLU A 140 9.215 3.097 -14.042 1.00 0.51 O ATOM 2135 CB GLU A 140 8.441 3.722 -10.910 1.00 0.45 C ATOM 2136 CG GLU A 140 7.589 4.158 -9.748 1.00 0.75 C ATOM 2137 CD GLU A 140 7.027 5.553 -9.916 1.00 0.87 C ATOM 2138 OE1 GLU A 140 7.755 6.530 -9.647 1.00 1.14 O ATOM 2139 OE2 GLU A 140 5.855 5.677 -10.320 1.00 1.01 O ATOM 0 H GLU A 140 6.040 3.205 -11.176 1.00 0.42 H new ATOM 0 HA GLU A 140 7.775 4.763 -12.685 1.00 0.44 H new ATOM 0 HB2 GLU A 140 8.793 2.707 -10.724 1.00 0.45 H new ATOM 0 HB3 GLU A 140 9.322 4.362 -10.957 1.00 0.45 H new ATOM 0 HG2 GLU A 140 6.766 3.454 -9.624 1.00 0.75 H new ATOM 0 HG3 GLU A 140 8.183 4.119 -8.835 1.00 0.75 H new ATOM 2146 N TRP A 141 8.127 1.493 -12.895 1.00 0.35 N ATOM 2147 CA TRP A 141 8.855 0.387 -13.478 1.00 0.35 C ATOM 2148 C TRP A 141 8.245 0.001 -14.813 1.00 0.38 C ATOM 2149 O TRP A 141 8.920 -0.558 -15.677 1.00 0.45 O ATOM 2150 CB TRP A 141 8.891 -0.783 -12.507 1.00 0.32 C ATOM 2151 CG TRP A 141 9.339 -0.408 -11.108 1.00 0.29 C ATOM 2152 CD1 TRP A 141 9.621 0.847 -10.627 1.00 0.34 C ATOM 2153 CD2 TRP A 141 9.526 -1.294 -9.998 1.00 0.25 C ATOM 2154 NE1 TRP A 141 9.967 0.791 -9.311 1.00 0.31 N ATOM 2155 CE2 TRP A 141 9.918 -0.512 -8.893 1.00 0.26 C ATOM 2156 CE3 TRP A 141 9.397 -2.670 -9.835 1.00 0.23 C ATOM 2157 CZ2 TRP A 141 10.174 -1.063 -7.641 1.00 0.24 C ATOM 2158 CZ3 TRP A 141 9.644 -3.218 -8.589 1.00 0.23 C ATOM 2159 CH2 TRP A 141 10.029 -2.417 -7.505 1.00 0.23 C ATOM 0 H TRP A 141 7.366 1.214 -12.276 1.00 0.35 H new ATOM 0 HA TRP A 141 9.885 0.690 -13.667 1.00 0.35 H new ATOM 0 HB2 TRP A 141 7.897 -1.228 -12.453 1.00 0.32 H new ATOM 0 HB3 TRP A 141 9.561 -1.548 -12.900 1.00 0.32 H new ATOM 0 HD1 TRP A 141 9.575 1.754 -11.212 1.00 0.34 H new ATOM 0 HE1 TRP A 141 10.221 1.590 -8.731 1.00 0.31 H new ATOM 0 HE3 TRP A 141 9.110 -3.298 -10.665 1.00 0.23 H new ATOM 0 HZ2 TRP A 141 10.476 -0.445 -6.808 1.00 0.24 H new ATOM 0 HZ3 TRP A 141 9.538 -4.284 -8.449 1.00 0.23 H new ATOM 0 HH2 TRP A 141 10.214 -2.877 -6.545 1.00 0.23 H new ATOM 2170 N GLY A 142 6.965 0.309 -14.986 1.00 0.35 N ATOM 2171 CA GLY A 142 6.357 0.161 -16.286 1.00 0.39 C ATOM 2172 C GLY A 142 5.300 -0.908 -16.300 1.00 0.38 C ATOM 2173 O GLY A 142 5.043 -1.526 -17.328 1.00 0.45 O ATOM 0 H GLY A 142 6.345 0.655 -14.254 1.00 0.35 H new ATOM 0 HA2 GLY A 142 5.915 1.110 -16.589 1.00 0.39 H new ATOM 0 HA3 GLY A 142 7.126 -0.081 -17.020 1.00 0.39 H new ATOM 2177 N GLY A 143 4.706 -1.144 -15.146 1.00 0.33 N ATOM 2178 CA GLY A 143 3.632 -2.100 -15.061 1.00 0.34 C ATOM 2179 C GLY A 143 2.284 -1.428 -15.012 1.00 0.37 C ATOM 2180 O GLY A 143 1.885 -0.742 -15.954 1.00 0.50 O ATOM 0 H GLY A 143 4.949 -0.690 -14.266 1.00 0.33 H new ATOM 0 HA2 GLY A 143 3.673 -2.769 -15.920 1.00 0.34 H new ATOM 0 HA3 GLY A 143 3.763 -2.715 -14.171 1.00 0.34 H new ATOM 2184 N ASP A 144 1.599 -1.596 -13.897 1.00 0.33 N ATOM 2185 CA ASP A 144 0.264 -1.044 -13.734 1.00 0.40 C ATOM 2186 C ASP A 144 -0.045 -0.774 -12.271 1.00 0.30 C ATOM 2187 O ASP A 144 -1.188 -0.933 -11.830 1.00 0.32 O ATOM 2188 CB ASP A 144 -0.788 -1.988 -14.303 1.00 0.57 C ATOM 2189 CG ASP A 144 -1.368 -1.517 -15.622 1.00 0.93 C ATOM 2190 OD1 ASP A 144 -2.170 -0.558 -15.623 1.00 1.30 O ATOM 2191 OD2 ASP A 144 -1.028 -2.101 -16.671 1.00 1.19 O ATOM 0 H ASP A 144 1.945 -2.111 -13.088 1.00 0.33 H new ATOM 0 HA ASP A 144 0.236 -0.102 -14.281 1.00 0.40 H new ATOM 0 HB2 ASP A 144 -0.344 -2.974 -14.441 1.00 0.57 H new ATOM 0 HB3 ASP A 144 -1.595 -2.100 -13.579 1.00 0.57 H new ATOM 2196 N THR A 145 0.964 -0.400 -11.498 1.00 0.25 N ATOM 2197 CA THR A 145 0.736 -0.149 -10.084 1.00 0.24 C ATOM 2198 C THR A 145 1.260 1.211 -9.639 1.00 0.24 C ATOM 2199 O THR A 145 2.448 1.506 -9.742 1.00 0.31 O ATOM 2200 CB THR A 145 1.358 -1.267 -9.240 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.857 -2.520 -9.710 1.00 0.32 O ATOM 2202 CG2 THR A 145 1.017 -1.106 -7.769 1.00 0.28 C ATOM 0 H THR A 145 1.924 -0.266 -11.815 1.00 0.25 H new ATOM 0 HA THR A 145 -0.343 -0.138 -9.930 1.00 0.24 H new ATOM 0 HB THR A 145 2.443 -1.221 -9.339 1.00 0.25 H new ATOM 0 HG1 THR A 145 -0.120 -2.480 -9.770 1.00 0.32 H new ATOM 0 HG21 THR A 145 1.474 -1.915 -7.199 1.00 0.28 H new ATOM 0 HG22 THR A 145 1.397 -0.150 -7.410 1.00 0.28 H new ATOM 0 HG23 THR A 145 -0.065 -1.137 -7.641 1.00 0.28 H new ATOM 2210 N ILE A 146 0.354 2.038 -9.133 1.00 0.26 N ATOM 2211 CA ILE A 146 0.699 3.380 -8.692 1.00 0.27 C ATOM 2212 C ILE A 146 1.144 3.362 -7.230 1.00 0.24 C ATOM 2213 O ILE A 146 0.338 3.129 -6.333 1.00 0.26 O ATOM 2214 CB ILE A 146 -0.490 4.365 -8.863 1.00 0.35 C ATOM 2215 CG1 ILE A 146 -0.854 4.554 -10.343 1.00 0.48 C ATOM 2216 CG2 ILE A 146 -0.170 5.711 -8.226 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -1.621 3.394 -10.950 1.00 1.23 C ATOM 0 H ILE A 146 -0.631 1.799 -9.018 1.00 0.26 H new ATOM 0 HA ILE A 146 1.520 3.727 -9.319 1.00 0.27 H new ATOM 0 HB ILE A 146 -1.351 3.930 -8.355 1.00 0.35 H new ATOM 0 HG12 ILE A 146 -1.449 5.461 -10.446 1.00 0.48 H new ATOM 0 HG13 ILE A 146 0.062 4.707 -10.914 1.00 0.48 H new ATOM 0 HG21 ILE A 146 -1.016 6.386 -8.357 1.00 0.34 H new ATOM 0 HG22 ILE A 146 0.023 5.573 -7.162 1.00 0.34 H new ATOM 0 HG23 ILE A 146 0.712 6.138 -8.702 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -1.838 3.609 -11.996 1.00 1.23 H new ATOM 0 HD12 ILE A 146 -1.021 2.486 -10.883 1.00 1.23 H new ATOM 0 HD13 ILE A 146 -2.556 3.252 -10.408 1.00 1.23 H new ATOM 2229 N PHE A 147 2.425 3.590 -6.997 1.00 0.23 N ATOM 2230 CA PHE A 147 2.964 3.604 -5.644 1.00 0.22 C ATOM 2231 C PHE A 147 2.870 4.993 -5.031 1.00 0.24 C ATOM 2232 O PHE A 147 3.596 5.909 -5.424 1.00 0.38 O ATOM 2233 CB PHE A 147 4.416 3.124 -5.640 1.00 0.23 C ATOM 2234 CG PHE A 147 4.527 1.636 -5.559 1.00 0.21 C ATOM 2235 CD1 PHE A 147 4.323 0.848 -6.677 1.00 0.20 C ATOM 2236 CD2 PHE A 147 4.807 1.022 -4.352 1.00 0.21 C ATOM 2237 CE1 PHE A 147 4.401 -0.527 -6.592 1.00 0.20 C ATOM 2238 CE2 PHE A 147 4.882 -0.352 -4.259 1.00 0.22 C ATOM 2239 CZ PHE A 147 4.681 -1.127 -5.382 1.00 0.19 C ATOM 0 H PHE A 147 3.114 3.769 -7.727 1.00 0.23 H new ATOM 0 HA PHE A 147 2.366 2.923 -5.039 1.00 0.22 H new ATOM 0 HB2 PHE A 147 4.913 3.473 -6.545 1.00 0.23 H new ATOM 0 HB3 PHE A 147 4.941 3.571 -4.795 1.00 0.23 H new ATOM 0 HD1 PHE A 147 4.100 1.313 -7.626 1.00 0.20 H new ATOM 0 HD2 PHE A 147 4.969 1.626 -3.471 1.00 0.21 H new ATOM 0 HE1 PHE A 147 4.243 -1.133 -7.472 1.00 0.20 H new ATOM 0 HE2 PHE A 147 5.097 -0.820 -3.310 1.00 0.22 H new ATOM 0 HZ PHE A 147 4.743 -2.203 -5.314 1.00 0.19 H new ATOM 2249 N CYS A 148 1.966 5.147 -4.078 1.00 0.25 N ATOM 2250 CA CYS A 148 1.827 6.399 -3.365 1.00 0.28 C ATOM 2251 C CYS A 148 2.564 6.306 -2.044 1.00 0.26 C ATOM 2252 O CYS A 148 2.251 5.454 -1.219 1.00 0.32 O ATOM 2253 CB CYS A 148 0.352 6.715 -3.100 1.00 0.30 C ATOM 2254 SG CYS A 148 0.047 8.398 -2.513 1.00 1.10 S ATOM 0 H CYS A 148 1.318 4.417 -3.782 1.00 0.25 H new ATOM 0 HA CYS A 148 2.249 7.197 -3.977 1.00 0.28 H new ATOM 0 HB2 CYS A 148 -0.213 6.555 -4.018 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -0.032 6.010 -2.363 1.00 0.30 H new ATOM 0 HG CYS A 148 -0.377 9.131 -3.499 1.00 1.10 H new ATOM 2260 N LYS A 149 3.558 7.149 -1.851 1.00 0.37 N ATOM 2261 CA LYS A 149 4.222 7.234 -0.565 1.00 0.38 C ATOM 2262 C LYS A 149 3.551 8.311 0.273 1.00 0.39 C ATOM 2263 O LYS A 149 3.739 9.507 0.048 1.00 0.47 O ATOM 2264 CB LYS A 149 5.720 7.506 -0.731 1.00 0.47 C ATOM 2265 CG LYS A 149 6.057 8.645 -1.681 1.00 0.64 C ATOM 2266 CD LYS A 149 7.430 9.235 -1.388 1.00 0.94 C ATOM 2267 CE LYS A 149 8.528 8.184 -1.420 1.00 1.57 C ATOM 2268 NZ LYS A 149 9.849 8.752 -1.035 1.00 2.44 N ATOM 0 H LYS A 149 3.923 7.782 -2.563 1.00 0.37 H new ATOM 0 HA LYS A 149 4.131 6.277 -0.051 1.00 0.38 H new ATOM 0 HB2 LYS A 149 6.146 7.729 0.247 1.00 0.47 H new ATOM 0 HB3 LYS A 149 6.203 6.597 -1.089 1.00 0.47 H new ATOM 0 HG2 LYS A 149 6.028 8.282 -2.709 1.00 0.64 H new ATOM 0 HG3 LYS A 149 5.300 9.425 -1.597 1.00 0.64 H new ATOM 0 HD2 LYS A 149 7.653 10.012 -2.119 1.00 0.94 H new ATOM 0 HD3 LYS A 149 7.416 9.713 -0.409 1.00 0.94 H new ATOM 0 HE2 LYS A 149 8.271 7.370 -0.743 1.00 1.57 H new ATOM 0 HE3 LYS A 149 8.594 7.757 -2.421 1.00 1.57 H new ATOM 0 HZ1 LYS A 149 10.511 8.663 -1.832 1.00 2.44 H new ATOM 0 HZ2 LYS A 149 9.737 9.756 -0.789 1.00 2.44 H new ATOM 0 HZ3 LYS A 149 10.224 8.234 -0.215 1.00 2.44 H new ATOM 2282 N LEU A 150 2.735 7.886 1.221 1.00 0.40 N ATOM 2283 CA LEU A 150 1.911 8.822 1.966 1.00 0.45 C ATOM 2284 C LEU A 150 2.014 8.629 3.471 1.00 0.45 C ATOM 2285 O LEU A 150 2.868 7.902 3.978 1.00 0.49 O ATOM 2286 CB LEU A 150 0.449 8.668 1.562 1.00 0.60 C ATOM 2287 CG LEU A 150 -0.163 7.314 1.891 1.00 0.49 C