USER MOD reduce.3.24.130724 H: found=0, std=0, add=1752, rem=0, adj=58 USER MOD reduce.3.24.130724 removed 1754 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: B 16 HIS : no HE2:sc= 2.1 K(o=5.4,f=-15!) USER MOD Set 1.2: B 92 SER OG : rot -56:sc= 1.35 USER MOD Set 1.3: B 108 CYS SG : rot 127:sc= 1.91 USER MOD Set 2.1: B 14 SER OG : rot 75:sc= 1.12 USER MOD Set 2.2: B 90 THR OG1 : rot -70:sc= 0.524 USER MOD Set 2.3: B 110 ASN : amide:sc= 0.0644 K(o=1.7,f=-3!) USER MOD Set 3.1: A 88 MET CE :methyl -132:sc= -0.692 (180deg=-3.27) USER MOD Set 3.2: A 90 THR OG1 : rot -88:sc= 0.945 USER MOD Set 3.3: A 110 ASN : amide:sc= 0.937 K(o=1.2,f=-1.4) USER MOD Set 4.1: A 16 HIS : no HE2:sc= 2.04 K(o=4.2,f=-17!) USER MOD Set 4.2: A 92 SER OG : rot -69:sc= 1.37 USER MOD Set 4.3: A 108 CYS SG : rot 113:sc= 0.841 USER MOD Single : A 7 CYS SG : rot 21:sc= 0.0036 USER MOD Single : A 8 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.018) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 14 SER OG : rot 75:sc= 0.967 USER MOD Single : A 17 ASN : amide:sc= -0.471 K(o=-0.47,f=-8!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.00875 USER MOD Single : A 27 HIS : no HE2:sc= 0.596 K(o=0.6,f=-1.9!) USER MOD Single : A 29 CYS SG : rot 104:sc= 1.16 USER MOD Single : A 32 THR OG1 : rot 81:sc= 1.15 USER MOD Single : A 35 TYR OH : rot 180:sc= 0.44 USER MOD Single : A 36 GLN :FLIP amide:sc= -0.0826 F(o=-1.5!,f=-0.083) USER MOD Single : A 38 GLN : amide:sc= 0.86 K(o=0.86,f=-6.7!) USER MOD Single : A 43 LYS NZ :NH3+ -158:sc= 0.763 (180deg=0.0197!) USER MOD Single : A 44 ASN : amide:sc= 0.462 X(o=0.46,f=0) USER MOD Single : A 49 CYS SG : rot 75:sc= 0.193 USER MOD Single : A 50 HIS : no HE2:sc= -1.45 K(o=-1.4,f=-7.4!) USER MOD Single : A 54 GLN : amide:sc= -0.806 K(o=-0.81,f=-2.9!) USER MOD Single : A 55 GLN : amide:sc= -0.818 K(o=-0.82,f=-7.3!) USER MOD Single : A 60 SER OG : rot 81:sc= 1.28 USER MOD Single : A 62 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.12) USER MOD Single : A 63 GLN : amide:sc= 0.966 K(o=0.97,f=-0.08) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 161:sc= 1.26 (180deg=1.11) USER MOD Single : A 70 GLN : amide:sc= -0.12 K(o=-0.12,f=-1.6) USER MOD Single : A 73 SER OG : rot 180:sc= 0.0631 USER MOD Single : A 75 MET CE :methyl 153:sc= -0.212 (180deg=-0.722) USER MOD Single : A 80 SER OG : rot 164:sc= -0.0724! USER MOD Single : A 81 LYS NZ :NH3+ -151:sc= 1.21 (180deg=1.13) USER MOD Single : A 82 ASN : amide:sc= 1.23 K(o=1.2,f=-0.18) USER MOD Single : A 83 GLN : amide:sc=-0.00701 X(o=-0.007,f=-0.081) USER MOD Single : A 91 SER OG : rot 75:sc= 1.63 USER MOD Single : A 94 THR OG1 : rot -130:sc= 0.44 USER MOD Single : A 96 GLN : amide:sc= -1.68 X(o=-1.7,f=-1.5) USER MOD Single : A 97 ASN : amide:sc= -0.36 K(o=-0.36,f=-4.4!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0.936 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -98:sc= 0.901 USER MOD Single : A 112 ASN : amide:sc= -0.86! X(o=-0.86!,f=-0.71) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 CYS SG : rot 180:sc= 0 USER MOD Single : B 8 GLN : amide:sc= 0.409 K(o=0.41,f=-4.5!) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0.0839 USER MOD Single : B 17 ASN : amide:sc= -0.724 K(o=-0.72,f=-7.7!) USER MOD Single : B 23 THR OG1 : rot 180:sc= 0 USER MOD Single : B 27 HIS : no HD1:sc= 0 X(o=0,f=-2.2e-05) USER MOD Single : B 29 CYS SG : rot 87:sc= 0.828 USER MOD Single : B 32 THR OG1 : rot 69:sc= 1.14 USER MOD Single : B 35 TYR OH : rot 180:sc= 0.48 USER MOD Single : B 36 GLN : amide:sc= -0.0768 K(o=-0.077,f=-0.89) USER MOD Single : B 38 GLN : amide:sc= 0.71 K(o=0.71,f=-6.4!) USER MOD Single : B 43 LYS NZ :NH3+ -146:sc= 0.129 (180deg=-0.337!) USER MOD Single : B 44 ASN : amide:sc= 0.0672 X(o=0.067,f=-0.078) USER MOD Single : B 49 CYS SG : rot 74:sc= 0.894 USER MOD Single : B 50 HIS : no HE2:sc= -0.625 K(o=-0.62,f=-4.5!) USER MOD Single : B 54 GLN : amide:sc= 0.664 K(o=0.66,f=-0.53) USER MOD Single : B 55 GLN : amide:sc= -0.192 K(o=-0.19,f=-1.1) USER MOD Single : B 60 SER OG : rot 84:sc= 1.28 USER MOD Single : B 62 GLN : amide:sc= -0.279 X(o=-0.28,f=-0.38) USER MOD Single : B 63 GLN : amide:sc= 0.00114 X(o=0.0011,f=0) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 LYS NZ :NH3+ 147:sc= 1.45 (180deg=1.11) USER MOD Single : B 70 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.41) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 75 MET CE :methyl 160:sc= -2.15 (180deg=-2.9!) USER MOD Single : B 80 SER OG : rot 160:sc= -2.45! USER MOD Single : B 81 LYS NZ :NH3+ 166:sc= 1.26 (180deg=1.18) USER MOD Single : B 82 ASN : amide:sc= 1.2 K(o=1.2,f=-0.055) USER MOD Single : B 83 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.28) USER MOD Single : B 88 MET CE :methyl 164:sc= 0 (180deg=-0.413) USER MOD Single : B 91 SER OG : rot 74:sc= 1.42 USER MOD Single : B 94 THR OG1 : rot -140:sc= 1.11 USER MOD Single : B 96 GLN : amide:sc= 0.496 K(o=0.5,f=-1.2) USER MOD Single : B 97 ASN : amide:sc= 0.0686 K(o=0.069,f=-0.59) USER MOD Single : B 99 TYR OH : rot 180:sc= 0 USER MOD Single : B 100 SER OG : rot 87:sc= 1.24 USER MOD Single : B 105 TYR OH : rot -100:sc= 0.864 USER MOD Single : B 109 THR OG1 : rot -116:sc= 1.27 USER MOD Single : B 111 THR OG1 : rot -130:sc= -0.314 USER MOD Single : B 112 ASN : amide:sc= -0.406! X(o=-0.41!,f=-0.2) USER MOD Single : B 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 7 5.536 -3.426 -13.963 1.00 15.60 N ATOM 2 CA CYS A 7 4.223 -4.083 -13.803 1.00 14.69 C ATOM 3 C CYS A 7 3.494 -3.498 -12.601 1.00 14.16 C ATOM 4 O CYS A 7 4.128 -3.046 -11.645 1.00 14.28 O ATOM 5 CB CYS A 7 4.408 -5.588 -13.628 1.00 14.54 C ATOM 6 SG CYS A 7 5.574 -6.325 -14.798 1.00 15.21 S ATOM 0 HA CYS A 7 3.626 -3.907 -14.697 1.00 14.69 H new ATOM 0 HB2 CYS A 7 4.753 -5.786 -12.613 1.00 14.54 H new ATOM 0 HB3 CYS A 7 3.441 -6.078 -13.737 1.00 14.54 H new ATOM 0 HG CYS A 7 6.353 -5.400 -15.275 1.00 15.21 H new ATOM 12 N GLN A 8 2.170 -3.494 -12.652 1.00 13.72 N ATOM 13 CA GLN A 8 1.369 -2.957 -11.561 1.00 13.30 C ATOM 14 C GLN A 8 1.024 -4.059 -10.569 1.00 12.74 C ATOM 15 O GLN A 8 0.361 -5.035 -10.923 1.00 12.41 O ATOM 16 CB GLN A 8 0.083 -2.319 -12.092 1.00 13.55 C ATOM 17 CG GLN A 8 0.301 -1.331 -13.227 1.00 14.28 C ATOM 18 CD GLN A 8 1.040 -0.083 -12.790 1.00 14.71 C ATOM 19 OE1 GLN A 8 0.433 0.878 -12.320 1.00 14.83 O ATOM 20 NE2 GLN A 8 2.352 -0.081 -12.958 1.00 15.08 N ATOM 0 H GLN A 8 1.628 -3.856 -13.436 1.00 13.72 H new ATOM 0 HA GLN A 8 1.956 -2.190 -11.056 1.00 13.30 H new ATOM 0 HB2 GLN A 8 -0.586 -3.108 -12.435 1.00 13.55 H new ATOM 0 HB3 GLN A 8 -0.421 -1.808 -11.272 1.00 13.55 H new ATOM 0 HG2 GLN A 8 0.862 -1.819 -14.024 1.00 14.28 H new ATOM 0 HG3 GLN A 8 -0.665 -1.047 -13.645 1.00 14.28 H new ATOM 0 HE21 GLN A 8 2.817 -0.899 -13.351 1.00 15.08 H new ATOM 0 HE22 GLN A 8 2.899 0.739 -12.694 1.00 15.08 H new ATOM 29 N PRO A 9 1.496 -3.929 -9.320 1.00 12.79 N ATOM 30 CA PRO A 9 1.227 -4.913 -8.269 1.00 12.47 C ATOM 31 C PRO A 9 -0.253 -4.964 -7.901 1.00 11.53 C ATOM 32 O PRO A 9 -0.976 -3.981 -8.072 1.00 11.34 O ATOM 33 CB PRO A 9 2.056 -4.412 -7.080 1.00 12.83 C ATOM 34 CG PRO A 9 2.278 -2.965 -7.343 1.00 13.43 C ATOM 35 CD PRO A 9 2.332 -2.817 -8.838 1.00 13.37 C ATOM 0 HA PRO A 9 1.485 -5.925 -8.582 1.00 12.47 H new ATOM 0 HB2 PRO A 9 1.528 -4.565 -6.139 1.00 12.83 H new ATOM 0 HB3 PRO A 9 3.002 -4.949 -7.005 1.00 12.83 H new ATOM 0 HG2 PRO A 9 1.473 -2.364 -6.921 1.00 13.43 H new ATOM 0 HG3 PRO A 9 3.205 -2.623 -6.884 1.00 13.43 H new ATOM 0 HD2 PRO A 9 1.942 -1.852 -9.161 1.00 13.37 H new ATOM 0 HD3 PRO A 9 3.353 -2.890 -9.213 1.00 13.37 H new ATOM 43 N THR A 10 -0.695 -6.109 -7.392 1.00 11.09 N ATOM 44 CA THR A 10 -2.088 -6.300 -6.993 1.00 10.34 C ATOM 45 C THR A 10 -2.379 -5.629 -5.649 1.00 9.71 C ATOM 46 O THR A 10 -3.047 -6.195 -4.785 1.00 9.71 O ATOM 47 CB THR A 10 -2.417 -7.799 -6.887 1.00 10.40 C ATOM 48 OG1 THR A 10 -1.242 -8.529 -6.497 1.00 11.09 O ATOM 49 CG2 THR A 10 -2.944 -8.336 -8.211 1.00 10.67 C ATOM 0 H THR A 10 -0.104 -6.927 -7.244 1.00 11.09 H new ATOM 0 HA THR A 10 -2.712 -5.840 -7.759 1.00 10.34 H new ATOM 0 HB THR A 10 -3.193 -7.928 -6.132 1.00 10.40 H new ATOM 0 HG1 THR A 10 -1.457 -9.483 -6.429 1.00 11.09 H new ATOM 0 HG21 THR A 10 -3.169 -9.398 -8.109 1.00 10.67 H new ATOM 0 HG22 THR A 10 -3.851 -7.798 -8.487 1.00 10.67 H new ATOM 0 HG23 THR A 10 -2.190 -8.198 -8.986 1.00 10.67 H new ATOM 57 N GLU A 11 -1.872 -4.422 -5.489 1.00 9.37 N ATOM 58 CA GLU A 11 -2.044 -3.659 -4.270 1.00 9.01 C ATOM 59 C GLU A 11 -2.148 -2.189 -4.623 1.00 