USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1411 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 80 TYR OH : rot 100:sc= -0.855 USER MOD Set 1.2: A 137 HIS : no HE2:sc= 0.124 K(o=-0.73,f=-2.3) USER MOD Set 2.1: A 75 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 78 THR OG1 : rot 62:sc= 1.81 USER MOD Set 3.1: A 4 SER OG : rot -64:sc= 1.09 USER MOD Set 3.2: A 43 SER OG : rot -149:sc= 0.0304 USER MOD Set 4.1: A 5 ASN : amide:sc= 1.02 K(o=1,f=-3.2!) USER MOD Set 4.2: A 135 ASN : amide:sc=-0.000777 K(o=1,f=0.0098) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0.125 (180deg=-0.188) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0.547 K(o=0.55,f=-6.8!) USER MOD Single : A 14 SER OG : rot -82:sc= 0.445 USER MOD Single : A 15 TYR OH : rot 30:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -5.51! K(o=-5.5!,f=-0.85) USER MOD Single : A 28 SER OG : rot 165:sc= 0.789 USER MOD Single : A 33 ASN : amide:sc= -0.988 K(o=-0.99,f=-0.0026) USER MOD Single : A 35 THR OG1 : rot 45:sc= 0.418 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 162:sc= 2.46 (180deg=1.56) USER MOD Single : A 48 GLN : amide:sc= -1.42 K(o=-1.4,f=-6.3!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0.0435 USER MOD Single : A 69 THR OG1 : rot -87:sc= 1.22 USER MOD Single : A 70 SER OG : rot 69:sc= 1.27 USER MOD Single : A 71 GLN : amide:sc= -1.27! K(o=-1.3!,f=-0.043) USER MOD Single : A 73 HIS : no HD1:sc= -0.0522 X(o=-0.052,f=-0.0036) USER MOD Single : A 81 GLN : amide:sc= -0.844 K(o=-0.84,f=-0.037) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -3.96! K(o=-4!,f=-1) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 96 ASN : amide:sc= -0.249 K(o=-0.25,f=-5.6!) USER MOD Single : A 105 SER OG : rot 77:sc= 1.14 USER MOD Single : A 111 CYS SG : rot 180:sc= -1.22 USER MOD Single : A 114 SER OG : rot 68:sc= -1.66! USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 MET CE :methyl -143:sc= -5.08! (180deg=-6.83!) USER MOD Single : A 120 GLN : amide:sc= -0.114 K(o=-0.11,f=-0.99) USER MOD Single : A 124 SER OG : rot 180:sc= 0.0744 USER MOD Single : A 130 MET CE :methyl -112:sc= -3.88! (180deg=-6.19!) USER MOD Single : A 132 THR OG1 : rot 78:sc= 1.27 USER MOD Single : A 133 TYR OH : rot 1:sc= 1.05 USER MOD Single : A 143 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.14) USER MOD Single : A 145 ASN : amide:sc= 1.15 K(o=1.1,f=0) USER MOD Single : A 150 THR OG1 : rot -119:sc= -0.0516 USER MOD Single : A 155 TYR OH : rot 24:sc= 1.32 USER MOD Single : A 157 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 158 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 165 LYS NZ :NH3+ -166:sc= -0.045 (180deg=-0.261) USER MOD Single : A 167 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 172 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 173 HIS : no HE2:sc= 1.09 K(o=1.1,f=-3.4!) USER MOD Single : A 174 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HD1:sc=-0.00162 X(o=-0.0016,f=-0.015) USER MOD Single : A 177 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.0052) USER MOD Single : A 180 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 181 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 182 HIS : no HD1:sc= 0.404 K(o=0.4,f=-2.9!) USER MOD Single : A 183 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 185 HIS : no HD1:sc=-0.00631 X(o=-0.0063,f=-0.0076) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.671 2.375 18.509 1.00 3.19 N ATOM 2 CA MET A 1 8.232 2.321 18.161 1.00 2.85 C ATOM 3 C MET A 1 8.048 2.511 16.659 1.00 2.27 C ATOM 4 O MET A 1 9.028 2.522 15.909 1.00 2.72 O ATOM 5 CB MET A 1 7.458 3.400 18.927 1.00 3.07 C ATOM 6 CG MET A 1 7.489 3.218 20.435 1.00 3.85 C ATOM 7 SD MET A 1 6.609 4.521 21.319 1.00 4.63 S ATOM 8 CE MET A 1 6.898 4.032 23.019 1.00 5.45 C ATOM 0 H1 MET A 1 9.906 1.581 19.138 1.00 3.19 H new ATOM 0 H2 MET A 1 10.241 2.309 17.641 1.00 3.19 H new ATOM 0 H3 MET A 1 9.878 3.273 18.992 1.00 3.19 H new ATOM 0 HA MET A 1 7.841 1.344 18.444 1.00 2.85 H new ATOM 0 HB2 MET A 1 7.872 4.377 18.679 1.00 3.07 H new ATOM 0 HB3 MET A 1 6.421 3.399 18.591 1.00 3.07 H new ATOM 0 HG2 MET A 1 7.049 2.253 20.688 1.00 3.85 H new ATOM 0 HG3 MET A 1 8.525 3.194 20.772 1.00 3.85 H new ATOM 0 HE1 MET A 1 6.414 4.743 23.689 1.00 5.45 H new ATOM 0 HE2 MET A 1 6.486 3.037 23.186 1.00 5.45 H new ATOM 0 HE3 MET A 1 7.970 4.019 23.217 1.00 5.45 H new ATOM 20 N SER A 2 6.793 2.641 16.227 1.00 1.75 N ATOM 21 CA SER A 2 6.462 2.856 14.818 1.00 1.66 C ATOM 22 C SER A 2 6.899 1.678 13.946 1.00 1.36 C ATOM 23 O SER A 2 7.204 1.844 12.764 1.00 1.24 O ATOM 24 CB SER A 2 7.092 4.159 14.315 1.00 2.18 C ATOM 25 OG SER A 2 6.576 5.277 15.020 1.00 2.93 O ATOM 0 H SER A 2 5.980 2.600 16.842 1.00 1.75 H new ATOM 0 HA SER A 2 5.377 2.934 14.742 1.00 1.66 H new ATOM 0 HB2 SER A 2 8.174 4.115 14.437 1.00 2.18 H new ATOM 0 HB3 SER A 2 6.896 4.274 13.249 1.00 2.18 H new ATOM 0 HG SER A 2 6.994 6.097 14.683 1.00 2.93 H new ATOM 31 N GLN A 3 6.889 0.479 14.521 1.00 1.37 N ATOM 32 CA GLN A 3 7.263 -0.718 13.781 1.00 1.24 C ATOM 33 C GLN A 3 6.103 -1.199 12.918 1.00 0.92 C ATOM 34 O GLN A 3 6.269 -2.073 12.068 1.00 0.86 O ATOM 35 CB GLN A 3 7.730 -1.833 14.722 1.00 1.49 C ATOM 36 CG GLN A 3 9.038 -1.523 15.434 1.00 1.69 C ATOM 37 CD GLN A 3 10.166 -1.171 14.472 1.00 2.43 C ATOM 38 OE1 GLN A 3 10.200 -1.641 13.332 1.00 3.10 O ATOM 39 NE2 GLN A 3 11.102 -0.351 14.927 1.00 2.97 N ATOM 0 H GLN A 3 6.627 0.312 15.493 1.00 1.37 H new ATOM 0 HA GLN A 3 8.098 -0.459 13.130 1.00 1.24 H new ATOM 0 HB2 GLN A 3 6.955 -2.016 15.467 1.00 1.49 H new ATOM 0 HB3 GLN A 3 7.847 -2.754 14.150 1.00 1.49 H new ATOM 0 HG2 GLN A 3 8.883 -0.693 16.124 1.00 1.69 H new ATOM 0 HG3 GLN A 3 9.333 -2.385 16.033 1.00 1.69 H new ATOM 0 HE21 GLN A 3 11.040 0.018 15.876 1.00 2.97 H new ATOM 0 HE22 GLN A 3 11.885 -0.088 14.328 1.00 2.97 H new ATOM 48 N SER A 4 4.928 -0.619 13.129 1.00 0.88 N ATOM 49 CA SER A 4 3.765 -0.937 12.310 1.00 0.77 C ATOM 50 C SER A 4 3.951 -0.417 10.887 1.00 0.62 C ATOM 51 O SER A 4 3.303 -0.891 9.954 1.00 0.64 O ATOM 52 CB SER A 4 2.492 -0.372 12.939 1.00 1.02 C ATOM 53 OG SER A 4 2.245 -0.989 14.193 1.00 1.34 O ATOM 0 H SER A 4 4.755 0.073 13.859 1.00 0.88 H new ATOM 0 HA SER A 4 3.664 -2.021 12.262 1.00 0.77 H new ATOM 0 HB2 SER A 4 2.590 0.706 13.070 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.645 -0.536 12.272 1.00 1.02 H new ATOM 0 HG SER A 4 2.065 -1.943 14.058 1.00 1.34 H new ATOM 59 N ASN A 5 4.856 0.544 10.721 1.00 0.59 N ATOM 60 CA ASN A 5 5.250 0.989 9.386 1.00 0.55 C ATOM 61 C ASN A 5 5.906 -0.166 8.627 1.00 0.43 C ATOM 62 O ASN A 5 5.811 -0.259 7.405 1.00 0.44 O ATOM 63 CB ASN A 5 6.209 2.190 9.465 1.00 0.65 C ATOM 64 CG ASN A 5 5.495 3.500 9.787 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.330 3.691 9.432 1.00 1.71 O ATOM 66 ND2 ASN A 5 6.187 4.417 10.455 1.00 0.67 N ATOM 0 H ASN A 5 5.327 1.026 11.486 1.00 0.59 H new ATOM 0 HA ASN A 5 4.356 1.308 8.850 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.964 1.996 10.227 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.734 2.292 8.515 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.756 5.311 10.689 1.00 0.67 H new ATOM 0 HD22 ASN A 5 7.149 4.227 10.734 1.00 0.67 H new ATOM 73 N ARG A 6 6.551 -1.060 9.372 1.00 0.41 N ATOM 74 CA ARG A 6 7.177 -2.241 8.792 1.00 0.41 C ATOM 75 C ARG A 6 6.113 -3.263 8.394 1.00 0.37 C ATOM 76 O ARG A 6 6.282 -4.002 7.423 1.00 0.38 O ATOM 77 CB ARG A 6 8.153 -2.866 9.798 1.00 0.54 C ATOM 78 CG ARG A 6 9.018 -3.973 9.217 1.00 0.65 C ATOM 79 CD ARG A 6 9.868 -4.647 10.288 1.00 0.83 C ATOM 80 NE ARG A 6 10.586 -3.677 11.115 1.00 1.50 N ATOM 81 CZ ARG A 6 11.913 -3.585 11.181 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.680 -4.406 10.473 1.00 2.16 N ATOM 83 NH2 ARG A 6 12.468 -2.681 11.972 1.00 3.18 N ATOM 0 H ARG A 6 6.653 -0.986 10.384 1.00 0.41 H new ATOM 0 HA ARG A 6 7.728 -1.942 7.900 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.800 -2.084 10.194 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.585 -3.266 10.638 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.382 -4.716 8.736 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.667 -3.560 8.444 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.229 -5.261 10.923 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.584 -5.317 9.813 1.00 0.83 H new ATOM 0 HE ARG A 6 10.034 -3.029 11.678 1.00 1.50 H new ATOM 0 HH11 ARG A 6 12.253 -5.113 9.874 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.696 -4.330 10.528 1.00 2.16 H new ATOM 0 HH21 ARG A 6 11.880 -2.059 12.527 1.00 3.18 H new ATOM 0 HH22 ARG A 6 13.484 -2.606 12.027 1.00 3.18 H new ATOM 97 N GLU A 7 5.011 -3.285 9.144 1.00 0.36 N ATOM 98 CA GLU A 7 3.910 -4.212 8.878 1.00 0.37 C ATOM 99 C GLU A 7 3.311 -3.950 7.508 1.00 0.29 C ATOM 100 O GLU A 7 2.947 -4.876 6.784 1.00 0.29 O ATOM 101 CB GLU A 7 2.801 -4.062 9.920 1.00 0.46 C ATOM 102 CG GLU A 7 3.210 -4.387 11.345 1.00 0.60 C ATOM 103 CD GLU A 7 2.010 -4.399 12.266 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.191 -5.334 12.149 1.00 1.58 O ATOM 105 OE2 GLU A 7 1.857 -3.462 13.078 1.00 2.00 O ATOM 0 H GLU A 7 4.857 -2.670 9.943 1.00 0.36 H new ATOM 0 HA GLU A 7 4.320 -5.221 8.922 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.431 -3.037 9.889 1.00 0.46 H new ATOM 0 HB3 GLU A 7 1.970 -4.710 9.640 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.703 -5.359 11.373 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.934 -3.652 11.696 1.00 0.60 H new ATOM 112 N LEU A 8 3.223 -2.676 7.163 1.00 0.27 N ATOM 113 CA LEU A 8 2.598 -2.251 5.923 1.00 0.28 C ATOM 114 C LEU A 8 3.432 -2.694 4.736 1.00 0.28 C ATOM 115 O LEU A 8 2.943 -2.790 3.617 1.00 0.39 O ATOM 116 CB LEU A 8 2.438 -0.734 5.922 1.00 0.31 C ATOM 117 CG LEU A 8 1.779 -0.169 7.174 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.662 1.339 7.072 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.416 -0.809 7.382 1.00 0.35 C ATOM 0 H LEU A 8 3.582 -1.910 7.733 1.00 0.27 H new ATOM 0 HA LEU A 8 1.613 -2.712 5.844 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.421 -0.277 5.806 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.847 -0.444 5.053 1.00 0.31 H new ATOM 0 HG LEU A 8 2.401 -0.402 8.038 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.189 1.729 7.973 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.655 1.775 6.966 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.057 1.599 6.203 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.046 -0.398 8.280 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.218 -0.602 6.520 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.534 -1.887 7.496 1.00 0.35 H new ATOM 131 N VAL A 9 4.697 -2.958 5.002 1.00 0.26 N ATOM 132 CA VAL A 9 5.597 -3.479 3.999 1.00 0.28 C ATOM 133 C VAL A 9 5.548 -5.002 3.984 1.00 0.29 C ATOM 134 O VAL A 9 5.099 -5.603 3.016 1.00 0.31 O ATOM 135 CB VAL A 9 7.038 -3.025 4.271 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.975 -3.585 3.217 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.116 -1.511 4.319 1.00 0.31 C ATOM 0 H VAL A 9 5.126 -2.817 5.917 1.00 0.26 H new ATOM 0 HA VAL A 9 5.278 -3.093 3.031 1.00 0.28 H new ATOM 0 HB VAL A 9 7.350 -3.410 5.242 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.993 -3.255 3.423 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.936 -4.674 3.237 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.670 -3.229 2.233 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.144 -1.206 4.513 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.789 -1.099 3.364 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.471 -1.138 5.115 1.00 0.31 H new ATOM 147 N VAL A 10 5.995 -5.610 5.082 1.00 0.30 N ATOM 148 CA VAL A 10 6.115 -7.064 5.185 1.00 0.32 C ATOM 149 C VAL A 10 4.818 -7.774 4.815 1.00 0.35 C ATOM 150 O VAL A 10 4.810 -8.664 3.960 1.00 0.36 O ATOM 151 CB VAL A 10 6.533 -7.479 6.610 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.536 -8.992 6.757 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.900 -6.912 6.944 1.00 0.38 C ATOM 0 H VAL A 10 6.283 -5.110 5.923 1.00 0.30 H new ATOM 0 HA VAL A 10 6.885 -7.365 4.474 1.00 0.32 H new ATOM 0 HB VAL A 10 5.804 -7.072 7.311 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.834 -9.258 7.771 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.536 -9.379 6.559 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.240 -9.425 6.046 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.182 -7.213 7.953 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.635 -7.291 6.233 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.867 -5.824 6.886 1.00 0.38 H new ATOM 163 N ASP A 11 3.723 -7.377 5.448 1.00 0.39 N ATOM 164 CA ASP A 11 2.437 -8.034 5.225 1.00 0.46 C ATOM 165 C ASP A 11 1.920 -7.757 3.817 1.00 0.44 C ATOM 166 O ASP A 11 1.098 -8.502 3.286 1.00 0.50 O ATOM 167 CB ASP A 11 1.412 -7.580 6.265 1.00 0.55 C ATOM 168 CG ASP A 11 0.114 -8.353 6.169 1.00 0.71 C ATOM 169 OD1 ASP A 11 0.142 -9.589 6.338 1.00 0.92 O ATOM 170 OD2 ASP A 11 -0.937 -7.735 5.903 1.00 0.84 O ATOM 0 H ASP A 11 3.696 -6.608 6.117 1.00 0.39 H new ATOM 0 HA ASP A 11 2.587 -9.109 5.330 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.832 -7.703 7.263 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.210 -6.517 6.133 1.00 0.55 H new ATOM 175 N PHE A 12 2.416 -6.690 3.208 1.00 0.41 N ATOM 176 CA PHE A 12 2.034 -6.349 1.843 1.00 0.42 C ATOM 177 C PHE A 12 2.847 -7.184 0.858 1.00 0.37 C ATOM 178 O PHE A 12 2.309 -7.713 -0.118 1.00 0.41 O ATOM 179 CB PHE A 12 2.253 -4.851 1.578 1.00 0.44 C ATOM 180 CG PHE A 12 1.537 -4.329 0.362 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.115 -4.411 -0.896 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.284 -3.750 0.482 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.454 -3.927 -2.010 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.381 -3.266 -0.628 1.00 0.68 C ATOM 185 CZ PHE A 12 0.204 -3.355 -1.874 1.00 0.60 C ATOM 0 H PHE A 12 3.082 -6.046 3.635 1.00 0.41 H new ATOM 0 HA PHE A 12 0.975 -6.568 1.709 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.923 -4.287 2.450 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.321 -4.666 1.464 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.092 -4.858 -1.007 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.178 -3.676 1.455 1.00 0.62 H new ATOM 0 HE1 PHE A 12 1.914 -3.996 -2.985 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.358 -2.818 -0.520 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.315 -2.978 -2.743 1.00 0.60 H new ATOM 195 N LEU A 13 4.144 -7.320 1.134 1.00 0.33 N ATOM 196 CA LEU A 13 5.031 -8.091 0.275 1.00 0.32 C ATOM 197 C LEU A 13 4.614 -9.554 0.281 1.00 0.33 C ATOM 198 O LEU A 13 4.527 -10.193 -0.768 1.00 0.35 O ATOM 199 CB LEU A 13 6.489 -7.972 0.737 1.00 0.32 C ATOM 200 CG LEU A 13 6.996 -6.546 0.972 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.489 -6.549 1.254 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.680 -5.651 -0.216 1.00 0.38 C ATOM 0 H LEU A 13 4.600 -6.905 1.946 1.00 0.33 H new ATOM 0 HA LEU A 13 4.955 -7.691 -0.736 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.605 -8.536 1.662 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.127 -8.447 -0.008 1.00 0.32 H new ATOM 0 HG LEU A 13 6.479 -6.145 1.844 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.830 -5.527 1.418 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.690 -7.146 2.143 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.019 -6.976 0.403 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.051 -4.645 -0.022 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.161 -6.049 -1.110 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.601 -5.617 -0.369 1.00 0.38 H new ATOM 214 N SER A 14 4.335 -10.068 1.472 1.00 0.34 N ATOM 215 CA SER A 14 3.935 -11.457 1.642 1.00 0.38 C ATOM 216 C SER A 14 2.584 -11.724 0.986 1.00 0.39 C ATOM 217 O SER A 14 2.337 -12.818 0.475 1.00 0.41 O ATOM 218 CB SER A 14 3.884 -11.802 3.130 1.00 0.45 C ATOM 219 OG SER A 14 3.123 -10.847 3.850 1.00 1.14 O ATOM 0 H SER A 14 4.379 -9.537 2.342 1.00 0.34 H new ATOM 0 HA SER A 14 4.674 -12.092 1.153 1.00 0.38 H new ATOM 0 HB2 SER A 14 3.449 -12.793 3.262 1.00 0.45 H new ATOM 0 HB3 SER A 14 4.896 -11.843 3.532 1.00 0.45 H new ATOM 0 HG SER A 14 3.680 -10.064 4.044 1.00 1.14 H new ATOM 225 N TYR A 15 1.720 -10.715 0.990 1.00 0.42 N ATOM 226 CA TYR A 15 0.399 -10.835 0.387 1.00 0.47 C ATOM 227 C TYR A 15 0.523 -10.934 -1.129 1.00 0.45 C ATOM 228 O TYR A 15 -0.187 -11.707 -1.772 1.00 0.52 O ATOM 229 CB TYR A 15 -0.474 -9.637 0.780 1.00 0.55 C ATOM 230 CG TYR A 15 -1.910 -9.734 0.308 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.784 -10.656 0.870 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.392 -8.898 -0.690 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.096 -10.744 0.447 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.703 -8.981 -1.117 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.549 -9.905 -0.545 1.00 1.02 C ATOM 236 OH TYR A 15 -5.854 -9.991 -0.973 1.00 1.20 O ATOM 0 H TYR A 15 1.912 -9.803 1.405 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.077 -11.743 0.756 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.466 -9.536 1.865 1.00 0.55 H new ATOM 0 HB3 TYR A 15 -0.030 -8.729 0.372 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.432 -11.315 1.650 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.732 -8.171 -1.140 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.763 -11.467 0.893 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -4.063 -8.325 -1.896 1.00 0.94 H new ATOM 0 HH TYR A 15 -6.421 -10.294 -0.234 1.00 1.20 H new ATOM 246 N LYS A 16 1.453 -10.168 -1.690 1.00 0.40 N ATOM 247 CA LYS A 16 1.670 -10.166 -3.128 1.00 0.41 C ATOM 248 C LYS A 16 2.373 -11.452 -3.552 1.00 0.35 C ATOM 249 O LYS A 16 1.986 -12.090 -4.531 1.00 0.39 O ATOM 250 CB LYS A 16 2.506 -8.952 -3.541 1.00 0.49 C ATOM 251 CG LYS A 16 2.539 -8.712 -5.042 1.00 0.90 C ATOM 252 CD LYS A 16 1.284 -8.006 -5.537 1.00 0.83 C ATOM 253 CE LYS A 16 1.194 -6.584 -4.998 1.00 1.35 C ATOM 254 NZ LYS A 16 0.060 -5.827 -5.591 1.00 1.39 N ATOM 0 H LYS A 16 2.067 -9.542 -1.169 1.00 0.40 H new ATOM 0 HA LYS A 16 0.702 -10.108 -3.626 1.00 0.41 H new ATOM 0 HB2 LYS A 16 2.108 -8.064 -3.049 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.526 -9.086 -3.181 1.00 0.49 H new ATOM 0 HG2 LYS A 16 3.414 -8.113 -5.294 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.646 -9.666 -5.559 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.284 -7.984 -6.627 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.403 -8.569 -5.229 1.00 0.83 H new ATOM 0 HE2 LYS A 16 1.080 -6.615 -3.914 1.00 1.35 H new ATOM 0 HE3 LYS A 16 2.127 -6.059 -5.206 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 0.039 -4.866 -5.194 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 0.180 -5.773 -6.623 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -0.834 -6.312 -5.371 1.00 1.39 H new ATOM 268 N LEU A 17 3.404 -11.831 -2.798 1.00 0.30 N ATOM 269 CA LEU A 17 4.126 -13.076 -3.036 1.00 0.27 C ATOM 270 C LEU A 17 3.188 -14.275 -2.963 1.00 0.31 C ATOM 271 O LEU A 17 3.338 -15.237 -3.715 1.00 0.32 O ATOM 272 CB LEU A 17 5.248 -13.241 -2.008 1.00 0.25 C ATOM 273 CG LEU A 17 6.398 -12.249 -2.141 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.299 -12.323 -0.925 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.191 -12.526 -3.401 1.00 0.25 C ATOM 0 H LEU A 17 3.759 -11.287 -2.011 1.00 0.30 H new ATOM 0 HA LEU A 17 4.554 -13.029 -4.037 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.821 -13.147 -1.009 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.649 -14.251 -2.090 1.00 0.25 H new ATOM 0 HG LEU A 17 5.983 -11.243 -2.207 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.116 -11.609 -1.033 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.724 -12.083 -0.031 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.706 -13.330 -0.835 1.00 0.29 H new ATOM 0 HD21 LEU A 17 8.008 -11.809 -3.481 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.597 -13.537 -3.360 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.539 -12.432 -4.269 1.00 0.25 H new ATOM 287 N SER A 18 2.214 -14.202 -2.064 1.00 0.37 N ATOM 288 CA SER A 18 1.263 -15.289 -1.879 1.00 0.44 C ATOM 289 C SER A 18 0.411 -15.469 -3.137 1.00 0.47 C ATOM 290 O SER A 18 0.045 -16.590 -3.492 1.00 0.51 O ATOM 291 CB SER A 18 0.377 -15.030 -0.651 1.00 0.54 C ATOM 292 OG SER A 18 -0.371 -16.183 -0.302 1.00 1.26 O ATOM 0 H SER A 18 2.063 -13.400 -1.452 1.00 0.37 H new ATOM 0 HA SER A 18 1.818 -16.211 -1.706 1.00 0.44 H new ATOM 0 HB2 SER A 18 0.999 -14.729 0.192 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.302 -14.203 -0.858 1.00 0.54 H new ATOM 0 HG SER A 18 -0.924 -15.989 0.483 1.00 1.26 H new ATOM 298 N GLN A 19 0.128 -14.366 -3.830 1.00 0.48 N ATOM 299 CA GLN A 19 -0.627 -14.416 -5.078 1.00 0.53 C ATOM 300 C GLN A 19 0.228 -15.052 -6.172 1.00 0.48 C ATOM 301 O GLN A 19 -0.280 -15.700 -7.088 1.00 0.55 O ATOM 302 CB GLN A 19 -1.054 -13.000 -5.491 1.00 0.59 C ATOM 303 CG GLN A 19 -1.904 -12.943 -6.755 1.00 0.71 C ATOM 304 CD GLN A 19 -2.252 -11.519 -7.158 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.263 -10.968 -6.724 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.425 -10.916 -8.000 1.00 1.65 N ATOM 0 H GLN A 19 0.411 -13.428 -3.547 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.522 -15.021 -4.932 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.613 -12.548 -4.671 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.161 -12.393 -5.640 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.369 -13.428 -7.571 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.823 -13.507 -6.597 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -0.596 -11.405 -8.339 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -1.617 -9.963 -8.309 1.00 1.65 H new ATOM 315 N LYS A 20 1.536 -14.877 -6.042 1.00 0.41 N ATOM 316 CA LYS A 20 2.496 -15.412 -7.002 1.00 0.40 C ATOM 317 C LYS A 20 2.784 -16.888 -6.727 1.00 0.44 C ATOM 318 O LYS A 20 3.601 -17.508 -7.409 1.00 0.48 O ATOM 319 CB LYS A 20 3.800 -14.614 -6.929 1.00 0.36 C ATOM 320 CG LYS A 20 3.643 -13.135 -7.246 1.00 0.68 C ATOM 321 CD LYS A 20 3.513 -12.884 -8.741 1.00 0.61 C ATOM 322 CE LYS A 20 3.274 -11.412 -9.038 1.00 1.06 C ATOM 323 NZ LYS A 20 3.418 -11.101 -10.485 1.00 1.87 N ATOM 0 H LYS A 20 1.962 -14.362 -5.271 1.00 0.41 H new ATOM 0 HA LYS A 20 2.065 -15.325 -7.999 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.221 -14.717 -5.929 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.519 -15.049 -7.624 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.762 -12.746 -6.735 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.503 -12.588 -6.860 1.00 0.68 H new ATOM 0 HD2 LYS A 20 4.419 -13.216 -9.247 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.689 -13.476 -9.141 1.00 0.61 H new ATOM 0 HE2 LYS A 20 2.274 -11.134 -8.706 1.00 1.06 H new ATOM 0 HE3 LYS A 20 3.979 -10.808 -8.466 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 3.247 -10.087 -10.641 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 4.380 -11.342 -10.798 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.728 -11.657 -11.030 1.00 1.87 H new ATOM 337 N GLY A 21 2.118 -17.440 -5.720 1.00 0.48 N ATOM 338 CA GLY A 21 2.290 -18.844 -5.395 1.00 0.54 C ATOM 339 C GLY A 21 3.453 -19.097 -4.452 1.00 0.53 C ATOM 340 O GLY A 21 3.898 -20.233 -4.305 1.00 0.67 O ATOM 0 H GLY A 21 1.461 -16.940 -5.122 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.373 -19.221 -4.942 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.446 -19.408 -6.315 1.00 0.54 H new ATOM 344 N TYR A 22 3.951 -18.046 -3.812 1.00 0.43 N ATOM 345 CA TYR A 22 5.070 -18.186 -2.885 1.00 0.42 C ATOM 346 C TYR A 22 4.627 -17.894 -1.454 1.00 0.43 C ATOM 347 O TYR A 22 3.633 -17.202 -1.235 1.00 0.46 O ATOM 348 CB TYR A 22 6.213 -17.240 -3.269 1.00 0.40 C ATOM 349 CG TYR A 22 6.830 -17.516 -4.627 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.088 -18.814 -5.058 1.00 0.65 C ATOM 351 CD2 TYR A 22 7.159 -16.468 -5.474 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.659 -19.052 -6.295 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.729 -16.698 -6.710 1.00 0.57 C ATOM 354 CZ TYR A 22 7.978 -17.991 -7.117 1.00 0.69 C ATOM 355 OH TYR A 22 8.551 -18.223 -8.347 1.00 0.81 O ATOM 0 H TYR A 22 3.602 -17.093 -3.916 1.00 0.43 H new ATOM 0 HA TYR A 22 5.424 -19.215 -2.944 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.840 -16.216 -3.255 1.00 0.40 H new ATOM 0 HB3 TYR A 22 6.992 -17.306 -2.510 1.00 0.40 H new ATOM 0 HD1 TYR A 22 6.839 -19.647 -4.417 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.966 -15.453 -5.161 1.00 0.47 H new ATOM 0 HE1 TYR A 22 7.854 -20.064 -6.616 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.979 -15.869 -7.355 1.00 0.57 H new ATOM 0 HH TYR A 22 8.711 -17.369 -8.800 1.00 0.81 H new ATOM 365 N SER A 23 5.348 -18.447 -0.488 1.00 0.45 N ATOM 366 CA SER A 23 5.088 -18.172 0.918 1.00 0.49 C ATOM 367 C SER A 23 6.230 -17.353 1.522 1.00 0.43 C ATOM 368 O SER A 23 7.405 -17.648 1.298 1.00 0.44 O ATOM 369 CB SER A 23 4.910 -19.477 1.697 1.00 0.59 C ATOM 370 OG SER A 23 4.541 -19.226 3.044 1.00 1.41 O ATOM 0 H SER A 23 6.121 -19.092 -0.654 1.00 0.45 H new ATOM 0 HA SER A 23 4.166 -17.595 0.988 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.147 -20.089 1.216 1.00 0.59 H new ATOM 0 HB3 SER A 23 5.838 -20.048 1.672 1.00 0.59 H new ATOM 0 HG SER A 23 4.432 -20.077 3.517 1.00 1.41 H new ATOM 376 N TRP A 24 5.872 -16.338 2.297 1.00 0.43 N ATOM 377 CA TRP A 24 6.847 -15.454 2.936 1.00 0.41 C ATOM 378 C TRP A 24 7.762 -16.231 3.882 1.00 0.47 C ATOM 379 O TRP A 24 8.977 -16.014 3.909 1.00 0.53 O ATOM 380 CB TRP A 24 6.107 -14.341 3.695 1.00 0.44 C ATOM 381 CG TRP A 24 6.997 -13.401 4.457 1.00 0.46 C ATOM 382 CD1 TRP A 24 7.196 -13.379 5.810 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.796 -12.337 3.918 1.00 0.43 C ATOM 384 NE1 TRP A 24 8.066 -12.371 6.142 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.451 -11.719 5.002 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.025 -11.848 2.627 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.314 -10.638 4.834 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.884 -10.777 2.462 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.519 -10.183 3.560 1.00 0.48 C ATOM 0 H TRP A 24 4.901 -16.102 2.502 1.00 0.43 H new ATOM 0 HA TRP A 24 7.475 -15.010 2.163 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.518 -13.764 2.982 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.405 -14.800 4.391 1.00 0.44 H new ATOM 0 HD1 TRP A 24 6.736 -14.056 6.514 1.00 0.55 H new ATOM 0 HE1 TRP A 24 8.376 -12.144 7.087 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.539 -12.299 1.774 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.803 -10.176 5.679 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.068 -10.392 1.470 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.185 -9.348 3.398 1.00 0.48 H new ATOM 400 N SER A 25 7.180 -17.154 4.635 1.00 0.54 N ATOM 401 CA SER A 25 7.924 -17.910 5.637 1.00 0.63 C ATOM 402 C SER A 25 8.901 -18.901 4.996 1.00 0.63 C ATOM 403 O SER A 25 9.768 -19.452 5.673 1.00 0.75 O ATOM 404 CB SER A 25 6.948 -18.646 6.551 1.00 0.75 C ATOM 405 OG SER A 25 5.972 -17.753 7.063 1.00 1.20 O ATOM 0 H SER A 25 6.192 -17.399 4.572 1.00 0.54 H new ATOM 0 HA SER A 25 8.515 -17.205 6.221 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.460 -19.449 5.999 1.00 0.75 H new ATOM 0 HB3 SER A 25 7.492 -19.110 7.374 1.00 0.75 H new ATOM 0 HG SER A 25 5.354 -18.243 7.645 1.00 1.20 H new ATOM 411 N GLN A 26 8.770 -19.126 3.694 1.00 0.61 N ATOM 412 CA GLN A 26 9.664 -20.037 2.994 1.00 0.73 C ATOM 413 C GLN A 26 10.989 -19.353 2.673 1.00 0.79 C ATOM 414 O GLN A 26 12.037 -19.998 2.635 1.00 0.93 O ATOM 415 CB GLN A 26 9.007 -20.561 1.707 1.00 0.80 C ATOM 416 CG GLN A 26 9.901 -21.473 0.861 1.00 1.25 C ATOM 417 CD GLN A 26 10.132 -22.857 1.462 1.00 1.53 C ATOM 418 OE1 GLN A 26 10.324 -23.830 0.734 1.00 1.91 O ATOM 419 NE2 GLN A 26 10.117 -22.964 2.782 1.00 2.26 N ATOM 0 H GLN A 26 8.058 -18.693 3.106 1.00 0.61 H new ATOM 0 HA GLN A 26 9.864 -20.885 3.649 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.102 -21.107 1.973 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.699 -19.710 1.099 1.00 0.80 H new ATOM 0 HG2 GLN A 26 9.453 -21.588 -0.126 1.00 1.25 H new ATOM 0 HG3 GLN A 26 10.866 -20.986 0.718 1.00 1.25 H new ATOM 0 HE21 GLN A 26 9.955 -22.138 3.359 1.00 2.26 H new ATOM 0 HE22 GLN A 26 10.267 -23.872 3.222 1.00 2.26 H new ATOM 428 N PHE A 27 10.953 -18.042 2.478 1.00 0.76 N ATOM 429 CA PHE A 27 12.146 -17.315 2.062 1.00 0.92 C ATOM 430 C PHE A 27 12.743 -16.549 3.237 1.00 0.98 C ATOM 431 O PHE A 27 13.939 -16.259 3.260 1.00 1.18 O ATOM 432 CB PHE A 27 11.817 -16.368 0.903 1.00 0.99 C ATOM 433 CG PHE A 27 11.003 -17.030 -0.175 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.457 -18.179 -0.804 1.00 1.07 C ATOM 435 CD2 PHE A 27 9.776 -16.510 -0.549 1.00 0.93 C ATOM 436 CE1 PHE A 27 10.704 -18.797 -1.781 1.00 1.13 C ATOM 437 CE2 PHE A 27 9.020 -17.123 -1.527 1.00 0.96 C ATOM 438 CZ PHE A 27 9.483 -18.267 -2.142 1.00 1.05 C ATOM 0 H PHE A 27 10.121 -17.465 2.599 1.00 0.76 H new ATOM 0 HA PHE A 27 12.888 -18.034 1.715 1.00 0.92 H new ATOM 0 HB2 PHE A 27 11.271 -15.506 1.287 1.00 0.99 H new ATOM 0 HB3 PHE A 27 12.745 -15.991 0.472 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.413 -18.596 -0.525 1.00 1.07 H new ATOM 0 HD2 PHE A 27 9.407 -15.615 -0.070 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.069 -19.693 -2.261 1.00 1.13 H new ATOM 0 HE2 PHE A 27 8.065 -16.706 -1.811 1.00 0.96 H new ATOM 0 HZ PHE A 27 8.890 -18.748 -2.906 1.00 1.05 H new ATOM 448 N SER A 28 11.906 -16.229 4.210 1.00 0.93 N ATOM 449 CA SER A 28 12.375 -15.609 5.436 1.00 1.07 C ATOM 450 C SER A 28 12.565 -16.684 6.500 1.00 1.04 C ATOM 451 O SER A 28 11.630 -17.426 6.806 1.00 1.02 O ATOM 452 CB SER A 28 11.367 -14.562 5.913 1.00 1.21 C ATOM 453 OG SER A 28 11.012 -13.689 4.854 1.00 1.73 O ATOM 0 H SER A 28 10.899 -16.389 4.174 1.00 0.93 H new ATOM 0 HA SER A 28 13.327 -15.112 5.252 1.00 1.07 H new ATOM 0 HB2 SER A 28 10.475 -15.057 6.297 1.00 1.21 H new ATOM 0 HB3 SER A 28 11.793 -13.989 6.736 1.00 1.21 H new ATOM 0 HG SER A 28 10.209 -13.185 5.101 1.00 1.73 H new ATOM 459 N ASP A 29 13.772 -16.798 7.039 1.00 1.25 N ATOM 460 CA ASP A 29 14.047 -17.817 8.040 1.00 1.33 C ATOM 461 C ASP A 29 13.452 -17.403 9.380 1.00 1.40 C ATOM 462 O ASP A 29 13.817 -16.368 9.935 1.00 1.62 O ATOM 463 CB ASP A 29 15.551 -18.058 8.183 1.00 1.63 C ATOM 464 CG ASP A 29 15.857 -19.305 8.988 1.00 1.96 C ATOM 465 OD1 ASP A 29 15.898 -19.215 10.235 1.00 2.16 O ATOM 466 OD2 ASP A 29 16.051 -20.378 8.386 1.00 2.43 O ATOM 0 H ASP A 29 14.567 -16.204 6.803 1.00 1.25 H new ATOM 0 HA ASP A 29 13.585 -18.749 7.714 1.00 1.33 H new ATOM 0 HB2 ASP A 29 15.999 -18.148 7.193 1.00 1.63 H new ATOM 0 HB3 ASP A 29 16.011 -17.195 8.664 1.00 1.63 H new ATOM 471 N VAL A 30 12.530 -18.212 9.878 1.00 1.40 N ATOM 472 CA VAL A 30 11.813 -17.914 11.112 1.00 1.63 C ATOM 473 C VAL A 30 12.760 -17.864 12.308 1.00 1.66 C ATOM 474 O VAL A 30 12.672 -16.961 13.144 1.00 1.79 O ATOM 475 CB VAL A 30 10.716 -18.966 11.372 1.00 1.89 C ATOM 476 CG1 VAL A 30 9.954 -18.658 12.653 1.00 2.24 C ATOM 477 CG2 VAL A 30 9.764 -19.040 10.189 1.00 1.95 C ATOM 0 H VAL A 30 12.257 -19.092 9.441 1.00 1.40 H new ATOM 0 HA VAL A 30 11.353 -16.933 10.991 1.00 1.63 H new ATOM 0 HB VAL A 30 11.198 -19.936 11.494 1.00 1.89 H new ATOM 0 HG11 VAL A 30 9.187 -19.416 12.811 1.00 2.24 H new ATOM 0 HG12 VAL A 30 10.645 -18.659 13.496 1.00 2.24 H new ATOM 0 HG13 VAL A 30 9.484 -17.678 12.570 1.00 2.24 H new ATOM 0 HG21 VAL A 30 8.995 -19.787 10.387 1.00 1.95 H new ATOM 0 HG22 VAL A 30 9.295 -18.068 10.038 1.00 1.95 H new ATOM 0 HG23 VAL A 30 10.318 -19.319 9.293 1.00 1.95 H new ATOM 487 N GLU A 31 13.655 -18.842 12.386 1.00 1.67 N ATOM 488 CA GLU A 31 14.612 -18.928 13.481 1.00 1.83 C ATOM 489 C GLU A 31 15.537 -17.713 13.493 1.00 1.78 C ATOM 490 O GLU A 31 15.693 -17.052 14.519 1.00 1.99 O ATOM 491 CB GLU A 31 15.439 -20.212 13.350 1.00 2.07 C ATOM 492 CG GLU A 31 16.402 -20.450 14.499 1.00 2.55 C ATOM 493 CD GLU A 31 15.687 -20.716 15.805 1.00 2.93 C ATOM 494 OE1 GLU A 31 15.384 -21.889 16.096 1.00 3.42 O ATOM 495 OE2 GLU A 31 15.416 -19.754 16.547 1.00 3.27 O ATOM 0 H GLU A 31 13.737 -19.591 11.698 1.00 1.67 H new ATOM 0 HA GLU A 31 14.059 -18.947 14.420 1.00 1.83 H new ATOM 0 HB2 GLU A 31 14.761 -21.062 13.277 1.00 2.07 H new ATOM 0 HB3 GLU A 31 16.004 -20.174 12.419 1.00 2.07 H new ATOM 0 HG2 GLU A 31 17.045 -21.297 14.261 1.00 2.55 H new ATOM 0 HG3 GLU A 31 17.049 -19.581 14.613 1.00 2.55 H new ATOM 502 N GLU A 32 16.124 -17.415 12.343 1.00 1.61 N ATOM 503 CA GLU A 32 17.075 -16.314 12.232 1.00 1.65 C ATOM 504 C GLU A 32 16.387 -14.957 12.342 1.00 1.75 C ATOM 505 O GLU A 32 16.870 -14.062 13.036 1.00 2.00 O ATOM 506 CB GLU A 32 17.850 -16.401 10.915 1.00 1.54 C ATOM 507 CG GLU A 32 18.801 -17.583 10.851 1.00 1.79 C ATOM 508 CD GLU A 32 19.823 -17.557 11.967 1.00 2.33 C ATOM 509 OE1 GLU A 32 20.717 -16.687 11.941 1.00 3.01 O ATOM 510 OE2 GLU A 32 19.740 -18.412 12.874 1.00 2.57 O ATOM 0 H GLU A 32 15.960 -17.920 11.472 1.00 1.61 H new ATOM 0 HA GLU A 32 17.772 -16.405 13.065 1.00 1.65 H new ATOM 0 HB2 GLU A 32 17.142 -16.469 10.089 1.00 1.54 H new ATOM 0 HB3 GLU A 32 18.416 -15.481 10.774 1.00 1.54 H new ATOM 0 HG2 GLU A 32 18.230 -18.510 10.906 1.00 1.79 H new ATOM 0 HG3 GLU A 32 19.315 -17.582 9.890 1.00 1.79 H new ATOM 517 N ASN A 33 15.262 -14.806 11.659 1.00 1.77 N ATOM 518 CA ASN A 33 14.555 -13.530 11.637 1.00 2.01 C ATOM 519 C ASN A 33 13.203 -13.651 12.323 1.00 1.89 C ATOM 520 O ASN A 33 12.226 -14.094 11.714 1.00 2.13 O ATOM 521 CB ASN A 33 14.357 -13.038 10.197 1.00 2.35 C ATOM 522 CG ASN A 33 15.663 -12.771 9.465 1.00 3.05 C ATOM 523 OD1 ASN A 33 15.748 -12.933 8.247 1.00 3.61 O ATOM 524 ND2 ASN A 33 16.683 -12.348 10.196 1.00 3.58 N ATOM 0 H ASN A 33 14.819 -15.546 11.114 1.00 1.77 H new ATOM 0 HA ASN A 33 15.165 -12.806 12.177 1.00 2.01 H new ATOM 0 HB2 ASN A 33 13.784 -13.781 9.643 1.00 2.35 H new ATOM 0 HB3 ASN A 33 13.764 -12.124 10.212 1.00 2.35 H new ATOM 0 HD21 ASN A 33 17.579 -12.144 9.752 1.00 3.58 H new ATOM 0 HD22 ASN A 33 16.573 -12.226 11.203 1.00 3.58 H new ATOM 531 N ARG A 34 13.140 -13.270 13.592 1.00 1.88 N ATOM 532 CA ARG A 34 11.888 -13.321 14.332 1.00 1.96 C ATOM 533 C ARG A 34 11.142 -12.000 14.207 1.00 1.98 C ATOM 534 O ARG A 34 11.481 -11.012 14.861 1.00 2.34 O ATOM 535 CB ARG A 34 12.131 -13.668 15.806 1.00 2.42 C ATOM 536 CG ARG A 34 10.851 -13.738 16.629 1.00 2.86 C ATOM 537 CD ARG A 34 11.083 -14.382 17.985 1.00 3.54 C ATOM 538 NE ARG A 34 11.518 -15.771 17.854 1.00 3.97 N ATOM 539 CZ ARG A 34 11.312 -16.710 18.774 1.00 4.63 C ATOM 540 NH1 ARG A 34 10.671 -16.417 19.901 1.00 4.92 N ATOM 541 NH2 ARG A 34 11.735 -17.948 18.559 1.00 5.33 N ATOM 0 H ARG A 34 13.937 -12.924 14.127 1.00 1.88 H new ATOM 0 HA ARG A 34 11.272 -14.110 13.900 1.00 1.96 H new ATOM 0 HB2 ARG A 34 12.646 -14.627 15.866 1.00 2.42 H new ATOM 0 HB3 ARG A 34 12.795 -12.922 16.243 1.00 2.42 H new ATOM 0 HG2 ARG A 34 10.454 -12.733 16.768 1.00 2.86 H new ATOM 0 HG3 ARG A 34 10.098 -14.305 16.082 1.00 2.86 H new ATOM 0 HD2 ARG A 34 11.835 -13.815 18.534 1.00 3.54 H new ATOM 0 HD3 ARG A 34 10.164 -14.342 18.570 1.00 3.54 H new ATOM 0 HE ARG A 34 12.011 -16.038 17.002 1.00 3.97 H new ATOM 0 HH11 ARG A 34 10.334 -15.468 20.064 1.00 4.92 H new ATOM 0 HH12 ARG A 34 10.516 -17.141 20.603 1.00 4.92 H new ATOM 0 HH21 ARG A 34 12.217 -18.179 17.690 1.00 5.33 H new ATOM 0 HH22 ARG A 34 11.578 -18.670 19.262 1.00 5.33 H new ATOM 555 N THR A 35 10.138 -11.983 13.343 1.00 1.80 N ATOM 556 CA THR A 35 9.336 -10.794 13.126 1.00 1.96 C ATOM 557 C THR A 35 7.990 -10.915 13.836 1.00 1.86 C ATOM 558 O THR A 35 7.073 -11.574 13.342 1.00 2.02 O ATOM 559 CB THR A 35 9.107 -10.562 11.618 1.00 2.32 C ATOM 560 OG1 THR A 35 8.612 -11.761 11.006 1.00 2.88 O ATOM 561 CG2 THR A 35 10.398 -10.138 10.932 1.00 2.78 C ATOM 0 H THR A 35 9.860 -12.786 12.779 1.00 1.80 H new ATOM 0 HA THR A 35 9.878 -9.943 13.538 1.00 1.96 H new ATOM 0 HB THR A 35 8.373 -9.764 11.505 1.00 2.32 H new ATOM 0 HG1 THR A 35 7.908 -12.148 11.567 1.00 2.88 H new ATOM 0 HG21 THR A 35 10.211 -9.981 9.870 1.00 2.78 H new ATOM 0 HG22 THR A 35 10.760 -9.212 11.378 1.00 2.78 H new ATOM 0 HG23 THR A 35 11.149 -10.918 11.056 1.00 2.78 H new ATOM 569 N GLU A 36 7.884 -10.304 15.007 1.00 1.87 N ATOM 570 CA GLU A 36 6.650 -10.349 15.775 1.00 1.94 C ATOM 571 C GLU A 36 5.901 -9.028 15.650 1.00 1.78 C ATOM 572 O GLU A 36 6.294 -8.018 16.238 1.00 1.92 O ATOM 573 CB GLU A 36 6.926 -10.656 17.249 1.00 2.27 C ATOM 574 CG GLU A 36 5.668 -10.672 18.104 1.00 2.71 C ATOM 575 CD GLU A 36 5.952 -10.945 19.564 1.00 3.32 C ATOM 576 OE1 GLU A 36 6.393 -10.019 20.275 1.00 3.86 O ATOM 577 OE2 GLU A 36 5.729 -12.086 20.014 1.00 3.69 O ATOM 0 H GLU A 36 8.636 -9.772 15.445 1.00 1.87 H new ATOM 0 HA GLU A 36 6.032 -11.150 15.370 1.00 1.94 H new ATOM 0 HB2 GLU A 36 7.421 -11.624 17.325 1.00 2.27 H new ATOM 0 HB3 GLU A 36 7.617 -9.912 17.645 1.00 2.27 H new ATOM 0 HG2 GLU A 36 5.160 -9.712 18.011 1.00 2.71 H new ATOM 0 HG3 GLU A 36 4.986 -11.432 17.723 1.00 2.71 H new ATOM 584 N ALA A 37 4.837 -9.040 14.865 1.00 1.73 N ATOM 585 CA ALA A 37 4.009 -7.863 14.685 1.00 1.70 C ATOM 586 C ALA A 37 3.117 -7.647 15.902 1.00 1.55 C ATOM 587 O ALA A 37 2.521 -8.595 16.420 1.00 1.78 O ATOM 588 CB ALA A 37 3.171 -7.999 13.425 1.00 2.06 C ATOM 0 H ALA A 37 4.526 -9.858 14.340 1.00 1.73 H new ATOM 0 HA ALA A 37 4.657 -6.993 14.578 1.00 1.70 H new ATOM 0 HB1 ALA A 37 2.554 -7.109 13.301 1.00 2.06 H new ATOM 0 HB2 ALA A 37 3.827 -8.109 12.562 1.00 2.06 H new ATOM 0 HB3 ALA A 37 2.530 -8.877 13.507 1.00 2.06 H new ATOM 594 N PRO A 38 3.024 -6.403 16.386 1.00 1.53 N ATOM 595 CA PRO A 38 2.184 -6.060 17.527 1.00 1.68 C ATOM 596 C PRO A 38 0.726 -5.921 17.114 1.00 1.55 C ATOM 597 O PRO A 38 0.410 -5.931 15.925 1.00 1.51 O ATOM 598 CB PRO A 38 2.740 -4.706 18.003 1.00 2.02 C ATOM 599 CG PRO A 38 3.884 -4.375 17.092 1.00 2.11 C ATOM 600 CD PRO A 38 3.718 -5.222 15.863 1.00 1.77 C ATOM 0 HA PRO A 38 2.206 -6.826 18.302 1.00 1.68 H new ATOM 0 HB2 PRO A 38 1.972 -3.934 17.959 1.00 2.02 H new ATOM 0 HB3 PRO A 38 3.073 -4.765 19.039 1.00 2.02 H new ATOM 0 HG2 PRO A 38 3.880 -3.316 16.835 1.00 2.11 H new ATOM 0 HG3 PRO A 38 4.838 -4.581 17.578 1.00 2.11 H new ATOM 0 HD2 PRO A 38 3.134 -4.714 15.096 1.00 1.77 H new ATOM 0 HD3 PRO A 38 4.677 -5.480 15.415 1.00 1.77 H new ATOM 608 N GLU A 39 -0.159 -5.800 18.089 1.00 1.87 N ATOM 609 CA GLU A 39 -1.572 -5.596 17.805 1.00 1.91 C ATOM 610 C GLU A 39 -1.783 -4.188 17.267 1.00 1.53 C ATOM 611 O GLU A 39 -1.763 -3.214 18.022 1.00 1.78 O ATOM 612 CB GLU A 39 -2.417 -5.821 19.060 1.00 2.57 C ATOM 613 CG GLU A 39 -2.245 -7.202 19.669 1.00 3.24 C ATOM 614 CD GLU A 39 -3.214 -7.459 20.801 1.00 3.67 C ATOM 615 OE1 GLU A 39 -2.974 -6.969 21.925 1.00 4.19 O ATOM 616 OE2 GLU A 39 -4.225 -8.154 20.573 1.00 3.88 O ATOM 0 H GLU A 39 0.073 -5.839 19.081 1.00 1.87 H new ATOM 0 HA GLU A 39 -1.889 -6.320 17.054 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -2.154 -5.069 19.804 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -3.468 -5.671 18.812 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -2.386 -7.957 18.896 1.00 3.24 H new ATOM 0 HG3 GLU A 39 -1.225 -7.309 20.037 1.00 3.24 H new ATOM 623 N GLY A 40 -1.955 -4.080 15.957 1.00 1.33 N ATOM 624 CA GLY A 40 -2.058 -2.783 15.336 1.00 1.39 C ATOM 625 C GLY A 40 -3.410 -2.538 14.704 1.00 1.23 C ATOM 626 O GLY A 40 -3.726 -3.103 13.653 1.00 1.20 O ATOM 0 H GLY A 40 -2.025 -4.870 15.316 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -1.867 -2.012 16.083 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -1.284 -2.688 14.574 1.00 1.39 H new ATOM 630 N THR A 41 -4.214 -1.709 15.350 1.00 1.33 N ATOM 631 CA THR A 41 -5.474 -1.266 14.780 1.00 1.34 C ATOM 632 C THR A 41 -5.199 -0.398 13.553 1.00 1.09 C ATOM 633 O THR A 41 -5.705 -0.663 12.458 1.00 1.05 O ATOM 634 CB THR A 41 -6.285 -0.460 15.814 1.00 1.62 C ATOM 635 OG1 THR A 41 -6.361 -1.190 17.048 1.00 1.89 O ATOM 636 CG2 THR A 41 -7.688 -0.175 15.300 1.00 1.79 C ATOM 0 H THR A 41 -4.014 -1.328 16.275 1.00 1.33 H new ATOM 0 HA THR A 41 -6.055 -2.141 14.490 1.00 1.34 H new ATOM 0 HB THR A 41 -5.779 0.491 15.982 1.00 1.62 H new ATOM 0 HG1 THR A 41 -6.876 -0.673 17.703 1.00 1.89 H new ATOM 0 HG21 THR A 41 -8.241 0.395 16.047 1.00 1.79 H new ATOM 0 HG22 THR A 41 -7.627 0.401 14.377 1.00 1.79 H new ATOM 0 HG23 THR A 41 -8.203 -1.116 15.107 1.00 1.79 H new ATOM 644 N GLU A 42 -4.381 0.632 13.749 1.00 1.02 N ATOM 645 CA GLU A 42 -3.963 1.517 12.672 1.00 0.87 C ATOM 646 C GLU A 42 -3.304 0.729 11.548 1.00 0.73 C ATOM 647 O GLU A 42 -3.527 1.016 10.372 1.00 0.63 O ATOM 648 CB GLU A 42 -2.999 2.580 13.209 1.00 1.05 C ATOM 649 CG GLU A 42 -2.491 3.543 12.152 1.00 1.53 C ATOM 650 CD GLU A 42 -1.729 4.700 12.756 1.00 2.12 C ATOM 651 OE1 GLU A 42 -0.531 4.539 13.062 1.00 2.82 O ATOM 652 OE2 GLU A 42 -2.334 5.774 12.948 1.00 2.42 O ATOM 0 H GLU A 42 -3.991 0.875 14.660 1.00 1.02 H new ATOM 0 HA GLU A 42 -4.848 2.010 12.270 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -3.501 3.148 13.992 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -2.147 2.082 13.672 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -1.845 3.008 11.455 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -3.333 3.926 11.576 1.00 1.53 H new ATOM 659 N SER A 43 -2.519 -0.279 11.921 1.00 0.79 N ATOM 660 CA SER A 43 -1.824 -1.125 10.953 1.00 0.75 C ATOM 661 C SER A 43 -2.789 -1.685 9.912 1.00 0.67 C ATOM 662 O SER A 43 -2.467 -1.738 8.727 1.00 0.62 O ATOM 663 CB SER A 43 -1.115 -2.279 11.667 1.00 0.94 C ATOM 664 OG SER A 43 -0.326 -1.809 12.747 1.00 1.14 O ATOM 0 H SER A 43 -2.347 -0.531 12.894 1.00 0.79 H new ATOM 0 HA SER A 43 -1.087 -0.505 10.442 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.854 -2.990 12.036 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.483 -2.815 10.958 1.00 0.94 H new ATOM 0 HG SER A 43 0.449 -2.397 12.866 1.00 1.14 H new ATOM 670 N GLU A 44 -3.977 -2.079 10.352 1.00 0.72 N ATOM 671 CA GLU A 44 -4.960 -2.670 9.452 1.00 0.73 C ATOM 672 C GLU A 44 -5.755 -1.602 8.708 1.00 0.61 C ATOM 673 O GLU A 44 -6.364 -1.878 7.673 1.00 0.66 O ATOM 674 CB GLU A 44 -5.903 -3.597 10.217 1.00 0.85 C ATOM 675 CG GLU A 44 -5.250 -4.903 10.637 1.00 1.32 C ATOM 676 CD GLU A 44 -4.749 -5.701 9.450 1.00 1.96 C ATOM 677 OE1 GLU A 44 -5.557 -6.416 8.818 1.00 1.90 O ATOM 678 OE2 GLU A 44 -3.542 -5.618 9.139 1.00 2.98 O ATOM 0 H GLU A 44 -4.283 -2.001 11.322 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.415 -3.256 8.712 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.269 -3.080 11.104 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.771 -3.816 9.594 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.417 -4.691 11.308 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -5.967 -5.502 11.198 1.00 1.32 H new ATOM 685 N ALA A 45 -5.739 -0.383 9.225 1.00 0.53 N ATOM 686 CA ALA A 45 -6.444 0.715 8.587 1.00 0.45 C ATOM 687 C ALA A 45 -5.686 1.168 7.352 1.00 0.39 C ATOM 688 O ALA A 45 -6.241 1.230 6.257 1.00 0.39 O ATOM 689 CB ALA A 45 -6.623 1.872 9.557 1.00 0.48 C ATOM 0 H ALA A 45 -5.247 -0.131 10.082 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.433 0.369 8.286 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.153 2.685 9.060 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.198 1.537 10.420 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.646 2.225 9.887 1.00 0.48 H new ATOM 695 N VAL A 46 -4.407 1.461 7.531 1.00 0.36 N ATOM 696 CA VAL A 46 -3.558 1.860 6.422 1.00 0.32 C ATOM 697 C VAL A 46 -3.302 0.679 5.491 1.00 0.34 C ATOM 698 O VAL A 46 -3.147 0.849 4.283 1.00 0.35 O ATOM 699 CB VAL A 46 -2.229 2.471 6.911 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.692 1.715 8.107 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.207 2.491 5.793 1.00 0.34 C ATOM 0 H VAL A 46 -3.935 1.430 8.435 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.086 2.634 5.864 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.424 3.498 7.219 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.754 2.166 8.432 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.417 1.759 8.920 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.518 0.675 7.832 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.277 2.926 6.158 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.022 1.473 5.451 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.586 3.089 4.964 1.00 0.34 H new ATOM 711 N LYS A 47 -3.281 -0.517 6.059 1.00 0.41 N ATOM 712 CA LYS A 47 -3.200 -1.737 5.263 1.00 0.50 C ATOM 713 C LYS A 47 -4.333 -1.755 4.243 1.00 0.51 C ATOM 714 O LYS A 47 -4.131 -2.058 3.068 1.00 0.59 O ATOM 715 CB LYS A 47 -3.317 -2.969 6.161 1.00 0.63 C ATOM 716 CG LYS A 47 -2.988 -4.274 5.460 1.00 0.84 C ATOM 717 CD LYS A 47 -1.487 -4.470 5.334 1.00 1.45 C ATOM 718 CE LYS A 47 -0.829 -4.563 6.703 1.00 1.93 C ATOM 719 NZ LYS A 47 -1.398 -5.672 7.515 1.00 2.14 N ATOM 0 H LYS A 47 -3.319 -0.671 7.067 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.237 -1.758 4.753 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.651 -2.849 7.015 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -4.332 -3.025 6.554 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.420 -5.106 6.015 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -3.442 -4.282 4.469 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.282 -5.378 4.766 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -1.055 -3.640 4.775 1.00 1.45 H new ATOM 0 HE2 LYS A 47 0.243 -4.715 6.581 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -0.959 -3.620 7.234 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -0.746 -5.904 8.292 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.315 -5.379 7.908 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -1.531 -6.510 6.913 1.00 2.14 H new ATOM 733 N GLN A 48 -5.523 -1.399 4.712 1.00 0.47 N ATOM 734 CA GLN A 48 -6.702 -1.344 3.863 1.00 0.52 C ATOM 735 C GLN A 48 -6.606 -0.152 2.921 1.00 0.48 C ATOM 736 O GLN A 48 -7.011 -0.226 1.758 1.00 0.54 O ATOM 737 CB GLN A 48 -7.964 -1.240 4.725 1.00 0.55 C ATOM 738 CG GLN A 48 -9.263 -1.218 3.931 1.00 0.85 C ATOM 739 CD GLN A 48 -9.544 -2.522 3.201 1.00 1.50 C ATOM 740 OE1 GLN A 48 -8.631 -3.241 2.788 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.816 -2.840 3.039 1.00 2.02 N ATOM 0 H GLN A 48 -5.695 -1.143 5.684 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.758 -2.257 3.270 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.988 -2.082 5.416 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.905 -0.334 5.328 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -10.090 -1.003 4.607 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.224 -0.405 3.206 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -11.545 -2.222 3.394 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -11.069 -3.704 2.559 1.00 2.02 H new ATOM 750 N ALA A 49 -6.054 0.940 3.435 1.00 0.42 N ATOM 751 CA ALA A 49 -5.836 2.137 2.649 1.00 0.40 C ATOM 752 C ALA A 49 -4.975 1.831 1.432 1.00 0.39 C ATOM 753 O ALA A 49 -5.359 2.132 0.308 1.00 0.42 O ATOM 754 CB ALA A 49 -5.184 3.208 3.504 1.00 0.36 C ATOM 0 H ALA A 49 -5.748 1.016 4.405 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.801 2.504 2.299 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.024 4.104 2.905 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.833 3.446 4.347 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.226 2.844 3.875 1.00 0.36 H new ATOM 760 N LEU A 50 -3.824 1.207 1.665 1.00 0.38 N ATOM 761 CA LEU A 50 -2.913 0.844 0.580 1.00 0.39 C ATOM 762 C LEU A 50 -3.519 -0.237 -0.307 1.00 0.46 C ATOM 763 O LEU A 50 -3.271 -0.270 -1.512 1.00 0.49 O ATOM 764 CB LEU A 50 -1.559 0.367 1.123 1.00 0.39 C ATOM 765 CG LEU A 50 -0.503 1.460 1.324 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.216 2.176 0.013 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.943 2.451 2.388 1.00 0.29 C ATOM 0 H LEU A 50 -3.499 0.942 2.595 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.752 1.742 -0.017 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.726 -0.132 2.078 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.157 -0.380 0.439 1.00 0.39 H new ATOM 0 HG LEU A 50 0.416 0.983 1.664 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.536 2.948 0.177 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.154 1.459 -0.720 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.132 2.635 -0.359 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.177 3.216 2.512 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.879 2.920 2.084 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.090 1.929 3.333 1.00 0.29 H new ATOM 779 N ARG A 51 -4.318 -1.110 0.293 1.00 0.52 N ATOM 780 CA ARG A 51 -4.981 -2.176 -0.448 1.00 0.61 C ATOM 781 C ARG A 51 -5.893 -1.590 -1.519 1.00 0.62 C ATOM 782 O ARG A 51 -5.818 -1.971 -2.689 1.00 0.69 O ATOM 783 CB ARG A 51 -5.783 -3.064 0.509 1.00 0.67 C ATOM 784 CG ARG A 51 -6.530 -4.203 -0.169 1.00 0.98 C ATOM 785 CD ARG A 51 -5.587 -5.145 -0.898 1.00 1.49 C ATOM 786 NE ARG A 51 -6.294 -6.303 -1.445 1.00 2.00 N ATOM 787 CZ ARG A 51 -6.044 -6.839 -2.639 1.00 2.89 C ATOM 788 NH1 ARG A 51 -5.128 -6.303 -3.434 1.00 3.39 N ATOM 789 NH2 ARG A 51 -6.719 -7.911 -3.035 1.00 3.74 N ATOM 0 H ARG A 51 -4.523 -1.101 1.292 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.222 -2.786 -0.937 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -5.104 -3.482 1.252 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.501 -2.444 1.046 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -7.095 -4.761 0.577 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -7.252 -3.794 -0.876 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -5.089 -4.608 -1.705 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -4.810 -5.484 -0.213 1.00 1.49 H new ATOM 0 HE ARG A 51 -7.026 -6.728 -0.875 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -4.611 -5.477 -3.132 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -4.940 -6.717 -4.347 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -7.427 -8.322 -2.426 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -6.530 -8.324 -3.948 1.00 3.74 H new ATOM 803 N GLU A 52 -6.732 -0.644 -1.123 1.00 0.59 N ATOM 804 CA GLU A 52 -7.657 -0.017 -2.055 1.00 0.62 C ATOM 805 C GLU A 52 -6.955 1.055 -2.881 1.00 0.59 C ATOM 806 O GLU A 52 -7.373 1.368 -3.997 1.00 0.65 O ATOM 807 CB GLU A 52 -8.851 0.575 -1.309 1.00 0.66 C ATOM 808 CG GLU A 52 -9.688 -0.469 -0.589 1.00 0.92 C ATOM 809 CD GLU A 52 -10.135 -1.588 -1.508 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.141 -1.410 -2.228 1.00 1.45 O ATOM 811 OE2 GLU A 52 -9.480 -2.654 -1.518 1.00 1.88 O ATOM 0 H GLU A 52 -6.791 -0.295 -0.166 1.00 0.59 H new ATOM 0 HA GLU A 52 -8.022 -0.784 -2.738 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.492 1.306 -0.584 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.483 1.112 -2.017 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -9.110 -0.888 0.235 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -10.564 0.010 -0.152 1.00 0.92 H new ATOM 818 N ALA A 53 -5.886 1.616 -2.332 1.00 0.52 N ATOM 819 CA ALA A 53 -5.077 2.584 -3.057 1.00 0.49 C ATOM 820 C ALA A 53 -4.404 1.923 -4.245 1.00 0.52 C ATOM 821 O ALA A 53 -4.465 2.428 -5.364 1.00 0.53 O ATOM 822 CB ALA A 53 -4.042 3.200 -2.137 1.00 0.43 C ATOM 0 H ALA A 53 -5.559 1.417 -1.386 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.728 3.377 -3.425 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.444 3.922 -2.693 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.544 3.704 -1.311 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.393 2.418 -1.744 1.00 0.43 H new ATOM 828 N GLY A 54 -3.773 0.780 -3.993 1.00 0.57 N ATOM 829 CA GLY A 54 -3.135 0.029 -5.056 1.00 0.64 C ATOM 830 C GLY A 54 -4.137 -0.447 -6.084 1.00 0.74 C ATOM 831 O GLY A 54 -3.793 -0.681 -7.239 1.00 0.82 O ATOM 0 H GLY A 54 -3.693 0.360 -3.067 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -2.384 0.652 -5.541 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.613 -0.829 -4.633 1.00 0.64 H new ATOM 835 N ASP A 55 -5.386 -0.568 -5.658 1.00 0.79 N ATOM 836 CA ASP A 55 -6.458 -1.009 -6.538 1.00 0.92 C ATOM 837 C ASP A 55 -6.817 0.092 -7.529 1.00 0.88 C ATOM 838 O ASP A 55 -7.008 -0.163 -8.718 1.00 0.97 O ATOM 839 CB ASP A 55 -7.690 -1.405 -5.717 1.00 1.04 C ATOM 840 CG ASP A 55 -8.860 -1.819 -6.585 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.814 -2.923 -7.165 1.00 1.34 O ATOM 842 OD2 ASP A 55 -9.829 -1.036 -6.696 1.00 1.29 O ATOM 0 H ASP A 55 -5.683 -0.366 -4.703 1.00 0.79 H new ATOM 0 HA ASP A 55 -6.114 -1.880 -7.095 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -7.429 -2.226 -5.050 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.988 -0.566 -5.088 1.00 1.04 H new ATOM 847 N GLU A 56 -6.891 1.322 -7.030 1.00 0.79 N ATOM 848 CA GLU A 56 -7.245 2.465 -7.862 1.00 0.83 C ATOM 849 C GLU A 56 -6.039 2.967 -8.660 1.00 0.78 C ATOM 850 O GLU A 56 -6.139 3.196 -9.866 1.00 0.85 O ATOM 851 CB GLU A 56 -7.820 3.595 -6.995 1.00 0.83 C ATOM 852 CG GLU A 56 -8.261 4.818 -7.788 1.00 0.94 C ATOM 853 CD GLU A 56 -8.840 5.909 -6.910 1.00 1.27 C ATOM 854 OE1 GLU A 56 -10.018 5.792 -6.506 1.00 1.38 O ATOM 855 OE2 GLU A 56 -8.117 6.886 -6.614 1.00 2.06 O ATOM 0 H GLU A 56 -6.710 1.552 -6.053 1.00 0.79 H new ATOM 0 HA GLU A 56 -8.005 2.141 -8.573 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -8.672 3.211 -6.434 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -7.069 3.898 -6.266 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.408 5.215 -8.339 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -9.005 4.518 -8.526 1.00 0.94 H new ATOM 862 N PHE A 57 -4.895 3.110 -7.994 1.00 0.72 N ATOM 863 CA PHE A 57 -3.712 3.704 -8.615 1.00 0.76 C ATOM 864 C PHE A 57 -3.213 2.844 -9.776 1.00 0.82 C ATOM 865 O PHE A 57 -2.906 3.360 -10.852 1.00 0.90 O ATOM 866 CB PHE A 57 -2.594 3.898 -7.580 1.00 0.77 C ATOM 867 CG PHE A 57 -1.434 4.722 -8.079 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.386 4.121 -8.760 1.00 1.05 C ATOM 869 CD2 PHE A 57 -1.388 6.093 -7.867 1.00 1.07 C ATOM 870 CE1 PHE A 57 0.683 4.868 -9.219 1.00 1.25 C ATOM 871 CE2 PHE A 57 -0.321 6.844 -8.323 1.00 1.26 C ATOM 872 CZ PHE A 57 0.698 6.255 -9.001 1.00 1.34 C ATOM 0 H PHE A 57 -4.762 2.823 -7.024 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.996 4.680 -9.008 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -3.012 4.376 -6.694 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -2.225 2.920 -7.271 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.405 3.055 -8.934 1.00 1.05 H new ATOM 0 HD2 PHE A 57 -2.196 6.579 -7.339 1.00 1.07 H new ATOM 0 HE1 PHE A 57 1.499 4.389 -9.740 1.00 1.25 H new ATOM 0 HE2 PHE A 57 -0.297 7.908 -8.139 1.00 1.26 H new ATOM 0 HZ PHE A 57 1.518 6.852 -9.372 1.00 1.34 H new ATOM 882 N GLU A 58 -3.174 1.531 -9.567 1.00 0.83 N ATOM 883 CA GLU A 58 -2.655 0.609 -10.577 1.00 0.95 C ATOM 884 C GLU A 58 -3.635 0.492 -11.742 1.00 0.99 C ATOM 885 O GLU A 58 -3.282 0.048 -12.830 1.00 1.08 O ATOM 886 CB GLU A 58 -2.407 -0.772 -9.953 1.00 1.05 C ATOM 887 CG GLU A 58 -1.747 -1.778 -10.888 1.00 1.35 C ATOM 888 CD GLU A 58 -1.594 -3.142 -10.250 1.00 1.27 C ATOM 889 OE1 GLU A 58 -0.779 -3.278 -9.319 1.00 1.45 O ATOM 890 OE2 GLU A 58 -2.300 -4.083 -10.667 1.00 1.61 O ATOM 0 H GLU A 58 -3.494 1.081 -8.710 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.710 1.000 -10.955 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.780 -0.650 -9.070 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.359 -1.180 -9.614 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.341 -1.869 -11.797 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -0.766 -1.406 -11.184 1.00 1.35 H new ATOM 897 N LEU A 59 -4.871 0.895 -11.505 1.00 0.98 N ATOM 898 CA LEU A 59 -5.891 0.858 -12.536 1.00 1.10 C ATOM 899 C LEU A 59 -5.851 2.131 -13.373 1.00 1.10 C ATOM 900 O LEU A 59 -6.337 2.167 -14.506 1.00 1.24 O ATOM 901 CB LEU A 59 -7.270 0.693 -11.896 1.00 1.19 C ATOM 902 CG LEU A 59 -8.420 0.445 -12.870 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.197 -0.851 -13.631 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.742 0.408 -12.124 1.00 1.56 C ATOM 0 H LEU A 59 -5.192 1.252 -10.605 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.696 0.008 -13.190 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.228 -0.138 -11.192 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.493 1.590 -11.318 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.453 1.263 -13.589 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.025 -1.015 -14.321 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.264 -0.788 -14.191 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.142 -1.681 -12.927 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.553 0.231 -12.830 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.721 -0.394 -11.386 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.902 1.361 -11.620 1.00 1.56 H new ATOM 916 N ARG A 60 -5.269 3.181 -12.811 1.00 1.00 N ATOM 917 CA ARG A 60 -5.218 4.472 -13.486 1.00 1.06 C ATOM 918 C ARG A 60 -3.855 4.718 -14.123 1.00 1.00 C ATOM 919 O ARG A 60 -3.770 5.199 -15.252 1.00 1.07 O ATOM 920 CB ARG A 60 -5.570 5.616 -12.522 1.00 1.10 C ATOM 921 CG ARG A 60 -7.034 5.641 -12.062 1.00 1.19 C ATOM 922 CD ARG A 60 -8.022 5.762 -13.225 1.00 1.31 C ATOM 923 NE ARG A 60 -8.043 4.566 -14.067 1.00 1.81 N ATOM 924 CZ ARG A 60 -8.856 4.392 -15.107 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.755 5.313 -15.420 1.00 2.15 N ATOM 926 NH2 ARG A 60 -8.771 3.283 -15.827 1.00 3.21 N ATOM 0 H ARG A 60 -4.826 3.166 -11.892 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.963 4.448 -14.281 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.929 5.543 -11.644 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.340 6.565 -13.007 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.249 4.731 -11.502 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.181 6.478 -11.379 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -9.022 5.943 -12.831 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.758 6.627 -13.834 1.00 1.31 H new ATOM 0 HE ARG A 60 -7.391 3.815 -13.842 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.829 6.164 -14.863 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.374 5.171 -16.218 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -8.085 2.568 -15.583 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -9.391 3.144 -16.625 1.00 3.21 H new ATOM 940 N TYR A 61 -2.790 4.386 -13.403 1.00 0.91 N ATOM 941 CA TYR A 61 -1.438 4.627 -13.891 1.00 0.90 C ATOM 942 C TYR A 61 -0.629 3.335 -13.875 1.00 0.84 C ATOM 943 O TYR A 61 0.412 3.245 -13.223 1.00 0.83 O ATOM 944 CB TYR A 61 -0.737 5.698 -13.045 1.00 0.96 C ATOM 945 CG TYR A 61 -1.495 7.008 -12.958 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.798 7.732 -14.106 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.903 7.526 -11.731 1.00 1.04 C ATOM 948 CE1 TYR A 61 -2.485 8.931 -14.034 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.591 8.722 -11.654 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.896 9.407 -12.790 1.00 1.27 C ATOM 951 OH TYR A 61 -3.558 10.612 -12.734 1.00 1.41 O ATOM 0 H TYR A 61 -2.836 3.950 -12.482 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.507 4.987 -14.917 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.586 5.310 -12.038 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.251 5.889 -13.464 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -1.492 7.352 -15.070 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.678 6.984 -10.825 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -2.700 9.492 -14.932 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -2.887 9.113 -10.692 1.00 1.14 H new ATOM 0 HH TYR A 61 -3.785 10.818 -11.803 1.00 1.41 H new ATOM 961 N ARG A 62 -1.108 2.333 -14.598 1.00 0.86 N ATOM 962 CA ARG A 62 -0.431 1.043 -14.645 1.00 0.85 C ATOM 963 C ARG A 62 0.789 1.120 -15.555 1.00 0.87 C ATOM 964 O ARG A 62 1.759 0.380 -15.378 1.00 0.85 O ATOM 965 CB ARG A 62 -1.392 -0.051 -15.120 1.00 0.95 C ATOM 966 CG ARG A 62 -0.850 -1.462 -14.949 1.00 1.04 C ATOM 967 CD ARG A 62 -1.928 -2.511 -15.178 1.00 1.23 C ATOM 968 NE ARG A 62 -3.002 -2.421 -14.188 1.00 1.73 N ATOM 969 CZ ARG A 62 -3.814 -3.433 -13.877 1.00 2.16 C ATOM 970 NH1 ARG A 62 -3.661 -4.615 -14.466 1.00 2.24 N ATOM 971 NH2 ARG A 62 -4.771 -3.267 -12.969 1.00 3.02 N ATOM 0 H ARG A 62 -1.959 2.387 -15.158 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.096 0.789 -13.639 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.329 0.037 -14.570 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.624 0.114 -16.172 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.030 -1.624 -15.649 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.440 -1.575 -13.946 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -2.346 -2.389 -16.177 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -1.481 -3.504 -15.138 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.138 -1.532 -13.707 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -2.922 -4.749 -15.156 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -4.282 -5.388 -14.227 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -4.886 -2.364 -12.508 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -5.390 -4.042 -12.733 1.00 3.02 H new ATOM 985 N ARG A 63 0.747 2.037 -16.517 1.00 0.94 N ATOM 986 CA ARG A 63 1.874 2.248 -17.414 1.00 1.01 C ATOM 987 C ARG A 63 3.033 2.880 -16.650 1.00 0.95 C ATOM 988 O ARG A 63 4.200 2.691 -16.992 1.00 0.99 O ATOM 989 CB ARG A 63 1.466 3.129 -18.601 1.00 1.16 C ATOM 990 CG ARG A 63 2.593 3.384 -19.591 1.00 1.70 C ATOM 991 CD ARG A 63 2.110 4.168 -20.798 1.00 2.14 C ATOM 992 NE ARG A 63 3.196 4.461 -21.728 1.00 2.71 N ATOM 993 CZ ARG A 63 3.237 4.033 -22.985 1.00 3.58 C ATOM 994 NH1 ARG A 63 2.278 3.244 -23.458 1.00 3.92 N ATOM 995 NH2 ARG A 63 4.249 4.389 -23.763 1.00 4.52 N ATOM 0 H ARG A 63 -0.054 2.643 -16.694 1.00 0.94 H new ATOM 0 HA ARG A 63 2.195 1.283 -17.806 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.635 2.656 -19.124 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.102 4.085 -18.224 1.00 1.16 H new ATOM 0 HG2 ARG A 63 3.395 3.933 -19.097 1.00 1.70 H new ATOM 0 HG3 ARG A 63 3.013 2.433 -19.918 1.00 1.70 H new ATOM 0 HD2 ARG A 63 1.335 3.601 -21.313 1.00 2.14 H new ATOM 0 HD3 ARG A 63 1.655 5.101 -20.466 1.00 2.14 H new ATOM 0 HE ARG A 63 3.973 5.030 -21.392 1.00 2.71 H new ATOM 0 HH11 ARG A 63 1.505 2.964 -22.855 1.00 3.92 H new ATOM 0 HH12 ARG A 63 2.315 2.919 -24.424 1.00 3.92 H new ATOM 0 HH21 ARG A 63 4.989 4.987 -23.396 1.00 4.52 H new ATOM 0 HH22 ARG A 63 4.288 4.065 -24.729 1.00 4.52 H new ATOM 1009 N ALA A 64 2.700 3.630 -15.607 1.00 0.90 N ATOM 1010 CA ALA A 64 3.711 4.188 -14.727 1.00 0.89 C ATOM 1011 C ALA A 64 4.315 3.082 -13.877 1.00 0.75 C ATOM 1012 O ALA A 64 5.529 3.012 -13.703 1.00 0.73 O ATOM 1013 CB ALA A 64 3.117 5.273 -13.845 1.00 0.94 C ATOM 0 H ALA A 64 1.740 3.864 -15.353 1.00 0.90 H new ATOM 0 HA ALA A 64 4.496 4.640 -15.334 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.892 5.677 -13.194 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.716 6.071 -14.470 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.317 4.850 -13.238 1.00 0.94 H new ATOM 1019 N PHE A 65 3.452 2.205 -13.378 1.00 0.69 N ATOM 1020 CA PHE A 65 3.872 1.090 -12.535 1.00 0.61 C ATOM 1021 C PHE A 65 4.905 0.215 -13.248 1.00 0.59 C ATOM 1022 O PHE A 65 5.991 -0.030 -12.721 1.00 0.59 O ATOM 1023 CB PHE A 65 2.657 0.244 -12.130 1.00 0.62 C ATOM 1024 CG PHE A 65 2.987 -0.877 -11.185 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.172 -0.634 -9.833 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.113 -2.174 -11.651 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.475 -1.665 -8.965 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.416 -3.208 -10.787 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.597 -2.946 -9.434 1.00 0.66 C ATOM 0 H PHE A 65 2.446 2.245 -13.545 1.00 0.69 H new ATOM 0 HA PHE A 65 4.336 1.503 -11.639 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.914 0.892 -11.665 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.200 -0.172 -13.028 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.078 0.373 -9.454 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.973 -2.380 -12.702 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.616 -1.460 -7.914 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.512 -4.217 -11.161 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.833 -3.751 -8.754 1.00 0.66 H new ATOM 1039 N SER A 66 4.571 -0.239 -14.449 1.00 0.64 N ATOM 1040 CA SER A 66 5.446 -1.132 -15.198 1.00 0.68 C ATOM 1041 C SER A 66 6.742 -0.430 -15.610 1.00 0.66 C ATOM 1042 O SER A 66 7.826 -1.020 -15.554 1.00 0.68 O ATOM 1043 CB SER A 66 4.706 -1.680 -16.421 1.00 0.83 C ATOM 1044 OG SER A 66 3.947 -0.663 -17.054 1.00 1.20 O ATOM 0 H SER A 66 3.700 -0.004 -14.926 1.00 0.64 H new ATOM 0 HA SER A 66 5.723 -1.965 -14.551 1.00 0.68 H new ATOM 0 HB2 SER A 66 5.423 -2.097 -17.128 1.00 0.83 H new ATOM 0 HB3 SER A 66 4.048 -2.494 -16.118 1.00 0.83 H new ATOM 0 HG SER A 66 3.485 -1.037 -17.833 1.00 1.20 H new ATOM 1050 N ASP A 67 6.635 0.833 -16.001 1.00 0.68 N ATOM 1051 CA ASP A 67 7.808 1.603 -16.411 1.00 0.73 C ATOM 1052 C ASP A 67 8.744 1.846 -15.230 1.00 0.65 C ATOM 1053 O ASP A 67 9.957 1.643 -15.334 1.00 0.66 O ATOM 1054 CB ASP A 67 7.391 2.940 -17.033 1.00 0.89 C ATOM 1055 CG ASP A 67 8.579 3.758 -17.500 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.098 3.483 -18.602 1.00 1.41 O ATOM 1057 OD2 ASP A 67 9.003 4.680 -16.766 1.00 2.06 O ATOM 0 H ASP A 67 5.755 1.346 -16.044 1.00 0.68 H new ATOM 0 HA ASP A 67 8.342 1.019 -17.161 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.728 2.753 -17.878 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.822 3.515 -16.303 1.00 0.89 H new ATOM 1062 N LEU A 68 8.180 2.258 -14.099 1.00 0.63 N ATOM 1063 CA LEU A 68 8.979 2.592 -12.930 1.00 0.66 C ATOM 1064 C LEU A 68 9.587 1.346 -12.291 1.00 0.57 C ATOM 1065 O LEU A 68 10.726 1.383 -11.828 1.00 0.63 O ATOM 1066 CB LEU A 68 8.145 3.370 -11.906 1.00 0.75 C ATOM 1067 CG LEU A 68 7.660 4.748 -12.373 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.825 5.418 -11.292 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.837 5.631 -12.757 1.00 1.07 C ATOM 0 H LEU A 68 7.174 2.368 -13.969 1.00 0.63 H new ATOM 0 HA LEU A 68 9.799 3.227 -13.264 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.277 2.769 -11.636 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.738 3.499 -11.000 1.00 0.75 H new ATOM 0 HG LEU A 68 7.034 4.606 -13.254 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.491 6.394 -11.643 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.958 4.798 -11.065 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.427 5.543 -10.392 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.470 6.604 -13.085 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.490 5.762 -11.894 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.395 5.161 -13.567 1.00 1.07 H new ATOM 1081 N THR A 69 8.848 0.236 -12.280 1.00 0.49 N ATOM 1082 CA THR A 69 9.372 -1.006 -11.712 1.00 0.49 C ATOM 1083 C THR A 69 10.534 -1.538 -12.540 1.00 0.46 C ATOM 1084 O THR A 69 11.445 -2.162 -12.005 1.00 0.51 O ATOM 1085 CB THR A 69 8.296 -2.102 -11.584 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.554 -2.219 -12.804 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.355 -1.807 -10.429 1.00 0.63 C ATOM 0 H THR A 69 7.900 0.171 -12.651 1.00 0.49 H new ATOM 0 HA THR A 69 9.718 -0.756 -10.709 1.00 0.49 H new ATOM 0 HB THR A 69 8.800 -3.047 -11.384 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.811 -1.580 -12.798 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.605 -2.595 -10.360 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.922 -1.764 -9.499 