ATOM 2288 CD1 LEU A 150 -1.614 7.470 2.307 1.00 1.25 C ATOM 2289 CD2 LEU A 150 -0.036 6.386 0.699 1.00 1.27 C ATOM 0 H LEU A 150 2.625 6.909 1.492 1.00 0.40 H new ATOM 0 HA LEU A 150 2.281 9.818 1.724 1.00 0.45 H new ATOM 0 HB2 LEU A 150 -0.134 9.445 2.057 1.00 0.60 H new ATOM 0 HB3 LEU A 150 0.363 8.839 0.489 1.00 0.60 H new ATOM 0 HG LEU A 150 0.378 6.876 2.730 1.00 0.49 H new ATOM 0 HD11 LEU A 150 -2.034 6.491 2.538 1.00 1.25 H new ATOM 0 HD12 LEU A 150 -1.673 8.107 3.189 1.00 1.25 H new ATOM 0 HD13 LEU A 150 -2.179 7.924 1.493 1.00 1.25 H new ATOM 0 HD21 LEU A 150 -0.476 5.419 0.942 1.00 1.27 H new ATOM 0 HD22 LEU A 150 -0.558 6.818 -0.155 1.00 1.27 H new ATOM 0 HD23 LEU A 150 1.017 6.253 0.452 1.00 1.27 H new ATOM 2301 N SER A 151 1.109 9.314 4.166 1.00 0.49 N ATOM 2302 CA SER A 151 0.971 9.235 5.605 1.00 0.55 C ATOM 2303 C SER A 151 -0.357 9.855 6.024 1.00 0.57 C ATOM 2304 O SER A 151 -0.622 11.016 5.728 1.00 0.60 O ATOM 2305 CB SER A 151 2.139 9.927 6.291 1.00 0.66 C ATOM 2306 OG SER A 151 3.281 9.089 6.308 1.00 1.79 O ATOM 0 H SER A 151 0.442 9.950 3.729 1.00 0.49 H new ATOM 0 HA SER A 151 0.980 8.189 5.911 1.00 0.55 H new ATOM 0 HB2 SER A 151 2.372 10.857 5.772 1.00 0.66 H new ATOM 0 HB3 SER A 151 1.862 10.192 7.311 1.00 0.66 H new ATOM 0 HG SER A 151 3.205 8.418 5.598 1.00 1.79 H new ATOM 2312 N ALA A 152 -1.201 9.067 6.680 1.00 0.62 N ATOM 2313 CA ALA A 152 -2.528 9.523 7.098 1.00 0.70 C ATOM 2314 C ALA A 152 -2.479 10.240 8.439 1.00 0.74 C ATOM 2315 O ALA A 152 -3.443 10.888 8.832 1.00 0.87 O ATOM 2316 CB ALA A 152 -3.485 8.342 7.162 1.00 0.86 C ATOM 0 H ALA A 152 -0.991 8.102 6.937 1.00 0.62 H new ATOM 0 HA ALA A 152 -2.887 10.238 6.358 1.00 0.70 H new ATOM 0 HB1 ALA A 152 -4.470 8.689 7.474 1.00 0.86 H new ATOM 0 HB2 ALA A 152 -3.558 7.879 6.178 1.00 0.86 H new ATOM 0 HB3 ALA A 152 -3.114 7.611 7.880 1.00 0.86 H new ATOM 2322 N LYS A 153 -1.360 10.131 9.139 1.00 0.77 N ATOM 2323 CA LYS A 153 -1.193 10.829 10.395 1.00 0.93 C ATOM 2324 C LYS A 153 -0.808 12.274 10.124 1.00 0.86 C ATOM 2325 O LYS A 153 -1.362 13.211 10.694 1.00 0.96 O ATOM 2326 CB LYS A 153 -0.127 10.125 11.235 1.00 1.13 C ATOM 2327 CG LYS A 153 1.299 10.268 10.725 1.00 1.19 C ATOM 2328 CD LYS A 153 2.302 9.603 11.652 1.00 1.68 C ATOM 2329 CE LYS A 153 3.723 9.994 11.286 1.00 2.31 C ATOM 2330 NZ LYS A 153 3.951 11.455 11.449 1.00 3.03 N ATOM 0 H LYS A 153 -0.559 9.567 8.856 1.00 0.77 H new ATOM 0 HA LYS A 153 -2.130 10.820 10.953 1.00 0.93 H new ATOM 0 HB2 LYS A 153 -0.173 10.515 12.252 1.00 1.13 H new ATOM 0 HB3 LYS A 153 -0.372 9.064 11.289 1.00 1.13 H new ATOM 0 HG2 LYS A 153 1.375 9.827 9.731 1.00 1.19 H new ATOM 0 HG3 LYS A 153 1.544 11.325 10.624 1.00 1.19 H new ATOM 0 HD2 LYS A 153 2.096 9.890 12.683 1.00 1.68 H new ATOM 0 HD3 LYS A 153 2.193 8.520 11.595 1.00 1.68 H new ATOM 0 HE2 LYS A 153 4.425 9.444 11.913 1.00 2.31 H new ATOM 0 HE3 LYS A 153 3.925 9.707 10.254 1.00 2.31 H new ATOM 0 HZ1 LYS A 153 4.176 11.876 10.525 1.00 3.03 H new ATOM 0 HZ2 LYS A 153 3.093 11.900 11.832 1.00 3.03 H new ATOM 0 HZ3 LYS A 153 4.744 11.612 12.103 1.00 3.03 H new ATOM 2344 N THR A 154 0.150 12.420 9.235 1.00 0.78 N ATOM 2345 CA THR A 154 0.594 13.716 8.766 1.00 0.81 C ATOM 2346 C THR A 154 -0.387 14.255 7.725 1.00 0.73 C ATOM 2347 O THR A 154 -0.475 15.458 7.486 1.00 0.82 O ATOM 2348 CB THR A 154 2.001 13.580 8.151 1.00 0.89 C ATOM 2349 OG1 THR A 154 2.706 12.529 8.826 1.00 1.19 O ATOM 2350 CG2 THR A 154 2.796 14.867 8.274 1.00 1.20 C ATOM 0 H THR A 154 0.648 11.636 8.813 1.00 0.78 H new ATOM 0 HA THR A 154 0.633 14.414 9.603 1.00 0.81 H new ATOM 0 HB THR A 154 1.887 13.353 7.091 1.00 0.89 H new ATOM 0 HG1 THR A 154 2.937 11.825 8.184 1.00 1.19 H new ATOM 0 HG21 THR A 154 3.781 14.730 7.829 1.00 1.20 H new ATOM 0 HG22 THR A 154 2.272 15.669 7.755 1.00 1.20 H new ATOM 0 HG23 THR A 154 2.906 15.127 9.327 1.00 1.20 H new ATOM 2358 N LYS A 155 -1.122 13.322 7.120 1.00 0.65 N ATOM 2359 CA LYS A 155 -2.163 13.614 6.121 1.00 0.67 C ATOM 2360 C LYS A 155 -1.624 14.258 4.840 1.00 0.66 C ATOM 2361 O LYS A 155 -2.399 14.585 3.942 1.00 0.86 O ATOM 2362 CB LYS A 155 -3.276 14.470 6.727 1.00 0.86 C ATOM 2363 CG LYS A 155 -4.126 13.697 7.718 1.00 1.27 C ATOM 2364 CD LYS A 155 -5.194 14.551 8.372 1.00 1.12 C ATOM 2365 CE LYS A 155 -6.438 14.660 7.504 1.00 1.39 C ATOM 2366 NZ LYS A 155 -6.223 15.500 6.290 1.00 2.27 N ATOM 0 H LYS A 155 -1.013 12.326 7.309 1.00 0.65 H new ATOM 0 HA LYS A 155 -2.572 12.648 5.826 1.00 0.67 H new ATOM 0 HB2 LYS A 155 -2.836 15.333 7.226 1.00 0.86 H new ATOM 0 HB3 LYS A 155 -3.912 14.853 5.929 1.00 0.86 H new ATOM 0 HG2 LYS A 155 -4.601 12.860 7.206 1.00 1.27 H new ATOM 0 HG3 LYS A 155 -3.482 13.275 8.490 1.00 1.27 H new ATOM 0 HD2 LYS A 155 -5.461 14.123 9.338 1.00 1.12 H new ATOM 0 HD3 LYS A 155 -4.796 15.547 8.564 1.00 1.12 H new ATOM 0 HE2 LYS A 155 -6.751 13.662 7.199 1.00 1.39 H new ATOM 0 HE3 LYS A 155 -7.251 15.083 8.094 1.00 1.39 H new ATOM 0 HZ1 LYS A 155 -7.089 16.037 6.082 1.00 2.27 H new ATOM 0 HZ2 LYS A 155 -5.438 16.161 6.460 1.00 2.27 H new ATOM 0 HZ3 LYS A 155 -5.992 14.888 5.481 1.00 2.27 H new ATOM 2380 N GLU A 156 -0.307 14.403 4.742 1.00 0.62 N ATOM 2381 CA GLU A 156 0.327 14.947 3.541 1.00 0.66 C ATOM 2382 C GLU A 156 0.003 14.080 2.331 1.00 0.59 C ATOM 2383 O GLU A 156 -0.541 14.542 1.317 1.00 0.58 O ATOM 2384 CB GLU A 156 1.845 14.986 3.733 1.00 0.75 C ATOM 2385 CG GLU A 156 2.290 15.776 4.949 1.00 1.13 C ATOM 2386 CD GLU A 156 2.114 17.270 4.774 1.00 1.78 C ATOM 2387 OE1 GLU A 156 1.015 17.787 5.059 1.00 2.64 O ATOM 2388 OE2 GLU A 156 3.083 17.936 4.349 1.00 2.03 O ATOM 0 H GLU A 156 0.347 14.151 5.483 1.00 0.62 H new ATOM 0 HA GLU A 156 -0.054 15.955 3.374 1.00 0.66 H new ATOM 0 HB2 GLU A 156 2.217 13.965 3.819 1.00 0.75 H new ATOM 0 HB3 GLU A 156 2.303 15.418 2.843 1.00 0.75 H new ATOM 0 HG2 GLU A 156 1.721 15.447 5.819 1.00 1.13 H new ATOM 0 HG3 GLU A 156 3.339 15.560 5.154 1.00 1.13 H new ATOM 2395 N GLY A 157 0.335 12.809 2.463 1.00 0.62 N ATOM 2396 CA GLY A 157 0.151 11.874 1.388 1.00 0.61 C ATOM 2397 C GLY A 157 -1.302 11.573 1.091 1.00 0.48 C ATOM 2398 O GLY A 157 -1.605 10.963 0.074 1.00 0.46 O ATOM 0 H GLY A 157 0.735 12.407 3.311 1.00 0.62 H new ATOM 0 HA2 GLY A 157 0.623 12.269 0.489 1.00 0.61 H new ATOM 0 HA3 GLY A 157 0.663 10.944 1.634 1.00 0.61 H new ATOM 2402 N LEU A 158 -2.205 11.987 1.977 1.00 0.48 N ATOM 2403 CA LEU A 158 -3.628 11.783 1.755 1.00 0.50 C ATOM 2404 C LEU A 158 -4.113 12.645 0.601 1.00 0.46 C ATOM 2405 O LEU A 158 -4.873 12.188 -0.254 1.00 0.51 O ATOM 2406 CB LEU A 158 -4.425 12.104 3.016 1.00 0.62 C ATOM 2407 CG LEU A 158 -4.307 11.075 4.139 1.00 0.83 C ATOM 2408 CD1 LEU A 158 -5.227 11.443 5.290 1.00 1.55 C ATOM 2409 CD2 LEU A 158 -4.633 9.684 3.617 1.00 1.27 C ATOM 0 H LEU A 158 -1.975 12.463 2.849 1.00 0.48 H new ATOM 0 HA LEU A 158 -3.784 10.734 1.504 1.00 0.50 H new ATOM 0 HB2 LEU A 158 -4.099 13.072 3.396 1.00 0.62 H new ATOM 0 HB3 LEU A 158 -5.476 12.205 2.746 1.00 0.62 H new ATOM 0 HG LEU A 158 -3.280 11.073 4.506 1.00 0.83 H new ATOM 0 HD11 LEU A 158 -5.132 10.701 6.083 1.00 1.55 H new ATOM 0 HD12 LEU A 158 -4.952 12.424 5.677 1.00 1.55 H new ATOM 0 HD13 LEU A 158 -6.258 11.468 4.938 1.00 1.55 H new ATOM 0 HD21 LEU A 158 -4.545 8.961 4.428 1.00 1.27 H new ATOM 0 HD22 LEU A 158 -5.651 9.671 3.228 1.00 1.27 H new ATOM 0 HD23 LEU A 158 -3.937 9.422 2.820 1.00 1.27 H new ATOM 2421 N ASP A 159 -3.656 13.892 0.580 1.00 0.48 N ATOM 2422 CA ASP A 159 -3.969 14.799 -0.515 1.00 0.57 C ATOM 2423 C ASP A 159 -3.385 14.257 -1.809 1.00 0.50 C ATOM 2424 O ASP A 159 -4.059 14.205 -2.837 1.00 0.52 O ATOM 2425 CB ASP A 159 -3.405 16.192 -0.232 1.00 0.73 C ATOM 2426 CG ASP A 159 -3.760 17.193 -1.315 1.00 1.54 C ATOM 2427 OD1 ASP A 159 -4.865 17.769 -1.253 1.00 1.58 O ATOM 2428 OD2 ASP A 159 -2.931 17.414 -2.224 1.00 2.50 O ATOM 0 H ASP A 159 -3.068 14.297 1.309 1.00 0.48 H new ATOM 0 HA ASP A 159 -5.052 14.876 -0.611 1.00 0.57 H new ATOM 0 HB2 ASP A 159 -3.786 16.547 0.726 1.00 0.73 H new ATOM 0 HB3 ASP A 159 -2.321 16.130 -0.140 1.00 0.73 H new ATOM 2433 N HIS A 160 -2.130 13.820 -1.737 1.00 0.47 N ATOM 2434 CA HIS A 160 -1.454 13.248 -2.900 1.00 0.46 C ATOM 2435 C HIS A 160 -2.136 11.951 -3.341 1.00 0.41 C ATOM 2436 O HIS A 160 -2.131 11.612 -4.524 1.00 0.43 O ATOM 2437 CB HIS A 160 0.026 12.990 -2.582 1.00 0.50 C ATOM 2438 CG HIS A 160 0.841 12.553 -3.766 1.00 0.56 C ATOM 2439 ND1 HIS A 160 1.269 13.421 -4.743 1.00 0.67 N ATOM 2440 CD2 HIS A 160 1.311 11.333 -4.120 1.00 0.59 C ATOM 2441 CE1 HIS A 160 1.963 12.759 -5.650 1.00 0.73 C ATOM 2442 NE2 HIS A 160 2.007 11.487 -5.296 1.00 0.67 N ATOM 0 H HIS A 160 -1.562 13.850 -0.890 1.00 0.47 H new ATOM 0 HA HIS A 160 -1.518 13.964 -3.719 1.00 0.46 H new ATOM 0 HB2 HIS A 160 0.462 13.900 -2.170 1.00 0.50 H new ATOM 0 HB3 HIS A 160 0.092 12.226 -1.807 1.00 0.50 H new ATOM 0 HD2 HIS A 160 1.166 10.410 -3.579 1.00 0.59 H new ATOM 0 HE1 HIS A 160 2.418 13.185 -6.532 1.00 0.73 H new ATOM 0 HE2 HIS A 160 2.479 10.743 -5.810 1.00 0.67 H new ATOM 2451 N LEU A 161 -2.729 11.242 -2.387 1.00 0.39 N ATOM 2452 CA LEU A 161 -3.383 9.968 -2.664 1.00 0.39 C ATOM 2453 C LEU A 161 -4.618 10.162 -3.534 1.00 0.39 C ATOM 2454 O LEU A 161 -4.690 9.620 -4.633 1.00 0.42 O ATOM 2455 CB LEU A 161 -3.774 9.274 -1.357 1.00 0.41 C ATOM 2456 CG LEU A 161 -4.454 7.914 -1.522 1.00 0.51 C ATOM 2457 CD1 LEU A 161 -3.532 6.945 -2.246 1.00 0.91 C ATOM 2458 CD2 LEU A 161 -4.872 7.357 -0.169 1.00 0.88 C ATOM 0 H LEU A 161 -2.770 11.530 -1.409 1.00 0.39 H new ATOM 0 HA LEU A 161 -2.675 9.341 -3.206 1.00 0.39 H new ATOM 0 HB2 LEU A 161 -2.877 9.143 -0.751 1.00 0.41 H new ATOM 0 HB3 LEU A 161 -4.442 9.931 -0.800 1.00 0.41 H new ATOM 0 HG LEU A 161 -5.352 8.046 -2.125 1.00 0.51 H new ATOM 0 HD11 LEU A 161 -4.030 5.982 -2.356 1.00 0.91 H new ATOM 0 HD12 LEU A 161 -3.289 7.342 -3.232 1.00 0.91 H new ATOM 0 HD13 LEU A 161 -2.615 6.816 -1.670 1.00 0.91 H new ATOM 0 HD21 LEU A 161 -5.354 6.389 -0.307 1.00 0.88 H new ATOM 0 HD22 LEU A 161 -3.992 7.237 0.463 1.00 0.88 H new ATOM 0 HD23 LEU A 161 -5.570 8.045 0.308 1.00 0.88 H new ATOM 2470 N LEU A 162 -5.572 10.947 -3.043 1.00 0.40 N ATOM 2471 CA LEU A 162 -6.816 11.204 -3.764 1.00 0.44 C ATOM 2472 C LEU A 162 -6.528 11.726 -5.166 1.00 0.45 C ATOM 2473 O LEU A 162 -7.177 11.324 -6.132 1.00 0.48 O ATOM 2474 CB LEU A 162 -7.658 12.221 -2.993 1.00 0.50 C ATOM 2475 CG LEU A 162 -8.060 11.801 -1.579 1.00 0.69 C ATOM 2476 CD1 LEU A 162 -8.852 12.907 -0.900 1.00 1.05 C ATOM 2477 CD2 LEU A 162 -8.868 10.511 -1.614 1.00 1.06 C ATOM 0 H LEU A 162 -5.507 11.420 -2.142 1.00 0.40 H new ATOM 0 HA LEU A 162 -7.367 10.268 -3.851 1.00 0.44 H new ATOM 0 HB2 LEU A 162 -7.102 13.156 -2.932 1.00 0.50 H new ATOM 0 HB3 LEU A 162 -8.563 12.426 -3.564 1.00 0.50 H new ATOM 0 HG LEU A 162 -7.152 11.623 -1.002 1.00 0.69 H new ATOM 0 HD11 LEU A 162 -9.130 12.591 0.105 1.00 1.05 H new ATOM 0 HD12 LEU A 162 -8.242 13.808 -0.841 1.00 1.05 H new ATOM 0 HD13 LEU A 162 -9.753 13.116 -1.477 1.00 1.05 H new ATOM 0 HD21 LEU A 162 -9.145 10.228 -0.599 1.00 1.06 H new ATOM 0 HD22 LEU A 162 -9.770 10.662 -2.207 1.00 1.06 H new ATOM 0 HD23 LEU A 162 -8.268 9.718 -2.061 1.00 1.06 H new ATOM 2489 N GLU A 163 -5.526 12.592 -5.268 1.00 0.46 N ATOM 2490 CA GLU A 163 -5.137 13.176 -6.547 1.00 0.52 C ATOM 2491 C GLU A 163 -4.631 12.107 -7.511 1.00 0.51 C ATOM 2492 O GLU A 163 -4.897 12.167 -8.711 1.00 0.56 O ATOM 2493 CB GLU A 163 -4.067 14.245 -6.338 1.00 0.62 C ATOM 2494 CG GLU A 163 -4.596 15.517 -5.697 1.00 1.06 C ATOM 2495 CD GLU A 163 -5.505 16.307 -6.618 1.00 1.75 C ATOM 2496 OE1 GLU A 163 -4.983 16.970 -7.541 1.00 1.97 O ATOM 2497 OE2 GLU A 163 -6.734 16.288 -6.421 1.00 2.49 O ATOM 0 H GLU A 163 -4.966 12.907 -4.476 1.00 0.46 H new ATOM 0 HA GLU A 163 -6.020 13.638 -6.987 1.00 0.52 H new ATOM 0 HB2 GLU A 163 -3.273 13.836 -5.713 1.00 0.62 H new ATOM 0 HB3 GLU A 163 -3.619 14.492 -7.300 1.00 0.62 H new ATOM 0 HG2 GLU A 163 -5.141 15.261 -4.789 1.00 1.06 H new ATOM 0 HG3 GLU A 163 -3.756 16.144 -5.398 1.00 1.06 H new ATOM 2504 N MET A 164 -3.904 11.127 -6.988 1.00 0.49 N ATOM 2505 CA MET A 164 -3.432 10.017 -7.811 1.00 0.52 C ATOM 2506 C MET A 164 -4.593 9.101 -8.168 1.00 0.51 C ATOM 2507 O MET A 164 -4.695 8.622 -9.294 1.00 0.57 O ATOM 2508 CB MET A 164 -2.341 9.216 -7.093 1.00 0.53 C ATOM 2509 CG MET A 164 -1.033 9.966 -6.870 1.00 0.68 C ATOM 2510 SD MET A 164 -0.191 10.438 -8.398 1.00 0.87 S ATOM 2511 CE MET A 164 -1.058 11.942 -8.847 1.00 0.67 C ATOM 0 H MET A 164 -3.630 11.077 -6.007 1.00 0.49 H new ATOM 0 HA MET A 164 -3.004 10.434 -8.723 1.00 0.52 H new ATOM 0 HB2 MET A 164 -2.726 8.892 -6.126 1.00 0.53 H new ATOM 0 HB3 MET A 164 -2.132 8.316 -7.671 1.00 0.53 H new ATOM 0 HG2 MET A 164 -1.235 10.864 -6.286 1.00 0.68 H new ATOM 0 HG3 MET A 164 -0.365 9.343 -6.276 1.00 0.68 H new ATOM 0 HE1 MET A 164 -0.347 12.667 -9.244 1.00 0.67 H new ATOM 0 HE2 MET A 164 -1.809 11.717 -9.605 1.00 0.67 H new ATOM 0 HE3 MET A 164 -1.546 12.358 -7.965 