8.63 C ATOM 60 O GLU A 11 -1.290 -1.660 -5.327 1.00 9.08 O ATOM 61 CB GLU A 11 -0.862 -3.900 -3.329 1.00 9.39 C ATOM 62 CG GLU A 11 -0.882 -3.041 -2.078 1.00 9.30 C ATOM 63 CD GLU A 11 0.540 -3.161 -1.221 1.00 10.28 C ATOM 64 OE1 GLU A 11 0.866 -2.718 -2.344 1.00 10.59 O ATOM 65 OE2 GLU A 11 -0.429 -3.930 -1.043 1.00 10.48 O ATOM 0 H GLU A 11 -1.327 -3.942 -6.205 1.00 9.37 H new ATOM 0 HA GLU A 11 -2.955 -3.975 -3.761 1.00 9.01 H new ATOM 0 HB2 GLU A 11 -0.853 -4.950 -3.036 1.00 9.39 H new ATOM 0 HB3 GLU A 11 0.065 -3.712 -3.871 1.00 9.39 H new ATOM 0 HG2 GLU A 11 -1.053 -2.001 -2.355 1.00 9.30 H new ATOM 0 HG3 GLU A 11 -1.715 -3.343 -1.443 1.00 9.30 H new ATOM 72 N PHE A 12 -3.202 -1.536 -4.162 1.00 8.06 N ATOM 73 CA PHE A 12 -3.391 -0.127 -4.458 1.00 8.00 C ATOM 74 C PHE A 12 -4.044 0.603 -3.289 1.00 7.20 C ATOM 75 O PHE A 12 -4.715 -0.006 -2.453 1.00 6.96 O ATOM 76 CB PHE A 12 -4.213 0.042 -5.745 1.00 8.48 C ATOM 77 CG PHE A 12 -5.674 -0.292 -5.621 1.00 7.99 C ATOM 78 CD1 PHE A 12 -6.116 -1.600 -5.741 1.00 8.45 C ATOM 79 CD2 PHE A 12 -6.607 0.709 -5.401 1.00 7.85 C ATOM 80 CE1 PHE A 12 -7.460 -1.903 -5.641 1.00 8.74 C ATOM 81 CE2 PHE A 12 -7.951 0.412 -5.302 1.00 8.21 C ATOM 82 CZ PHE A 12 -8.378 -0.896 -5.421 1.00 8.93 C ATOM 0 H PHE A 12 -3.933 -1.955 -3.587 1.00 8.06 H new ATOM 0 HA PHE A 12 -2.410 0.322 -4.614 1.00 8.00 H new ATOM 0 HB2 PHE A 12 -4.120 1.074 -6.083 1.00 8.48 H new ATOM 0 HB3 PHE A 12 -3.777 -0.588 -6.521 1.00 8.48 H new ATOM 0 HD1 PHE A 12 -5.402 -2.391 -5.915 1.00 8.45 H new ATOM 0 HD2 PHE A 12 -6.278 1.733 -5.306 1.00 7.85 H new ATOM 0 HE1 PHE A 12 -7.792 -2.926 -5.735 1.00 8.74 H new ATOM 0 HE2 PHE A 12 -8.668 1.201 -5.132 1.00 8.21 H new ATOM 0 HZ PHE A 12 -9.429 -1.131 -5.342 1.00 8.93 H new ATOM 92 N ILE A 13 -3.828 1.911 -3.235 1.00 7.08 N ATOM 93 CA ILE A 13 -4.382 2.742 -2.179 1.00 6.69 C ATOM 94 C ILE A 13 -5.802 3.185 -2.520 1.00 5.92 C ATOM 95 O ILE A 13 -6.026 3.887 -3.508 1.00 5.90 O ATOM 96 CB ILE A 13 -3.498 3.986 -1.927 1.00 7.52 C ATOM 97 CG1 ILE A 13 -2.172 3.571 -1.281 1.00 8.17 C ATOM 98 CG2 ILE A 13 -4.219 5.015 -1.062 1.00 7.63 C ATOM 99 CD1 ILE A 13 -2.335 2.784 0.002 1.00 8.66 C ATOM 0 H ILE A 13 -3.268 2.421 -3.918 1.00 7.08 H new ATOM 0 HA ILE A 13 -4.408 2.139 -1.271 1.00 6.69 H new ATOM 0 HB ILE A 13 -3.290 4.453 -2.890 1.00 7.52 H new ATOM 0 HG12 ILE A 13 -1.604 2.973 -1.993 1.00 8.17 H new ATOM 0 HG13 ILE A 13 -1.584 4.465 -1.075 1.00 8.17 H new ATOM 0 HG21 ILE A 13 -3.570 5.876 -0.904 1.00 7.63 H new ATOM 0 HG22 ILE A 13 -5.132 5.336 -1.563 1.00 7.63 H new ATOM 0 HG23 ILE A 13 -4.471 4.569 -0.100 1.00 7.63 H new ATOM 0 HD11 ILE A 13 -1.353 2.527 0.398 1.00 8.66 H new ATOM 0 HD12 ILE A 13 -2.875 3.387 0.732 1.00 8.66 H new ATOM 0 HD13 ILE A 13 -2.895 1.871 -0.200 1.00 8.66 H new ATOM 111 N SER A 14 -6.754 2.764 -1.706 1.00 5.60 N ATOM 112 CA SER A 14 -8.142 3.123 -1.912 1.00 5.30 C ATOM 113 C SER A 14 -8.576 4.172 -0.888 1.00 5.64 C ATOM 114 O SER A 14 -8.980 3.837 0.230 1.00 6.11 O ATOM 115 CB SER A 14 -9.028 1.879 -1.804 1.00 5.40 C ATOM 116 OG SER A 14 -8.291 0.702 -2.094 1.00 5.67 O ATOM 0 H SER A 14 -6.588 2.171 -0.893 1.00 5.60 H new ATOM 0 HA SER A 14 -8.250 3.546 -2.911 1.00 5.30 H new ATOM 0 HB2 SER A 14 -9.446 1.812 -0.800 1.00 5.40 H new ATOM 0 HB3 SER A 14 -9.868 1.965 -2.494 1.00 5.40 H new ATOM 0 HG SER A 14 -7.714 0.482 -1.333 1.00 5.67 H new ATOM 122 N ARG A 15 -8.456 5.439 -1.260 1.00 5.77 N ATOM 123 CA ARG A 15 -8.849 6.535 -0.384 1.00 6.44 C ATOM 124 C ARG A 15 -10.352 6.741 -0.473 1.00 6.84 C ATOM 125 O ARG A 15 -10.876 7.052 -1.542 1.00 7.10 O ATOM 126 CB ARG A 15 -8.124 7.825 -0.779 1.00 6.76 C ATOM 127 CG ARG A 15 -6.806 8.048 -0.055 1.00 7.07 C ATOM 128 CD ARG A 15 -6.010 9.167 -0.705 1.00 7.39 C ATOM 129 NE ARG A 15 -5.330 10.014 0.276 1.00 8.02 N ATOM 130 CZ ARG A 15 -4.009 10.186 0.326 1.00 8.40 C ATOM 131 NH1 ARG A 15 -3.215 9.520 -0.498 1.00 8.31 N ATOM 132 NH2 ARG A 15 -3.481 11.023 1.212 1.00 9.09 N ATOM 0 H ARG A 15 -8.089 5.734 -2.165 1.00 5.77 H new ATOM 0 HA ARG A 15 -8.574 6.283 0.640 1.00 6.44 H new ATOM 0 HB2 ARG A 15 -7.937 7.809 -1.853 1.00 6.76 H new ATOM 0 HB3 ARG A 15 -8.781 8.672 -0.582 1.00 6.76 H new ATOM 0 HG2 ARG A 15 -6.998 8.293 0.990 1.00 7.07 H new ATOM 0 HG3 ARG A 15 -6.221 7.128 -0.065 1.00 7.07 H new ATOM 0 HD2 ARG A 15 -5.272 8.737 -1.383 1.00 7.39 H new ATOM 0 HD3 ARG A 15 -6.678 9.781 -1.309 1.00 7.39 H new ATOM 0 HE ARG A 15 -5.902 10.503 0.964 1.00 8.02 H new ATOM 0 HH11 ARG A 15 -3.613 8.871 -1.176 1.00 8.31 H new ATOM 0 HH12 ARG A 15 -2.205 9.656 -0.454 1.00 8.31 H new ATOM 0 HH21 ARG A 15 -4.086 11.534 1.854 1.00 9.09 H new ATOM 0 HH22 ARG A 15 -2.470 11.154 1.250 1.00 9.09 H new ATOM 146 N HIS A 16 -11.048 6.555 0.636 1.00 7.25 N ATOM 147 CA HIS A 16 -12.495 6.720 0.648 1.00 8.00 C ATOM 148 C HIS A 16 -12.978 7.202 2.006 1.00 8.80 C ATOM 149 O HIS A 16 -12.293 7.030 3.012 1.00 9.25 O ATOM 150 CB HIS A 16 -13.190 5.400 0.286 1.00 7.87 C ATOM 151 CG HIS A 16 -12.999 4.299 1.289 1.00 8.55 C ATOM 152 ND1 HIS A 16 -13.726 4.206 2.458 1.00 8.91 N ATOM 153 CD2 HIS A 16 -12.157 3.241 1.292 1.00 9.13 C ATOM 154 CE1 HIS A 16 -13.339 3.143 3.132 1.00 9.65 C ATOM 155 NE2 HIS A 16 -12.389 2.538 2.448 1.00 9.79 N ATOM 0 H HIS A 16 -10.641 6.292 1.533 1.00 7.25 H new ATOM 0 HA HIS A 16 -12.751 7.473 -0.097 1.00 8.00 H new ATOM 0 HB2 HIS A 16 -14.258 5.586 0.169 1.00 7.87 H new ATOM 0 HB3 HIS A 16 -12.818 5.062 -0.681 1.00 7.87 H new ATOM 0 HD1 HIS A 16 -14.451 4.859 2.754 1.00 8.91 H new ATOM 0 HD2 HIS A 16 -11.436 2.995 0.527 1.00 9.13 H new ATOM 0 HE1 HIS A 16 -13.734 2.821 4.085 1.00 9.65 H new ATOM 164 N ASN A 17 -14.167 7.786 2.033 1.00 9.21 N ATOM 165 CA ASN A 17 -14.743 8.278 3.275 1.00 10.20 C ATOM 166 C ASN A 17 -15.381 7.127 4.059 1.00 10.40 C ATOM 167 O ASN A 17 -15.389 5.982 3.593 1.00 10.47 O ATOM 168 CB ASN A 17 -15.762 9.397 2.996 1.00 11.03 C ATOM 169 CG ASN A 17 -17.146 8.892 2.619 1.00 11.85 C ATOM 170 OD1 ASN A 17 -17.307 7.815 2.043 1.00 11.82 O ATOM 171 ND2 ASN A 17 -18.157 9.679 2.944 1.00 12.69 N ATOM 0 H ASN A 17 -14.751 7.931 1.209 1.00 9.21 H new ATOM 0 HA ASN A 17 -13.946 8.701 3.886 1.00 10.20 H new ATOM 0 HB2 ASN A 17 -15.845 10.028 3.881 1.00 11.03 H new ATOM 0 HB3 ASN A 17 -15.384 10.026 2.190 1.00 11.03 H new ATOM 0 HD21 ASN A 17 -19.112 9.402 2.718 1.00 12.69 H new ATOM 0 HD22 ASN A 17 -17.982 10.564 3.421 1.00 12.69 H new ATOM 178 N ILE A 18 -15.912 7.429 5.237 1.00 10.70 N ATOM 179 CA ILE A 18 -16.536 6.420 6.101 1.00 11.18 C ATOM 180 C ILE A 18 -17.703 5.689 5.426 1.00 11.08 C ATOM 181 O ILE A 18 -17.984 4.533 5.747 1.00 11.25 O ATOM 182 CB ILE A 18 -17.022 7.042 7.427 1.00 12.00 C ATOM 183 CG1 ILE A 18 -17.793 8.340 7.164 1.00 12.63 C ATOM 184 CG2 ILE A 18 -15.839 7.294 8.353 1.00 12.34 C ATOM 185 CD1 ILE A 18 -18.379 8.965 8.412 1.00 13.58 C ATOM 0 H ILE A 18 -15.925 8.373 5.624 1.00 10.70 H new ATOM 0 HA ILE A 18 -15.757 5.685 6.304 1.00 11.18 H new ATOM 0 HB ILE A 18 -17.699 6.340 7.914 1.00 12.00 H new ATOM 0 HG12 ILE A 18 -17.125 9.058 6.688 1.00 12.63 H new ATOM 0 HG13 ILE A 18 -18.598 8.137 6.458 1.00 12.63 H new ATOM 0 HG21 ILE A 18 -16.194 7.733 9.285 1.00 12.34 H new ATOM 0 HG22 ILE A 18 -15.335 6.351 8.565 1.00 12.34 H new ATOM 0 HG23 ILE A 18 -15.140 7.979 7.872 1.00 12.34 H new ATOM 0 HD11 ILE A 18 -18.910 9.879 8.146 1.00 13.58 H new ATOM 0 HD12 ILE A 18 -19.073 8.265 8.878 1.00 13.58 H new ATOM 0 HD13 ILE A 18 -17.577 9.201 9.112 1.00 13.58 H new ATOM 197 N GLU A 19 -18.374 6.352 4.489 1.00 10.98 N ATOM 198 CA GLU A 19 -19.503 5.748 3.780 1.00 11.15 C ATOM 199 C GLU A 19 -19.018 4.731 2.752 1.00 10.09 C ATOM 200 O GLU A 19 -19.753 3.829 2.349 1.00 10.09 O ATOM 201 CB GLU A 19 -20.323 6.819 3.065 1.00 12.03 C ATOM 202 CG GLU A 19 -20.900 7.875 3.988 1.00 13.15 C ATOM 203 CD GLU A 19 -21.574 8.986 3.216 1.00 13.37 C ATOM 204 OE1 GLU A 19 -22.595 8.717 2.545 1.00 13.85 O ATOM 205 OE2 GLU A 19 -21.072 10.124 3.252 1.00 13.50 O ATOM 0 H GLU A 19 -18.158 7.306 4.202 1.00 10.98 H new ATOM 0 HA GLU A 19 -20.125 5.244 4.520 1.00 11.15 H new ATOM 0 HB2 GLU A 19 -19.694 7.307 2.321 1.00 12.03 H new ATOM 0 HB3 GLU A 19 -21.139 6.337 2.526 1.00 12.03 H new ATOM 0 HG2 GLU A 19 -21.620 7.413 4.664 1.00 13.15 H new ATOM 0 HG3 GLU A 19 -20.105 8.292 4.606 1.00 13.15 H new ATOM 212 N GLY A 20 -17.779 4.896 2.319 1.00 9.38 N ATOM 213 CA GLY A 20 -17.213 4.002 1.337 1.00 8.49 C ATOM 214 C GLY A 20 -16.960 4.702 0.023 1.00 8.41 C ATOM 215 O GLY A 20 -16.348 4.135 -0.878 1.00 8.52 O ATOM 0 H GLY A 20 -17.153 5.638 2.633 1.00 9.38 H new ATOM 0 HA2 GLY A 20 -16.277 3.591 1.716 1.00 8.49 H new ATOM 0 HA3 GLY A 20 -17.889 3.162 1.177 1.00 8.49 H new ATOM 219 N ILE A 21 -17.425 5.944 -0.067 1.00 8.47 N ATOM 220 CA ILE A 21 -17.258 6.755 -1.265 1.00 8.70 C ATOM 221 C ILE A 21 -15.788 7.082 -1.471 1.00 8.24 C ATOM 222 O ILE A 21 -15.174 7.762 -0.647 1.00 8.70 O ATOM 223 CB ILE A 21 -18.068 8.069 -1.169 1.00 9.49 C ATOM 224 CG1 ILE A 21 -19.562 7.766 -1.012 1.00 10.11 C ATOM 225 CG2 ILE A 21 -17.823 8.947 -2.389 1.00 9.59 C ATOM 226 CD1 ILE A 21 -20.179 7.093 -2.218 1.00 10.74 C ATOM 0 H ILE A 21 -17.926 6.414 0.687 1.00 8.47 H new ATOM 0 HA ILE A 21 -17.630 6.180 -2.113 1.00 8.70 H new ATOM 0 HB ILE A 21 -17.732 8.615 -0.287 1.00 9.49 H new ATOM 0 HG12 ILE A 21 -19.704 7.128 -0.140 1.00 10.11 H new ATOM 0 HG13 ILE A 21 -20.093 8.697 -0.816 1.00 10.11 H new ATOM 0 HG21 ILE A 21 -18.403 9.865 -2.299 1.00 9.59 H new ATOM 0 HG22 ILE A 21 -16.763 9.192 -2.454 1.00 9.59 H new ATOM 0 HG23 ILE A 21 -18.127 8.413 -3.289 1.00 9.59 H new ATOM 0 HD11 ILE A 21 -21.237 6.911 -2.031 1.00 10.74 H new ATOM 0 HD12 ILE A 21 -20.070 7.738 -3.090 1.00 10.74 H new ATOM 0 HD13 ILE A 21 -19.675 6.145 -2.403 1.00 10.74 H new ATOM 238 N PHE A 22 -15.228 6.573 -2.557 1.00 7.56 N ATOM 239 CA PHE A 22 -13.823 6.795 -2.867 1.00 7.35 C ATOM 240 C PHE A 22 -13.569 8.235 -3.296 1.00 7.07 C ATOM 241 O PHE A 22 -14.244 8.768 -4.181 1.00 7.53 O ATOM 242 CB PHE A 22 -13.358 5.828 -3.956 1.00 7.50 C ATOM 243 CG PHE A 22 -13.409 4.386 -3.537 1.00 8.14 C ATOM 244 CD1 PHE A 22 -12.330 3.802 -2.893 1.00 8.60 C ATOM 245 CD2 PHE A 22 -14.533 3.616 -3.784 1.00 8.51 C ATOM 246 CE1 PHE A 22 -12.374 2.477 -2.504 1.00 9.42 C ATOM 247 CE2 PHE A 22 -14.582 2.291 -3.397 1.00 9.27 C ATOM 248 CZ PHE A 22 -13.499 1.720 -2.757 1.00 9.73 C ATOM 0 H PHE A 22 -15.725 6.002 -3.240 1.00 7.56 H new ATOM 0 HA PHE A 22 -13.249 6.609 -1.959 1.00 7.35 H new ATOM 0 HB2 PHE A 22 -13.980 5.963 -4.841 1.00 7.50 H new ATOM 0 HB3 PHE A 22 -12.337 6.079 -4.242 1.00 7.50 H new ATOM 0 HD1 PHE A 22 -11.446 4.389 -2.693 1.00 8.60 H new ATOM 0 HD2 PHE A 22 -15.382 4.057 -4.285 1.00 8.51 H new ATOM 0 HE1 PHE A 22 -11.527 2.034 -2.002 1.00 9.42 H new ATOM 0 HE2 PHE A 22 -15.466 1.702 -3.594 1.00 9.27 H new ATOM 0 HZ PHE A 22 -13.533 0.683 -2.456 1.00 9.73 H new ATOM 258 N THR A 23 -12.590 8.852 -2.652 1.00 6.58 N ATOM 259 CA THR A 23 -12.215 10.223 -2.939 1.00 6.57 C ATOM 260 C THR A 23 -11.057 10.253 -3.932 1.00 5.83 C ATOM 261 O THR A 23 -10.939 11.172 -4.748 1.00 5.91 O ATOM 262 CB THR A 23 -11.807 10.958 -1.649 1.00 7.05 C ATOM 263 OG1 THR A 23 -10.857 10.171 -0.918 1.00 7.33 O ATOM 264 CG2 THR A 23 -13.022 11.223 -0.772 1.00 7.74 C ATOM 0 H THR A 23 -12.035 8.414 -1.917 1.00 6.58 H new ATOM 0 HA THR A 23 -13.078 10.729 -3.373 1.00 6.57 H new ATOM 0 HB THR A 23 -11.358 11.912 -1.927 1.00 7.05 H new ATOM 0 HG1 THR A 23 -10.601 10.645 -0.099 1.00 7.33 H new ATOM 0 HG21 THR A 23 -12.710 11.743 0.134 1.00 7.74 H new ATOM 0 HG22 THR A 23 -13.737 11.840 -1.317 1.00 7.74 H new ATOM 0 HG23 THR A 23 -13.491 10.276 -0.504 1.00 7.74 H new ATOM 272 N PHE A 24 -10.212 9.231 -3.855 1.00 5.35 N ATOM 273 CA PHE A 24 -9.062 9.104 -4.737 1.00 4.99 C ATOM 274 C PHE A 24 -8.664 7.636 -4.843 1.00 4.39 C ATOM 275 O PHE A 24 -8.555 6.941 -3.832 1.00 4.25 O ATOM 276 CB PHE A 24 -7.886 9.937 -4.221 1.00 5.47 C ATOM 277 CG PHE A 24 -6.984 10.442 -5.314 1.00 5.80 C ATOM 278 CD1 PHE A 24 -5.952 9.654 -5.803 1.00 6.29 C ATOM 279 CD2 PHE A 24 -7.169 11.704 -5.856 1.00 5.92 C ATOM 280 CE1 PHE A 24 -5.124 10.116 -6.809 1.00 6.89 C ATOM 281 CE2 PHE A 24 -6.344 12.171 -6.863 1.00 6.43 C ATOM 282 CZ PHE A 24 -5.320 11.376 -7.340 1.00 6.92 C ATOM 0 H PHE A 24 -10.306 8.471 -3.181 1.00 5.35 H new ATOM 0 HA PHE A 24 -9.332 9.478 -5.724 1.00 4.99 H new ATOM 0 HB2 PHE A 24 -8.272 10.787 -3.658 1.00 5.47 H new ATOM 0 HB3 PHE A 24 -7.301 9.334 -3.527 1.00 5.47 H new ATOM 0 HD1 PHE A 24 -5.794 8.668 -5.393 1.00 6.29 H new ATOM 0 HD2 PHE A 24 -7.968 12.331 -5.487 1.00 5.92 H new ATOM 0 HE1 PHE A 24 -4.324 9.492 -7.180 1.00 6.89 H new ATOM 0 HE2 PHE A 24 -6.500 13.157 -7.276 1.00 6.43 H new ATOM 0 HZ PHE A 24 -4.674 11.739 -8.126 1.00 6.92 H new ATOM 292 N VAL A 25 -8.454 7.166 -6.062 1.00 4.43 N ATOM 293 CA VAL A 25 -8.086 5.776 -6.287 1.00 4.39 C ATOM 294 C VAL A 25 -6.699 5.673 -6.917 1.00 4.75 C ATOM 295 O VAL A 25 -6.312 6.516 -7.730 1.00 5.12 O ATOM 296 CB VAL A 25 -9.117 5.062 -7.191 1.00 5.05 C ATOM 297 CG1 VAL A 25 -8.841 3.569 -7.265 1.00 5.18 C ATOM 298 CG2 VAL A 25 -10.529 5.312 -6.688 1.00 6.02 C ATOM 0 H VAL A 25 -8.532 7.726 -6.911 1.00 4.43 H new ATOM 0 HA VAL A 25 -8.073 5.285 -5.314 1.00 4.39 H new ATOM 0 HB VAL A 25 -9.023 5.474 -8.196 1.00 5.05 H new ATOM 0 HG11 VAL A 25 -9.582 3.093 -7.908 1.00 5.18 H new ATOM 0 HG12 VAL A 25 -7.845 3.403 -7.675 1.00 5.18 H new ATOM 0 HG13 VAL A 25 -8.898 3.138 -6.265 1.00 5.18 H new ATOM 0 HG21 VAL A 25 -11.242 4.802 -7.336 1.00 6.02 H new ATOM 0 HG22 VAL A 25 -10.626 4.931 -5.671 1.00 6.02 H new ATOM 0 HG23 VAL A 25 -10.734 6.383 -6.695 1.00 6.02 H new ATOM 308 N ASP A 26 -5.957 4.651 -6.513 1.00 5.07 N ATOM 309 CA ASP A 26 -4.616 4.401 -7.029 1.00 5.85 C ATOM 310 C ASP A 26 -4.678 4.006 -8.506 1.00 6.77 C ATOM 311 O ASP A 26 -5.740 3.663 -9.020 1.00 6.87 O ATOM 312 CB ASP A 26 -3.964 3.285 -6.216 1.00 5.75 C ATOM 313 CG ASP A 26 -2.452 3.263 -6.304 1.00 6.66 C ATOM 314 OD1 ASP A 26 -1.914 2.892 -7.368 1.00 7.31 O ATOM 315 OD2 ASP A 26 -1.799 3.582 -5.292 1.00 6.95 O ATOM 0 H ASP A 26 -6.267 3.971 -5.818 1.00 5.07 H new ATOM 0 HA ASP A 26 -4.023 5.311 -6.941 1.00 5.85 H new ATOM 0 HB2 ASP A 26 -4.256 3.392 -5.171 1.00 5.75 H new ATOM 0 HB3 ASP A 26 -4.352 2.326 -6.558 1.00 5.75 H new ATOM 320 N HIS A 27 -3.540 4.026 -9.179 1.00 7.68 N ATOM 321 CA HIS A 27 -3.486 3.677 -10.595 1.00 8.77 C ATOM 322 C HIS A 27 -3.291 2.171 -10.772 1.00 9.47 C ATOM 323 O HIS A 27 -3.474 1.633 -11.865 1.00 9.87 O ATOM 324 CB HIS A 27 -2.352 4.439 -11.298 1.00 9.42 C ATOM 325 CG HIS A 27 -2.603 5.912 -11.457 1.00 10.21 C ATOM 326 ND1 HIS A 27 -1.684 6.777 -12.020 1.00 10.91 N ATOM 327 CD2 HIS A 27 -3.673 6.676 -11.122 1.00 10.62 C ATOM 328 CE1 HIS A 27 -2.176 8.001 -12.020 1.00 11.67 C ATOM 329 NE2 HIS A 27 -3.377 7.968 -11.480 1.00 11.51 N ATOM 0 H HIS A 27 -2.640 4.279 -8.771 1.00 7.68 H new ATOM 0 HA HIS A 27 -4.435 3.963 -11.049 1.00 8.77 H new ATOM 0 HB2 HIS A 27 -1.431 4.298 -10.733 1.00 9.42 H new ATOM 0 HB3 HIS A 27 -2.192 4.001 -12.283 1.00 9.42 H new ATOM 0 HD1 HIS A 27 -0.768 6.510 -12.380 1.00 10.91 H new ATOM 0 HD2 HIS A 27 -4.587 6.332 -10.660 1.00 10.62 H new ATOM 0 HE1 HIS A 27 -1.678 8.881 -12.399 1.00 11.67 H new ATOM 338 N ARG A 28 -2.935 1.494 -9.687 1.00 9.78 N ATOM 339 CA ARG A 28 -2.699 0.053 -9.716 1.00 10.59 C ATOM 340 C ARG A 28 -4.002 -0.744 -9.625 1.00 11.06 C ATOM 341 O ARG A 28 -3.994 -1.977 -9.691 1.00 11.12 O ATOM 342 CB ARG A 28 -1.763 -0.343 -8.574 1.00 10.74 C ATOM 343 CG ARG A 28 -0.382 0.277 -8.683 1.00 11.22 C ATOM 344 CD ARG A 28 0.402 0.123 -7.392 1.00 11.69 C ATOM 345 NE ARG A 28 0.013 1.104 -6.382 1.00 11.31 N ATOM 346 CZ ARG A 28 0.397 1.054 -5.104 1.00 11.44 C ATOM 347 NH1 ARG A 28 1.154 0.052 -4.667 1.00 11.91 N ATOM 348 NH2 ARG A 28 0.004 1.999 -4.260 1.00 11.23 N ATOM 0 H ARG A 28 -2.802 1.921 -8.770 1.00 9.78 H new ATOM 0 HA ARG A 28 -2.235 -0.186 -10.673 1.00 10.59 H new ATOM 0 HB2 ARG A 28 -2.212 -0.046 -7.626 1.00 10.74 H new ATOM 0 HB3 ARG A 28 -1.665 -1.428 -8.554 1.00 10.74 H new ATOM 0 HG2 ARG A 28 0.165 -0.193 -9.500 1.00 11.22 H new ATOM 0 HG3 ARG A 28 -0.476 1.335 -8.929 1.00 11.22 H new ATOM 0 HD2 ARG A 28 0.250 -0.881 -6.996 1.00 11.69 H new ATOM 0 HD3 ARG A 28 1.467 0.225 -7.603 1.00 11.69 H new ATOM 0 HE ARG A 28 -0.589 1.875 -6.671 1.00 11.31 H new ATOM 0 HH11 ARG A 28 1.445 -0.685 -5.309 1.00 11.91 H new ATOM 0 HH12 ARG A 28 1.444 0.020 -3.689 1.00 11.91 H new ATOM 0 HH21 ARG A 28 -0.590 2.761 -4.588 1.00 11.23 H new ATOM 0 HH22 ARG A 28 0.296 1.964 -3.283 1.00 11.23 H new ATOM 362 N CYS A 29 -5.123 -0.044 -9.495 1.00 11.56 N ATOM 363 CA CYS A 29 -6.425 -0.698 -9.387 1.00 12.23 C ATOM 364 C CYS A 29 -6.778 -1.446 -10.673 1.00 12.88 C ATOM 365 O CYS A 29 -7.457 -2.476 -10.642 1.00 12.99 O ATOM 366 CB CYS A 29 -7.510 0.334 -9.074 1.00 12.60 C ATOM 367 SG CYS A 29 -7.717 1.589 -10.355 1.00 12.95 S ATOM 0 H CYS A 29 -5.158 0.975 -9.462 1.00 11.56 H new ATOM 0 HA CYS A 29 -6.369 -1.422 -8.574 1.00 12.23 H new ATOM 0 HB2 CYS A 29 -8.459 -0.183 -8.929 1.00 12.60 H new ATOM 0 HB3 CYS A 29 -7.268 0.827 -8.132 1.00 