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.861 -0.850 -10.597 1.00 0.63 H new ATOM 1095 N SER A 70 10.508 -1.278 -13.844 1.00 0.46 N ATOM 1096 CA SER A 70 11.602 -1.680 -14.721 1.00 0.49 C ATOM 1097 C SER A 70 12.890 -0.960 -14.329 1.00 0.48 C ATOM 1098 O SER A 70 13.974 -1.540 -14.361 1.00 0.53 O ATOM 1099 CB SER A 70 11.252 -1.394 -16.185 1.00 0.57 C ATOM 1100 OG SER A 70 10.097 -2.120 -16.582 1.00 1.31 O ATOM 0 H SER A 70 9.744 -0.793 -14.315 1.00 0.46 H new ATOM 0 HA SER A 70 11.757 -2.753 -14.609 1.00 0.49 H new ATOM 0 HB2 SER A 70 11.079 -0.326 -16.320 1.00 0.57 H new ATOM 0 HB3 SER A 70 12.093 -1.664 -16.823 1.00 0.57 H new ATOM 0 HG SER A 70 9.310 -1.761 -16.121 1.00 1.31 H new ATOM 1106 N GLN A 71 12.752 0.296 -13.927 1.00 0.49 N ATOM 1107 CA GLN A 71 13.887 1.102 -13.498 1.00 0.53 C ATOM 1108 C GLN A 71 14.330 0.687 -12.097 1.00 0.46 C ATOM 1109 O GLN A 71 15.512 0.736 -11.756 1.00 0.53 O ATOM 1110 CB GLN A 71 13.500 2.584 -13.514 1.00 0.63 C ATOM 1111 CG GLN A 71 14.594 3.520 -13.030 1.00 0.69 C ATOM 1112 CD GLN A 71 14.122 4.959 -12.908 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.897 5.895 -13.095 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.852 5.151 -12.580 1.00 0.82 N ATOM 0 H GLN A 71 11.856 0.783 -13.889 1.00 0.49 H new ATOM 0 HA GLN A 71 14.718 0.942 -14.185 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.221 2.864 -14.530 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.616 2.724 -12.891 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.957 3.178 -12.061 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.436 3.475 -13.720 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.237 4.351 -12.432 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.490 6.099 -12.475 1.00 0.82 H new ATOM 1123 N LEU A 72 13.368 0.254 -11.297 1.00 0.39 N ATOM 1124 CA LEU A 72 13.626 -0.126 -9.916 1.00 0.33 C ATOM 1125 C LEU A 72 13.888 -1.628 -9.814 1.00 0.34 C ATOM 1126 O LEU A 72 13.895 -2.190 -8.722 1.00 0.37 O ATOM 1127 CB LEU A 72 12.431 0.276 -9.032 1.00 0.37 C ATOM 1128 CG LEU A 72 12.618 0.085 -7.522 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.831 0.853 -7.026 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.370 0.526 -6.777 1.00 0.92 C ATOM 0 H LEU A 72 12.394 0.156 -11.583 1.00 0.39 H new ATOM 0 HA LEU A 72 14.515 0.398 -9.566 1.00 0.33 H new ATOM 0 HB2 LEU A 72 12.202 1.325 -9.220 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.561 -0.301 -9.346 1.00 0.37 H new ATOM 0 HG LEU A 72 12.785 -0.975 -7.329 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.943 0.702 -5.952 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.724 0.494 -7.538 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.698 1.915 -7.231 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.517 0.385 -5.706 1.00 0.92 H new ATOM 0 HD22 LEU A 72 11.177 1.579 -6.981 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.519 -0.069 -7.108 1.00 0.92 H new ATOM 1142 N HIS A 73 14.119 -2.270 -10.958 1.00 0.41 N ATOM 1143 CA HIS A 73 14.359 -3.710 -10.993 1.00 0.46 C ATOM 1144 C HIS A 73 15.525 -4.071 -10.078 1.00 0.41 C ATOM 1145 O HIS A 73 16.649 -3.605 -10.277 1.00 0.45 O ATOM 1146 CB HIS A 73 14.644 -4.184 -12.422 1.00 0.60 C ATOM 1147 CG HIS A 73 14.748 -5.674 -12.538 1.00 1.34 C ATOM 1148 ND1 HIS A 73 15.936 -6.334 -12.768 1.00 2.07 N ATOM 1149 CD2 HIS A 73 13.802 -6.636 -12.442 1.00 2.33 C ATOM 1150 CE1 HIS A 73 15.716 -7.634 -12.806 1.00 2.86 C ATOM 1151 NE2 HIS A 73 14.429 -7.842 -12.613 1.00 3.01 N ATOM 0 H HIS A 73 14.145 -1.816 -11.871 1.00 0.41 H new ATOM 0 HA HIS A 73 13.459 -4.214 -10.640 1.00 0.46 H new ATOM 0 HB2 HIS A 73 13.852 -3.829 -13.081 1.00 0.60 H new ATOM 0 HB3 HIS A 73 15.573 -3.733 -12.769 1.00 0.60 H new ATOM 0 HD2 HIS A 73 12.748 -6.482 -12.264 1.00 2.33 H new ATOM 0 HE1 HIS A 73 16.463 -8.397 -12.968 1.00 2.86 H new ATOM 0 HE2 HIS A 73 13.973 -8.754 -12.594 1.00 3.01 H new ATOM 1160 N ILE A 74 15.249 -4.893 -9.078 1.00 0.37 N ATOM 1161 CA ILE A 74 16.229 -5.206 -8.057 1.00 0.36 C ATOM 1162 C ILE A 74 17.338 -6.103 -8.617 1.00 0.45 C ATOM 1163 O ILE A 74 17.072 -7.135 -9.239 1.00 0.61 O ATOM 1164 CB ILE A 74 15.548 -5.864 -6.831 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.546 -6.049 -5.690 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.909 -7.196 -7.203 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.898 -6.451 -4.389 1.00 0.34 C ATOM 0 H ILE A 74 14.349 -5.356 -8.954 1.00 0.37 H new ATOM 0 HA ILE A 74 16.689 -4.274 -7.730 1.00 0.36 H new ATOM 0 HB ILE A 74 14.757 -5.194 -6.493 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.275 -6.808 -5.974 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.095 -5.119 -5.542 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.439 -7.633 -6.322 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.155 -7.035 -7.974 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.675 -7.874 -7.580 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.663 -6.565 -3.621 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.189 -5.682 -4.083 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.373 -7.397 -4.521 1.00 0.34 H new ATOM 1179 N THR A 75 18.577 -5.679 -8.431 1.00 0.61 N ATOM 1180 CA THR A 75 19.722 -6.406 -8.945 1.00 0.73 C ATOM 1181 C THR A 75 20.471 -7.105 -7.812 1.00 0.58 C ATOM 1182 O THR A 75 20.265 -6.782 -6.639 1.00 0.57 O ATOM 1183 CB THR A 75 20.681 -5.456 -9.689 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.973 -4.314 -8.875 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.077 -5.002 -11.005 1.00 1.56 C ATOM 0 H THR A 75 18.815 -4.827 -7.923 1.00 0.61 H new ATOM 0 HA THR A 75 19.354 -7.158 -9.644 1.00 0.73 H new ATOM 0 HB THR A 75 21.603 -5.998 -9.897 1.00 1.02 H new ATOM 0 HG1 THR A 75 21.584 -3.717 -9.356 1.00 1.38 H new ATOM 0 HG21 THR A 75 20.772 -4.332 -11.512 1.00 1.56 H new ATOM 0 HG22 THR A 75 19.884 -5.870 -11.635 1.00 1.56 H new ATOM 0 HG23 THR A 75 19.141 -4.477 -10.814 1.00 1.56 H new ATOM 1193 N PRO A 76 21.339 -8.079 -8.140 1.00 0.66 N ATOM 1194 CA PRO A 76 22.150 -8.782 -7.142 1.00 0.73 C ATOM 1195 C PRO A 76 23.039 -7.824 -6.354 1.00 0.72 C ATOM 1196 O PRO A 76 24.076 -7.367 -6.843 1.00 0.81 O ATOM 1197 CB PRO A 76 23.002 -9.750 -7.973 1.00 0.93 C ATOM 1198 CG PRO A 76 22.266 -9.901 -9.257 1.00 1.06 C ATOM 1199 CD PRO A 76 21.590 -8.582 -9.500 1.00 0.90 C ATOM 0 HA PRO A 76 21.533 -9.285 -6.397 1.00 0.73 H new ATOM 0 HB2 PRO A 76 24.004 -9.354 -8.136 1.00 0.93 H new ATOM 0 HB3 PRO A 76 23.117 -10.709 -7.468 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.947 -10.147 -10.071 1.00 1.06 H new ATOM 0 HG3 PRO A 76 21.537 -10.709 -9.197 1.00 1.06 H new ATOM 0 HD2 PRO A 76 22.224 -7.903 -10.070 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.664 -8.701 -10.063 1.00 0.90 H new ATOM 1207 N GLY A 77 22.607 -7.499 -5.145 1.00 0.86 N ATOM 1208 CA GLY A 77 23.358 -6.589 -4.311 1.00 1.10 C ATOM 1209 C GLY A 77 22.884 -5.157 -4.455 1.00 1.00 C ATOM 1210 O GLY A 77 23.685 -4.257 -4.686 1.00 1.32 O ATOM 0 H GLY A 77 21.746 -7.852 -4.727 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.269 -6.896 -3.269 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.415 -6.648 -4.572 1.00 1.10 H new ATOM 1214 N THR A 78 21.580 -4.952 -4.346 1.00 0.85 N ATOM 1215 CA THR A 78 21.007 -3.613 -4.403 1.00 0.82 C ATOM 1216 C THR A 78 21.093 -2.938 -3.036 1.00 0.85 C ATOM 1217 O THR A 78 20.433 -3.355 -2.089 1.00 1.52 O ATOM 1218 CB THR A 78 19.532 -3.660 -4.858 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.441 -4.264 -6.153 1.00 1.52 O ATOM 1220 CG2 THR A 78 18.927 -2.264 -4.909 1.00 1.15 C ATOM 0 H THR A 78 20.896 -5.697 -4.217 1.00 0.85 H new ATOM 0 HA THR A 78 21.581 -3.037 -5.129 1.00 0.82 H new ATOM 0 HB THR A 78 18.975 -4.253 -4.133 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.765 -5.188 -6.107 1.00 1.52 H new ATOM 0 HG21 THR A 78 17.888 -2.329 -5.233 1.00 1.15 H new ATOM 0 HG22 THR A 78 18.971 -1.812 -3.918 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.488 -1.650 -5.613 1.00 1.15 H new ATOM 1228 N ALA A 79 21.939 -1.923 -2.928 1.00 0.68 N ATOM 1229 CA ALA A 79 22.079 -1.179 -1.685 1.00 0.73 C ATOM 1230 C ALA A 79 20.947 -0.167 -1.528 1.00 0.62 C ATOM 1231 O ALA A 79 20.265 0.166 -2.504 1.00 0.56 O ATOM 1232 CB ALA A 79 23.423 -0.469 -1.640 1.00 0.85 C ATOM 0 H ALA A 79 22.538 -1.596 -3.686 1.00 0.68 H new ATOM 0 HA ALA A 79 22.026 -1.888 -0.858 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.512 0.083 -0.704 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.225 -1.204 -1.705 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.497 0.224 -2.478 1.00 0.85 H new ATOM 1238 N TYR A 80 20.756 0.323 -0.303 1.00 0.63 N ATOM 1239 CA TYR A 80 19.746 1.345 -0.026 1.00 0.58 C ATOM 1240 C TYR A 80 19.948 2.557 -0.934 1.00 0.50 C ATOM 1241 O TYR A 80 18.983 3.157 -1.399 1.00 0.46 O ATOM 1242 CB TYR A 80 19.797 1.776 1.449 1.00 0.67 C ATOM 1243 CG TYR A 80 18.747 2.801 1.834 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.477 2.408 2.247 1.00 0.89 C ATOM 1245 CD2 TYR A 80 19.023 4.163 1.778 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.517 3.342 2.594 1.00 1.24 C ATOM 1247 CE2 TYR A 80 18.068 5.101 2.121 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.822 4.681 2.554 1.00 1.58 C ATOM 1249 OH TYR A 80 15.863 5.618 2.869 1.00 2.03 O ATOM 0 H TYR A 80 21.289 0.028 0.515 1.00 0.63 H new ATOM 0 HA TYR A 80 18.765 0.915 -0.227 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.675 0.894 2.078 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.784 2.186 1.662 1.00 0.67 H new ATOM 0 HD1 TYR A 80 17.237 1.356 2.297 1.00 0.89 H new ATOM 0 HD2 TYR A 80 20.001 4.493 1.461 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.531 3.020 2.895 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.292 6.155 2.052 1.00 1.55 H new ATOM 0 HH TYR A 80 15.996 5.925 3.790 1.00 2.03 H new ATOM 1259 N GLN A 81 21.210 2.898 -1.190 1.00 0.56 N ATOM 1260 CA GLN A 81 21.550 4.001 -2.084 1.00 0.59 C ATOM 1261 C GLN A 81 20.895 3.818 -3.452 1.00 0.54 C ATOM 1262 O GLN A 81 20.244 4.729 -3.964 1.00 0.63 O ATOM 1263 CB GLN A 81 23.074 4.110 -2.241 1.00 0.72 C ATOM 1264 CG GLN A 81 23.518 5.236 -3.170 1.00 0.84 C ATOM 1265 CD GLN A 81 23.069 6.608 -2.695 1.00 1.40 C ATOM 1266 OE1 GLN A 81 22.808 7.499 -3.504 1.00 2.01 O ATOM 1267 NE2 GLN A 81 22.999 6.800 -1.387 1.00 2.18 N ATOM 0 H GLN A 81 22.018 2.422 -0.788 1.00 0.56 H new ATOM 0 HA GLN A 81 21.171 4.923 -1.642 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.521 4.264 -1.259 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.459 3.164 -2.622 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.605 5.224 -3.253 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.120 5.055 -4.168 1.00 0.84 H new ATOM 0 HE21 GLN A 81 23.223 6.038 -0.747 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.721 7.710 -1.019 1.00 2.18 H new ATOM 1276 N SER A 82 21.045 2.629 -4.024 1.00 0.48 N ATOM 1277 CA SER A 82 20.506 2.335 -5.343 1.00 0.47 C ATOM 1278 C SER A 82 18.980 2.373 -5.321 1.00 0.40 C ATOM 1279 O SER A 82 18.341 2.808 -6.280 1.00 0.42 O ATOM 1280 CB SER A 82 20.991 0.962 -5.803 1.00 0.55 C ATOM 1281 OG SER A 82 22.393 0.829 -5.613 1.00 1.17 O ATOM 0 H SER A 82 21.539 1.849 -3.590 1.00 0.48 H new ATOM 0 HA SER A 82 20.858 3.094 -6.042 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.469 0.183 -5.247 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.748 0.820 -6.856 1.00 0.55 H new ATOM 0 HG SER A 82 22.681 -0.058 -5.913 1.00 1.17 H new ATOM 1287 N PHE A 83 18.411 1.926 -4.210 1.00 0.36 N ATOM 1288 CA PHE A 83 16.967 1.909 -4.035 1.00 0.33 C ATOM 1289 C PHE A 83 16.433 3.335 -3.887 1.00 0.31 C ATOM 1290 O PHE A 83 15.401 3.684 -4.466 1.00 0.32 O ATOM 1291 CB PHE A 83 16.605 1.053 -2.806 1.00 0.35 C ATOM 1292 CG PHE A 83 15.128 0.908 -2.553 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.360 0.052 -3.329 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.505 1.633 -1.547 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.003 -0.078 -3.107 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.148 1.503 -1.322 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.405 0.630 -2.066 1.00 0.38 C ATOM 0 H PHE A 83 18.933 1.568 -3.411 1.00 0.36 H new ATOM 0 HA PHE A 83 16.502 1.467 -4.916 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.037 0.060 -2.932 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.069 1.494 -1.924 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.829 -0.520 -4.116 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.087 2.305 -0.934 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.409 -0.724 -3.736 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.672 2.094 -0.554 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.357 0.489 -1.848 1.00 0.38 H new ATOM 1307 N GLU A 84 17.161 4.164 -3.143 1.00 0.34 N ATOM 1308 CA GLU A 84 16.732 5.534 -2.887 1.00 0.39 C ATOM 1309 C GLU A 84 16.749 6.358 -4.167 1.00 0.37 C ATOM 1310 O GLU A 84 15.840 7.140 -4.402 1.00 0.40 O ATOM 1311 CB GLU A 84 17.615 6.213 -1.831 1.00 0.51 C ATOM 1312 CG GLU A 84 17.174 7.636 -1.515 1.00 0.64 C ATOM 1313 CD GLU A 84 18.188 8.414 -0.703 1.00 0.90 C ATOM 1314 OE1 GLU A 84 19.260 8.752 -1.244 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.932 8.663 0.493 1.00 0.95 O ATOM 0 H GLU A 84 18.048 3.911 -2.708 1.00 0.34 H new ATOM 0 HA GLU A 84 15.712 5.483 -2.507 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.598 5.621 -0.916 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.647 6.227 -2.182 1.00 0.51 H new ATOM 0 HG2 GLU A 84 16.984 8.165 -2.449 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.231 7.603 -0.970 1.00 0.64 H new ATOM 1322 N GLN A 85 17.770 6.160 -4.999 1.00 0.37 N ATOM 1323 CA GLN A 85 17.931 6.937 -6.234 1.00 0.42 C ATOM 1324 C GLN A 85 16.641 6.954 -7.053 1.00 0.38 C ATOM 1325 O GLN A 85 16.299 7.963 -7.671 1.00 0.46 O ATOM 1326 CB GLN A 85 19.071 6.365 -7.082 1.00 0.50 C ATOM 1327 CG GLN A 85 20.456 6.546 -6.474 1.00 0.61 C ATOM 1328 CD GLN A 85 21.512 5.702 -7.165 1.00 1.44 C ATOM 1329 OE1 GLN A 85 22.685 6.070 -7.212 1.00 1.90 O ATOM 1330 NE2 GLN A 85 21.103 4.564 -7.708 1.00 2.16 N ATOM 0 H GLN A 85 18.502 5.467 -4.843 1.00 0.37 H new ATOM 0 HA GLN A 85 18.172 7.961 -5.949 1.00 0.42 H new ATOM 0 HB2 GLN A 85 18.892 5.301 -7.240 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.053 6.840 -8.063 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.740 7.597 -6.533 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.422 6.284 -5.417 1.00 0.61 H new ATOM 0 HE21 GLN A 85 20.121 4.294 -7.648 1.00 2.16 H new ATOM 0 HE22 GLN A 85 21.770 3.958 -8.186 1.00 2.16 H new ATOM 1339 N VAL A 86 15.922 5.842 -7.021 1.00 0.31 N ATOM 1340 CA VAL A 86 14.679 5.714 -7.756 1.00 0.31 C ATOM 1341 C VAL A 86 13.528 6.301 -6.952 1.00 0.29 C ATOM 1342 O VAL A 86 12.846 7.226 -7.393 1.00 0.32 O ATOM 1343 CB VAL A 86 14.370 4.236 -8.051 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.101 4.108 -8.875 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.545 3.573 -8.748 1.00 0.36 C ATOM 0 H VAL A 86 16.183 5.012 -6.489 1.00 0.31 H new ATOM 0 HA VAL A 86 14.790 6.256 -8.695 1.00 0.31 H new ATOM 0 HB VAL A 86 14.208 3.722 -7.104 1.00 0.33 H new ATOM 0 HG11 VAL A 86 12.900 3.055 -9.073 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.265 4.540 -8.325 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.226 4.637 -9.820 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.307 2.528 -8.948 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.747 4.086 -9.688 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.426 3.628 -8.108 1.00 0.36 H new ATOM 1355 N VAL A 87 13.334 5.759 -5.759 1.00 0.28 N ATOM 1356 CA VAL A 87 12.193 6.107 -4.925 1.00 0.32 C ATOM 1357 C VAL A 87 12.258 7.553 -4.430 1.00 0.35 C ATOM 1358 O VAL A 87 11.273 8.096 -3.933 1.00 0.37 O ATOM 1359 CB VAL A 87 12.073 5.149 -3.729 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.091 3.712 -4.215 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.180 5.392 -2.719 1.00 0.41 C ATOM 0 H VAL A 87 13.960 5.069 -5.343 1.00 0.28 H new ATOM 0 HA VAL A 87 11.306 6.009 -5.551 1.00 0.32 H new ATOM 0 HB VAL A 87 11.124 5.339 -3.227 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.006 3.038 -3.362 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.254 3.547 -4.893 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.027 3.517 -4.739 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.069 4.700 -1.884 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.148 5.235 -3.195 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.119 6.416 -2.352 1.00 0.41 H new ATOM 1371 N ASN A 88 13.420 8.170 -4.574 1.00 0.38 N ATOM 1372 CA ASN A 88 13.600 9.573 -4.211 1.00 0.47 C ATOM 1373 C ASN A 88 12.844 10.461 -5.189 1.00 0.44 C ATOM 1374 O ASN A 88 12.346 11.526 -4.823 1.00 0.45 O ATOM 1375 CB ASN A 88 15.088 9.953 -4.212 1.00 0.61 C ATOM 1376 CG ASN A 88 15.345 11.346 -3.665 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.619 11.828 -2.795 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.385 11.999 -4.163 1.00 0.97 N ATOM 0 H ASN A 88 14.259 7.721 -4.942 1.00 0.38 H new ATOM 0 HA ASN A 88 13.206 9.719 -3.205 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.643 9.227 -3.618 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.472 9.892 -5.230 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.608 12.936 -3.826 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.962 11.565 -4.883 1.00 0.97 H new ATOM 1385 N GLU A 89 12.718 9.994 -6.428 1.00 0.42 N ATOM 1386 CA GLU A 89 12.035 10.763 -7.456 1.00 0.45 C ATOM 1387 C GLU A 89 10.539 10.791 -7.181 1.00 0.38 C ATOM 1388 O GLU A 89 9.832 11.679 -7.639 1.00 0.43 O ATOM 1389 CB GLU A 89 12.316 10.198 -8.849 1.00 0.54 C ATOM 1390 CG GLU A 89 13.790 10.211 -9.216 1.00 0.65 C ATOM 1391 CD GLU A 89 14.023 10.074 -10.703 1.00 1.23 C ATOM 1392 OE1 GLU A 89 14.091 8.925 -11.189 1.00 2.04 O ATOM 1393 OE2 GLU A 89 14.130 11.106 -11.396 1.00 1.28 O ATOM 0 H GLU A 89 13.078 9.092 -6.740 1.00 0.42 H new ATOM 0 HA GLU A 89 12.418 11.783 -7.429 1.00 0.45 H new ATOM 0 HB2 GLU A 89 11.945 9.174 -8.900 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.760 10.776 -9.587 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.239 11.141 -8.866 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.297 9.397 -8.697 1.00 0.65 H new ATOM 1400 N LEU A 90 10.070 9.831 -6.394 1.00 0.31 N ATOM 1401 CA LEU A 90 8.674 9.793 -5.985 1.00 0.27 C ATOM 1402 C LEU A 90 8.380 10.954 -5.042 1.00 0.25 C ATOM 1403 O LEU A 90 7.239 11.384 -4.895 1.00 0.26 O ATOM 1404 CB LEU A 90 8.359 8.476 -5.281 1.00 0.26 C ATOM 1405 CG LEU A 90 8.683 7.212 -6.066 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.443 5.990 -5.198 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.853 7.142 -7.336 1.00 0.37 C ATOM 0 H LEU A 90 10.638 9.068 -6.026 1.00 0.31 H new ATOM 0 HA LEU A 90 8.050 9.877 -6.875 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.909 8.448 -4.340 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.298 8.464 -5.031 1.00 0.26 H new ATOM 0 HG LEU A 90 9.734 7.236 -6.354 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.677 5.089 -5.765 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.082 6.039 -4.316 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.398 5.963 -4.888 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.100 6.232 -7.882 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.794 7.135 -7.079 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.069 8.009 -7.960 1.00 0.37 H new ATOM 1419 N PHE A 91 9.424 11.441 -4.384 1.00 0.27 N ATOM 1420 CA PHE A 91 9.290 12.576 -3.482 1.00 0.29 C ATOM 1421 C PHE A 91 9.511 13.876 -4.249 1.00 0.33 C ATOM 1422 O PHE A 91 8.897 14.897 -3.951 1.00 0.33 O ATOM 1423 CB PHE A 91 10.299 12.462 -2.332 1.00 0.35 C ATOM 1424 CG PHE A 91 9.874 13.162 -1.070 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.124 14.512 -0.884 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.229 12.458 -0.065 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.736 15.147 0.280 1.00 0.53 C ATOM 1428 CE2 PHE A 91 8.838 13.090 1.101 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.093 14.436 1.273 1.00 0.50 C ATOM 0 H PHE A 91 10.371 11.068 -4.458 1.00 0.27 H new ATOM 0 HA PHE A 91 8.284 12.578 -3.063 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.465 11.407 -2.112 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.254 12.873 -2.659 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.627 15.074 -1.657 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.030 11.404 -0.194 1.00 0.37 H new ATOM 0 HE1 PHE A 91 9.936 16.200 0.413 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.334 12.532 1.876 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.790 14.932 2.183 1.00 0.50 H new ATOM 1439 N ARG A 92 10.371 13.820 -5.259 1.00 0.39 N ATOM 1440 CA ARG A 92 10.743 15.006 -6.019 1.00 0.49 C ATOM 1441 C ARG A 92 9.701 15.322 -7.098 1.00 0.51 C ATOM 1442 O ARG A 92 9.662 16.430 -7.636 1.00 0.62 O ATOM 1443 CB ARG A 92 12.120 14.795 -6.656 1.00 0.56 C ATOM 1444 CG ARG A 92 12.777 16.078 -7.137 1.00 1.24 C ATOM 1445 CD ARG A 92 13.056 17.015 -5.973 1.00 1.54 C ATOM 1446 NE ARG A 92 13.698 18.256 -6.395 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.084 19.212 -5.550 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.930 19.047 -4.239 1.00 3.13 N ATOM 1449 NH2 ARG A 92 14.636 20.325 -6.013 1.00 3.95 N ATOM 0 H ARG A 92 10.825 12.962 -5.571 1.00 0.39 H new ATOM 0 HA ARG A 92 10.784 15.856 -5.337 1.00 0.49 H new ATOM 0 HB2 ARG A 92 12.775 14.312 -5.931 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.019 14.111 -7.499 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.709 15.843 -7.651 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.130 16.573 -7.861 1.00 1.24 H new ATOM 0 HD2 ARG A 92 12.120 17.248 -5.466 1.00 1.54 H new ATOM 0 HD3 ARG A 92 13.693 16.509 -5.248 1.00 1.54 H new ATOM 0 HE ARG A 92 13.860 18.400 -7.392 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.516 18.187 -3.878 1.00 3.13 H new ATOM 0 HH12 ARG A 92 14.226 19.780 -3.594 1.00 3.13 H new ATOM 0 HH21 ARG A 92 14.766 20.451 -7.017 1.00 3.95 H new ATOM 0 HH22 ARG A 92 14.931 21.056 -5.365 1.00 3.95 H new ATOM 1463 N ASP A 93 8.849 14.348 -7.394 1.00 0.46 N ATOM 1464 CA ASP A 93 7.828 14.490 -8.437 1.00 0.53 C ATOM 1465 C ASP A 93 6.573 15.170 -7.878 1.00 0.50 C ATOM 1466 O ASP A 93 5.482 15.059 -8.439 1.00 0.60 O ATOM 1467 CB ASP A 93 7.483 13.101 -9.017 1.00 0.62 C ATOM 1468 CG ASP A 93 6.543 13.153 -10.210 1.00 0.90 C ATOM 1469 OD1 ASP A 93 6.946 13.687 -11.265 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.388 12.687 -10.091 1.00 1.11 O ATOM 0 H ASP A 93 8.842 