1.00 0.67 H new ATOM 2521 N ILE A 165 -5.476 8.880 -7.201 1.00 0.48 N ATOM 2522 CA ILE A 165 -6.634 8.028 -7.376 1.00 0.51 C ATOM 2523 C ILE A 165 -7.519 8.524 -8.518 1.00 0.58 C ATOM 2524 O ILE A 165 -7.887 7.755 -9.410 1.00 0.64 O ATOM 2525 CB ILE A 165 -7.438 7.965 -6.062 1.00 0.50 C ATOM 2526 CG1 ILE A 165 -6.625 7.260 -4.975 1.00 0.48 C ATOM 2527 CG2 ILE A 165 -8.761 7.269 -6.273 1.00 0.59 C ATOM 2528 CD1 ILE A 165 -7.297 7.262 -3.619 1.00 0.50 C ATOM 0 H ILE A 165 -5.403 9.292 -6.271 1.00 0.48 H new ATOM 0 HA ILE A 165 -6.288 7.027 -7.635 1.00 0.51 H new ATOM 0 HB ILE A 165 -7.643 8.985 -5.736 1.00 0.50 H new ATOM 0 HG12 ILE A 165 -6.443 6.229 -5.280 1.00 0.48 H new ATOM 0 HG13 ILE A 165 -5.652 7.743 -4.890 1.00 0.48 H new ATOM 0 HG21 ILE A 165 -9.310 7.237 -5.332 1.00 0.59 H new ATOM 0 HG22 ILE A 165 -9.345 7.814 -7.015 1.00 0.59 H new ATOM 0 HG23 ILE A 165 -8.585 6.252 -6.625 1.00 0.59 H new ATOM 0 HD11 ILE A 165 -6.663 6.745 -2.898 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -7.454 8.290 -3.292 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -8.258 6.752 -3.688 1.00 0.50 H new ATOM 2540 N LEU A 166 -7.844 9.815 -8.512 1.00 0.61 N ATOM 2541 CA LEU A 166 -8.677 10.380 -9.560 1.00 0.72 C ATOM 2542 C LEU A 166 -7.931 10.444 -10.883 1.00 0.72 C ATOM 2543 O LEU A 166 -8.522 10.262 -11.950 1.00 0.81 O ATOM 2544 CB LEU A 166 -9.195 11.764 -9.185 1.00 0.82 C ATOM 2545 CG LEU A 166 -8.175 12.772 -8.643 1.00 0.98 C ATOM 2546 CD1 LEU A 166 -7.526 13.556 -9.777 1.00 1.81 C ATOM 2547 CD2 LEU A 166 -8.847 13.719 -7.664 1.00 1.48 C ATOM 0 H LEU A 166 -7.545 10.480 -7.799 1.00 0.61 H new ATOM 0 HA LEU A 166 -9.534 9.716 -9.675 1.00 0.72 H new ATOM 0 HB2 LEU A 166 -9.664 12.199 -10.067 1.00 0.82 H new ATOM 0 HB3 LEU A 166 -9.978 11.640 -8.437 1.00 0.82 H new ATOM 0 HG LEU A 166 -7.392 12.220 -8.123 1.00 0.98 H new ATOM 0 HD11 LEU A 166 -6.807 14.264 -9.365 1.00 1.81 H new ATOM 0 HD12 LEU A 166 -7.013 12.867 -10.449 1.00 1.81 H new ATOM 0 HD13 LEU A 166 -8.293 14.098 -10.330 1.00 1.81 H new ATOM 0 HD21 LEU A 166 -8.114 14.431 -7.285 1.00 1.48 H new ATOM 0 HD22 LEU A 166 -9.648 14.258 -8.170 1.00 1.48 H new ATOM 0 HD23 LEU A 166 -9.262 13.149 -6.833 1.00 1.48 H new ATOM 2559 N LEU A 167 -6.636 10.706 -10.808 1.00 0.69 N ATOM 2560 CA LEU A 167 -5.788 10.697 -11.989 1.00 0.79 C ATOM 2561 C LEU A 167 -5.878 9.346 -12.678 1.00 0.87 C ATOM 2562 O LEU A 167 -5.831 9.257 -13.899 1.00 1.02 O ATOM 2563 CB LEU A 167 -4.336 11.000 -11.619 1.00 0.84 C ATOM 2564 CG LEU A 167 -3.361 11.019 -12.797 1.00 1.06 C ATOM 2565 CD1 LEU A 167 -3.763 12.083 -13.804 1.00 1.42 C ATOM 2566 CD2 LEU A 167 -1.941 11.255 -12.312 1.00 1.41 C ATOM 0 H LEU A 167 -6.148 10.928 -9.940 1.00 0.69 H new ATOM 0 HA LEU A 167 -6.136 11.473 -12.670 1.00 0.79 H new ATOM 0 HB2 LEU A 167 -4.298 11.968 -11.120 1.00 0.84 H new ATOM 0 HB3 LEU A 167 -3.997 10.256 -10.898 1.00 0.84 H new ATOM 0 HG LEU A 167 -3.399 10.047 -13.289 1.00 1.06 H new ATOM 0 HD11 LEU A 167 -3.058 12.082 -14.635 1.00 1.42 H new ATOM 0 HD12 LEU A 167 -4.765 11.871 -14.177 1.00 1.42 H new ATOM 0 HD13 LEU A 167 -3.755 13.061 -13.323 1.00 1.42 H new ATOM 0 HD21 LEU A 167 -1.262 11.265 -13.165 1.00 1.41 H new ATOM 0 HD22 LEU A 167 -1.888 12.213 -11.794 1.00 1.41 H new ATOM 0 HD23 LEU A 167 -1.653 10.457 -11.628 1.00 1.41 H new ATOM 2578 N VAL A 168 -6.057 8.302 -11.883 1.00 0.83 N ATOM 2579 CA VAL A 168 -6.133 6.953 -12.396 1.00 0.96 C ATOM 2580 C VAL A 168 -7.510 6.703 -12.996 1.00 1.01 C ATOM 2581 O VAL A 168 -7.640 6.046 -14.028 1.00 1.14 O ATOM 2582 CB VAL A 168 -5.830 5.924 -11.290 1.00 1.03 C ATOM 2583 CG1 VAL A 168 -6.201 4.527 -11.737 1.00 1.17 C ATOM 2584 CG2 VAL A 168 -4.359 5.982 -10.914 1.00 1.14 C ATOM 0 H VAL A 168 -6.153 8.371 -10.870 1.00 0.83 H new ATOM 0 HA VAL A 168 -5.380 6.837 -13.176 1.00 0.96 H new ATOM 0 HB VAL A 168 -6.431 6.172 -10.415 1.00 1.03 H new ATOM 0 HG11 VAL A 168 -5.978 3.818 -10.939 1.00 1.17 H new ATOM 0 HG12 VAL A 168 -7.266 4.490 -11.968 1.00 1.17 H new ATOM 0 HG13 VAL A 168 -5.627 4.265 -12.626 1.00 1.17 H new ATOM 0 HG21 VAL A 168 -4.154 5.251 -10.132 1.00 1.14 H new ATOM 0 HG22 VAL A 168 -3.750 5.756 -11.790 1.00 1.14 H new ATOM 0 HG23 VAL A 168 -4.115 6.980 -10.551 1.00 1.14 H new ATOM 2594 N SER A 169 -8.528 7.270 -12.356 1.00 0.98 N ATOM 2595 CA SER A 169 -9.895 7.192 -12.853 1.00 1.14 C ATOM 2596 C SER A 169 -9.973 7.713 -14.287 1.00 1.22 C ATOM 2597 O SER A 169 -10.730 7.194 -15.106 1.00 1.41 O ATOM 2598 CB SER A 169 -10.828 8.000 -11.938 1.00 1.20 C ATOM 2599 OG SER A 169 -12.171 7.967 -12.394 1.00 1.54 O ATOM 0 H SER A 169 -8.429 7.792 -11.485 1.00 0.98 H new ATOM 0 HA SER A 169 -10.212 6.149 -12.851 1.00 1.14 H new ATOM 0 HB2 SER A 169 -10.778 7.601 -10.925 1.00 1.20 H new ATOM 0 HB3 SER A 169 -10.485 9.034 -11.891 1.00 1.20 H new ATOM 0 HG SER A 169 -12.764 7.737 -11.648 1.00 1.54 H new ATOM 2605 N GLU A 170 -9.173 8.730 -14.590 1.00 1.15 N ATOM 2606 CA GLU A 170 -9.155 9.310 -15.924 1.00 1.33 C ATOM 2607 C GLU A 170 -8.085 8.652 -16.797 1.00 1.37 C ATOM 2608 O GLU A 170 -8.348 8.296 -17.946 1.00 1.53 O ATOM 2609 CB GLU A 170 -8.931 10.821 -15.843 1.00 1.46 C ATOM 2610 CG GLU A 170 -8.987 11.513 -17.192 1.00 2.02 C ATOM 2611 CD GLU A 170 -8.968 13.021 -17.082 1.00 2.31 C ATOM 2612 OE1 GLU A 170 -10.044 13.619 -16.875 1.00 2.65 O ATOM 2613 OE2 GLU A 170 -7.880 13.620 -17.229 1.00 2.79 O ATOM 0 H GLU A 170 -8.530 9.168 -13.930 1.00 1.15 H new ATOM 0 HA GLU A 170 -10.124 9.125 -16.388 1.00 1.33 H new ATOM 0 HB2 GLU A 170 -9.685 11.258 -15.188 1.00 1.46 H new ATOM 0 HB3 GLU A 170 -7.961 11.013 -15.385 1.00 1.46 H new ATOM 0 HG2 GLU A 170 -8.141 11.187 -17.797 1.00 2.02 H new ATOM 0 HG3 GLU A 170 -9.891 11.203 -17.716 1.00 2.02 H new ATOM 2620 N MET A 171 -6.887 8.466 -16.245 1.00 1.30 N ATOM 2621 CA MET A 171 -5.763 7.925 -17.011 1.00 1.44 C ATOM 2622 C MET A 171 -6.024 6.486 -17.444 1.00 1.51 C ATOM 2623 O MET A 171 -5.382 5.994 -18.362 1.00 1.76 O ATOM 2624 CB MET A 171 -4.460 7.985 -16.213 1.00 1.40 C ATOM 2625 CG MET A 171 -3.218 7.815 -17.078 1.00 1.67 C ATOM 2626 SD MET A 171 -1.719 7.538 -16.117 1.00 1.82 S ATOM 2627 CE MET A 171 -2.036 5.894 -15.481 1.00 1.77 C ATOM 0 H MET A 171 -6.669 8.681 -15.272 1.00 1.30 H new ATOM 0 HA MET A 171 -5.662 8.549 -17.899 1.00 1.44 H new ATOM 0 HB2 MET A 171 -4.404 8.941 -15.692 1.00 1.40 H new ATOM 0 HB3 MET A 171 -4.473 7.207 -15.450 1.00 1.40 H new ATOM 0 HG2 MET A 171 -3.368 6.975 -17.757 1.00 1.67 H new ATOM 0 HG3 MET A 171 -3.088 8.704 -17.695 1.00 1.67 H new ATOM 0 HE1 MET A 171 -1.094 5.428 -15.191 1.00 1.77 H new ATOM 0 HE2 MET A 171 -2.691 5.960 -14.612 1.00 1.77 H new ATOM 0 HE3 MET A 171 -2.516 5.292 -16.252 1.00 1.77 H new ATOM 2637 N GLU A 172 -6.953 5.812 -16.777 1.00 1.43 N ATOM 2638 CA GLU A 172 -7.378 4.476 -17.185 1.00 1.58 C ATOM 2639 C GLU A 172 -7.746 4.442 -18.671 1.00 1.73 C ATOM 2640 O GLU A 172 -7.573 3.428 -19.345 1.00 2.00 O ATOM 2641 CB GLU A 172 -8.576 4.033 -16.346 1.00 1.62 C ATOM 2642 CG GLU A 172 -8.363 2.708 -15.637 1.00 2.05 C ATOM 2643 CD GLU A 172 -8.235 1.547 -16.602 1.00 2.83 C ATOM 2644 OE1 GLU A 172 -9.282 1.006 -17.021 1.00 3.31 O ATOM 2645 OE2 GLU A 172 -7.093 1.174 -16.945 1.00 3.45 O ATOM 0 H GLU A 172 -7.429 6.169 -15.948 1.00 1.43 H new ATOM 0 HA GLU A 172 -6.545 3.791 -17.024 1.00 1.58 H new ATOM 0 HB2 GLU A 172 -8.794 4.802 -15.605 1.00 1.62 H new ATOM 0 HB3 GLU A 172 -9.451 3.954 -16.991 1.00 1.62 H new ATOM 0 HG2 GLU A 172 -7.463 2.768 -15.025 1.00 2.05 H new ATOM 0 HG3 GLU A 172 -9.197 2.523 -14.960 1.00 2.05 H new ATOM 2652 N GLU A 173 -8.240 5.563 -19.180 1.00 1.74 N ATOM 2653 CA GLU A 173 -8.630 5.651 -20.576 1.00 2.08 C ATOM 2654 C GLU A 173 -7.506 6.249 -21.425 1.00 2.36 C ATOM 2655 O GLU A 173 -7.475 6.070 -22.641 1.00 2.69 O ATOM 2656 CB GLU A 173 -9.896 6.505 -20.714 1.00 2.29 C ATOM 2657 CG GLU A 173 -11.047 6.040 -19.831 1.00 2.72 C ATOM 2658 CD GLU A 173 -12.297 6.880 -20.002 1.00 2.95 C ATOM 2659 OE1 GLU A 173 -12.358 7.992 -19.435 1.00 3.36 O ATOM 2660 OE2 GLU A 173 -13.235 6.427 -20.695 1.00 3.18 O ATOM 0 H GLU A 173 -8.379 6.421 -18.646 1.00 1.74 H new ATOM 0 HA GLU A 173 -8.832 4.642 -20.936 1.00 2.08 H new ATOM 0 HB2 GLU A 173 -9.655 7.539 -20.467 1.00 2.29 H new ATOM 0 HB3 GLU A 173 -10.220 6.493 -21.755 1.00 2.29 H new ATOM 0 HG2 GLU A 173 -11.279 5.001 -20.063 1.00 2.72 H new ATOM 0 HG3 GLU A 173 -10.734 6.072 -18.787 1.00 2.72 H new ATOM 2667 N LEU A 174 -6.580 6.951 -20.778 1.00 2.34 N ATOM 2668 CA LEU A 174 -5.548 7.703 -21.497 1.00 2.77 C ATOM 2669 C LEU A 174 -4.162 7.064 -21.405 1.00 2.83 C ATOM 2670 O LEU A 174 -3.228 7.534 -22.049 1.00 3.15 O ATOM 2671 CB LEU