12.60 H new ATOM 0 HG CYS A 29 -8.788 1.332 -11.046 1.00 12.95 H new ATOM 373 N VAL A 30 -6.287 -0.932 -11.795 1.00 13.46 N ATOM 374 CA VAL A 30 -6.551 -1.520 -13.105 1.00 14.27 C ATOM 375 C VAL A 30 -6.012 -2.947 -13.202 1.00 14.13 C ATOM 376 O VAL A 30 -6.659 -3.827 -13.767 1.00 14.19 O ATOM 377 CB VAL A 30 -5.934 -0.665 -14.231 1.00 15.19 C ATOM 378 CG1 VAL A 30 -6.351 -1.183 -15.601 1.00 16.15 C ATOM 379 CG2 VAL A 30 -6.327 0.796 -14.065 1.00 15.20 C ATOM 0 H VAL A 30 -5.697 -0.100 -11.824 1.00 13.46 H new ATOM 0 HA VAL A 30 -7.634 -1.547 -13.226 1.00 14.27 H new ATOM 0 HB VAL A 30 -4.849 -0.741 -14.160 1.00 15.19 H new ATOM 0 HG11 VAL A 30 -5.902 -0.562 -16.377 1.00 16.15 H new ATOM 0 HG12 VAL A 30 -6.013 -2.212 -15.719 1.00 16.15 H new ATOM 0 HG13 VAL A 30 -7.437 -1.145 -15.689 1.00 16.15 H new ATOM 0 HG21 VAL A 30 -5.884 1.386 -14.867 1.00 15.20 H new ATOM 0 HG22 VAL A 30 -7.412 0.888 -14.105 1.00 15.20 H new ATOM 0 HG23 VAL A 30 -5.967 1.163 -13.104 1.00 15.20 H new ATOM 389 N ALA A 31 -4.838 -3.177 -12.637 1.00 14.12 N ATOM 390 CA ALA A 31 -4.229 -4.501 -12.677 1.00 14.20 C ATOM 391 C ALA A 31 -4.728 -5.378 -11.535 1.00 14.41 C ATOM 392 O ALA A 31 -4.608 -6.603 -11.584 1.00 15.07 O ATOM 393 CB ALA A 31 -2.714 -4.389 -12.632 1.00 14.19 C ATOM 0 H ALA A 31 -4.289 -2.471 -12.148 1.00 14.12 H new ATOM 0 HA ALA A 31 -4.522 -4.973 -13.615 1.00 14.20 H new ATOM 0 HB1 ALA A 31 -2.274 -5.386 -12.663 1.00 14.19 H new ATOM 0 HB2 ALA A 31 -2.366 -3.813 -13.489 1.00 14.19 H new ATOM 0 HB3 ALA A 31 -2.413 -3.888 -11.712 1.00 14.19 H new ATOM 399 N THR A 32 -5.294 -4.750 -10.516 1.00 13.95 N ATOM 400 CA THR A 32 -5.793 -5.477 -9.358 1.00 14.24 C ATOM 401 C THR A 32 -7.218 -5.994 -9.578 1.00 14.03 C ATOM 402 O THR A 32 -7.485 -7.185 -9.415 1.00 14.20 O ATOM 403 CB THR A 32 -5.746 -4.597 -8.091 1.00 14.27 C ATOM 404 OG1 THR A 32 -4.429 -4.052 -7.924 1.00 14.90 O ATOM 405 CG2 THR A 32 -6.117 -5.397 -6.852 1.00 14.04 C ATOM 0 H THR A 32 -5.419 -3.739 -10.467 1.00 13.95 H new ATOM 0 HA THR A 32 -5.138 -6.337 -9.219 1.00 14.24 H new ATOM 0 HB THR A 32 -6.470 -3.791 -8.215 1.00 14.27 H new ATOM 0 HG1 THR A 32 -4.323 -3.269 -8.504 1.00 14.90 H new ATOM 0 HG21 THR A 32 -6.075 -4.751 -5.975 1.00 14.04 H new ATOM 0 HG22 THR A 32 -7.127 -5.793 -6.963 1.00 14.04 H new ATOM 0 HG23 THR A 32 -5.416 -6.222 -6.728 1.00 14.04 H new ATOM 413 N VAL A 33 -8.132 -5.108 -9.955 1.00 13.80 N ATOM 414 CA VAL A 33 -9.520 -5.507 -10.170 1.00 13.77 C ATOM 415 C VAL A 33 -10.008 -5.162 -11.573 1.00 13.68 C ATOM 416 O VAL A 33 -11.042 -5.658 -12.016 1.00 13.84 O ATOM 417 CB VAL A 33 -10.467 -4.853 -9.141 1.00 13.66 C ATOM 418 CG1 VAL A 33 -10.362 -5.553 -7.798 1.00 13.80 C ATOM 419 CG2 VAL A 33 -10.171 -3.367 -8.996 1.00 13.68 C ATOM 0 H VAL A 33 -7.942 -4.119 -10.117 1.00 13.80 H new ATOM 0 HA VAL A 33 -9.540 -6.590 -10.045 1.00 13.77 H new ATOM 0 HB VAL A 33 -11.489 -4.960 -9.506 1.00 13.66 H new ATOM 0 HG11 VAL A 33 -11.037 -5.078 -7.086 1.00 13.80 H new ATOM 0 HG12 VAL A 33 -10.635 -6.602 -7.912 1.00 13.80 H new ATOM 0 HG13 VAL A 33 -9.338 -5.483 -7.430 1.00 13.80 H new ATOM 0 HG21 VAL A 33 -10.852 -2.930 -8.265 1.00 13.68 H new ATOM 0 HG22 VAL A 33 -9.143 -3.232 -8.660 1.00 13.68 H new ATOM 0 HG23 VAL A 33 -10.306 -2.873 -9.958 1.00 13.68 H new ATOM 429 N GLY A 34 -9.276 -4.303 -12.267 1.00 13.56 N ATOM 430 CA GLY A 34 -9.672 -3.915 -13.607 1.00 13.65 C ATOM 431 C GLY A 34 -10.525 -2.666 -13.602 1.00 13.54 C ATOM 432 O GLY A 34 -10.751 -2.045 -14.641 1.00 13.85 O ATOM 0 H GLY A 34 -8.418 -3.868 -11.929 1.00 13.56 H new ATOM 0 HA2 GLY A 34 -8.783 -3.745 -14.214 1.00 13.65 H new ATOM 0 HA3 GLY A 34 -10.225 -4.731 -14.073 1.00 13.65 H new ATOM 436 N TYR A 35 -11.003 -2.304 -12.425 1.00 13.21 N ATOM 437 CA TYR A 35 -11.833 -1.124 -12.264 1.00 13.20 C ATOM 438 C TYR A 35 -11.004 0.139 -12.430 1.00 12.81 C ATOM 439 O TYR A 35 -9.913 0.253 -11.866 1.00 12.67 O ATOM 440 CB TYR A 35 -12.481 -1.106 -10.880 1.00 13.25 C ATOM 441 CG TYR A 35 -13.712 -1.972 -10.736 1.00 15.79 C ATOM 442 CD1 TYR A 35 -14.504 -2.294 -11.831 1.00 16.05 C ATOM 443 CD2 TYR A 35 -14.086 -2.459 -9.491 1.00 16.35 C ATOM 444 CE1 TYR A 35 -15.635 -3.075 -11.686 1.00 16.85 C ATOM 445 CE2 TYR A 35 -15.210 -3.240 -9.339 1.00 17.14 C ATOM 446 CZ TYR A 35 -15.981 -3.546 -10.437 1.00 15.43 C ATOM 447 OH TYR A 35 -17.102 -4.325 -10.283 1.00 18.28 O ATOM 0 H TYR A 35 -10.829 -2.815 -11.560 1.00 13.21 H new ATOM 0 HA TYR A 35 -12.608 -1.157 -13.030 1.00 13.20 H new ATOM 0 HB2 TYR A 35 -11.742 -1.427 -10.146 1.00 13.25 H new ATOM 0 HB3 TYR A 35 -12.748 -0.078 -10.635 1.00 13.25 H new ATOM 0 HD1 TYR A 35 -14.232 -1.929 -12.810 1.00 16.05 H new ATOM 0 HD2 TYR A 35 -13.485 -2.221 -8.626 1.00 16.35 H new ATOM 0 HE1 TYR A 35 -16.244 -3.315 -12.545 1.00 16.85 H new ATOM 0 HE2 TYR A 35 -15.485 -3.611 -8.363 1.00 17.14 H new ATOM 0 HH TYR A 35 -17.201 -4.573 -9.340 1.00 18.28 H new ATOM 457 N GLN A 36 -11.511 1.073 -13.214 1.00 12.79 N ATOM 458 CA GLN A 36 -10.834 2.339 -13.421 1.00 12.57 C ATOM 459 C GLN A 36 -11.085 3.225 -12.205 1.00 11.54 C ATOM 460 O GLN A 36 -12.118 3.091 -11.554 1.00 11.22 O ATOM 461 CB GLN A 36 -11.346 3.026 -14.693 1.00 13.45 C ATOM 462 CG GLN A 36 -11.224 2.176 -15.952 1.00 14.56 C ATOM 463 CD GLN A 36 -9.813 1.671 -16.185 1.00 15.07 C ATOM 464 OE1 GLN A 36 -9.549 0.442 -15.774 1.00 15.22 O flip ATOM 465 NE2 GLN A 36 -8.972 2.373 -16.745 1.00 15.48 N flip ATOM 0 H GLN A 36 -12.392 0.978 -13.719 1.00 12.79 H new ATOM 0 HA GLN A 36 -9.765 2.166 -13.543 1.00 12.57 H new ATOM 0 HB2 GLN A 36 -12.392 3.297 -14.551 1.00 13.45 H new ATOM 0 HB3 GLN A 36 -10.793 3.954 -14.839 1.00 13.45 H new ATOM 0 HG2 GLN A 36 -11.902 1.326 -15.878 1.00 14.56 H new ATOM 0 HG3 GLN A 36 -11.542 2.763 -16.814 1.00 14.56 H new ATOM 0 HE21 GLN A 36 -9.215 3.316 -17.047 1.00 15.48 H new ATOM 0 HE22 GLN A 36 -8.032 2.012 -16.907 1.00 15.48 H new ATOM 474 N PRO A 37 -10.154 4.131 -11.874 1.00 11.14 N ATOM 475 CA PRO A 37 -10.300 5.025 -10.719 1.00 10.29 C ATOM 476 C PRO A 37 -11.649 5.742 -10.701 1.00 10.51 C ATOM 477 O PRO A 37 -12.309 5.823 -9.664 1.00 10.47 O ATOM 478 CB PRO A 37 -9.159 6.027 -10.901 1.00 10.16 C ATOM 479 CG PRO A 37 -8.127 5.280 -11.670 1.00 10.93 C ATOM 480 CD PRO A 37 -8.884 4.356 -12.585 1.00 11.63 C ATOM 0 HA PRO A 37 -10.260 4.481 -9.775 1.00 10.29 H new ATOM 0 HB2 PRO A 37 -9.492 6.914 -11.441 1.00 10.16 H new ATOM 0 HB3 PRO A 37 -8.771 6.365 -9.940 1.00 10.16 H new ATOM 0 HG2 PRO A 37 -7.494 5.961 -12.239 1.00 10.93 H new ATOM 0 HG3 PRO A 37 -7.472 4.719 -11.003 1.00 10.93 H new ATOM 0 HD2 PRO A 37 -9.047 4.806 -13.564 1.00 11.63 H new ATOM 0 HD3 PRO A 37 -8.345 3.423 -12.748 1.00 11.63 H new ATOM 488 N GLN A 38 -12.068 6.224 -11.866 1.00 10.92 N ATOM 489 CA GLN A 38 -13.333 6.940 -12.007 1.00 11.42 C ATOM 490 C GLN A 38 -14.536 6.052 -11.684 1.00 11.86 C ATOM 491 O GLN A 38 -15.601 6.555 -11.338 1.00 12.08 O ATOM 492 CB GLN A 38 -13.474 7.495 -13.429 1.00 12.31 C ATOM 493 CG GLN A 38 -12.530 8.650 -13.734 1.00 12.40 C ATOM 494 CD GLN A 38 -11.197 8.195 -14.306 1.00 12.97 C ATOM 495 OE1 GLN A 38 -10.727 7.089 -14.034 1.00 13.31 O ATOM 496 NE2 GLN A 38 -10.577 9.049 -15.105 1.00 13.23 N ATOM 0 H GLN A 38 -11.544 6.131 -12.736 1.00 10.92 H new ATOM 0 HA GLN A 38 -13.319 7.760 -11.289 1.00 11.42 H new ATOM 0 HB2 GLN A 38 -13.292 6.691 -14.142 1.00 12.31 H new ATOM 0 HB3 GLN A 38 -14.501 7.828 -13.579 1.00 12.31 H new ATOM 0 HG2 GLN A 38 -13.010 9.327 -14.441 1.00 12.40 H new ATOM 0 HG3 GLN A 38 -12.352 9.217 -12.820 1.00 12.40 H new ATOM 0 HE21 GLN A 38 -10.998 9.956 -15.307 1.00 13.23 H new ATOM 0 HE22 GLN A 38 -9.679 8.800 -15.519 1.00 13.23 H new ATOM 505 N GLU A 39 -14.362 4.738 -11.783 1.00 12.10 N ATOM 506 CA GLU A 39 -15.445 3.799 -11.504 1.00 12.60 C ATOM 507 C GLU A 39 -15.693 3.684 -10.004 1.00 12.14 C ATOM 508 O GLU A 39 -16.779 3.294 -9.571 1.00 12.03 O ATOM 509 CB GLU A 39 -15.124 2.417 -12.082 1.00 13.06 C ATOM 510 CG GLU A 39 -14.969 2.401 -13.594 1.00 14.17 C ATOM 511 CD GLU A 39 -14.925 0.994 -14.149 1.00 16.63 C ATOM 512 OE1 GLU A 39 -16.001 0.367 -14.270 1.00 17.34 O ATOM 513 OE2 GLU A 39 -13.822 0.506 -14.461 1.00 16.43 O ATOM 0 H GLU A 39 -13.482 4.299 -12.054 1.00 12.10 H new ATOM 0 HA GLU A 39 -16.348 4.182 -11.980 1.00 12.60 H new ATOM 0 HB2 GLU A 39 -14.203 2.050 -11.629 1.00 13.06 H new ATOM 0 HB3 GLU A 39 -15.917 1.724 -11.801 1.00 13.06 H new ATOM 0 HG2 GLU A 39 -15.798 2.943 -14.048 1.00 14.17 H new ATOM 0 HG3 GLU A 39 -14.055 2.927 -13.869 1.00 14.17 H new ATOM 520 N LEU A 40 -14.681 4.024 -9.217 