13.442 -6.925 1.00 0.46 H new ATOM 0 HA ASP A 93 8.222 15.120 -9.235 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.405 12.602 -9.314 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.029 12.493 -8.234 1.00 0.62 H new ATOM 1475 N GLY A 94 6.726 15.897 -6.778 1.00 0.45 N ATOM 1476 CA GLY A 94 5.581 16.564 -6.193 1.00 0.47 C ATOM 1477 C GLY A 94 4.870 15.689 -5.188 1.00 0.39 C ATOM 1478 O GLY A 94 3.644 15.733 -5.110 1.00 0.42 O ATOM 0 H GLY A 94 7.609 16.035 -6.287 1.00 0.45 H new ATOM 0 HA2 GLY A 94 5.906 17.484 -5.707 1.00 0.47 H new ATOM 0 HA3 GLY A 94 4.885 16.849 -6.982 1.00 0.47 H new ATOM 1482 N VAL A 95 5.662 14.889 -4.452 1.00 0.32 N ATOM 1483 CA VAL A 95 5.173 13.815 -3.567 1.00 0.26 C ATOM 1484 C VAL A 95 3.700 13.954 -3.174 1.00 0.25 C ATOM 1485 O VAL A 95 3.305 14.826 -2.399 1.00 0.29 O ATOM 1486 CB VAL A 95 6.047 13.707 -2.292 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.295 15.074 -1.680 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.409 12.771 -1.275 1.00 0.33 C ATOM 0 H VAL A 95 6.679 14.972 -4.455 1.00 0.32 H new ATOM 0 HA VAL A 95 5.254 12.900 -4.153 1.00 0.26 H new ATOM 0 HB VAL A 95 7.011 13.289 -2.584 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.911 14.967 -0.787 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.810 15.708 -2.402 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.342 15.530 -1.411 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.041 12.711 -0.389 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.427 13.152 -0.995 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.302 11.778 -1.712 1.00 0.33 H new ATOM 1498 N ASN A 96 2.903 13.084 -3.765 1.00 0.24 N ATOM 1499 CA ASN A 96 1.475 12.993 -3.494 1.00 0.29 C ATOM 1500 C ASN A 96 1.195 11.669 -2.779 1.00 0.23 C ATOM 1501 O ASN A 96 2.089 10.836 -2.671 1.00 0.21 O ATOM 1502 CB ASN A 96 0.698 13.100 -4.822 1.00 0.41 C ATOM 1503 CG ASN A 96 -0.799 12.885 -4.676 1.00 1.33 C ATOM 1504 OD1 ASN A 96 -1.292 11.768 -4.837 1.00 2.13 O ATOM 1505 ND2 ASN A 96 -1.530 13.941 -4.367 1.00 2.00 N ATOM 0 H ASN A 96 3.231 12.410 -4.457 1.00 0.24 H new ATOM 0 HA ASN A 96 1.148 13.809 -2.849 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.874 14.084 -5.256 1.00 0.41 H new ATOM 0 HB3 ASN A 96 1.094 12.366 -5.524 1.00 0.41 H new ATOM 0 HD21 ASN A 96 -2.539 13.847 -4.254 1.00 2.00 H new ATOM 0 HD22 ASN A 96 -1.085 14.850 -4.242 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.024 11.464 -2.292 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.373 10.202 -1.639 1.00 0.24 C ATOM 1514 C TRP A 97 -0.155 9.018 -2.585 1.00 0.25 C ATOM 1515 O TRP A 97 0.114 7.899 -2.142 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.825 10.223 -1.147 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.074 11.231 -0.061 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.750 12.414 -0.175 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.646 11.148 1.307 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.767 13.065 1.034 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.097 12.311 1.958 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.927 10.202 2.047 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.852 12.555 3.307 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.684 10.446 3.385 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.147 11.612 4.004 1.00 0.30 C ATOM 0 H TRP A 97 -0.782 12.146 -2.335 1.00 0.25 H new ATOM 0 HA TRP A 97 0.283 10.083 -0.777 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.483 10.438 -1.989 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.091 9.232 -0.780 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.204 12.783 -1.083 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.209 13.967 1.214 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.568 9.297 1.580 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.206 13.456 3.786 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 -0.127 9.724 3.963 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.944 11.771 5.053 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.238 9.281 -3.887 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.056 8.239 -4.881 1.00 0.29 C ATOM 1538 C GLY A 98 1.349 7.664 -4.893 1.00 0.26 C ATOM 1539 O GLY A 98 1.534 6.485 -5.190 1.00 0.27 O ATOM 0 H GLY A 98 -0.430 10.206 -4.273 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.769 7.436 -4.691 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.285 8.642 -5.867 1.00 0.29 H new ATOM 1543 N ARG A 99 2.345 8.485 -4.558 1.00 0.26 N ATOM 1544 CA ARG A 99 3.736 8.024 -4.548 1.00 0.25 C ATOM 1545 C ARG A 99 3.930 6.993 -3.450 1.00 0.21 C ATOM 1546 O ARG A 99 4.776 6.112 -3.554 1.00 0.20 O ATOM 1547 CB ARG A 99 4.725 9.192 -4.376 1.00 0.30 C ATOM 1548 CG ARG A 99 4.744 9.820 -2.985 1.00 0.70 C ATOM 1549 CD ARG A 99 5.719 9.126 -2.044 1.00 1.40 C ATOM 1550 NE ARG A 99 7.102 9.524 -2.290 1.00 1.74 N ATOM 1551 CZ ARG A 99 8.163 8.884 -1.801 1.00 2.46 C ATOM 1552 NH1 ARG A 99 8.007 7.750 -1.122 1.00 3.06 N ATOM 1553 NH2 ARG A 99 9.378 9.366 -2.012 1.00 2.98 N ATOM 0 H ARG A 99 2.219 9.462 -4.293 1.00 0.26 H new ATOM 0 HA ARG A 99 3.945 7.564 -5.514 1.00 0.25 H new ATOM 0 HB2 ARG A 99 5.728 8.837 -4.612 1.00 0.30 H new ATOM 0 HB3 ARG A 99 4.481 9.965 -5.104 1.00 0.30 H new ATOM 0 HG2 ARG A 99 5.013 10.873 -3.069 1.00 0.70 H new ATOM 0 HG3 ARG A 99 3.742 9.780 -2.558 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.454 9.359 -1.013 1.00 1.40 H new ATOM 0 HD3 ARG A 99 5.627 8.046 -2.161 1.00 1.40 H new ATOM 0 HE ARG A 99 7.266 10.344 -2.873 1.00 1.74 H new ATOM 0 HH11 ARG A 99 7.073 7.368 -0.975 1.00 3.06 H new ATOM 0 HH12 ARG A 99 8.822 7.263 -0.749 1.00 3.06 H new ATOM 0 HH21 ARG A 99 9.500 10.225 -2.548 1.00 2.98 H new ATOM 0 HH22 ARG A 99 10.192 8.878 -1.639 1.00 2.98 H new ATOM 1567 N ILE A 100 3.143 7.121 -2.392 1.00 0.22 N ATOM 1568 CA ILE A 100 3.169 6.166 -1.303 1.00 0.21 C ATOM 1569 C ILE A 100 2.565 4.855 -1.774 1.00 0.20 C ATOM 1570 O ILE A 100 3.119 3.782 -1.545 1.00 0.19 O ATOM 1571 CB ILE A 100 2.401 6.701 -0.077 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.093 7.953 0.467 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.296 5.636 1.000 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.475 8.487 1.737 1.00 0.30 C ATOM 0 H ILE A 100 2.476 7.883 -2.268 1.00 0.22 H new ATOM 0 HA ILE A 100 4.204 6.004 -1.001 1.00 0.21 H new ATOM 0 HB ILE A 100 1.390 6.965 -0.387 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.143 7.725 0.653 1.00 0.26 H new ATOM 0 HG13 ILE A 100 3.066 8.732 -0.295 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.751 6.036 1.855 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.766 4.769 0.604 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.296 5.337 1.315 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.019 9.374 2.061 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.433 8.748 1.553 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.526 7.725 2.515 1.00 0.30 H new ATOM 1586 N VAL A 101 1.439 4.964 -2.461 1.00 0.21 N ATOM 1587 CA VAL A 101 0.788 3.815 -3.060 1.00 0.21 C ATOM 1588 C VAL A 101 1.749 3.095 -3.993 1.00 0.20 C ATOM 1589 O VAL A 101 1.948 1.882 -3.893 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.445 4.246 -3.863 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.153 3.034 -4.429 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.379 5.073 -3.002 1.00 0.26 C ATOM 0 H VAL A 101 0.954 5.848 -2.617 1.00 0.21 H new ATOM 0 HA VAL A 101 0.480 3.148 -2.255 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.120 4.869 -4.696 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -2.026 3.355 -4.997 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.474 2.489 -5.085 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.469 2.384 -3.614 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.248 5.370 -3.589 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.704 4.482 -2.146 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.857 5.963 -2.651 1.00 0.26 H new ATOM 1602 N ALA A 102 2.333 3.863 -4.902 1.00 0.19 N ATOM 1603 CA ALA A 102 3.295 3.341 -5.851 1.00 0.19 C ATOM 1604 C ALA A 102 4.474 2.700 -5.130 1.00 0.17 C ATOM 1605 O ALA A 102 4.877 1.592 -5.461 1.00 0.19 O ATOM 1606 CB ALA A 102 3.770 4.451 -6.774 1.00 0.21 C ATOM 0 H ALA A 102 2.151 4.862 -4.999 1.00 0.19 H new ATOM 0 HA ALA A 102 2.809 2.571 -6.450 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.493 4.049 -7.484 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.919 4.862 -7.316 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.239 5.238 -6.184 1.00 0.21 H new ATOM 1612 N PHE A 103 4.992 3.396 -4.120 1.00 0.16 N ATOM 1613 CA PHE A 103 6.136 2.917 -3.342 1.00 0.17 C ATOM 1614 C PHE A 103 5.878 1.519 -2.782 1.00 0.17 C ATOM 1615 O PHE A 103 6.708 0.620 -2.922 1.00 0.21 O ATOM 1616 CB PHE A 103 6.444 3.900 -2.200 1.00 0.17 C ATOM 1617 CG PHE A 103 7.605 3.496 -1.332 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.895 3.440 -1.845 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.407 3.166 -0.003 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.958 3.064 -1.046 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.467 2.790 0.799 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.758 2.759 0.267 1.00 0.26 C ATOM 0 H PHE A 103 4.634 4.302 -3.818 1.00 0.16 H new ATOM 0 HA PHE A 103 6.998 2.858 -4.006 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.649 4.882 -2.627 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.557 4.003 -1.575 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.069 3.693 -2.880 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.411 3.203 0.413 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.952 3.012 -1.464 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.298 2.522 1.831 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.596 2.494 0.895 1.00 0.26 H new ATOM 1632 N PHE A 104 4.712 1.334 -2.179 1.00 0.16 N ATOM 1633 CA PHE A 104 4.365 0.053 -1.577 1.00 0.18 C ATOM 1634 C PHE A 104 4.111 -0.998 -2.650 1.00 0.19 C ATOM 1635 O PHE A 104 4.474 -2.165 -2.492 1.00 0.23 O ATOM 1636 CB PHE A 104 3.142 0.196 -0.669 1.00 0.19 C ATOM 1637 CG PHE A 104 3.447 0.810 0.671 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.907 2.114 0.776 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.276 0.072 1.830 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.187 2.668 2.008 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.556 0.623 3.063 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.010 1.921 3.154 1.00 0.30 C ATOM 0 H PHE A 104 3.992 2.052 -2.093 1.00 0.16 H new ATOM 0 HA PHE A 104 5.209 -0.274 -0.970 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.395 0.806 -1.176 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.699 -0.788 -0.515 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.048 2.703 -0.118 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.920 -0.946 1.768 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.544 3.685 2.075 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.419 0.036 3.959 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.227 2.352 4.120 1.00 0.30 H new ATOM 1652 N SER A 105 3.509 -0.574 -3.750 1.00 0.18 N ATOM 1653 CA SER A 105 3.223 -1.476 -4.854 1.00 0.21 C ATOM 1654 C SER A 105 4.512 -1.901 -5.559 1.00 0.21 C ATOM 1655 O SER A 105 4.582 -2.991 -6.131 1.00 0.23 O ATOM 1656 CB SER A 105 2.262 -0.808 -5.838 1.00 0.25 C ATOM 1657 OG SER A 105 1.069 -0.408 -5.181 1.00 1.04 O ATOM 0 H SER A 105 3.209 0.389 -3.902 1.00 0.18 H new ATOM 0 HA SER A 105 2.750 -2.374 -4.456 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.742 0.060 -6.291 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.024 -1.499 -6.647 1.00 0.25 H new ATOM 0 HG SER A 105 1.236 0.412 -4.670 1.00 1.04 H new ATOM 1663 N PHE A 106 5.532 -1.044 -5.507 1.00 0.20 N ATOM 1664 CA PHE A 106 6.828 -1.369 -6.091 1.00 0.21 C ATOM 1665 C PHE A 106 7.474 -2.502 -5.314 1.00 0.22 C ATOM 1666 O PHE A 106 7.946 -3.469 -5.905 1.00 0.24 O ATOM 1667 CB PHE A 106 7.766 -0.153 -6.110 1.00 0.23 C ATOM 1668 CG PHE A 106 7.345 0.949 -7.047 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.458 0.688 -8.078 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.836 2.239 -6.903 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.069 1.689 -8.947 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.449 3.243 -7.769 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.573 2.996 -8.762 1.00 0.33 C ATOM 0 H PHE A 106 5.484 -0.124 -5.068 1.00 0.20 H new ATOM 0 HA PHE A 106 6.659 -1.677 -7.123 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.834 0.253 -5.101 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.766 -0.486 -6.388 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.066 -0.310 -8.204 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.529 2.460 -6.105 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.388 1.475 -9.758 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.853 4.237 -7.649 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.256 3.795 -9.416 1.00 0.33 H new ATOM 1683 N GLY A 107 7.476 -2.387 -3.987 1.00 0.23 N ATOM 1684 CA GLY A 107 8.021 -3.444 -3.154 1.00 0.27 C ATOM 1685 C GLY A 107 7.330 -4.768 -3.400 1.00 0.32 C ATOM 1686 O GLY A 107 7.968 -5.818 -3.391 1.00 0.37 O ATOM 0 H GLY A 107 7.111 -1.583 -3.476 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.088 -3.549 -3.352 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.917 -3.169 -2.104 1.00 0.27 H new ATOM 1690 N GLY A 108 6.021 -4.707 -3.632 1.00 0.33 N ATOM 1691 CA GLY A 108 5.249 -5.901 -3.937 1.00 0.41 C ATOM 1692 C GLY A 108 5.668 -6.553 -5.242 1.00 0.42 C ATOM 1693 O GLY A 108 5.423 -7.736 -5.461 1.00 0.63 O ATOM 0 H GLY A 108 5.477 -3.844 -3.614 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.362 -6.619 -3.125 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.192 -5.641 -3.989 1.00 0.41 H new ATOM 1697 N ALA A 109 6.282 -5.780 -6.119 1.00 0.27 N ATOM 1698 CA ALA A 109 6.818 -6.314 -7.360 1.00 0.26 C ATOM 1699 C ALA A 109 8.258 -6.758 -7.155 1.00 0.23 C ATOM 1700 O ALA A 109 8.683 -7.793 -7.670 1.00 0.24 O ATOM 1701 CB ALA A 109 6.731 -5.270 -8.459 1.00 0.29 C ATOM 0 H ALA A 109 6.423 -4.777 -5.995 1.00 0.27 H new ATOM 0 HA ALA A 109 6.227 -7.179 -7.660 1.00 0.26 H new ATOM 0 HB1 ALA A 109 7.135 -5.681 -9.384 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.689 -4.989 -8.612 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.306 -4.390 -8.171 1.00 0.29 H new ATOM 1707 N LEU A 110 8.985 -5.966 -6.376 1.00 0.22 N ATOM 1708 CA LEU A 110 10.381 -6.225 -6.071 1.00 0.23 C ATOM 1709 C LEU A 110 10.549 -7.555 -5.360 1.00 0.21 C ATOM 1710 O LEU A 110 11.419 -8.352 -5.710 1.00 0.21 O ATOM 1711 CB LEU A 110 10.931 -5.106 -5.192 1.00 0.25 C ATOM 1712 CG LEU A 110 10.924 -3.724 -5.829 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.418 -2.689 -4.841 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.775 -3.721 -7.083 1.00 0.36 C ATOM 0 H LEU A 110 8.617 -5.122 -5.937 1.00 0.22 H new ATOM 0 HA LEU A 110 10.932 -6.265 -7.010 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.348 -5.068 -4.272 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.954 -5.355 -4.911 1.00 0.25 H new ATOM 0 HG LEU A 110 9.902 -3.469 -6.108 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.408 -1.705 -5.309 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.767 -2.681 -3.966 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.435 -2.935 -4.535 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.762 -2.727 -7.529 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.800 -3.991 -6.828 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.376 -4.444 -7.795 1.00 0.36 H new ATOM 1726 N CYS A 111 9.715 -7.787 -4.355 1.00 0.21 N ATOM 1727 CA CYS A 111 9.792 -9.008 -3.569 1.00 0.21 C ATOM 1728 C CYS A 111 9.638 -10.237 -4.457 1.00 0.21 C ATOM 1729 O CYS A 111 10.310 -11.250 -4.261 1.00 0.25 O ATOM 1730 CB CYS A 111 8.725 -9.004 -2.471 1.00 0.22 C ATOM 1731 SG CYS A 111 7.025 -8.862 -3.068 1.00 1.34 S ATOM 0 H CYS A 111 8.977 -7.144 -4.066 1.00 0.21 H new ATOM 0 HA CYS A 111 10.775 -9.049 -3.100 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.816 -9.923 -1.892 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.927 -8.177 -1.791 1.00 0.22 H new ATOM 0 HG CYS A 111 6.208 -8.871 -2.057 1.00 1.34 H new ATOM 1737 N VAL A 112 8.774 -10.124 -5.455 1.00 0.19 N ATOM 1738 CA VAL A 112 8.502 -11.222 -6.364 1.00 0.20 C ATOM 1739 C VAL A 112 9.689 -11.475 -7.277 1.00 0.22 C ATOM 1740 O VAL A 112 10.220 -12.586 -7.327 1.00 0.25 O ATOM 1741 CB VAL A 112 7.263 -10.930 -7.224 1.00 0.23 C ATOM 1742 CG1 VAL A 112 7.008 -12.077 -8.185 1.00 0.27 C ATOM 1743 CG2 VAL A 112 6.049 -10.685 -6.343 1.00 0.25 C ATOM 0 H VAL A 112 8.246 -9.274 -5.655 1.00 0.19 H new ATOM 0 HA VAL A 112 8.317 -12.108 -5.757 1.00 0.20 H new ATOM 0 HB VAL A 112 7.447 -10.027 -7.807 1.00 0.23 H new ATOM 0 HG11 VAL A 112 6.127 -11.857 -8.788 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.872 -12.204 -8.837 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.841 -12.994 -7.620 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.181 -10.480 -6.969 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.857 -11.569 -5.734 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.238 -9.831 -5.693 1.00 0.25 H new ATOM 1753 N GLU A 113 10.099 -10.437 -7.995 1.00 0.22 N ATOM 1754 CA GLU A 113 11.205 -10.550 -8.939 1.00 0.25 C ATOM 1755 C GLU A 113 12.486 -10.988 -8.235 1.00 0.25 C ATOM 1756 O GLU A 113 13.343 -11.632 -8.839 1.00 0.30 O ATOM 1757 CB GLU A 113 11.420 -9.237 -9.693 1.00 0.29 C ATOM 1758 CG GLU A 113 11.648 -8.031 -8.801 1.00 0.30 C ATOM 1759 CD GLU A 113 11.770 -6.749 -9.593 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.776 -6.347 -10.233 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.864 -6.152 -9.600 1.00 0.50 O ATOM 0 H GLU A 113 9.683 -9.507 -7.942 1.00 0.22 H new ATOM 0 HA GLU A 113 10.943 -11.318 -9.667 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.277 -9.350 -10.357 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.551 -9.048 -10.324 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.822 -7.942 -8.095 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.554 -8.181 -8.215 1.00 0.30 H new ATOM 1768 N SER A 114 12.602 -10.661 -6.955 1.00 0.23 N ATOM 1769 CA SER A 114 13.731 -11.114 -6.161 1.00 0.28 C ATOM 1770 C SER A 114 13.715 -12.631 -6.053 1.00 0.27 C ATOM 1771 O SER A 114 14.719 -13.290 -6.301 1.00 0.31 O ATOM 1772 CB SER A 114 13.706 -10.487 -4.766 1.00 0.33 C ATOM 1773 OG SER A 114 13.848 -9.084 -4.843 1.00 0.99 O ATOM 0 H SER A 114 11.930 -10.086 -6.448 1.00 0.23 H new ATOM 0 HA SER A 114 14.648 -10.800 -6.659 1.00 0.28 H new ATOM 0 HB2 SER A 114 12.769 -10.735 -4.268 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.510 -10.905 -4.160 1.00 0.33 H new ATOM 0 HG SER A 114 13.051 -8.697 -5.261 1.00 0.99 H new ATOM 1779 N VAL A 115 12.556 -13.183 -5.727 1.00 0.28 N ATOM 1780 CA VAL A 115 12.417 -14.619 -5.569 1.00 0.33 C ATOM 1781 C VAL A 115 12.569 -15.318 -6.914 1.00 0.37 C ATOM 1782 O VAL A 115 13.192 -16.378 -7.009 1.00 0.42 O ATOM 1783 CB VAL A 115 11.058 -14.977 -4.948 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.916 -16.481 -4.800 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.900 -14.292 -3.603 1.00 0.41 C ATOM 0 H VAL A 115 11.698 -12.655 -5.567 1.00 0.28 H new ATOM 0 HA VAL A 115 13.205 -14.959 -4.897 1.00 0.33 H new ATOM 0 HB VAL A 115 10.270 -14.625 -5.613 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.947 -16.713 -4.358 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.990 -16.952 -5.780 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.709 -16.860 -4.155 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.933 -14.553 -3.173 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.695 -14.618 -2.933 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.958 -13.212 -3.736 1.00 0.41 H new ATOM 1795 N ASP A 116 12.004 -14.712 -7.951 1.00 0.38 N ATOM 1796 CA ASP A 116 12.124 -15.234 -9.310 1.00 0.46 C ATOM 1797 C ASP A 116 13.589 -15.317 -9.736 1.00 0.47 C ATOM 1798 O ASP A 116 14.000 -16.277 -10.385 1.00 0.56 O ATOM 1799 CB ASP A 116 11.339 -14.362 -10.296 1.00 0.49 C ATOM 1800 CG ASP A 116 11.543 -14.788 -11.736 1.00 1.08 C ATOM 1801 OD1 ASP A 116 10.975 -15.826 -12.139 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.266 -14.087 -12.471 1.00 1.89 O ATOM 0 H ASP A 116 11.456 -13.855 -7.878 1.00 0.38 H new ATOM 0 HA ASP A 116 11.704 -16.240 -9.319 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.277 -14.410 -10.053 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.646 -13.322 -10.181 1.00 0.49 H new ATOM 1807 N LYS A 117 14.376 -14.323 -9.345 1.00 0.43 N ATOM 1808 CA LYS A 117 15.798 -14.296 -9.683 1.00 0.49 C ATOM 1809 C LYS A 117 16.627 -15.045 -8.638 1.00 0.47 C ATOM 1810 O LYS A 117 17.850 -14.911 -8.596 1.00 0.52 O ATOM 1811 CB LYS A 117 16.300 -12.852 -9.810 1.00 0.53 C ATOM 1812 CG LYS A 117 15.627 -12.057 -10.922 1.00 0.61 C ATOM 1813 CD LYS A 117 15.816 -12.712 -12.285 1.00 1.20 C ATOM 1814 CE LYS A 117 15.129 -11.915 -13.388 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.220 -12.592 -14.707 1.00 1.90 N ATOM 0 H LYS A 117 14.057 -13.525 -8.795 1.00 0.43 H new ATOM 0 HA LYS A 117 15.918 -14.797 -10.644 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.140 -12.338 -8.862 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.375 -12.866 -9.987 1.00 0.53 H new ATOM 0 HG2 LYS A 117 14.562 -11.964 -10.708 1.00 0.61 H new ATOM 0 HG3 LYS A 117 16.036 -11.047 -10.945 1.00 0.61 H new ATOM 0 HD2 LYS A 117 16.880 -12.797 -12.505 1.00 1.20 H new ATOM 0 HD3 LYS A 117 15.414 -13.725 -12.262 1.00 1.20 H new ATOM 0 HE2 LYS A 117 14.081 -11.767 -13.129 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.583 -10.926 -13.457 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.740 -12.015 -15.427 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.220 -12.710 -14.968 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 14.764 -13.525 -14.650 1.00 1.90 H new ATOM 1829 N GLU A 118 15.946 -15.825 -7.797 1.00 0.45 N ATOM 1830 CA GLU A 118 16.600 -16.671 -6.794 1.00 0.49 C ATOM 1831 C GLU A 118 17.345 -15.821 -5.760 1.00 0.45 C ATOM 1832 O GLU A 118 18.301 -16.264 -5.128 1.00 0.55 O ATOM 1833 CB GLU A 118 17.552 -17.662 -7.480 1.00 0.59 C ATOM 1834 CG GLU A 118 18.049 -18.775 -6.571 1.00 1.07 C ATOM 1835 CD GLU A 118 18.957 -19.744 -7.290 1.00 1.72 C ATOM 1836 OE1 GLU A 118 20.178 -19.492 -7.341 1.00 2.54 O ATOM 1837 OE2 GLU A 118 18.454 -20.766 -7.810 1.00 1.89 O ATOM 0 H GLU A 118 14.928 -15.889 -7.791 1.00 0.45 H new ATOM 0 HA GLU A 118 15.833 -17.236 -6.264 1.00 0.49 H new ATOM 0 HB2 GLU A 118 17.043 -18.106 -8.335 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.410 -17.115 -7.869 1.00 0.59 H new ATOM 0 HG2 GLU A 118 18.583 -18.339 -5.727 1.00 1.07 H new ATOM 0 HG3 GLU A 118 17.195 -19.316 -6.163 1.00 1.07 H new ATOM 1844 N MET A 119 16.874 -14.603 -5.570 1.00 0.35 N ATOM 1845 CA MET A 119 17.478 -13.690 -4.616 1.00 0.33 C ATOM 1846 C MET A 119 16.604 -13.608 -3.371 1.00 0.31 C ATOM 1847 O MET A 119 16.014 -12.569 -3.068 1.00 0.27 O ATOM 1848 CB MET A 119 17.660 -12.305 -5.240 1.00 0.34 C ATOM 1849 CG MET A 119 18.430 -12.328 -6.552 1.00 0.41 C ATOM 1850 SD MET A 119 18.659 -10.686 -7.266 1.00 0.47 S ATOM 1851 CE MET A 119 16.973 -10.080 -7.249 1.00 0.44 C ATOM 0 H MET A 119 16.070 -14.220 -6.067 1.00 0.35 H new ATOM 0 HA MET A 119 18.463 -14.064 -4.336 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.680 -11.860 -5.411 1.00 0.34 H new ATOM 0 HB3 MET A 119 18.183 -11.662 -4.532 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.406 -12.785 -6.386 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.900 -12.958 -7.267 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.792 -9.483 -8.143 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.283 -10.924 -7.230 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.817 -9.464 -6.363 1.00 0.44 H new ATOM 1861 N GLN A 120 16.520 -14.723 -2.661 1.00 0.36 N ATOM 1862 CA GLN A 120 15.660 -14.839 -1.490 1.00 0.39 C ATOM 1863 C GLN A 120 16.228 -14.065 -0.304 1.00 0.41 C ATOM 1864 O GLN A 120 15.536 -13.825 0.682 1.00 0.47 O ATOM 1865 CB GLN A 120 15.480 -16.308 -1.112 1.00 0.49 C ATOM 1866 CG GLN A 120 14.727 -17.125 -2.155 1.00 0.53 C ATOM 1867 CD GLN A 120 14.683 -18.602 -1.809 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.731 -18.976 -0.636 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.564 -19.449 -2.821 1.00 0.70 N ATOM 0 H GLN A 120 17.044 -15.571 -2.878 1.00 0.36 H new ATOM 0 HA GLN A 120 14.691 -14.409 -1.744 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.461 -16.755 -0.953 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.946 -16.366 -0.164 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.709 -16.745 -2.245 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.203 -16.996 -3.127 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.528 -19.098 -3.778 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.509 -20.452 -2.643 1.00 0.70 H new ATOM 1878 N VAL A 121 17.492 -13.687 -0.392 1.00 0.39 N ATOM 1879 CA VAL A 121 18.100 -12.862 0.639 1.00 0.44 C ATOM 1880 C VAL A 121 17.786 -11.391 0.404 1.00 0.38 C ATOM 1881 O VAL A 121 17.979 -10.554 1.282 1.00 0.47 O ATOM 1882 CB VAL A 121 19.626 -13.054 0.706 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.964 -14.497 1.028 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.280 -12.625 -0.595 1.00 0.92 C ATOM 0 H VAL A 121 18.114 -13.936 -1.161 1.00 0.39 H new ATOM 0 HA VAL A 121 17.674 -13.180 1.591 1.00 0.44 H new ATOM 0 HB VAL A 121 20.017 -12.423 1.504 1.00 0.52 H new ATOM 0 HG11 VAL A 121 21.047 -14.616 1.072 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.530 -14.766 1.991 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.559 -15.147 0.253 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.358 -12.769 -0.525 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.886 -13.225 -1.415 1.00 0.92 H new ATOM 0 HG23 VAL A 121 20.066 -11.572 -0.780 1.00 0.92 H new ATOM 1894 N LEU A 122 17.291 -11.080 -0.787 1.00 0.30 N ATOM 1895 CA LEU A 122 16.942 -9.710 -1.127 1.00 0.27 C ATOM 1896 C LEU A 122 15.502 -9.396 -0.757 1.00 0.23 C ATOM 1897 O LEU A 122 15.206 -8.288 -0.329 1.00 0.23 O ATOM 1898 CB LEU A 122 17.176 -9.435 -2.612 1.00 0.28 C ATOM 1899 CG LEU A 122 18.561 -8.890 -2.960 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.651 -9.839 -2.498 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.665 -8.652 -4.450 1.00 0.41 C ATOM 0 H LEU A 122 17.123 -11.757 -1.531 1.00 0.30 H new ATOM 0 HA LEU A 122 17.594 -9.057 -0.546 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.017 -10.360 -3.166 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.426 -8.724 -2.957 1.00 0.28 H new ATOM 0 HG LEU A 122 18.698 -7.942 -2.439 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.626 -9.427 -2.758 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.588 -9.967 -1.417 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.523 -10.805 -2.986 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.655 -8.264 -4.688 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.506 -9.591 -4.980 1.00 0.41 H new ATOM 0 HD23 LEU A 122 17.909 -7.930 -4.757 1.00 0.41 H new ATOM 1913 N VAL A 123 14.613 -10.374 -0.902 1.00 0.23 N ATOM 1914 CA VAL A 123 13.198 -10.164 -0.612 1.00 0.25 C ATOM 1915 C VAL A 123 12.989 -9.735 0.842 1.00 0.27 C ATOM 1916 O VAL A 123 12.168 -8.864 1.134 1.00 0.31 O ATOM 1917 CB VAL A 123 12.356 -11.425 -0.923 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.836 -12.628 -0.131 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.885 -11.163 -0.651 1.00 0.31 C ATOM 0 H VAL A 123 14.846 -11.316 -1.217 1.00 0.23 H new ATOM 0 HA VAL A 123 12.856 -9.361 -1.264 1.00 0.25 H new ATOM 0 HB VAL A 123 12.483 -11.654 -1.981 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.221 -13.494 -0.376 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.875 -12.838 -0.383 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.757 -12.417 0.935 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.308 -12.060 -0.875 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.751 -10.898 0.398 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.539 -10.343 -1.280 1.00 0.31 H new ATOM 1929 N SER A 124 13.762 -10.323 1.738 1.00 0.29 N ATOM 1930 CA SER A 124 13.675 -10.002 3.152 1.00 0.35 C ATOM 1931 C SER A 124 14.279 -8.627 3.438 1.00 0.34 C ATOM 1932 O SER A 124 13.824 -7.906 4.331 1.00 0.44 O ATOM 1933 CB SER A 124 14.379 -11.093 3.961 1.00 0.43 C ATOM 1934 OG SER A 124 15.543 -11.544 3.285 1.00 1.32 O ATOM 0 H SER A 124 14.461 -11.030 1.510 1.00 0.29 H new ATOM 0 HA SER A 124 12.626 -9.962 3.447 1.00 0.35 H new ATOM 0 HB2 SER A 124 14.649 -10.707 4.944 1.00 0.43 H new ATOM 0 HB3 SER A 124 13.699 -11.929 4.123 1.00 0.43 H new ATOM 0 HG SER A 124 15.981 -12.240 3.817 1.00 1.32 H new ATOM 1940 N ARG A 125 15.287 -8.258 2.656 1.00 0.28 N ATOM 1941 CA ARG A 125 15.940 -6.962 2.806 1.00 0.31 C ATOM 1942 C ARG A 125 15.103 -5.858 2.168 1.00 0.24 C ATOM 1943 O ARG A 125 15.178 -4.702 2.578 1.00 0.24 O ATOM 1944 CB ARG A 125 17.345 -6.998 2.193 1.00 0.41 C ATOM 1945 CG ARG A 125 18.341 -7.821 3.005 1.00 0.91 C ATOM 1946 CD ARG A 125 19.640 -8.069 2.243 1.00 0.74 C ATOM 1947 NE ARG A 125 20.240 -6.841 1.730 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.304 -6.817 0.928 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.905 -7.952 0.579 1.00 1.28 N ATOM 1950 NH2 ARG A 125 21.776 -5.657 0.493 1.00 1.84 N ATOM 0 H ARG A 125 15.671 -8.839 1.910 1.00 0.28 H new ATOM 0 HA ARG A 125 16.032 -6.745 3.870 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.283 -7.408 1.185 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.719 -5.978 2.100 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.562 -7.303 3.938 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.889 -8.777 3.270 1.00 0.91 H new ATOM 0 HD2 ARG A 125 20.352 -8.568 2.901 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.444 -8.747 1.412 1.00 0.74 H new ATOM 0 HE ARG A 125 19.821 -5.951 2.001 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.551 -8.844 0.926 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.719 -7.930 -0.035 1.00 1.28 H new ATOM 0 HH21 ARG A 125 21.325 -4.786 0.772 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.590 -5.636 -0.121 1.00 1.84 H new ATOM 1964 N ILE A 126 14.301 -6.221 1.174 1.00 0.21 N ATOM 1965 CA ILE A 126 13.367 -5.287 0.556 1.00 0.19 C ATOM 1966 C ILE A 126 12.438 -4.699 1.606 1.00 0.19 C ATOM 1967 O ILE A 126 12.271 -3.480 1.687 1.00 0.19 O ATOM 1968 CB ILE A 126 12.544 -5.983 -0.545 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.428 -6.242 -1.760 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.326 -5.155 -0.934 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.741 -7.023 -2.847 1.00 0.23 C ATOM 0 H ILE A 126 14.279 -7.160 0.777 1.00 0.21 H new ATOM 0 HA ILE A 126 13.943 -4.482 0.100 1.00 0.19 H new ATOM 0 HB ILE A 126 12.182 -6.934 -0.156 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.763 -5.287 -2.166 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.319 -6.783 -1.442 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.767 -5.674 -1.713 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.688 -5.014 -0.062 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.650 -4.183 -1.307 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.429 -7.170 -3.680 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.430 -7.992 -2.458 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.866 -6.473 -3.192 1.00 0.23 H new ATOM 1983 N ALA A 127 11.848 -5.571 2.414 1.00 0.22 N ATOM 1984 CA ALA A 127 10.983 -5.145 3.501 1.00 0.25 C ATOM 1985 C ALA A 127 11.714 -4.195 4.441 1.00 0.24 C ATOM 1986 O ALA A 127 11.121 -3.263 4.981 1.00 0.26 O ATOM 1987 CB ALA A 127 10.467 -6.351 4.263 1.00 0.30 C ATOM 0 H ALA A 127 11.955 -6.582 2.334 1.00 0.22 H new ATOM 0 HA ALA A 127 10.136 -4.609 3.073 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.820 -6.019 5.075 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.901 -6.993 3.588 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.308 -6.909 4.674 1.00 0.30 H new ATOM 1993 N ALA A 128 13.008 -4.430 4.611 1.00 0.22 N ATOM 1994 CA ALA A 128 13.830 -3.589 5.461 1.00 0.23 C ATOM 1995 C ALA A 128 13.993 -2.199 4.856 1.00 0.19 C ATOM 1996 O ALA A 128 13.713 -1.199 5.514 1.00 0.19 O ATOM 1997 CB ALA A 128 15.186 -4.233 5.690 1.00 0.27 C ATOM 0 H ALA A 128 13.510 -5.200 4.168 1.00 0.22 H new ATOM 0 HA ALA A 128 13.329 -3.483 6.423 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.791 -3.590 6.329 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.052 -5.201 6.172 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.690 -4.370 4.733 1.00 0.27 H new ATOM 2003 N TRP A 129 14.424 -2.142 3.598 1.00 0.17 N ATOM 2004 CA TRP A 129 14.642 -0.860 2.923 1.00 0.17 C ATOM 2005 C TRP A 129 13.342 -0.070 2.846 1.00 0.15 C ATOM 2006 O TRP A 129 13.324 1.138 3.080 1.00 0.18 O ATOM 2007 CB TRP A 129 15.201 -1.058 1.509 1.00 0.20 C ATOM 2008 CG TRP A 129 16.427 -1.915 1.456 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.482 -1.899 2.322 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.732 -2.904 0.468 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.416 -2.832 1.941 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.979 -3.459 0.804 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.067 -3.377 -0.667 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.573 -4.464 0.048 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.659 -4.373 -1.418 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.902 -4.909 -1.057 1.00 0.50 C ATOM 0 H TRP A 129 14.629 -2.962 3.026 1.00 0.17 H new ATOM 0 HA TRP A 129 15.373 -0.304 3.510 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.429 -1.506 0.883 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.432 -0.083 1.081 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.570 -1.249 3.180 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.292 -3.026 2.426 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.108 -2.971 -0.951 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.531 -4.879 0.324 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.156 -4.745 -2.298 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.339 -5.689 -1.663 1.00 0.50 H new ATOM 2027 N MET A 130 12.258 -0.771 2.537 1.00 0.16 N ATOM 2028 CA MET A 130 10.941 -0.152 2.424 1.00 0.21 C ATOM 2029 C MET A 130 10.519 0.469 3.747 1.00 0.19 C ATOM 2030 O MET A 130 10.149 1.643 3.806 1.00 0.21 O ATOM 2031 CB MET A 130 9.905 -1.190 2.001 1.00 0.29 C ATOM 2032 CG MET A 130 9.975 -1.596 0.539 1.00 0.33 C ATOM 2033 SD MET A 130 8.978 -0.531 -0.512 1.00 0.71 S ATOM 2034 CE MET A 130 7.373 -0.747 0.254 1.00 0.29 C ATOM 0 H MET A 130 12.265 -1.775 2.359 1.00 0.16 H new ATOM 0 HA MET A 130 11.002 0.632 1.669 1.00 0.21 H new ATOM 0 HB2 MET A 130 10.029 -2.080 2.618 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.910 -0.796 2.207 1.00 0.29 H new ATOM 0 HG2 MET A 130 11.012 -1.565 0.205 1.00 0.33 H new ATOM 0 HG3 MET A 130 9.637 -2.627 0.434 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.715 -1.287 -0.426 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.484 -1.314 1.178 1.00 0.29 H new ATOM 0 HE3 MET A 130 6.942 0.229 0.477 1.00 0.29 H new ATOM 2044 N ALA A 131 10.595 -0.324 4.810 1.00 0.18 N ATOM 2045 CA ALA A 131 10.174 0.113 6.132 1.00 0.20 C ATOM 2046 C ALA A 131 11.030 1.271 6.618 1.00 0.21 C ATOM 2047 O ALA A 131 10.524 2.236 7.188 1.00 0.23 O ATOM 2048 CB ALA A 131 10.247 -1.042 7.113 1.00 0.23 C ATOM 0 H ALA A 131 10.948 -1.281 4.779 1.00 0.18 H new ATOM 0 HA ALA A 131 9.142 0.457 6.066 1.00 0.20 H new ATOM 0 HB1 ALA A 131 9.930 -0.703 8.099 1.00 0.23 H new ATOM 0 HB2 ALA A 131 9.592 -1.846 6.778 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.272 -1.408 7.168 1.00 0.23 H new ATOM 2054 N THR A 132 12.326 1.167 6.375 1.00 0.22 N ATOM 2055 CA THR A 132 13.268 2.198 6.773 1.00 0.25 C ATOM 2056 C THR A 132 12.987 3.506 6.032 1.00 0.24 C ATOM 2057 O THR A 132 12.859 4.563 6.652 1.00 0.25 O ATOM 2058 CB THR A 132 14.713 1.742 6.504 1.00 0.31 C ATOM 2059 OG1 THR A 132 14.930 0.464 7.111 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.714 2.740 7.058 1.00 0.37 C ATOM 0 H THR A 132 12.752 0.371 5.900 1.00 0.22 H new ATOM 0 HA THR A 132 13.146 2.371 7.842 1.00 0.25 H new ATOM 0 HB THR A 132 14.856 1.674 5.426 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.527 -0.235 6.555 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.726 2.392 6.853 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.561 3.710 6.584 1.00 0.37 H new ATOM 0 HG23 THR A 132 15.574 2.836 8.135 1.00 0.37 H new ATOM 2068 N TYR A 133 12.881 3.430 4.707 1.00 0.23 N ATOM 2069 CA TYR A 133 12.616 4.615 3.897 1.00 0.24 C ATOM 2070 C TYR A 133 11.296 5.260 4.310 1.00 0.21 C ATOM 2071 O TYR A 133 11.200 6.485 4.422 1.00 0.23 O ATOM 2072 CB TYR A 133 12.586 4.260 2.406 1.00 0.27 C ATOM 2073 CG TYR A 133 12.367 5.456 1.509 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.426 6.272 1.135 1.00 0.42 C ATOM 2075 CD2 TYR A 133 11.102 5.766 1.033 1.00 0.36 C ATOM 2076 CE1 TYR A 133 13.228 7.362 0.313 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.895 6.854 0.211 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.970 7.659 -0.134 1.00 0.51 C ATOM 2079 OH TYR A 133 11.761 8.735 -0.962 1.00 0.61 O ATOM 0 H TYR A 133 12.974 2.565 4.175 1.00 0.23 H new ATOM 0 HA TYR A 133 13.423 5.328 4.066 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.526 3.780 2.135 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.794 3.533 2.229 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.420 6.050 1.493 1.00 0.42 H new ATOM 0 HD2 TYR A 133 10.264 5.144 1.311 1.00 0.36 H new ATOM 0 HE1 TYR A 133 14.065 7.980 0.023 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.906 7.077 -0.160 1.00 0.45 H new ATOM 0 HH TYR A 133 12.615 9.180 -1.143 1.00 0.61 H new ATOM 2089 N LEU A 134 10.291 4.425 4.546 1.00 0.20 N ATOM 2090 CA LEU A 134 8.989 4.888 4.995 1.00 0.20 C ATOM 2091 C LEU A 134 9.099 5.575 6.354 1.00 0.21 C ATOM 2092 O LEU A 134 8.645 6.701 6.524 1.00 0.24 O ATOM 2093 CB LEU A 134 8.017 3.705 5.062 1.00 0.20 C ATOM 2094 CG LEU A 134 6.740 3.925 5.877 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.922 5.070 5.312 1.00 0.26 C ATOM 2096 CD2 LEU A 134 5.913 2.653 5.914 1.00 0.26 C ATOM 0 H LEU A 134 10.357 3.414 4.431 1.00 0.20 H new ATOM 0 HA LEU A 134 8.608 5.619 4.282 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.732 3.438 4.044 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.547 2.849 5.480 1.00 0.20 H new ATOM 0 HG LEU A 134 7.029 4.187 6.895 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.021 5.203 5.911 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.513 5.986 5.336 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.644 4.845 4.282 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.008 2.824 6.497 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.641 2.366 4.898 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.495 1.854 6.374 1.00 0.26 H new ATOM 2108 N ASN A 135 9.739 4.908 7.299 1.00 0.24 N ATOM 2109 CA ASN A 135 9.808 5.395 8.672 1.00 0.29 C ATOM 2110 C ASN A 135 10.666 6.657 8.794 1.00 0.30 C ATOM 2111 O ASN A 135 10.370 7.539 9.598 1.00 0.33 O ATOM 2112 CB ASN A 135 10.347 4.289 9.586 1.00 0.37 C ATOM 2113 CG ASN A 135 10.541 4.743 11.021 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.606 4.719 11.824 1.00 1.17 O ATOM 2115 ND2 ASN A 135 11.762 5.120 11.367 1.00 1.46 N ATOM 0 H ASN A 135 10.221 4.023 7.142 1.00 0.24 H new ATOM 0 HA ASN A 135 8.798 5.665 8.982 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.658 3.444 9.569 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.299 3.933 9.192 1.00 0.37 H new ATOM 0 HD21 ASN A 135 11.955 5.404 12.327 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.510 5.126 10.673 1.00 1.46 H new ATOM 2122 N ASP A 136 11.722 6.748 7.997 1.00 0.32 N ATOM 2123 CA ASP A 136 12.636 7.886 8.086 1.00 0.37 C ATOM 2124 C ASP A 136 12.232 9.030 7.164 1.00 0.34 C ATOM 2125 O ASP A 136 12.007 10.147 7.620 1.00 0.36 O ATOM 2126 CB ASP A 136 14.076 7.472 7.764 1.00 0.46 C ATOM 2127 CG ASP A 136 14.755 6.738 8.900 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.310 7.406 9.799 1.00 1.27 O ATOM 2129 OD2 ASP A 136 14.761 5.493 8.889 1.00 2.07 O ATOM 0 H ASP A 136 11.968 6.057 7.288 1.00 0.32 H new ATOM 0 HA ASP A 136 12.578 8.236 9.117 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.075 6.836 6.879 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.656 8.361 7.517 1.00 0.46 H new ATOM 2134 N HIS A 137 12.162 8.760 5.866 1.00 0.33 N ATOM 2135 CA HIS A 137 12.012 9.832 4.878 1.00 0.35 C ATOM 2136 C HIS A 137 10.555 10.115 4.525 1.00 0.29 C ATOM 2137 O HIS A 137 10.196 11.251 4.217 1.00 0.32 O ATOM 2138 CB HIS A 137 12.805 9.515 3.603 1.00 0.45 C ATOM 2139 CG HIS A 137 14.289 9.479 3.818 1.00 0.63 C ATOM 2140 ND1 HIS A 137 15.057 8.353 3.608 1.00 1.07 N ATOM 2141 CD2 HIS A 137 15.148 10.445 4.220 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.318 8.628 3.875 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.403 9.890 4.246 1.00 1.34 N ATOM 0 H HIS A 137 12.206 7.820 5.472 1.00 0.33 H new ATOM 0 HA HIS A 137 12.414 10.732 5.342 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.479 8.552 3.211 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.573 10.263 2.845 1.00 0.45 H new ATOM 0 HD1 HIS A 137 14.704 7.449 3.295 1.00 1.07 H new ATOM 0 HD2 HIS A 137 14.893 11.463 4.473 1.00 1.53 H new ATOM 0 HE1 HIS A 137 17.143 7.935 3.802 1.00 0.95 H new ATOM 2152 N LEU A 138 9.719 9.091 4.562 1.00 0.26 N ATOM 2153 CA LEU A 138 8.343 9.224 4.100 1.00 0.25 C ATOM 2154 C LEU A 138 7.415 9.700 5.219 1.00 0.24 C ATOM 2155 O LEU A 138 6.526 10.523 4.987 1.00 0.25 O ATOM 2156 CB LEU A 138 7.867 7.888 3.532 1.00 0.23 C ATOM 2157 CG LEU A 138 6.521 7.919 2.810 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.534 8.960 1.704 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.203 6.547 2.245 1.00 0.22 C ATOM 0 H LEU A 138 9.965 8.162 4.905 1.00 0.26 H new ATOM 0 HA LEU A 138 8.313 9.982 3.317 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.622 7.519 2.838 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.805 7.168 4.348 1.00 0.23 H new ATOM 0 HG LEU A 138 5.746 8.192 3.526 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.567 8.968 1.201 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.728 9.943 2.132 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.316 8.717 0.984 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.242 6.579 1.732 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.981 6.255 1.540 1.00 0.22 H new ATOM 0 HD23 LEU A 138 6.157 5.821 3.057 1.00 0.22 H new ATOM 2171 N GLU A 139 7.636 9.182 6.424 1.00 0.26 N ATOM 2172 CA GLU A 139 6.840 9.543 7.600 1.00 0.29 C ATOM 2173 C GLU A 139 6.705 11.068 7.780 1.00 0.30 C ATOM 2174 O GLU A 139 5.597 11.548 7.995 1.00 0.30 O ATOM 2175 CB GLU A 139 7.441 8.912 8.863 1.00 0.36 C ATOM 2176 CG GLU A 139 6.622 9.146 10.128 1.00 0.52 C ATOM 2177 CD GLU A 139 5.368 8.291 10.197 1.00 1.00 C ATOM 2178 OE1 GLU A 139 4.333 8.692 9.630 1.00 1.74 O ATOM 2179 OE2 GLU A 139 5.416 7.215 10.842 1.00 1.46 O ATOM 0 H GLU A 139 8.370 8.501 6.616 1.00 0.26 H new ATOM 0 HA GLU A 139 5.836 9.150 7.437 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.546 7.839 8.705 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.444 9.312 9.014 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.244 8.938 10.999 1.00 0.52 H new ATOM 0 HG3 GLU A 139 6.340 10.198 10.181 1.00 0.52 H new ATOM 2186 N PRO A 140 7.808 11.862 7.700 1.00 0.33 N ATOM 2187 CA PRO A 140 7.735 13.325 7.856 1.00 0.36 C ATOM 2188 C PRO A 140 6.653 13.976 6.993 1.00 0.31 C ATOM 2189 O PRO A 140 5.982 14.910 7.434 1.00 0.36 O ATOM 2190 CB PRO A 140 9.117 13.804 7.416 1.00 0.42 C ATOM 2191 CG PRO A 140 10.017 12.663 7.725 1.00 0.42 C ATOM 2192 CD PRO A 140 9.203 11.416 7.494 1.00 0.35 C ATOM 0 HA PRO A 140 7.472 13.596 8.878 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.134 14.048 6.354 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.416 14.704 7.954 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.899 12.677 7.084 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.370 12.713 8.755 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.352 11.021 6.489 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.477 10.624 8.191 1.00 0.35 H new ATOM 2200 N TRP A 141 6.475 13.479 5.774 1.00 0.28 N ATOM 2201 CA TRP A 141 5.468 14.026 4.872 1.00 0.25 C ATOM 2202 C TRP A 141 4.084 13.527 5.275 1.00 0.22 C ATOM 2203 O TRP A 141 3.120 14.296 5.326 1.00 0.22 O ATOM 2204 CB TRP A 141 5.766 13.638 3.416 1.00 0.29 C ATOM 2205 CG TRP A 141 4.868 14.325 2.433 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.072 15.543 1.850 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.618 13.842 1.926 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.026 15.845 1.015 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.121 14.819 1.044 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.872 12.679 2.132 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.912 14.669 0.372 