A 174 -5.464 9.144 -20.983 1.00 3.04 C ATOM 2672 CG LEU A 174 -6.566 10.093 -21.469 1.00 3.65 C ATOM 2673 CD1 LEU A 174 -7.893 9.791 -20.792 1.00 4.14 C ATOM 2674 CD2 LEU A 174 -6.160 11.537 -21.226 1.00 4.09 C ATOM 0 H LEU A 174 -6.520 7.017 -19.762 1.00 2.34 H new ATOM 0 HA LEU A 174 -5.852 7.692 -22.544 1.00 2.77 H new ATOM 0 HB2 LEU A 174 -5.484 9.122 -19.893 1.00 3.04 H new ATOM 0 HB3 LEU A 174 -4.499 9.558 -21.276 1.00 3.04 H new ATOM 0 HG LEU A 174 -6.697 9.939 -22.540 1.00 3.65 H new ATOM 0 HD11 LEU A 174 -8.653 10.481 -21.158 1.00 4.14 H new ATOM 0 HD12 LEU A 174 -8.192 8.768 -21.018 1.00 4.14 H new ATOM 0 HD13 LEU A 174 -7.786 9.908 -19.714 1.00 4.14 H new ATOM 0 HD21 LEU A 174 -6.951 12.201 -21.575 1.00 4.09 H new ATOM 0 HD22 LEU A 174 -5.998 11.695 -20.160 1.00 4.09 H new ATOM 0 HD23 LEU A 174 -5.239 11.752 -21.768 1.00 4.09 H new ATOM 2686 N LYS A 175 -4.025 6.014 -20.599 1.00 2.71 N ATOM 2687 CA LYS A 175 -2.723 5.382 -20.380 1.00 2.98 C ATOM 2688 C LYS A 175 -2.090 4.940 -21.697 1.00 2.92 C ATOM 2689 O LYS A 175 -2.624 4.086 -22.405 1.00 3.27 O ATOM 2690 CB LYS A 175 -2.837 4.190 -19.423 1.00 3.56 C ATOM 2691 CG LYS A 175 -1.509 3.479 -19.201 1.00 3.99 C ATOM 2692 CD LYS A 175 -1.561 2.503 -18.041 1.00 4.91 C ATOM 2693 CE LYS A 175 -0.252 1.741 -17.921 1.00 5.73 C ATOM 2694 NZ LYS A 175 -0.192 0.904 -16.698 1.00 6.31 N ATOM 0 H LYS A 175 -4.795 5.583 -20.088 1.00 2.71 H new ATOM 0 HA LYS A 175 -2.076 6.131 -19.923 1.00 2.98 H new ATOM 0 HB2 LYS A 175 -3.223 4.536 -18.464 1.00 3.56 H new ATOM 0 HB3 LYS A 175 -3.562 3.479 -19.820 1.00 3.56 H new ATOM 0 HG2 LYS A 175 -1.230 2.945 -20.109 1.00 3.99 H new ATOM 0 HG3 LYS A 175 -0.731 4.219 -19.015 1.00 3.99 H new ATOM 0 HD2 LYS A 175 -1.760 3.042 -17.115 1.00 4.91 H new ATOM 0 HD3 LYS A 175 -2.383 1.802 -18.185 1.00 4.91 H new ATOM 0 HE2 LYS A 175 -0.123 1.107 -18.798 1.00 5.73 H new ATOM 0 HE3 LYS A 175 0.577 2.448 -17.914 1.00 5.73 H new ATOM 0 HZ1 LYS A 175 0.303 0.015 -16.910 1.00 6.31 H new ATOM 0 HZ2 LYS A 175 0.320 1.416 -15.952 1.00 6.31 H new ATOM 0 HZ3 LYS A 175 -1.157 0.694 -16.374 1.00 6.31 H new ATOM 2708 N ALA A 176 -0.942 5.528 -22.008 1.00 3.23 N ATOM 2709 CA ALA A 176 -0.243 5.252 -23.253 1.00 3.81 C ATOM 2710 C ALA A 176 1.066 4.519 -22.990 1.00 4.06 C ATOM 2711 O ALA A 176 1.960 4.485 -23.838 1.00 4.47 O ATOM 2712 CB ALA A 176 0.015 6.549 -24.010 1.00 4.57 C ATOM 0 H ALA A 176 -0.473 6.206 -21.407 1.00 3.23 H new ATOM 0 HA ALA A 176 -0.874 4.608 -23.865 1.00 3.81 H new ATOM 0 HB1 ALA A 176 0.539 6.329 -24.940 1.00 4.57 H new ATOM 0 HB2 ALA A 176 -0.935 7.034 -24.234 1.00 4.57 H new ATOM 0 HB3 ALA A 176 0.626 7.212 -23.398 1.00 4.57 H new ATOM 2718 N ASN A 177 1.180 3.951 -21.800 1.00 4.28 N ATOM 2719 CA ASN A 177 2.345 3.156 -21.440 1.00 4.87 C ATOM 2720 C ASN A 177 1.972 1.682 -21.378 1.00 5.36 C ATOM 2721 O ASN A 177 1.010 1.313 -20.704 1.00 5.81 O ATOM 2722 CB ASN A 177 2.920 3.606 -20.089 1.00 5.37 C ATOM 2723 CG ASN A 177 4.037 2.697 -19.601 1.00 5.96 C ATOM 2724 OD1 ASN A 177 5.205 2.885 -19.946 1.00 6.37 O ATOM 2725 ND2 ASN A 177 3.691 1.707 -18.790 1.00 6.38 N ATOM 0 H ASN A 177 0.478 4.026 -21.064 1.00 4.28 H new ATOM 0 HA ASN A 177 3.107 3.303 -22.205 1.00 4.87 H new ATOM 0 HB2 ASN A 177 3.298 4.624 -20.179 1.00 5.37 H new ATOM 0 HB3 ASN A 177 2.122 3.627 -19.347 1.00 5.37 H new ATOM 0 HD21 ASN A 177 4.402 1.070 -18.430 1.00 6.38 H new ATOM 0 HD22 ASN A 177 2.714 1.582 -18.526 1.00 6.38 H new ATOM 2732 N PRO A 178 2.710 0.828 -22.097 1.00 5.69 N ATOM 2733 CA PRO A 178 2.497 -0.619 -22.080 1.00 6.51 C ATOM 2734 C PRO A 178 2.919 -1.226 -20.747 1.00 7.07 C ATOM 2735 O PRO A 178 4.140 -1.378 -20.526 1.00 7.39 O ATOM 2736 CB PRO A 178 3.391 -1.142 -23.217 1.00 6.95 C ATOM 2737 CG PRO A 178 3.831 0.066 -23.973 1.00 6.50 C ATOM 2738 CD PRO A 178 3.813 1.199 -22.990 1.00 5.73 C ATOM 2739 OXT PRO A 178 2.031 -1.547 -19.932 1.00 7.47 O ATOM 0 HA PRO A 178 1.447 -0.882 -22.209 1.00 6.51 H new ATOM 0 HB2 PRO A 178 4.247 -1.690 -22.822 1.00 6.95 H new ATOM 0 HB3 PRO A 178 2.843 -1.829 -23.862 1.00 6.95 H new ATOM 0 HG2 PRO A 178 4.829 -0.075 -24.387 1.00 6.50 H new ATOM 0 HG3 PRO A 178 3.164 0.266 -24.811 1.00 6.50 H new ATOM 0 HD2 PRO A 178 4.758 1.286 -22.453 1.00 5.73 H new ATOM 0 HD3 PRO A 178 3.635 2.157 -23.478 1.00 5.73 H new TER 2747 PRO A 178