1.00 12.04 N ATOM 521 CA LEU A 40 -14.784 3.956 -7.765 1.00 11.75 C ATOM 522 C LEU A 40 -15.102 5.328 -7.180 1.00 11.42 C ATOM 523 O LEU A 40 -15.747 5.436 -6.138 1.00 11.04 O ATOM 524 CB LEU A 40 -13.481 3.427 -7.152 1.00 11.89 C ATOM 525 CG LEU A 40 -13.218 1.923 -7.308 1.00 12.41 C ATOM 526 CD1 LEU A 40 -14.502 1.122 -7.152 1.00 12.70 C ATOM 527 CD2 LEU A 40 -12.558 1.630 -8.647 1.00 13.25 C ATOM 0 H LEU A 40 -13.778 4.350 -9.560 1.00 12.04 H new ATOM 0 HA LEU A 40 -15.595 3.270 -7.522 1.00 11.75 H new ATOM 0 HB2 LEU A 40 -12.648 3.968 -7.600 1.00 11.89 H new ATOM 0 HB3 LEU A 40 -13.481 3.666 -6.088 1.00 11.89 H new ATOM 0 HG LEU A 40 -12.536 1.617 -6.515 1.00 12.41 H new ATOM 0 HD11 LEU A 40 -14.285 0.060 -7.267 1.00 12.70 H new ATOM 0 HD12 LEU A 40 -14.924 1.301 -6.163 1.00 12.70 H new ATOM 0 HD13 LEU A 40 -15.218 1.431 -7.914 1.00 12.70 H new ATOM 0 HD21 LEU A 40 -12.380 0.559 -8.738 1.00 13.25 H new ATOM 0 HD22 LEU A 40 -13.212 1.959 -9.455 1.00 13.25 H new ATOM 0 HD23 LEU A 40 -11.609 2.162 -8.709 1.00 13.25 H new ATOM 539 N LEU A 41 -14.644 6.375 -7.857 1.00 11.77 N ATOM 540 CA LEU A 41 -14.861 7.744 -7.400 1.00 11.76 C ATOM 541 C LEU A 41 -16.349 8.086 -7.366 1.00 12.25 C ATOM 542 O LEU A 41 -16.987 8.251 -8.409 1.00 12.72 O ATOM 543 CB LEU A 41 -14.113 8.729 -8.302 1.00 12.25 C ATOM 544 CG LEU A 41 -12.597 8.534 -8.348 1.00 12.23 C ATOM 545 CD1 LEU A 41 -11.957 9.524 -9.304 1.00 12.99 C ATOM 546 CD2 LEU A 41 -11.998 8.671 -6.958 1.00 11.79 C ATOM 0 H LEU A 41 -14.118 6.302 -8.728 1.00 11.77 H new ATOM 0 HA LEU A 41 -14.472 7.825 -6.385 1.00 11.76 H new ATOM 0 HB2 LEU A 41 -14.507 8.643 -9.315 1.00 12.25 H new ATOM 0 HB3 LEU A 41 -14.324 9.743 -7.963 1.00 12.25 H new ATOM 0 HG LEU A 41 -12.394 7.527 -8.712 1.00 12.23 H new ATOM 0 HD11 LEU A 41 -10.878 9.368 -9.321 1.00 12.99 H new ATOM 0 HD12 LEU A 41 -12.361 9.376 -10.305 1.00 12.99 H new ATOM 0 HD13 LEU A 41 -12.171 10.540 -8.973 1.00 12.99 H new ATOM 0 HD21 LEU A 41 -10.919 8.529 -7.011 1.00 11.79 H new ATOM 0 HD22 LEU A 41 -12.214 9.664 -6.565 1.00 11.79 H new ATOM 0 HD23 LEU A 41 -12.431 7.918 -6.299 1.00 11.79 H new ATOM 558 N GLY A 42 -16.891 8.193 -6.160 1.00 12.24 N ATOM 559 CA GLY A 42 -18.299 8.507 -6.001 1.00 12.82 C ATOM 560 C GLY A 42 -19.140 7.266 -5.784 1.00 13.07 C ATOM 561 O GLY A 42 -20.366 7.344 -5.687 1.00 13.39 O ATOM 0 H GLY A 42 -16.380 8.068 -5.286 1.00 12.24 H new ATOM 0 HA2 GLY A 42 -18.426 9.182 -5.155 1.00 12.82 H new ATOM 0 HA3 GLY A 42 -18.654 9.035 -6.886 1.00 12.82 H new ATOM 565 N LYS A 43 -18.482 6.121 -5.713 1.00 13.04 N ATOM 566 CA LYS A 43 -19.167 4.857 -5.502 1.00 13.33 C ATOM 567 C LYS A 43 -18.817 4.288 -4.136 1.00 12.82 C ATOM 568 O LYS A 43 -17.795 4.650 -3.552 1.00 13.01 O ATOM 569 CB LYS A 43 -18.786 3.860 -6.596 1.00 13.98 C ATOM 570 CG LYS A 43 -19.531 4.066 -7.907 1.00 15.04 C ATOM 571 CD LYS A 43 -20.957 3.544 -7.828 1.00 15.77 C ATOM 572 CE LYS A 43 -21.911 4.594 -7.285 1.00 16.37 C ATOM 573 NZ LYS A 43 -23.121 3.982 -6.681 1.00 16.87 N ATOM 0 H LYS A 43 -17.469 6.041 -5.799 1.00 13.04 H new ATOM 0 HA LYS A 43 -20.242 5.034 -5.544 1.00 13.33 H new ATOM 0 HB2 LYS A 43 -17.715 3.933 -6.783 1.00 13.98 H new ATOM 0 HB3 LYS A 43 -18.978 2.849 -6.236 1.00 13.98 H new ATOM 0 HG2 LYS A 43 -19.545 5.127 -8.156 1.00 15.04 H new ATOM 0 HG3 LYS A 43 -19.001 3.557 -8.712 1.00 15.04 H new ATOM 0 HD2 LYS A 43 -21.286 3.232 -8.819 1.00 15.77 H new ATOM 0 HD3 LYS A 43 -20.986 2.661 -7.190 1.00 15.77 H new ATOM 0 HE2 LYS A 43 -21.398 5.199 -6.537 1.00 16.37 H new ATOM 0 HE3 LYS A 43 -22.207 5.266 -8.090 1.00 16.37 H new ATOM 0 HZ1 LYS A 43 -23.891 4.680 -6.664 1.00 16.87 H new ATOM 0 HZ2 LYS A 43 -23.413 3.159 -7.246 1.00 16.87 H new ATOM 0 HZ3 LYS A 43 -22.908 3.677 -5.710 1.00 16.87 H new ATOM 587 N ASN A 44 -19.670 3.412 -3.626 1.00 12.28 N ATOM 588 CA ASN A 44 -19.442 2.796 -2.329 1.00 11.87 C ATOM 589 C ASN A 44 -18.731 1.461 -2.505 1.00 11.67 C ATOM 590 O ASN A 44 -19.097 0.664 -3.369 1.00 11.82 O ATOM 591 CB ASN A 44 -20.766 2.573 -1.590 1.00 11.97 C ATOM 592 CG ASN A 44 -21.515 3.859 -1.299 1.00 12.28 C ATOM 593 OD1 ASN A 44 -22.281 4.347 -2.130 1.00 12.50 O ATOM 594 ND2 ASN A 44 -21.318 4.412 -0.112 1.00 12.46 N ATOM 0 H ASN A 44 -20.527 3.112 -4.091 1.00 12.28 H new ATOM 0 HA ASN A 44 -18.820 3.468 -1.739 1.00 11.87 H new ATOM 0 HB2 ASN A 44 -21.401 1.918 -2.186 1.00 11.97 H new ATOM 0 HB3 ASN A 44 -20.567 2.056 -0.651 1.00 11.97 H new ATOM 0 HD21 ASN A 44 -21.809 5.270 0.138 1.00 12.46 H new ATOM 0 HD22 ASN A 44 -20.676 3.980 0.552 1.00 12.46 H new ATOM 601 N ILE A 45 -17.727 1.213 -1.676 1.00 11.52 N ATOM 602 CA ILE A 45 -16.971 -0.033 -1.742 1.00 11.55 C ATOM 603 C ILE A 45 -17.875 -1.227 -1.418 1.00 11.53 C ATOM 604 O ILE A 45 -17.660 -2.337 -1.907 1.00 11.49 O ATOM 605 CB ILE A 45 -15.749 -0.003 -0.782 1.00 11.20 C ATOM 606 CG1 ILE A 45 -15.000 -1.342 -0.805 1.00 11.40 C ATOM 607 CG2 ILE A 45 -16.183 0.345 0.635 1.00 11.02 C ATOM 608 CD1 ILE A 45 -13.646 -1.295 -0.130 1.00 11.72 C ATOM 0 H ILE A 45 -17.416 1.857 -0.949 1.00 11.52 H new ATOM 0 HA ILE A 45 -16.596 -0.143 -2.760 1.00 11.55 H new ATOM 0 HB ILE A 45 -15.067 0.773 -1.131 1.00 11.20 H new ATOM 0 HG12 ILE A 45 -15.613 -2.099 -0.317 1.00 11.40 H new ATOM 0 HG13 ILE A 45 -14.869 -1.657 -1.840 1.00 11.40 H new ATOM 0 HG21 ILE A 45 -15.311 0.360 1.289 1.00 11.02 H new ATOM 0 HG22 ILE A 45 -16.657 1.326 0.640 1.00 11.02 H new ATOM 0 HG23 ILE A 45 -16.892 -0.402 0.992 1.00 11.02 H new ATOM 0 HD11 ILE A 45 -13.177 -2.277 -0.186 1.00 11.72 H new ATOM 0 HD12 ILE A 45 -13.014 -0.562 -0.632 1.00 11.72 H new ATOM 0 HD13 ILE A 45 -13.770 -1.012 0.915 1.00 11.72 H new ATOM 620 N VAL A 46 -18.914 -0.976 -0.628 1.00 11.77 N ATOM 621 CA VAL A 46 -19.860 -2.015 -0.237 1.00 11.99 C ATOM 622 C VAL A 46 -20.698 -2.489 -1.434 1.00 12.29 C ATOM 623 O VAL A 46 -21.288 -3.571 -1.405 1.00 12.37 O ATOM 624 CB VAL A 46 -20.788 -1.515 0.898 1.00 12.37 C ATOM 625 CG1 VAL A 46 -21.837 -0.549 0.366 1.00 12.89 C ATOM 626 CG2 VAL A 46 -21.442 -2.680 1.624 1.00 12.52 C ATOM 0 H VAL A 46 -19.123 -0.055 -0.244 1.00 11.77 H new ATOM 0 HA VAL A 46 -19.281 -2.863 0.130 1.00 11.99 H new ATOM 0 HB VAL A 46 -20.170 -0.976 1.616 1.00 12.37 H new ATOM 0 HG11 VAL A 46 -22.473 -0.215 1.186 1.00 12.89 H new ATOM 0 HG12 VAL A 46 -21.343 0.312 -0.084 1.00 12.89 H new ATOM 0 HG13 VAL A 46 -22.447 -1.051 -0.385 1.00 12.89 H new ATOM 0 HG21 VAL A 46 -22.088 -2.299 2.415 1.00 12.52 H new ATOM 0 HG22 VAL A 46 -22.036 -3.261 0.919 1.00 12.52 H new ATOM 0 HG23 VAL A 46 -20.671 -3.316 2.059 1.00 12.52 H new ATOM 636 N GLU A 47 -20.722 -1.687 -2.496 1.00 12.64 N ATOM 637 CA GLU A 47 -21.490 -2.026 -3.690 1.00 13.14 C ATOM 638 C GLU A 47 -20.757 -3.056 -4.541 1.00 12.83 C ATOM 639 O GLU A 47 -21.377 -3.921 -5.163 1.00 12.91 O ATOM 640 CB GLU A 47 -21.759 -0.775 -4.525 1.00 14.14 C ATOM 641 CG GLU A 47 -22.430 0.342 -3.751 1.00 14.73 C ATOM 642 CD GLU A 47 -22.805 1.509 -4.637 1.00 15.67 C ATOM 643 OE1 GLU A 47 -21.965 2.406 -4.848 1.00 15.65 O ATOM 644 OE2 GLU A 47 -23.950 1.535 -5.132 1.00 16.53 O ATOM 0 H GLU A 47 -20.220 -0.801 -2.554 1.00 12.64 H new ATOM 0 HA GLU A 47 -22.438 -2.454 -3.363 1.00 13.14 H new ATOM 0 HB2 GLU A 47 -20.815 -0.409 -4.929 1.00 14.14 H new ATOM 0 HB3 GLU A 47 -22.387 -1.044 -5.375 1.00 14.14 H new ATOM 0 HG2 GLU A 47 -23.325 -0.044 -3.263 1.00 14.73 H new ATOM 0 HG3 GLU A 47 -21.761 0.687 -2.963 1.00 14.73 H new ATOM 651 N PHE A 48 -19.437 -2.963 -4.568 1.00 12.62 N ATOM 652 CA PHE A 48 -18.625 -3.884 -5.356 1.00 12.47 C ATOM 653 C PHE A 48 -18.128 -5.037 -4.495 1.00 11.91 C ATOM 654 O PHE A 48 -17.329 -5.862 -4.935 1.00 11.81 O ATOM 655 CB PHE A 48 -17.439 -3.146 -5.979 1.00 12.62 C ATOM 656 CG PHE A 48 -17.823 -1.897 -6.718 1.00 14.11 C ATOM 657 CD1 PHE A 48 -18.273 -1.962 -8.025 1.00 14.39 C ATOM 658 CD2 PHE A 48 -17.733 -0.659 -6.104 1.00 14.61 C ATOM 659 CE1 PHE A 48 -18.626 -0.814 -8.707 1.00 15.13 C ATOM 660 CE2 PHE A 48 -18.085 0.492 -6.780 1.00 15.34 C ATOM 661 CZ PHE A 48 -18.533 0.414 -8.084 1.00 14.85 C ATOM 0 H PHE A 48 -18.903 -2.261 -4.055 1.00 12.62 H new ATOM 0 HA PHE A 48 -19.247 -4.291 -6.153 1.00 12.47 H new ATOM 0 HB2 PHE A 48 -16.730 -2.888 -5.192 1.00 12.62 H new ATOM 0 HB3 PHE A 48 -16.924 -3.819 -6.665 1.00 12.62 H new ATOM 0 HD1 PHE A 48 -18.349 -2.920 -8.517 1.00 14.39 H new ATOM 0 HD2 PHE A 48 -17.383 -0.593 -5.084 1.00 14.61 H new ATOM 0 HE1 PHE A 48 -18.975 -0.877 -9.727 1.00 15.13 H new ATOM 0 HE2 PHE A 48 -18.010 1.452 -6.290 1.00 15.34 H new ATOM 0 HZ PHE A 48 -18.810 1.312 -8.615 1.00 