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.674 12.531 1.465 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.203 13.520 0.594 1.00 0.36 C ATOM 0 H TRP A 141 7.012 12.702 5.389 1.00 0.28 H new ATOM 0 HA TRP A 141 5.494 15.113 4.946 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.803 13.882 3.185 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.660 12.559 3.304 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.931 16.176 2.021 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.937 16.697 0.462 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.227 11.910 2.802 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.547 15.431 -0.300 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.089 11.636 1.618 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.261 13.373 0.087 1.00 0.36 H new ATOM 2224 N ILE A 142 4.005 12.238 5.577 1.00 0.20 N ATOM 2225 CA ILE A 142 2.759 11.608 5.993 1.00 0.19 C ATOM 2226 C ILE A 142 2.232 12.266 7.264 1.00 0.20 C ATOM 2227 O ILE A 142 1.116 12.791 7.294 1.00 0.20 O ATOM 2228 CB ILE A 142 2.977 10.099 6.246 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.402 9.395 4.958 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.720 9.455 6.806 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.788 7.951 5.164 1.00 0.23 C ATOM 0 H ILE A 142 4.801 11.601 5.541 1.00 0.20 H new ATOM 0 HA ILE A 142 2.028 11.734 5.194 1.00 0.19 H new ATOM 0 HB ILE A 142 3.774 9.993 6.982 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.585 9.446 4.238 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.245 9.930 4.521 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.900 8.393 6.975 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.455 9.933 7.749 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.902 9.576 6.096 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.079 7.512 4.209 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.625 7.894 5.860 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.939 7.402 5.572 1.00 0.23 H new ATOM 2243 N GLN A 143 3.066 12.252 8.295 1.00 0.25 N ATOM 2244 CA GLN A 143 2.717 12.781 9.604 1.00 0.30 C ATOM 2245 C GLN A 143 2.331 14.259 9.526 1.00 0.29 C ATOM 2246 O GLN A 143 1.395 14.698 10.193 1.00 0.31 O ATOM 2247 CB GLN A 143 3.901 12.587 10.558 1.00 0.40 C ATOM 2248 CG GLN A 143 3.609 12.954 12.002 1.00 0.51 C ATOM 2249 CD GLN A 143 2.456 12.158 12.583 1.00 0.95 C ATOM 2250 OE1 GLN A 143 1.304 12.586 12.520 1.00 1.51 O ATOM 2251 NE2 GLN A 143 2.751 10.992 13.140 1.00 1.60 N ATOM 0 H GLN A 143 4.010 11.870 8.245 1.00 0.25 H new ATOM 0 HA GLN A 143 1.850 12.238 9.979 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.218 11.545 10.518 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.739 13.189 10.205 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.502 12.785 12.604 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.379 14.018 12.064 1.00 0.51 H new ATOM 0 HE21 GLN A 143 3.719 10.673 13.172 1.00 1.60 H new ATOM 0 HE22 GLN A 143 2.010 10.414 13.536 1.00 1.60 H new ATOM 2260 N GLU A 144 3.040 15.019 8.696 1.00 0.29 N ATOM 2261 CA GLU A 144 2.775 16.452 8.554 1.00 0.33 C ATOM 2262 C GLU A 144 1.366 16.700 8.019 1.00 0.29 C ATOM 2263 O GLU A 144 0.733 17.704 8.349 1.00 0.35 O ATOM 2264 CB GLU A 144 3.807 17.112 7.635 1.00 0.41 C ATOM 2265 CG GLU A 144 3.611 18.612 7.486 1.00 0.64 C ATOM 2266 CD GLU A 144 4.693 19.263 6.656 1.00 1.09 C ATOM 2267 OE1 GLU A 144 5.783 19.536 7.200 1.00 1.25 O ATOM 2268 OE2 GLU A 144 4.464 19.508 5.454 1.00 1.75 O ATOM 0 H GLU A 144 3.800 14.670 8.112 1.00 0.29 H new ATOM 0 HA GLU A 144 2.853 16.899 9.545 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.806 16.921 8.027 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.756 16.647 6.651 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.642 18.803 7.026 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.591 19.071 8.474 1.00 0.64 H new ATOM 2275 N ASN A 145 0.874 15.780 7.200 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.469 15.903 6.640 1.00 0.28 C ATOM 2277 C ASN A 145 -1.500 15.218 7.532 1.00 0.30 C ATOM 2278 O ASN A 145 -2.647 15.022 7.131 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.532 15.321 5.220 1.00 0.32 C ATOM 2280 CG ASN A 145 0.129 16.221 4.188 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.515 17.117 3.635 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.405 15.989 3.905 1.00 0.33 N ATOM 0 H ASN A 145 1.380 14.944 6.909 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.705 16.966 6.589 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.046 14.345 5.210 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.574 15.161 4.943 1.00 0.32 H new ATOM 0 HD21 ASN A 145 1.885 16.560 3.210 1.00 0.33 H new ATOM 0 HD22 ASN A 145 1.905 15.239 4.383 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.095 14.859 8.744 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.028 14.278 9.692 1.00 0.30 C ATOM 2291 C GLY A 146 -1.705 12.837 10.024 1.00 0.30 C ATOM 2292 O GLY A 146 -2.147 12.314 11.047 1.00 0.41 O ATOM 0 H GLY A 146 -0.140 14.959 9.087 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.022 14.868 10.609 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.037 14.335 9.283 1.00 0.30 H new ATOM 2296 N GLY A 147 -0.939 12.193 9.161 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.575 10.813 9.382 1.00 0.22 C ATOM 2298 C GLY A 147 -1.364 9.880 8.493 1.00 0.19 C ATOM 2299 O GLY A 147 -2.086 10.332 7.599 1.00 0.20 O ATOM 0 H GLY A 147 -0.561 12.604 8.307 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.490 10.682 9.193 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.747 10.554 10.427 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.233 8.582 8.733 1.00 0.20 N ATOM 2304 CA TRP A 148 -1.960 7.585 7.958 1.00 0.21 C ATOM 2305 C TRP A 148 -3.466 7.804 8.033 1.00 0.23 C ATOM 2306 O TRP A 148 -4.177 7.519 7.074 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.629 6.167 8.428 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.265 5.696 8.020 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.751 5.299 8.842 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.230 5.567 6.682 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.840 4.919 8.096 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.546 5.077 6.769 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.313 5.815 5.416 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.324 4.828 5.644 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.463 5.569 4.300 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.770 5.078 4.421 1.00 0.24 C ATOM 0 H TRP A 148 -0.630 8.195 9.459 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.641 7.700 6.922 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.707 6.127 9.514 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.375 5.479 8.030 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.705 5.286 9.921 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.724 4.575 8.470 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.320 6.192 5.314 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.332 4.450 5.734 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.056 5.758 3.318 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.351 4.894 3.529 1.00 0.24 H new ATOM 2327 N ASP A 149 -3.945 8.321 9.167 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.381 8.572 9.363 1.00 0.31 C ATOM 2329 C ASP A 149 -5.977 9.368 8.204 1.00 0.30 C ATOM 2330 O ASP A 149 -7.120 9.137 7.805 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.645 9.311 10.683 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.528 8.408 11.894 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -6.393 7.527 12.075 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -4.562 8.568 12.667 1.00 1.94 O ATOM 0 H ASP A 149 -3.363 8.575 9.965 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.866 7.597 9.401 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -4.939 10.135 10.780 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.643 9.748 10.656 1.00 0.40 H new ATOM 2339 N THR A 150 -5.196 10.290 7.660 1.00 0.27 N ATOM 2340 CA THR A 150 -5.632 11.097 6.531 1.00 0.29 C ATOM 2341 C THR A 150 -5.792 10.231 5.281 1.00 0.28 C ATOM 2342 O THR A 150 -6.846 10.228 4.640 1.00 0.33 O ATOM 2343 CB THR A 150 -4.614 12.223 6.256 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.397 12.976 7.458 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.102 13.151 5.155 1.00 0.37 C ATOM 0 H THR A 150 -4.252 10.498 7.985 1.00 0.27 H new ATOM 0 HA THR A 150 -6.597 11.539 6.779 1.00 0.29 H new ATOM 0 HB THR A 150 -3.680 11.767 5.928 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.661 13.908 7.312 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.363 13.934 4.985 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.246 12.582 4.237 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.048 13.604 5.453 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.746 9.476 4.964 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.719 8.654 3.761 1.00 0.25 C ATOM 2355 C PHE A 151 -5.739 7.519 3.843 1.00 0.26 C ATOM 2356 O PHE A 151 -6.390 7.184 2.850 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.310 8.090 3.551 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.171 7.247 2.316 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.327 7.807 1.062 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.879 5.897 2.412 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.195 7.038 -0.076 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.749 5.121 1.278 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.922 5.685 0.035 1.00 0.34 C ATOM 0 H PHE A 151 -3.899 9.417 5.529 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.987 9.281 2.910 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.602 8.917 3.496 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.035 7.492 4.420 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.555 8.859 0.972 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.752 5.446 3.385 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.304 7.490 -1.051 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.511 4.071 1.366 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.845 5.074 -0.852 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.887 6.944 5.031 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.834 5.859 5.243 1.00 0.29 C ATOM 2375 C VAL A 152 -8.262 6.329 5.001 1.00 0.35 C ATOM 2376 O VAL A 152 -9.070 5.609 4.429 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.709 5.276 6.666 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.759 4.205 6.912 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.317 4.706 6.875 1.00 0.28 C ATOM 0 H VAL A 152 -5.361 7.213 5.863 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.595 5.074 4.526 1.00 0.29 H new ATOM 0 HB VAL A 152 -6.875 6.082 7.381 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.648 3.812 7.922 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.753 4.637 6.798 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.630 3.397 6.192 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.239 4.297 7.882 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.134 3.915 6.147 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.577 5.496 6.746 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.557 7.550 5.416 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.883 8.113 5.220 1.00 0.46 C ATOM 2391 C GLU A 153 -10.134 8.402 3.737 1.00 0.51 C ATOM 2392 O GLU A 153 -11.277 8.415 3.282 1.00 0.62 O ATOM 2393 CB GLU A 153 -10.045 9.387 6.051 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.449 9.967 6.013 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.599 11.182 6.899 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -11.157 12.276 6.494 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -12.161 11.048 8.005 1.00 1.42 O ATOM 0 H GLU A 153 -7.899 8.169 5.889 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.621 7.384 5.554 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.778 9.172 7.086 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.342 10.137 5.690 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.699 10.237 4.987 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -12.162 9.204 6.325 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.060 8.619 2.983 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.177 8.903 1.554 1.00 0.59 C ATOM 2406 C LEU A 154 -9.572 7.651 0.775 1.00 0.68 C ATOM 2407 O LEU A 154 -10.522 7.674 -0.008 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.866 9.474 0.997 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.459 10.839 1.550 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.093 11.242 1.014 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.500 11.890 1.195 1.00 0.67 C ATOM 0 H LEU A 154 -8.103 8.604 3.335 1.00 0.50 H new ATOM 0 HA LEU A 154 -9.962 9.649 1.433 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.064 8.764 1.201 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -7.954 9.551 -0.087 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.398 10.768 2.636 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.817 12.216 1.417 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.351 10.502 1.314 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.131 11.297 -0.074 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.194 12.856 1.597 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.591 11.960 0.111 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.462 11.608 1.622 1.00 0.67 H new ATOM 2423 N TYR A 155 -8.858 6.554 0.998 1.00 0.75 N ATOM 2424 CA TYR A 155 -9.117 5.323 0.252 1.00 0.90 C ATOM 2425 C TYR A 155 -9.965 4.343 1.053 1.00 0.97 C ATOM 2426 O TYR A 155 -10.195 3.210 0.626 1.00 1.15 O ATOM 2427 CB TYR A 155 -7.809 4.662 -0.199 1.00 0.98 C ATOM 2428 CG TYR A 155 -7.284 5.228 -1.499 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -7.800 4.795 -2.710 1.00 1.05 C ATOM 2430 CD2 TYR A 155 -6.288 6.196 -1.519 1.00 0.98 C ATOM 2431 CE1 TYR A 155 -7.343 5.308 -3.904 1.00 1.10 C ATOM 2432 CE2 TYR A 155 -5.823 6.716 -2.714 1.00 1.03 C ATOM 2433 CZ TYR A 155 -6.358 6.267 -3.904 1.00 1.08 C ATOM 2434 OH TYR A 155 -5.910 6.780 -5.100 1.00 1.17 O ATOM 0 H TYR A 155 -8.103 6.488 1.681 1.00 0.75 H new ATOM 0 HA TYR A 155 -9.684 5.602 -0.636 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -7.056 4.790 0.578 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -7.970 3.590 -0.313 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -8.574 4.042 -2.718 1.00 1.05 H new ATOM 0 HD2 TYR A 155 -5.870 6.548 -0.587 1.00 0.98 H new ATOM 0 HE1 TYR A 155 -7.757 4.958 -4.838 1.00 1.10 H new ATOM 0 HE2 TYR A 155 -5.047 7.467 -2.715 1.00 1.03 H new ATOM 0 HH TYR A 155 -6.607 6.677 -5.781 1.00 1.17 H new ATOM 2444 N GLY A 156 -10.447 4.790 2.201 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.339 3.974 2.995 1.00 1.02 C ATOM 2446 C GLY A 156 -12.778 4.171 2.576 1.00 1.11 C ATOM 2447 O GLY A 156 -13.602 4.631 3.362 1.00 1.68 O ATOM 0 H GLY A 156 -10.236 5.706 2.598 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -11.067 2.924 2.889 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -11.226 4.227 4.049 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.074 3.831 1.325 1.00 1.62 N ATOM 2452 CA ASN A 157 -14.412 4.015 0.767 1.00 2.05 C ATOM 2453 C ASN A 157 -15.430 3.160 1.510 1.00 2.33 C ATOM 2454 O ASN A 157 -16.587 3.550 1.658 1.00 2.52 O ATOM 2455 CB ASN A 157 -14.433 3.671 -0.726 1.00 3.21 C ATOM 2456 CG ASN A 157 -13.570 4.604 -1.557 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -13.400 5.780 -1.227 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -13.024 4.088 -2.648 1.00 4.60 N ATOM 0 H ASN A 157 -12.402 3.424 0.674 1.00 1.62 H new ATOM 0 HA ASN A 157 -14.681 5.064 0.887 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -14.088 2.646 -0.863 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -15.460 3.713 -1.089 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -12.439 4.669 -3.249 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -13.189 3.110 -2.887 1.00 4.60 H new ATOM 2465 N ASN A 158 -14.993 1.998 1.982 1.00 2.99 N ATOM 2466 CA ASN A 158 -15.861 1.120 2.764 1.00 4.03 C ATOM 2467 C ASN A 158 -16.191 1.768 4.105 1.00 4.18 C ATOM 2468 O ASN A 158 -17.344 1.769 4.542 1.00 4.81 O ATOM 2469 CB ASN A 158 -15.198 -0.239 2.992 1.00 5.08 C ATOM 2470 CG ASN A 158 -16.059 -1.171 3.825 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -16.016 -1.145 5.054 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -16.832 -2.015 3.161 1.00 6.76 N ATOM 0 H ASN A 158 -14.048 1.642 1.839 1.00 2.99 H new ATOM 0 HA ASN A 158 -16.783 0.964 2.204 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -14.990 -0.705 2.029 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -14.239 -0.093 3.489 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -17.420 -2.675 3.669 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -16.839 -2.005 2.141 1.00 6.76 H new ATOM 2479 N ALA A 159 -15.173 2.323 4.755 1.00 3.95 N ATOM 2480 CA ALA A 159 -15.363 3.032 6.015 1.00 4.72 C ATOM 2481 C ALA A 159 -16.198 4.292 5.803 1.00 4.66 C ATOM 2482 O ALA A 159 -17.085 4.606 6.598 1.00 5.63 O ATOM 2483 CB ALA A 159 -14.019 3.386 6.628 1.00 4.78 C ATOM 0 H ALA A 159 -14.207 2.295 4.429 1.00 3.95 H new ATOM 0 HA ALA A 159 -15.899 2.377 6.701 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -14.176 3.915 7.568 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -13.453 2.474 6.815 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.463 4.024 5.941 1.00 4.78 H new ATOM 2489 N ALA A 160 -15.913 5.003 4.719 1.00 3.75 N ATOM 2490 CA ALA A 160 -16.640 6.217 4.369 1.00 4.08 C ATOM 2491 C ALA A 160 -18.117 5.925 4.116 1.00 4.33 C ATOM 2492 O ALA A 160 -18.971 6.789 4.320 1.00 5.11 O ATOM 2493 CB ALA A 160 -16.016 6.873 3.147 1.00 3.59 C ATOM 0 H ALA A 160 -15.175 4.756 4.060 1.00 3.75 H new ATOM 0 HA ALA A 160 -16.572 6.903 5.213 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -16.569 7.778 2.898 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -14.979 7.130 3.362 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -16.052 6.182 2.305 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.414 4.702 3.685 1.00 3.93 N ATOM 2500 CA ALA A 161 -19.790 4.282 3.427 1.00 4.43 C ATOM 2501 C ALA A 161 -20.679 4.452 4.661 1.00 5.54 C ATOM 2502 O ALA A 161 -21.890 4.643 4.536 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.823 2.840 2.942 1.00 4.39 C ATOM 0 H ALA A 161 -17.716 3.980 3.506 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.189 4.928 2.645 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.855 2.543 2.754 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -19.247 2.753 2.021 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -19.391 2.190 3.703 1.00 4.39 H new ATOM 2509 N GLU A 162 -20.080 4.396 5.849 1.00 5.98 N ATOM 2510 CA GLU A 162 -20.827 4.603 7.084 1.00 7.23 C ATOM 2511 C GLU A 162 -21.328 6.039 7.161 1.00 7.80 C ATOM 2512 O GLU A 162 -22.497 6.286 7.458 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.961 4.302 8.306 1.00 7.72 C ATOM 2514 CG GLU A 162 -19.447 2.877 8.364 1.00 7.99 C ATOM 2515 CD GLU A 162 -18.764 2.575 9.678 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -19.464 2.190 10.635 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -17.531 2.741 9.774 1.00 9.09 O ATOM 0 H GLU A 162 -19.086 4.210 5.981 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.676 3.919 7.080 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -19.111 4.984 8.312 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -20.540 4.505 9.207 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -20.277 2.186 8.220 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.747 2.710 7.545 1.00 7.99 H new ATOM 2524 N SER A 163 -20.438 6.982 6.873 1.00 7.39 N ATOM 2525 CA SER A 163 -20.782 8.397 6.907 1.00 8.21 C ATOM 2526 C SER A 163 -21.622 8.773 5.690 1.00 8.28 C ATOM 2527 O SER A 163 -22.310 9.794 5.688 1.00 9.15 O ATOM 2528 CB SER A 163 -19.510 9.245 6.973 1.00 8.03 C ATOM 2529 OG SER A 163 -18.765 8.950 8.145 1.00 7.86 O ATOM 0 H SER A 163 -19.471 6.790 6.613 1.00 7.39 H new ATOM 0 HA SER A 163 -21.375 8.593 7.800 1.00 8.21 H new ATOM 0 HB2 SER A 163 -18.897 9.058 6.091 1.00 8.03 H new ATOM 0 HB3 SER A 163 -19.772 10.303 6.961 1.00 8.03 H new ATOM 0 HG SER A 163 -17.956 9.502 8.166 1.00 7.86 H new ATOM 2535 N ARG A 164 -21.564 7.935 4.660 1.00 7.47 N ATOM 2536 CA ARG A 164 -22.385 8.118 3.470 1.00 7.60 C ATOM 2537 C ARG A 164 -23.859 7.952 3.840 1.00 8.33 C ATOM 2538 O ARG A 164 -24.732 8.605 3.271 1.00 8.87 O ATOM 2539 CB ARG A 164 -21.963 7.112 2.386 1.00 6.69 C ATOM 2540 CG ARG A 164 -22.481 7.410 0.980 1.00 6.19 C ATOM 2541 CD ARG A 164 -23.952 7.061 0.814 1.00 5.74 C ATOM 2542 NE ARG A 164 -24.234 5.678 1.196 1.00 5.66 N ATOM 2543 CZ ARG A 164 -25.446 5.129 1.167 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -26.495 5.840 0.771 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -25.602 3.870 1.548 1.00 6.02 N ATOM 0 H ARG A 164 -20.953 7.119 4.627 1.00 7.47 H new ATOM 0 HA ARG A 164 -22.242 9.122 3.070 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -20.874 7.074 2.353 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -22.308 6.121 2.680 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -22.335 8.467 0.759 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -21.894 6.848 0.254 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -24.555 7.735 1.422 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -24.247 7.218 -0.224 1.00 5.74 H new ATOM 0 HE ARG A 164 -23.453 5.098 1.504 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -26.374 6.812 0.487 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -27.422 5.414 0.751 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -24.796 3.328 1.861 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -26.528 3.442 1.529 1.00 6.02 H new ATOM 2559 N LYS A 165 -24.125 7.088 4.812 1.00 8.52 N ATOM 2560 CA LYS A 165 -25.479 6.903 5.316 1.00 9.41 C ATOM 2561 C LYS A 165 -25.994 8.205 5.928 1.00 10.47 C ATOM 2562 O LYS A 165 -27.126 8.616 5.674 1.00 11.24 O ATOM 2563 CB LYS A 165 -25.512 5.774 6.349 1.00 9.61 C ATOM 2564 CG LYS A 165 -26.897 5.501 6.919 1.00 9.69 C ATOM 2565 CD LYS A 165 -27.875 5.075 5.835 1.00 10.12 C ATOM 2566 CE LYS A 165 -29.253 4.782 6.408 1.00 10.34 C ATOM 2567 NZ LYS A 165 -29.221 3.664 7.388 1.00 10.42 N ATOM 0 H LYS A 165 -23.422 6.505 5.266 1.00 8.52 H new ATOM 0 HA LYS A 165 -26.129 6.628 4.485 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -25.133 4.862 5.888 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -24.836 6.023 