14.85 H new ATOM 671 N CYS A 49 -18.607 -5.084 -3.264 1.00 11.77 N ATOM 672 CA CYS A 49 -18.221 -6.126 -2.335 1.00 11.49 C ATOM 673 C CYS A 49 -19.221 -7.276 -2.383 1.00 11.83 C ATOM 674 O CYS A 49 -20.381 -7.091 -2.772 1.00 11.97 O ATOM 675 CB CYS A 49 -18.129 -5.566 -0.910 1.00 11.25 C ATOM 676 SG CYS A 49 -17.585 -6.764 0.332 1.00 11.37 S ATOM 0 H CYS A 49 -19.268 -4.406 -2.885 1.00 11.77 H new ATOM 0 HA CYS A 49 -17.240 -6.502 -2.626 1.00 11.49 H new ATOM 0 HB2 CYS A 49 -17.440 -4.722 -0.909 1.00 11.25 H new ATOM 0 HB3 CYS A 49 -19.107 -5.180 -0.621 1.00 11.25 H new ATOM 0 HG CYS A 49 -16.306 -6.961 0.213 1.00 11.37 H new ATOM 682 N HIS A 50 -18.752 -8.459 -2.017 1.00 12.10 N ATOM 683 CA HIS A 50 -19.581 -9.654 -1.990 1.00 12.66 C ATOM 684 C HIS A 50 -20.710 -9.468 -0.982 1.00 12.75 C ATOM 685 O HIS A 50 -20.460 -9.093 0.154 1.00 12.20 O ATOM 686 CB HIS A 50 -18.717 -10.856 -1.607 1.00 13.24 C ATOM 687 CG HIS A 50 -19.267 -12.185 -2.021 1.00 13.78 C ATOM 688 ND1 HIS A 50 -19.231 -13.285 -1.204 1.00 14.15 N ATOM 689 CD2 HIS A 50 -19.832 -12.598 -3.181 1.00 14.13 C ATOM 690 CE1 HIS A 50 -19.742 -14.320 -1.840 1.00 14.67 C ATOM 691 NE2 HIS A 50 -20.116 -13.932 -3.040 1.00 14.65 N ATOM 0 H HIS A 50 -17.786 -8.618 -1.730 1.00 12.10 H new ATOM 0 HA HIS A 50 -20.016 -9.827 -2.974 1.00 12.66 H new ATOM 0 HB2 HIS A 50 -17.730 -10.733 -2.053 1.00 13.24 H new ATOM 0 HB3 HIS A 50 -18.580 -10.857 -0.526 1.00 13.24 H new ATOM 0 HD1 HIS A 50 -18.866 -13.300 -0.252 1.00 14.15 H new ATOM 0 HD2 HIS A 50 -20.023 -11.990 -4.053 1.00 14.13 H new ATOM 0 HE1 HIS A 50 -19.838 -15.320 -1.442 1.00 14.67 H new ATOM 700 N PRO A 51 -21.966 -9.708 -1.392 1.00 13.57 N ATOM 701 CA PRO A 51 -23.143 -9.551 -0.520 1.00 13.93 C ATOM 702 C PRO A 51 -22.968 -10.137 0.885 1.00 14.09 C ATOM 703 O PRO A 51 -23.212 -9.457 1.882 1.00 14.26 O ATOM 704 CB PRO A 51 -24.228 -10.302 -1.280 1.00 14.93 C ATOM 705 CG PRO A 51 -23.854 -10.129 -2.712 1.00 15.15 C ATOM 706 CD PRO A 51 -22.351 -10.138 -2.753 1.00 14.35 C ATOM 0 HA PRO A 51 -23.358 -8.499 -0.333 1.00 13.93 H new ATOM 0 HB2 PRO A 51 -24.255 -11.355 -0.999 1.00 14.93 H new ATOM 0 HB3 PRO A 51 -25.216 -9.891 -1.074 1.00 14.93 H new ATOM 0 HG2 PRO A 51 -24.266 -10.933 -3.322 1.00 15.15 H new ATOM 0 HG3 PRO A 51 -24.249 -9.194 -3.108 1.00 15.15 H new ATOM 0 HD2 PRO A 51 -21.962 -11.129 -2.986 1.00 14.35 H new ATOM 0 HD3 PRO A 51 -21.966 -9.458 -3.513 1.00 14.35 H new ATOM 714 N GLU A 52 -22.525 -11.386 0.967 1.00 14.17 N ATOM 715 CA GLU A 52 -22.339 -12.046 2.259 1.00 14.44 C ATOM 716 C GLU A 52 -21.117 -11.504 3.003 1.00 13.87 C ATOM 717 O GLU A 52 -20.930 -11.778 4.188 1.00 14.17 O ATOM 718 CB GLU A 52 -22.199 -13.559 2.076 1.00 15.45 C ATOM 719 CG GLU A 52 -23.248 -14.165 1.158 1.00 16.21 C ATOM 720 CD GLU A 52 -22.744 -14.340 -0.258 1.00 16.09 C ATOM 721 OE1 GLU A 52 -22.653 -13.331 -0.989 1.00 15.73 O ATOM 722 OE2 GLU A 52 -22.429 -15.486 -0.645 1.00 16.47 O ATOM 0 H GLU A 52 -22.288 -11.962 0.159 1.00 14.17 H new ATOM 0 HA GLU A 52 -23.224 -11.834 2.858 1.00 14.44 H new ATOM 0 HB2 GLU A 52 -21.209 -13.777 1.675 1.00 15.45 H new ATOM 0 HB3 GLU A 52 -22.261 -14.041 3.052 1.00 15.45 H new ATOM 0 HG2 GLU A 52 -23.557 -15.133 1.553 1.00 16.21 H new ATOM 0 HG3 GLU A 52 -24.132 -13.527 1.150 1.00 16.21 H new ATOM 729 N ASP A 53 -20.294 -10.730 2.312 1.00 13.16 N ATOM 730 CA ASP A 53 -19.088 -10.166 2.912 1.00 12.70 C ATOM 731 C ASP A 53 -19.251 -8.671 3.156 1.00 12.63 C ATOM 732 O ASP A 53 -18.346 -8.012 3.674 1.00 12.77 O ATOM 733 CB ASP A 53 -17.875 -10.416 2.008 1.00 12.21 C ATOM 734 CG ASP A 53 -17.490 -11.882 1.923 1.00 12.39 C ATOM 735 OD1 ASP A 53 -18.095 -12.616 1.111 1.00 13.14 O ATOM 736 OD2 ASP A 53 -16.580 -12.306 2.664 1.00 11.90 O ATOM 0 H ASP A 53 -20.437 -10.476 1.334 1.00 13.16 H new ATOM 0 HA ASP A 53 -18.926 -10.659 3.871 1.00 12.70 H new ATOM 0 HB2 ASP A 53 -18.093 -10.045 1.007 1.00 12.21 H new ATOM 0 HB3 ASP A 53 -17.026 -9.844 2.382 1.00 12.21 H new ATOM 741 N GLN A 54 -20.417 -8.144 2.794 1.00 12.56 N ATOM 742 CA GLN A 54 -20.711 -6.723 2.955 1.00 12.69 C ATOM 743 C GLN A 54 -20.646 -6.310 4.421 1.00 12.06 C ATOM 744 O GLN A 54 -19.976 -5.336 4.770 1.00 11.70 O ATOM 745 CB GLN A 54 -22.084 -6.397 2.367 1.00 13.60 C ATOM 746 CG GLN A 54 -22.057 -6.182 0.860 1.00 14.35 C ATOM 747 CD GLN A 54 -23.442 -6.071 0.249 1.00 15.27 C ATOM 748 OE1 GLN A 54 -24.389 -6.729 0.687 1.00 15.83 O ATOM 749 NE2 GLN A 54 -23.574 -5.231 -0.766 1.00 15.52 N ATOM 0 H GLN A 54 -21.179 -8.684 2.384 1.00 12.56 H new ATOM 0 HA GLN A 54 -19.953 -6.156 2.414 1.00 12.69 H new ATOM 0 HB2 GLN A 54 -22.773 -7.209 2.599 1.00 13.60 H new ATOM 0 HB3 GLN A 54 -22.474 -5.500 2.848 1.00 13.60 H new ATOM 0 HG2 GLN A 54 -21.495 -5.275 0.639 1.00 14.35 H new ATOM 0 HG3 GLN A 54 -21.525 -7.009 0.391 1.00 14.35 H new ATOM 0 HE21 GLN A 54 -22.767 -4.704 -1.100 1.00 15.52 H new ATOM 0 HE22 GLN A 54 -24.483 -5.111 -1.214 1.00 15.52 H new ATOM 758 N GLN A 55 -21.331 -7.057 5.280 1.00 12.07 N ATOM 759 CA GLN A 55 -21.333 -6.762 6.706 1.00 11.64 C ATOM 760 C GLN A 55 -19.929 -6.933 7.283 1.00 11.18 C ATOM 761 O GLN A 55 -19.512 -6.177 8.159 1.00 11.47 O ATOM 762 CB GLN A 55 -22.339 -7.656 7.443 1.00 12.30 C ATOM 763 CG GLN A 55 -22.395 -7.404 8.943 1.00 13.09 C ATOM 764 CD GLN A 55 -22.548 -5.935 9.296 1.00 13.56 C ATOM 765 OE1 GLN A 55 -23.242 -5.179 8.613 1.00 13.71 O ATOM 766 NE2 GLN A 55 -21.885 -5.518 10.363 1.00 13.94 N ATOM 0 H GLN A 55 -21.890 -7.868 5.014 1.00 12.07 H new ATOM 0 HA GLN A 55 -21.639 -5.725 6.846 1.00 11.64 H new ATOM 0 HB2 GLN A 55 -23.331 -7.498 7.019 1.00 12.30 H new ATOM 0 HB3 GLN A 55 -22.080 -8.700 7.268 1.00 12.30 H new ATOM 0 HG2 GLN A 55 -23.229 -7.962 9.368 1.00 13.09 H new ATOM 0 HG3 GLN A 55 -21.486 -7.789 9.404 1.00 13.09 H new ATOM 0 HE21 GLN A 55 -21.321 -6.175 10.902 1.00 13.94 H new ATOM 0 HE22 GLN A 55 -21.938 -4.539 10.646 1.00 13.94 H new ATOM 775 N LEU A 56 -19.199 -7.922 6.771 1.00 10.67 N ATOM 776 CA LEU A 56 -17.833 -8.183 7.214 1.00 10.41 C ATOM 777 C LEU A 56 -16.975 -6.939 7.000 1.00 9.74 C ATOM 778 O LEU A 56 -16.216 -6.526 7.882 1.00 10.08 O ATOM 779 CB LEU A 56 -17.247 -9.376 6.449 1.00 10.70 C ATOM 780 CG LEU A 56 -15.769 -9.674 6.723 1.00 11.52 C ATOM 781 CD1 LEU A 56 -15.585 -10.268 8.110 1.00 12.11 C ATOM 782 CD2 LEU A 56 -15.209 -10.611 5.663 1.00 11.94 C ATOM 0 H LEU A 56 -19.533 -8.557 6.046 1.00 10.67 H new ATOM 0 HA LEU A 56 -17.842 -8.426 8.276 1.00 10.41 H new ATOM 0 HB2 LEU A 56 -17.830 -10.264 6.694 1.00 10.70 H new ATOM 0 HB3 LEU A 56 -17.372 -9.197 5.381 1.00 10.70 H new ATOM 0 HG LEU A 56 -15.219 -8.734 6.680 1.00 11.52 H new ATOM 0 HD11 LEU A 56 -14.528 -10.471 8.282 1.00 12.11 H new ATOM 0 HD12 LEU A 56 -15.945 -9.562 8.859 1.00 12.11 H new ATOM 0 HD13 LEU A 56 -16.150 -11.197 8.186 1.00 12.11 H new ATOM 0 HD21 LEU A 56 -14.158 -10.812 5.873 1.00 11.94 H new ATOM 0 HD22 LEU A 56 -15.767 -11.547 5.674 1.00 11.94 H new ATOM 0 HD23 LEU A 56 -15.300 -10.146 4.681 1.00 11.94 H new ATOM 794 N LEU A 57 -17.119 -6.342 5.825 1.00 9.01 N ATOM 795 CA LEU A 57 -16.388 -5.135 5.476 1.00 8.57 C ATOM 796 C LEU A 57 -16.875 -3.966 6.327 1.00 8.01 C ATOM 797 O LEU A 57 -16.079 -3.223 6.900 1.00 7.76 O ATOM 798 CB LEU A 57 -16.589 -4.809 3.993 1.00 8.96 C ATOM 799 CG LEU A 57 -15.312 -4.662 3.167 1.00 9.22 C ATOM 800 CD1 LEU A 57 -15.622 -3.973 1.849 1.00 9.38 C ATOM 801 CD2 LEU A 57 -14.247 -3.890 3.935 1.00 9.71 C ATOM 0 H LEU A 57 -17.742 -6.679 5.092 1.00 9.01 H new ATOM 0 HA LEU A 57 -15.327 -5.300 5.666 1.00 8.57 H new ATOM 0 HB2 LEU A 57 -17.200 -5.594 3.547 1.00 8.96 H new ATOM 0 HB3 LEU A 57 -17.157 -3.882 3.918 1.00 8.96 H new ATOM 0 HG LEU A 57 -14.919 -5.658 2.963 1.00 9.22 H new ATOM 0 HD11 LEU A 57 -14.706 -3.872 1.267 1.00 9.38 H new ATOM 0 HD12 LEU A 57 -16.345 -4.567 1.289 1.00 9.38 H new ATOM 0 HD13 LEU A 57 -16.038 -2.985 2.044 1.00 9.38 H new ATOM 0 HD21 LEU A 57 -13.350 -3.801 3.323 1.00 9.71 H new ATOM 0 HD22 LEU A 57 -14.622 -2.895 4.176 1.00 9.71 H new ATOM 0 HD23 LEU A 57 -14.006 -4.421 4.856 1.00 9.71 H new ATOM 813 N ARG A 58 -18.192 -3.835 6.406 1.00 8.00 N ATOM 814 CA ARG A 58 -18.838 -2.771 7.168 1.00 7.77 C ATOM 815 C ARG A 58 -18.349 -2.750 8.615 1.00 7.79 C ATOM 816 O ARG A 58 -18.004 -1.693 9.150 1.00 7.99 O ATOM 817 CB ARG A 58 -20.353 -2.971 7.123 1.00 8.25 C ATOM 818 CG ARG A 58 -21.149 -1.846 7.752 1.00 8.49 C ATOM 819 CD ARG A 58 -22.638 -2.085 7.591 1.00 9.14 C ATOM 820 NE ARG A 58 -23.436 -1.121 8.339 1.00 9.67 N ATOM 821 CZ ARG A 58 -24.503 -1.445 9.067 1.00 10.46 C ATOM 822 NH1 ARG A 58 -24.883 -2.716 9.167 1.00 10.80 N ATOM 823 NH2 ARG A 58 -25.181 -0.500 9.702 1.00 11.06 N ATOM 0 H ARG A 58 -18.846 -4.465 5.942 1.00 8.00 H new ATOM 0 HA ARG A 58 -18.579 -1.812 6.719 1.00 7.77 H new ATOM 0 HB2 ARG A 58 -20.662 -3.082 6.084 1.00 8.25 H new ATOM 0 HB3 ARG A 58 -20.600 -3.903 7.631 1.00 8.25 H new ATOM 0 HG2 ARG A 58 -20.901 -1.767 8.810 1.00 8.49 H new ATOM 0 HG3 ARG A 58 -20.876 -0.898 7.289 1.00 8.49 H new ATOM 0 HD2 ARG A 58 -22.901 -2.029 6.535 1.00 9.14 H new ATOM 0 HD3 ARG A 58 -22.881 -3.093 7.927 1.00 9.14 H new ATOM 0 HE ARG A 58 -23.161 -0.140 8.303 1.00 9.67 H new ATOM 0 HH11 ARG A 58 -24.357 -3.445 8.685 1.00 10.80 H new ATOM 0 HH12 ARG A 58 -25.701 -2.961 9.725 1.00 10.80 H new ATOM 0 HH21 ARG A 58 -24.885 0.474 9.633 1.00 11.06 H new ATOM 0 HH22 ARG A 58 -25.999 -0.746 10.260 1.00 11.06 H new ATOM 837 N ASP A 59 -18.318 -3.920 9.238 1.00 7.90 N ATOM 838 CA ASP A 59 -17.865 -4.039 10.618 1.00 8.29 C ATOM 839 C ASP A 59 -16.393 -3.669 10.741 1.00 8.20 C ATOM 840 O ASP A 59 -16.004 -2.945 11.655 1.00 8.39 O ATOM 841 CB ASP A 59 -18.085 -5.459 11.134 1.00 8.86 C ATOM 842 CG ASP A 59 -17.397 -5.699 12.464 1.00 9.31 C ATOM 843 OD1 ASP A 59 -17.934 -5.264 13.506 1.00 9.71 O ATOM 844 OD2 ASP A 59 -16.325 -6.332 12.473 1.00 9.46 O ATOM 0 H ASP A 59 -18.601 -4.801 8.810 1.00 7.90 H new ATOM 0 HA ASP A 59 -18.451 -3.346 11.222 1.00 8.29 H new ATOM 0 HB2 ASP A 59 -19.154 -5.643 11.242 1.00 8.86 H new ATOM 0 HB3 ASP A 59 -17.711 -6.172 10.400 1.00 8.86 H new ATOM 849 N SER A 60 -15.583 -4.157 9.809 1.00 8.16 N ATOM 850 CA SER A 60 -14.154 -3.873 9.816 1.00 8.37 C ATOM 851 C SER A 60 -13.903 -2.369 9.712 1.00 8.73 C ATOM 852 O SER A 60 -12.965 -1.845 10.313 1.00 9.52 O ATOM 853 CB SER A 60 -13.462 -4.611 8.673 1.00 8.66 C ATOM 854 OG SER A 60 -13.709 -6.007 8.748 1.00 8.89 O ATOM 0 H SER A 60 -15.892 -4.751 9.039 1.00 8.16 H new ATOM 0 HA SER A 60 -13.737 -4.224 10.760 1.00 8.37 H new ATOM 0 HB2 SER A 60 -13.818 -4.226 7.718 1.00 8.66 H new ATOM 0 HB3 SER A 60 -12.389 -4.425 8.712 1.00 8.66 H new ATOM 0 HG SER A 60 -14.588 -6.205 8.362 1.00 8.89 H new ATOM 860 N PHE A 61 -14.753 -1.680 8.955 1.00 8.33 N ATOM 861 CA PHE A 61 -14.630 -0.238 8.794 1.00 8.80 C ATOM 862 C PHE A 61 -14.877 0.461 10.121 1.00 8.83 C ATOM 863 O PHE A 61 -14.121 1.343 10.519 1.00 9.18 O ATOM 864 CB PHE A 61 -15.609 0.277 7.739 1.00 9.15 C ATOM 865 CG PHE A 61 -15.150 0.034 6.332 1.00 9.81 C ATOM 866 CD1 PHE A 61 -13.816 0.186 5.990 1.00 10.30 C ATOM 867 CD2 PHE A 61 -16.049 -0.346 5.351 1.00 10.14 C ATOM 868 CE1 PHE A 61 -13.388 -0.038 4.697 1.00 11.11 C ATOM 869 CE2 PHE A 61 -15.627 -0.571 4.055 1.00 10.92 C ATOM 870 CZ PHE A 61 -14.295 -0.416 3.728 1.00 11.40 C ATOM 0 H PHE A 61 -15.532 -2.098 8.446 1.00 8.33 H new ATOM 0 HA PHE A 61 -13.617 -0.017 8.459 1.00 8.80 H new ATOM 0 HB2 PHE A 61 -16.576 -0.204 7.886 1.00 9.15 H new ATOM 0 HB3 PHE A 61 -15.759 1.347 7.885 1.00 9.15 H new ATOM 0 HD1 PHE A 61 -13.102 0.483 6.744 1.00 10.30 H new ATOM 0 HD2 PHE A 61 -17.092 -0.468 5.601 1.00 10.14 H new ATOM 0 HE1 PHE A 61 -12.345 0.082 4.444 1.00 11.11 H new ATOM 0 HE2 PHE A 61 -16.338 -0.868 3.299 1.00 10.92 H new ATOM 0 HZ PHE A 61 -13.963 -0.590 2.715 1.00 11.40 H new ATOM 880 N GLN A 62 -15.932 0.050 10.812 1.00 8.73 N ATOM 881 CA GLN A 62 -16.260 0.629 12.105 1.00 9.08 C ATOM 882 C GLN A 62 -15.177 0.279 13.122 1.00 9.26 C ATOM 883 O GLN A 62 -14.842 1.078 13.998 1.00 9.50 O ATOM 884 CB GLN A 62 -17.622 0.129 12.584 1.00 9.51 C ATOM 885 CG GLN A 62 -18.769 0.467 11.642 1.00 9.32 C ATOM 886 CD GLN A 62 -18.867 1.952 11.348 1.00 9.53 C ATOM 887 OE1 GLN A 62 -18.318 2.441 10.358 1.00 9.42 O ATOM 888 NE2 GLN A 62 -19.577 2.678 12.196 1.00 10.04 N ATOM 0 H GLN A 62 -16.572 -0.680 10.499 1.00 8.73 H new ATOM 0 HA GLN A 62 -16.310 1.713 12.002 1.00 9.08 H new ATOM 0 HB2 GLN A 62 -17.577 -0.952 12.712 1.00 9.51 H new ATOM 0 HB3 GLN A 62 -17.831 0.558 13.564 1.00 9.51 H new ATOM 0 HG2 GLN A 62 -18.637 -0.077 10.706 1.00 9.32 H new ATOM 0 HG3 GLN A 62 -19.707 0.125 12.080 1.00 9.32 H new ATOM 0 HE21 GLN A 62 -20.016 2.235 13.003 1.00 10.04 H new ATOM 0 HE22 GLN A 62 -19.686 3.680 12.042 1.00 10.04 H new ATOM 897 N GLN A 63 -14.623 -0.921 12.983 1.00 9.36 N ATOM 898 CA GLN A 63 -13.563 -1.387 13.864 1.00 9.71 C ATOM 899 C GLN A 63 -12.317 -0.518 13.712 1.00 10.03 C ATOM 900 O GLN A 63 -11.667 -0.174 14.701 1.00 10.60 O ATOM 901 CB GLN A 63 -13.214 -2.846 13.563 1.00 9.50 C ATOM 902 CG GLN A 63 -13.948 -3.852 14.436 1.00 9.75 C ATOM 903 CD GLN A 63 -13.317 -5.231 14.381 1.00 9.97 C ATOM 904 OE1 GLN A 63 -12.376 -5.524 15.120 1.00 10.06 O ATOM 905 NE2 GLN A 63 -13.834 -6.094 13.522 1.00 10.30 N ATOM 0 H GLN A 63 -14.894 -1.591 12.263 1.00 9.36 H new ATOM 0 HA GLN A 63 -13.922 -1.314 14.890 1.00 9.71 H new ATOM 0 HB2 GLN A 63 -13.441 -3.055 12.517 1.00 9.50 H new ATOM 0 HB3 GLN A 63 -12.140 -2.985 13.690 1.00 9.50 H new ATOM 0 HG2 GLN A 63 -13.954 -3.499 15.467 1.00 9.75 H new ATOM 0 HG3 GLN A 63 -14.988 -3.918 14.115 1.00 9.75 H new ATOM 0 HE21 GLN A 63 -14.613 -5.815 12.926 1.00 10.30 H new ATOM 0 HE22 GLN A 63 -13.453 -7.038 13.456 1.00 10.30 H new ATOM 914 N VAL A 64 -11.997 -0.146 12.472 1.00 9.80 N ATOM 915 CA VAL A 64 -10.823 0.681 12.205 1.00 10.18 C ATOM 916 C VAL A 64 -11.031 2.106 12.722 1.00 10.37 C ATOM 917 O VAL A 64 -10.064 2.808 13.036 1.00 10.25 O ATOM 918 CB VAL A 64 -10.445 0.690 10.700 1.00 10.36 C ATOM 919 CG1 VAL A 64 -11.113 1.836 9.949 1.00 10.34 C ATOM 920 CG2 VAL A 64 -8.933 0.753 10.534 1.00 10.62 C ATOM 0 H VAL A 64 -12.532 -0.403 11.642 1.00 9.80 H new ATOM 0 HA VAL A 64 -9.987 0.236 12.744 1.00 10.18 H new ATOM 0 HB VAL A 64 -10.813 -0.240 10.265 1.00 10.36 H new ATOM 0 HG11 VAL A 64 -10.820 1.803 8.900 1.00 10.34 H new ATOM 0 HG12 VAL A 64 -12.196 1.740 10.027 1.00 10.34 H new ATOM 0 HG13 VAL A 64 -10.801 2.786 10.383 1.00 10.34 H new ATOM 0 HG21 VAL A 64 -8.683 0.759 9.473 1.00 10.62 H new ATOM 0 HG22 VAL A 64 -8.553 1.662 11.001 1.00 10.62 H new ATOM 0 HG23 VAL A 64 -8.478 -0.116 11.009 1.00 10.62 H new ATOM 930 N VAL A 65 -12.292 2.526 12.816 1.00 10.88 N ATOM 931 CA VAL A 65 -12.618 3.852 13.330 1.00 11.34 C ATOM 932 C VAL A 65 -12.301 3.899 14.821 1.00 11.77 C ATOM 933 O VAL A 65 -11.800 4.897 15.340 1.00 11.90 O ATOM 934 CB VAL A 65 -14.109 4.206 13.103 1.00 11.81 C ATOM 935 CG1 VAL A 65 -14.481 5.503 13.810 1.00 12.41 C ATOM 936 CG2 VAL A 65 -14.414 4.307 11.615 1.00 11.68 C ATOM 0 H VAL A 65 -13.101 1.968 12.543 1.00 10.88 H new ATOM 0 HA VAL A 65 -12.019 4.585 12.790 1.00 11.34 H new ATOM 0 HB VAL A 65 -14.711 3.404 13.530 1.00 11.81 H new ATOM 0 HG11 VAL A 65 -15.533 5.725 13.632 1.00 12.41 H new ATOM 0 HG12 VAL A 65 -14.308 5.396 14.881 1.00 12.41 H new ATOM 0 HG13 VAL A 65 -13.868 6.317 13.423 1.00 12.41 H new ATOM 0 HG21 VAL A 65 -15.466 4.556 11.475 1.00 11.68 H new ATOM 0 HG22 VAL A 65 -13.794 5.085 11.169 1.00 11.68 H new ATOM 0 HG23 VAL A 65 -14.200 3.352 11.134 1.00 11.68 H new ATOM 946 N LYS A 66 -12.574 2.788 15.493 1.00 12.17 N ATOM 947 CA LYS A 66 -12.315 2.665 16.919 1.00 12.79 C ATOM 948 C LYS A 66 -10.822 2.453 17.169 1.00 12.52 C ATOM 949 O LYS A 66 -10.296 2.829 18.217 1.00 12.98 O ATOM 950 CB LYS A 66 -13.120 1.503 17.505 1.00 13.48 C ATOM 951 CG LYS A 66 -14.623 1.634 17.297 1.00 14.09 C ATOM 952 CD LYS A 66 -15.337 0.302 17.474 1.00 14.62 C ATOM 953 CE LYS A 66 -15.424 -0.097 18.938 1.00 15.63 C ATOM 954 NZ LYS A 66 -16.098 -1.408 19.115 1.00 16.25 N ATOM 0 H LYS A 66 -12.978 1.954 15.068 1.00 12.17 H new ATOM 0 HA LYS A 66 -12.624 3.587 17.411 1.00 12.79 H new ATOM 0 HB2 LYS A 66 -12.779 0.572 17.053 1.00 13.48 H new ATOM 0 HB3 LYS A 66 -12.915 1.432 18.573 1.00 13.48 H new ATOM 0 HG2 LYS A 66 -15.026 2.359 18.004 1.00 14.09 H new ATOM 0 HG3 LYS A 66 -14.819 2.021 16.297 1.00 14.09 H new ATOM 0 HD2 LYS A 66 -16.341 0.368 17.054 1.00 14.62 H new ATOM 0 HD3 LYS A 66 -14.809 -0.471 16.916 1.00 14.62 H new ATOM 0 HE2 LYS A 66 -14.421 -0.144 19.362 1.00 15.63 H new ATOM 0 HE3 LYS A 66 -15.968 0.669 19.491 1.00 15.63 H new ATOM 0 HZ1 LYS A 66 -16.137 -1.644 20.127 1.00 16.25 H new ATOM 0 HZ2 LYS A 66 -17.064 -1.356 18.734 1.00 16.25 H new ATOM 0 HZ3 LYS A 66 -15.565 -2.143 18.608 1.00 16.25 H new ATOM 968 N LEU A 67 -10.145 1.849 16.198 1.00 11.90 N ATOM 969 CA LEU A 67 -8.714 1.591 16.307 1.00 11.71 C ATOM 970 C LEU A 67 -7.919 2.888 16.186 1.00 11.44 C ATOM 971 O LEU A 67 -7.150 3.232 17.083 1.00 11.79 O ATOM 972 CB LEU A 67 -8.267 0.597 15.233 1.00 11.29 C ATOM 973 CG LEU A 67 -8.669 -0.855 15.486 1.00 11.71 C ATOM 974 