7.167 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -26.832 4.721 7.678 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -27.270 6.397 7.415 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -27.952 5.861 5.084 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -27.494 4.188 5.329 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -29.643 5.678 6.892 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -29.938 4.534 5.597 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -30.191 3.339 7.575 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -28.661 2.878 7.000 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -28.789 3.992 8.275 1.00 10.42 H new ATOM 2581 N GLY A 166 -25.150 8.858 6.719 1.00 10.61 N ATOM 2582 CA GLY A 166 -25.507 10.146 7.285 1.00 11.72 C ATOM 2583 C GLY A 166 -25.551 11.232 6.226 1.00 12.02 C ATOM 2584 O GLY A 166 -26.239 12.242 6.383 1.00 13.02 O ATOM 0 H GLY A 166 -24.224 8.518 6.979 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -26.480 10.073 7.772 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -24.785 10.418 8.055 1.00 11.72 H new ATOM 2588 N GLN A 167 -24.821 11.008 5.140 1.00 11.25 N ATOM 2589 CA GLN A 167 -24.778 11.945 4.017 1.00 11.64 C ATOM 2590 C GLN A 167 -26.142 12.023 3.336 1.00 12.01 C ATOM 2591 O GLN A 167 -26.521 13.069 2.806 1.00 12.84 O ATOM 2592 CB GLN A 167 -23.691 11.519 3.015 1.00 10.86 C ATOM 2593 CG GLN A 167 -23.612 12.375 1.761 1.00 11.50 C ATOM 2594 CD GLN A 167 -22.453 11.976 0.868 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -21.412 11.526 1.346 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -22.629 12.116 -0.433 1.00 12.41 N ATOM 0 H GLN A 167 -24.244 10.177 5.010 1.00 11.25 H new ATOM 0 HA GLN A 167 -24.530 12.937 4.395 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -22.724 11.544 3.517 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -23.872 10.485 2.722 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -24.545 12.287 1.204 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -23.507 13.422 2.044 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -23.506 12.493 -0.791 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -21.888 11.847 -1.080 1.00 12.41 H new ATOM 2605 N GLU A 168 -26.887 10.922 3.377 1.00 11.51 N ATOM 2606 CA GLU A 168 -28.249 10.891 2.849 1.00 11.94 C ATOM 2607 C GLU A 168 -29.116 11.935 3.549 1.00 13.03 C ATOM 2608 O GLU A 168 -29.947 12.595 2.928 1.00 13.73 O ATOM 2609 CB GLU A 168 -28.868 9.505 3.040 1.00 11.38 C ATOM 2610 CG GLU A 168 -28.192 8.407 2.237 1.00 10.85 C ATOM 2611 CD GLU A 168 -28.372 8.582 0.743 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -29.528 8.720 0.287 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -27.357 8.606 0.017 1.00 10.74 O ATOM 0 H GLU A 168 -26.570 10.036 3.772 1.00 11.51 H new ATOM 0 HA GLU A 168 -28.204 11.118 1.784 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -28.828 9.244 4.097 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -29.921 9.548 2.762 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -27.128 8.393 2.472 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -28.597 7.441 2.537 1.00 10.85 H new ATOM 2620 N ARG A 169 -28.899 12.085 4.848 1.00 13.26 N ATOM 2621 CA ARG A 169 -29.654 13.038 5.650 1.00 14.38 C ATOM 2622 C ARG A 169 -28.989 14.411 5.637 1.00 15.16 C ATOM 2623 O ARG A 169 -29.533 15.379 6.161 1.00 16.19 O ATOM 2624 CB ARG A 169 -29.786 12.529 7.083 1.00 14.52 C ATOM 2625 CG ARG A 169 -30.734 11.352 7.232 1.00 14.72 C ATOM 2626 CD ARG A 169 -30.729 10.808 8.652 1.00 14.96 C ATOM 2627 NE ARG A 169 -30.962 11.854 9.649 1.00 14.97 N ATOM 2628 CZ ARG A 169 -31.304 11.614 10.914 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -31.598 10.380 11.304 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -31.389 12.619 11.778 1.00 15.37 N ATOM 0 H ARG A 169 -28.202 11.556 5.372 1.00 13.26 H new ATOM 0 HA ARG A 169 -30.648 13.139 5.215 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -28.801 12.238 7.447 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -30.132 13.345 7.718 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -31.744 11.661 6.963 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -30.447 10.562 6.538 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -31.497 10.041 8.747 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -29.771 10.327 8.851 1.00 14.96 H new ATOM 0 HE ARG A 169 -30.856 12.826 9.358 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -31.563 9.611 10.634 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -31.859 10.200 12.273 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -31.193 13.572 11.473 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -31.651 12.438 12.747 1.00 15.37 H new ATOM 2644 N LEU A 170 -27.811 14.485 5.036 1.00 14.77 N ATOM 2645 CA LEU A 170 -27.088 15.743 4.922 1.00 15.59 C ATOM 2646 C LEU A 170 -27.554 16.499 3.685 1.00 16.06 C ATOM 2647 O LEU A 170 -27.812 17.704 3.732 1.00 17.05 O ATOM 2648 CB LEU A 170 -25.580 15.482 4.854 1.00 15.16 C ATOM 2649 CG LEU A 170 -24.697 16.725 4.730 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -24.855 17.626 5.945 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -23.244 16.322 4.545 1.00 15.45 C ATOM 0 H LEU A 170 -27.334 13.686 4.618 1.00 14.77 H new ATOM 0 HA LEU A 170 -27.293 16.352 5.802 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -25.284 14.936 5.750 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -25.381 14.831 4.003 1.00 15.16 H new ATOM 0 HG LEU A 170 -25.016 17.287 3.852 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -24.217 18.503 5.833 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -25.895 17.942 6.031 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -24.567 17.080 6.843 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -22.627 17.216 4.458 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -22.916 15.737 5.404 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -23.145 15.723 3.640 1.00 15.45 H new ATOM 2663 N GLU A 171 -27.672 15.776 2.576 1.00 15.42 N ATOM 2664 CA GLU A 171 -28.174 16.356 1.339 1.00 15.90 C ATOM 2665 C GLU A 171 -29.647 16.724 1.482 1.00 16.52 C ATOM 2666 O GLU A 171 -30.104 17.723 0.932 1.00 17.29 O ATOM 2667 CB GLU A 171 -27.982 15.385 0.171 1.00 15.17 C ATOM 2668 CG GLU A 171 -28.562 14.004 0.425 1.00 15.22 C ATOM 2669 CD GLU A 171 -28.542 13.130 -0.807 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -27.449 12.676 -1.196 1.00 14.68 O ATOM 2671 OE2 GLU A 171 -29.612 12.892 -1.394 1.00 15.07 O ATOM 0 H GLU A 171 -27.427 14.788 2.510 1.00 15.42 H new ATOM 0 HA GLU A 171 -27.606 17.263 1.132 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -28.446 15.806 -0.721 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -26.917 15.289 -0.039 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -27.997 13.517 1.220 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -29.588 14.104 0.778 1.00 15.22 H new ATOM 2678 N HIS A 172 -30.383 15.918 2.235 1.00 16.27 N ATOM 2679 CA HIS A 172 -31.791 16.187 2.481 1.00 16.96 C ATOM 2680 C HIS A 172 -31.944 17.110 3.684 1.00 17.80 C ATOM 2681 O HIS A 172 -31.852 16.675 4.830 1.00 18.06 O ATOM 2682 CB HIS A 172 -32.561 14.882 2.712 1.00 16.71 C ATOM 2683 CG HIS A 172 -34.024 15.085 2.975 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -34.627 14.762 4.170 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -35.002 15.583 2.186 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -35.912 15.054 4.106 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -36.164 15.555 2.912 1.00 16.80 N ATOM 0 H HIS A 172 -30.028 15.074 2.685 1.00 16.27 H new ATOM 0 HA HIS A 172 -32.208 16.678 1.602 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -32.443 14.241 1.838 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -32.119 14.354 3.557 1.00 16.71 H new ATOM 0 HD2 HIS A 172 -34.889 15.937 1.172 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -36.634 14.908 4.896 1.00 16.61 H new ATOM 0 HE2 HIS A 172 -37.076 15.871 2.582 1.00 16.80 H new ATOM 2696 N HIS A 173 -32.165 18.385 3.413 1.00 18.31 N ATOM 2697 CA HIS A 173 -32.325 19.376 4.466 1.00 19.22 C ATOM 2698 C HIS A 173 -33.342 20.425 4.047 1.00 19.76 C ATOM 2699 O HIS A 173 -33.772 20.452 2.893 1.00 19.79 O ATOM 2700 CB HIS A 173 -30.978 20.031 4.812 1.00 19.61 C ATOM 2701 CG HIS A 173 -30.273 20.648 3.643 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -29.206 20.049 3.009 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -30.485 21.816 2.993 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -28.797 20.820 2.020 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -29.556 21.897 1.987 1.00 20.87 N ATOM 0 H HIS A 173 -32.238 18.761 2.468 1.00 18.31 H new ATOM 0 HA HIS A 173 -32.691 18.873 5.361 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -31.144 20.799 5.567 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -30.327 19.280 5.259 1.00 19.61 H new ATOM 0 HD1 HIS A 173 -28.797 19.150 3.264 1.00 20.25 H new ATOM 0 HD2 HIS A 173 -31.245 22.548 3.224 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -27.978 20.605 1.350 1.00 20.74 H new ATOM 2714 N HIS A 174 -33.723 21.286 4.973 1.00 20.30 N ATOM 2715 CA HIS A 174 -34.731 22.299 4.697 1.00 20.96 C ATOM 2716 C HIS A 174 -34.116 23.511 4.016 1.00 21.59 C ATOM 2717 O HIS A 174 -32.947 23.831 4.238 1.00 21.97 O ATOM 2718 CB HIS A 174 -35.444 22.728 5.981 1.00 21.33 C ATOM 2719 CG HIS A 174 -36.313 21.662 6.570 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -37.587 21.397 6.120 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -36.082 20.787 7.574 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -38.101 20.406 6.823 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -37.208 20.016 7.713 1.00 21.66 N ATOM 0 H HIS A 174 -33.351 21.306 5.923 1.00 20.30 H new ATOM 0 HA HIS A 174 -35.464 21.856 4.023 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -34.698 23.025 6.718 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -36.054 23.607 5.772 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -35.178 20.709 8.159 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -39.087 19.985 6.692 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -37.334 19.265 8.392 1.00 21.66 H new ATOM 2732 N HIS A 175 -34.921 24.165 3.183 1.00 21.78 N ATOM 2733 CA HIS A 175 -34.522 25.369 2.454 1.00 22.46 C ATOM 2734 C HIS A 175 -33.504 25.046 1.365 1.00 23.08 C ATOM 2735 O HIS A 175 -32.314 24.868 1.629 1.00 23.17 O ATOM 2736 CB HIS A 175 -33.969 26.446 3.398 1.00 22.43 C ATOM 2737 CG HIS A 175 -33.730 27.765 2.727 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -32.500 28.158 2.242 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -34.577 28.788 2.460 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -32.602 29.360 1.711 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -33.851 29.766 1.828 1.00 22.28 N ATOM 0 H HIS A 175 -35.879 23.872 2.992 1.00 21.78 H new ATOM 0 HA HIS A 175 -35.420 25.765 1.979 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -34.668 26.588 4.223 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -33.033 26.093 3.831 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -35.629 28.827 2.700 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -31.797 29.919 1.256 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -34.217 30.660 1.502 1.00 22.28 H new ATOM 2750 N HIS A 176 -33.991 24.961 0.140 1.00 23.60 N ATOM 2751 CA HIS A 176 -33.135 24.758 -1.017 1.00 24.32 C ATOM 2752 C HIS A 176 -32.596 26.097 -1.492 1.00 24.96 C ATOM 2753 O HIS A 176 -33.101 27.150 -1.098 1.00 25.33 O ATOM 2754 CB HIS A 176 -33.906 24.080 -2.154 1.00 24.63 C ATOM 2755 CG HIS A 176 -34.316 22.668 -1.863 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -33.824 21.586 -2.556 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -35.189 22.165 -0.959 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -34.375 20.482 -2.094 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -35.209 20.803 -1.124 1.00 24.83 N ATOM 0 H HIS A 176 -34.984 25.030 -0.081 1.00 23.60 H new ATOM 0 HA HIS A 176 -32.308 24.110 -0.727 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -34.798 24.667 -2.374 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -33.289 24.089 -3.052 1.00 24.63 H new ATOM 0 HD2 HIS A 176 -35.764 22.731 -0.241 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -34.177 19.482 -2.450 1.00 25.05 H new ATOM 0 HE2 HIS A 176 -35.775 20.147 -0.586 1.00 24.83 H new ATOM 2768 N HIS A 177 -31.575 26.061 -2.331 1.00 25.19 N ATOM 2769 CA HIS A 177 -31.012 27.279 -2.893 1.00 25.89 C ATOM 2770 C HIS A 177 -30.808 27.122 -4.392 1.00 26.38 C ATOM 2771 O HIS A 177 -30.533 26.023 -4.877 1.00 26.64 O ATOM 2772 CB HIS A 177 -29.690 27.652 -2.201 1.00 26.07 C ATOM 2773 CG HIS A 177 -28.584 26.646 -2.358 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -28.188 25.801 -1.347 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -27.779 26.364 -3.411 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -27.192 25.047 -1.769 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -26.925 25.366 -3.018 1.00 27.04 N ATOM 0 H HIS A 177 -31.118 25.202 -2.639 1.00 25.19 H new ATOM 0 HA HIS A 177 -31.718 28.091 -2.719 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -29.349 28.609 -2.595 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -29.882 27.795 -1.138 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -27.805 26.838 -4.381 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -26.681 24.294 -1.187 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -26.202 24.941 -3.598 1.00 27.04 H new ATOM 2786 N LEU A 178 -30.954 28.220 -5.117 1.00 26.60 N ATOM 2787 CA LEU A 178 -30.722 28.222 -6.554 1.00 27.15 C ATOM 2788 C LEU A 178 -29.226 28.186 -6.836 1.00 27.42 C ATOM 2789 O LEU A 178 -28.423 28.527 -5.961 1.00 27.57 O ATOM 2790 CB LEU A 178 -31.355 29.453 -7.221 1.00 27.23 C ATOM 2791 CG LEU A 178 -30.703 30.807 -6.902 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -31.197 31.866 -7.872 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -30.999 31.239 -5.474 1.00 27.61 C ATOM 0 H LEU A 178 -31.233 29.123 -4.734 1.00 26.60 H new ATOM 0 HA LEU A 178 -31.193 27.334 -6.975 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -31.332 29.307 -8.301 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -32.404 29.500 -6.928 1.00 27.23 H new ATOM 0 HG LEU A 178 -29.624 30.693 -7.008 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -30.729 32.822 -7.637 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -30.938 31.576 -8.890 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -32.279 31.962 -7.786 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -30.524 32.200 -5.279 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -32.076 31.332 -5.338 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -30.609 30.494 -4.780 1.00 27.61 H new ATOM 2805 N GLU A 179 -28.867 27.778 -8.052 1.00 27.58 N ATOM 2806 CA GLU A 179 -27.468 27.627 -8.454 1.00 27.93 C ATOM 2807 C GLU A 179 -26.787 26.557 -7.609 1.00 28.01 C ATOM 2808 O GLU A 179 -26.301 26.830 -6.508 1.00 27.88 O ATOM 2809 CB GLU A 179 -26.710 28.953 -8.343 1.00 28.15 C ATOM 2810 CG GLU A 179 -27.280 30.058 -9.215 1.00 28.46 C ATOM 2811 CD GLU A 179 -27.264 29.700 -10.684 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -26.165 29.627 -11.273 1.00 29.07 O ATOM 2813 OE2 GLU A 179 -28.350 29.493 -11.260 1.00 29.20 O ATOM 0 H GLU A 179 -29.536 27.543 -8.786 1.00 27.58 H new ATOM 0 HA GLU A 179 -27.452 27.318 -9.499 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -26.720 29.281 -7.304 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -25.667 28.789 -8.615 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -28.304 30.269 -8.906 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -26.706 30.972 -9.060 1.00 28.46 H new ATOM 2820 N HIS A 180 -26.766 25.337 -8.118 1.00 28.32 N ATOM 2821 CA HIS A 180 -26.216 24.213 -7.378 1.00 28.53 C ATOM 2822 C HIS A 180 -24.721 24.079 -7.632 1.00 28.95 C ATOM 2823 O HIS A 180 -23.907 24.323 -6.743 1.00 29.23 O ATOM 2824 CB HIS A 180 -26.927 22.911 -7.755 1.00 28.74 C ATOM 2825 CG HIS A 180 -28.382 22.889 -7.405 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -29.378 22.744 -8.344 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -29.010 22.978 -6.209 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -30.552 22.746 -7.745 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -30.358 22.886 -6.446 1.00 28.84 N ATOM 0 H HIS A 180 -27.124 25.099 -9.043 1.00 28.32 H new ATOM 0 HA HIS A 180 -26.376 24.403 -6.317 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -26.819 22.747 -8.827 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -26.431 22.080 -7.254 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -28.537 23.099 -5.246 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -31.510 22.650 -8.234 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -31.090 22.920 -5.736 1.00 28.84 H new ATOM 2838 N HIS A 181 -24.363 23.699 -8.851 1.00 29.09 N ATOM 2839 CA HIS A 181 -22.965 23.493 -9.196 1.00 29.57 C ATOM 2840 C HIS A 181 -22.744 23.722 -10.686 1.00 29.91 C ATOM 2841 O HIS A 181 -23.474 23.191 -11.522 1.00 30.13 O ATOM 2842 CB HIS A 181 -22.528 22.074 -8.816 1.00 29.72 C ATOM 2843 CG HIS A 181 -21.051 21.843 -8.924 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -20.446 21.317 -10.046 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -20.058 22.061 -8.032 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -19.146 21.221 -9.838 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -18.885 21.666 -8.624 1.00 30.14 N ATOM 0 H HIS A 181 -25.019 23.528 -9.614 1.00 29.09 H new ATOM 0 HA HIS A 181 -22.364 24.211 -8.638 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -22.844 21.869 -7.793 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -23.045 21.361 -9.458 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -20.168 22.470 -7.038 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -18.420 20.843 -10.542 1.00 29.92 H new ATOM 0 HE2 HIS A 181 -17.961 21.709 -8.195 1.00 30.14 H new ATOM 2856 N HIS A 182 -21.747 24.525 -11.013 1.00 30.03 N ATOM 2857 CA HIS A 182 -21.382 24.765 -12.403 1.00 30.43 C ATOM 2858 C HIS A 182 -19.918 24.430 -12.618 1.00 30.87 C ATOM 2859 O HIS A 182 -19.128 24.433 -11.673 1.00 31.02 O ATOM 2860 CB HIS A 182 -21.620 26.225 -12.796 1.00 30.52 C ATOM 2861 CG HIS A 182 -23.056 26.649 -12.779 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -23.872 26.588 -13.886 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -23.812 27.170 -11.787 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -25.064 27.056 -13.575 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -25.056 27.419 -12.306 1.00 30.28 N ATOM 0 H HIS A 182 -21.172 25.025 -10.334 1.00 30.03 H new ATOM 0 HA HIS A 182 -22.009 24.127 -13.026 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -21.057 26.866 -12.118 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -21.218 26.388 -13.796 1.00 30.52 H new ATOM 0 HD2 HIS A 182 -23.494 27.356 -10.772 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -25.907 27.130 -14.246 1.00 30.28 H new ATOM 0 HE2 HIS A 182 -25.844 27.818 -11.796 1.00 30.28 H new ATOM 2874 N HIS A 183 -19.559 24.129 -13.853 1.00 31.15 N ATOM 2875 CA HIS A 183 -18.164 23.934 -14.209 1.00 31.67 C ATOM 2876 C HIS A 183 -17.580 25.248 -14.697 1.00 32.06 C ATOM 2877 O HIS A 183 -18.235 25.990 -15.430 1.00 32.12 O ATOM 2878 CB HIS A 183 -18.008 22.859 -15.287 1.00 31.92 C ATOM 2879 CG HIS A 183 -18.396 21.487 -14.830 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -19.387 20.745 -15.432 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -17.912 20.719 -13.827 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -19.499 19.584 -14.818 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -18.615 19.544 -13.842 1.00 31.97 N ATOM 0 H HIS A 183 -20.214 24.014 -14.627 1.00 31.15 H new ATOM 0 HA HIS A 183 -17.626 23.597 -13.323 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -18.617 23.131 -16.149 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -16.971 22.841 -15.622 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -17.119 20.983 -13.143 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -20.196 18.799 -15.072 1.00 31.97 H new ATOM 0 HE2 HIS A 183 -18.476 18.763 -13.201 1.00 31.97 H new ATOM 2892 N HIS A 184 -16.358 25.539 -14.283 1.00 32.40 N ATOM 2893 CA HIS A 184 -15.704 26.783 -14.663 1.00 32.88 C ATOM 2894 C HIS A 184 -14.881 26.577 -15.922 1.00 33.44 C ATOM 2895 O HIS A 184 -14.343 27.524 -16.492 1.00 33.70 O ATOM 2896 CB HIS A 184 -14.804 27.300 -13.538 1.00 33.08 C ATOM 2897 CG HIS A 184 -15.533 27.645 -12.274 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -15.001 27.427 -11.024 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -16.751 28.200 -12.070 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -15.858 27.831 -10.104 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -16.929 28.305 -10.712 1.00 32.91 N ATOM 0 H HIS A 184 -15.798 24.932 -13.684 1.00 32.40 H new ATOM 0 HA HIS A 184 -16.479 27.526 -14.853 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -14.051 26.544 -13.315 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -14.273 28.184 -13.890 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -17.452 28.504 -12.833 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -15.708 27.782 -9.036 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -17.754 28.687 -10.249 1.00 32.91 H new ATOM 2910 N HIS A 185 -14.771 25.324 -16.338 1.00 33.68 N ATOM 2911 CA HIS A 185 -14.033 24.976 -17.541 1.00 34.28 C ATOM 2912 C HIS A 185 -14.828 23.969 -18.351 1.00 34.40 C ATOM 2913 O HIS A 185 -14.574 22.756 -18.209 1.00 34.51 O ATOM 2914 CB HIS A 185 -12.656 24.400 -17.190 1.00 34.66 C ATOM 2915 CG HIS A 185 -11.799 25.337 -16.401 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -11.452 25.111 -15.088 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -11.227 26.515 -16.743 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -10.709 26.111 -14.655 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -10.557 26.973 -15.641 1.00 36.03 N ATOM 2920 OXT HIS A 185 -15.730 24.394 -19.099 1.00 34.44 O ATOM 0 H HIS A 185 -15.187 24.527 -15.856 1.00 33.68 H new ATOM 0 HA HIS A 185 -13.882 25.880 -18.131 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -12.791 23.479 -16.623 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -12.137 24.134 -18.111 1.00 34.66 H new ATOM 0 HD2 HIS A 185 -11.288 27.002 -17.705 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -10.296 26.207 -13.662 1.00 36.07 H new ATOM 0 HE2 HIS A 185 -10.025 27.842 -15.591 1.00 36.03 H new TER 2929 HIS A 185