CD1 LEU A 67 -8.282 -1.728 14.303 1.00 11.30 C ATOM 975 CD2 LEU A 67 -8.022 -1.373 16.761 1.00 12.66 C ATOM 0 H LEU A 67 -10.565 1.529 15.326 1.00 11.90 H new ATOM 0 HA LEU A 67 -8.521 1.158 17.289 1.00 11.71 H new ATOM 0 HB2 LEU A 67 -8.681 0.911 14.275 1.00 11.29 H new ATOM 0 HB3 LEU A 67 -7.182 0.647 15.143 1.00 11.29 H new ATOM 0 HG LEU A 67 -9.752 -0.896 15.607 1.00 11.71 H new ATOM 0 HD11 LEU A 67 -8.576 -2.759 14.500 1.00 11.30 H new ATOM 0 HD12 LEU A 67 -8.789 -1.371 13.406 1.00 11.30 H new ATOM 0 HD13 LEU A 67 -7.203 -1.680 14.153 1.00 11.30 H new ATOM 0 HD21 LEU A 67 -8.320 -2.409 16.925 1.00 12.66 H new ATOM 0 HD22 LEU A 67 -6.937 -1.318 16.667 1.00 12.66 H new ATOM 0 HD23 LEU A 67 -8.345 -0.765 17.606 1.00 12.66 H new ATOM 987 N LYS A 68 -8.123 3.596 15.072 1.00 11.01 N ATOM 988 CA LYS A 68 -7.446 4.868 14.799 1.00 10.94 C ATOM 989 C LYS A 68 -5.927 4.708 14.698 1.00 10.41 C ATOM 990 O LYS A 68 -5.231 4.536 15.700 1.00 10.69 O ATOM 991 CB LYS A 68 -7.793 5.915 15.862 1.00 11.97 C ATOM 992 CG LYS A 68 -9.127 6.605 15.632 1.00 12.39 C ATOM 993 CD LYS A 68 -9.334 7.755 16.605 1.00 13.41 C ATOM 994 CE LYS A 68 -10.501 8.630 16.184 1.00 13.95 C ATOM 995 NZ LYS A 68 -10.599 9.863 17.007 1.00 14.83 N ATOM 0 H LYS A 68 -8.762 3.304 14.333 1.00 11.01 H new ATOM 0 HA LYS A 68 -7.808 5.211 13.830 1.00 10.94 H new ATOM 0 HB2 LYS A 68 -7.807 5.435 16.840 1.00 11.97 H new ATOM 0 HB3 LYS A 68 -7.005 6.668 15.888 1.00 11.97 H new ATOM 0 HG2 LYS A 68 -9.173 6.979 14.609 1.00 12.39 H new ATOM 0 HG3 LYS A 68 -9.936 5.883 15.743 1.00 12.39 H new ATOM 0 HD2 LYS A 68 -9.515 7.360 17.605 1.00 13.41 H new ATOM 0 HD3 LYS A 68 -8.427 8.356 16.659 1.00 13.41 H new ATOM 0 HE2 LYS A 68 -10.389 8.903 15.135 1.00 13.95 H new ATOM 0 HE3 LYS A 68 -11.428 8.063 16.269 1.00 13.95 H new ATOM 0 HZ1 LYS A 68 -11.177 10.569 16.507 1.00 14.83 H new ATOM 0 HZ2 LYS A 68 -11.042 9.637 17.920 1.00 14.83 H new ATOM 0 HZ3 LYS A 68 -9.647 10.248 17.170 1.00 14.83 H new ATOM 1009 N GLY A 69 -5.419 4.757 13.475 1.00 9.80 N ATOM 1010 CA GLY A 69 -3.986 4.640 13.261 1.00 9.42 C ATOM 1011 C GLY A 69 -3.523 3.203 13.136 1.00 9.15 C ATOM 1012 O GLY A 69 -2.346 2.941 12.885 1.00 9.55 O ATOM 0 H GLY A 69 -5.971 4.876 12.626 1.00 9.80 H new ATOM 0 HA2 GLY A 69 -3.713 5.184 12.357 1.00 9.42 H new ATOM 0 HA3 GLY A 69 -3.460 5.115 14.089 1.00 9.42 H new ATOM 1016 N GLN A 70 -4.441 2.272 13.317 1.00 8.62 N ATOM 1017 CA GLN A 70 -4.121 0.859 13.212 1.00 8.50 C ATOM 1018 C GLN A 70 -4.584 0.328 11.864 1.00 7.86 C ATOM 1019 O GLN A 70 -5.720 0.564 11.457 1.00 7.96 O ATOM 1020 CB GLN A 70 -4.780 0.071 14.348 1.00 8.66 C ATOM 1021 CG GLN A 70 -4.395 -1.402 14.378 1.00 9.04 C ATOM 1022 CD GLN A 70 -2.897 -1.616 14.493 1.00 8.99 C ATOM 1023 OE1 GLN A 70 -2.202 -1.768 13.487 1.00 8.60 O ATOM 1024 NE2 GLN A 70 -2.393 -1.625 15.716 1.00 9.59 N ATOM 0 H GLN A 70 -5.417 2.469 13.538 1.00 8.62 H new ATOM 0 HA GLN A 70 -3.041 0.736 13.294 1.00 8.50 H new ATOM 0 HB2 GLN A 70 -4.508 0.527 15.300 1.00 8.66 H new ATOM 0 HB3 GLN A 70 -5.863 0.152 14.253 1.00 8.66 H new ATOM 0 HG2 GLN A 70 -4.892 -1.886 15.219 1.00 9.04 H new ATOM 0 HG3 GLN A 70 -4.758 -1.886 13.472 1.00 9.04 H new ATOM 0 HE21 GLN A 70 -3.006 -1.495 16.521 1.00 9.59 H new ATOM 0 HE22 GLN A 70 -1.392 -1.762 15.854 1.00 9.59 H new ATOM 1033 N VAL A 71 -3.696 -0.365 11.170 1.00 7.44 N ATOM 1034 CA VAL A 71 -4.016 -0.923 9.869 1.00 7.11 C ATOM 1035 C VAL A 71 -4.735 -2.262 10.030 1.00 6.68 C ATOM 1036 O VAL A 71 -4.138 -3.266 10.425 1.00 6.65 O ATOM 1037 CB VAL A 71 -2.748 -1.074 8.987 1.00 7.45 C ATOM 1038 CG1 VAL A 71 -1.628 -1.787 9.736 1.00 8.10 C ATOM 1039 CG2 VAL A 71 -3.072 -1.798 7.685 1.00 7.17 C ATOM 0 H VAL A 71 -2.746 -0.554 11.488 1.00 7.44 H new ATOM 0 HA VAL A 71 -4.684 -0.229 9.358 1.00 7.11 H new ATOM 0 HB VAL A 71 -2.398 -0.071 8.743 1.00 7.45 H new ATOM 0 HG11 VAL A 71 -0.756 -1.875 9.088 1.00 8.10 H new ATOM 0 HG12 VAL A 71 -1.363 -1.215 10.625 1.00 8.10 H new ATOM 0 HG13 VAL A 71 -1.963 -2.781 10.031 1.00 8.10 H new ATOM 0 HG21 VAL A 71 -2.167 -1.891 7.085 1.00 7.17 H new ATOM 0 HG22 VAL A 71 -3.463 -2.791 7.908 1.00 7.17 H new ATOM 0 HG23 VAL A 71 -3.819 -1.231 7.129 1.00 7.17 H new ATOM 1049 N LEU A 72 -6.030 -2.262 9.755 1.00 6.60 N ATOM 1050 CA LEU A 72 -6.830 -3.468 9.872 1.00 6.50 C ATOM 1051 C LEU A 72 -7.039 -4.098 8.503 1.00 6.09 C ATOM 1052 O LEU A 72 -7.734 -3.542 7.649 1.00 5.82 O ATOM 1053 CB LEU A 72 -8.178 -3.163 10.527 1.00 6.93 C ATOM 1054 CG LEU A 72 -8.947 -4.389 11.021 1.00 7.33 C ATOM 1055 CD1 LEU A 72 -8.161 -5.112 12.107 1.00 7.61 C ATOM 1056 CD2 LEU A 72 -10.316 -3.979 11.536 1.00 7.80 C ATOM 0 H LEU A 72 -6.549 -1.439 9.449 1.00 6.60 H new ATOM 0 HA LEU A 72 -6.293 -4.175 10.505 1.00 6.50 H new ATOM 0 HB2 LEU A 72 -8.012 -2.492 11.370 1.00 6.93 H new ATOM 0 HB3 LEU A 72 -8.800 -2.626 9.811 1.00 6.93 H new ATOM 0 HG LEU A 72 -9.082 -5.074 10.184 1.00 7.33 H new ATOM 0 HD11 LEU A 72 -8.724 -5.982 12.446 1.00 7.61 H new ATOM 0 HD12 LEU A 72 -7.200 -5.435 11.707 1.00 7.61 H new ATOM 0 HD13 LEU A 72 -7.995 -4.437 12.947 1.00 7.61 H new ATOM 0 HD21 LEU A 72 -10.853 -4.861 11.885 1.00 7.80 H new ATOM 0 HD22 LEU A 72 -10.199 -3.276 12.361 1.00 7.80 H new ATOM 0 HD23 LEU A 72 -10.880 -3.505 10.733 1.00 7.80 H new ATOM 1068 N SER A 73 -6.424 -5.248 8.295 1.00 6.37 N ATOM 1069 CA SER A 73 -6.530 -5.953 7.033 1.00 6.44 C ATOM 1070 C SER A 73 -7.722 -6.904 7.034 1.00 6.58 C ATOM 1071 O SER A 73 -7.716 -7.924 7.723 1.00 7.12 O ATOM 1072 CB SER A 73 -5.241 -6.728 6.775 1.00 7.06 C ATOM 1073 OG SER A 73 -4.274 -6.449 7.774 1.00 7.59 O ATOM 0 H SER A 73 -5.842 -5.715 8.990 1.00 6.37 H new ATOM 0 HA SER A 73 -6.684 -5.223 6.238 1.00 6.44 H new ATOM 0 HB2 SER A 73 -5.452 -7.797 6.756 1.00 7.06 H new ATOM 0 HB3 SER A 73 -4.844 -6.465 5.795 1.00 7.06 H new ATOM 0 HG SER A 73 -3.457 -6.958 7.590 1.00 7.59 H new ATOM 1079 N VAL A 74 -8.747 -6.553 6.278 1.00 6.36 N ATOM 1080 CA VAL A 74 -9.936 -7.381 6.171 1.00 6.77 C ATOM 1081 C VAL A 74 -9.889 -8.186 4.876 1.00 6.50 C ATOM 1082 O VAL A 74 -9.716 -7.629 3.791 1.00 6.07 O ATOM 1083 CB VAL A 74 -11.235 -6.537 6.240 1.00 7.13 C ATOM 1084 CG1 VAL A 74 -11.162 -5.326 5.322 1.00 6.85 C ATOM 1085 CG2 VAL A 74 -12.460 -7.388 5.912 1.00 7.84 C ATOM 0 H VAL A 74 -8.780 -5.696 5.726 1.00 6.36 H new ATOM 0 HA VAL A 74 -9.949 -8.063 7.021 1.00 6.77 H new ATOM 0 HB VAL A 74 -11.334 -6.175 7.263 1.00 7.13 H new ATOM 0 HG11 VAL A 74 -12.089 -4.757 5.396 1.00 6.85 H new ATOM 0 HG12 VAL A 74 -10.324 -4.695 5.618 1.00 6.85 H new ATOM 0 HG13 VAL A 74 -11.020 -5.657 4.293 1.00 6.85 H new ATOM 0 HG21 VAL A 74 -13.357 -6.771 5.968 1.00 7.84 H new ATOM 0 HG22 VAL A 74 -12.361 -7.795 4.906 1.00 7.84 H new ATOM 0 HG23 VAL A 74 -12.537 -8.206 6.628 1.00 7.84 H new ATOM 1095 N MET A 75 -10.018 -9.498 4.995 1.00 7.05 N ATOM 1096 CA MET A 75 -9.984 -10.370 3.832 1.00 7.23 C ATOM 1097 C MET A 75 -11.396 -10.770 3.429 1.00 7.58 C ATOM 1098 O MET A 75 -12.044 -11.573 4.106 1.00 8.07 O ATOM 1099 CB MET A 75 -9.137 -11.613 4.112 1.00 7.58 C ATOM 1100 CG MET A 75 -8.795 -12.409 2.861 1.00 8.16 C ATOM 1101 SD MET A 75 -7.849 -13.901 3.226 1.00 8.88 S ATOM 1102 CE MET A 75 -7.583 -14.536 1.574 1.00 9.35 C ATOM 0 H MET A 75 -10.147 -9.982 5.884 1.00 7.05 H new ATOM 0 HA MET A 75 -9.527 -9.824 3.007 1.00 7.23 H new ATOM 0 HB2 MET A 75 -8.213 -11.310 4.604 1.00 7.58 H new ATOM 0 HB3 MET A 75 -9.672 -12.258 4.809 1.00 7.58 H new ATOM 0 HG2 MET A 75 -9.716 -12.684 2.346 1.00 8.16 H new ATOM 0 HG3 MET A 75 -8.224 -11.779 2.179 1.00 8.16 H new ATOM 0 HE1 MET A 75 -6.670 -15.130 1.555 1.00 9.35 H new ATOM 0 HE2 MET A 75 -8.428 -15.160 1.284 1.00 9.35 H new ATOM 0 HE3 MET A 75 -7.489 -13.705 0.875 1.00 9.35 H new ATOM 1112 N PHE A 76 -11.864 -10.201 2.335 1.00 7.53 N ATOM 1113 CA PHE A 76 -13.198 -10.480 1.830 1.00 7.96 C ATOM 1114 C PHE A 76 -13.150 -10.724 0.327 1.00 8.18 C ATOM 1115 O PHE A 76 -12.072 -10.763 -0.271 1.00 8.37 O ATOM 1116 CB PHE A 76 -14.140 -9.308 2.146 1.00 7.98 C ATOM 1117 CG PHE A 76 -13.708 -8.009 1.525 1.00 8.18 C ATOM 1118 CD1 PHE A 76 -12.771 -7.205 2.150 1.00 8.46 C ATOM 1119 CD2 PHE A 76 -14.235 -7.596 0.312 1.00 8.59 C ATOM 1120 CE1 PHE A 76 -12.368 -6.015 1.578 1.00 9.07 C ATOM 1121 CE2 PHE A 76 -13.835 -6.409 -0.264 1.00 9.23 C ATOM 1122 CZ PHE A 76 -12.901 -5.616 0.368 1.00 9.66 C ATOM 0 H PHE A 76 -11.335 -9.535 1.772 1.00 7.53 H new ATOM 0 HA PHE A 76 -13.578 -11.377 2.319 1.00 7.96 H new ATOM 0 HB2 PHE A 76 -15.143 -9.553 1.796 1.00 7.98 H new ATOM 0 HB3 PHE A 76 -14.201 -9.182 3.227 1.00 7.98 H new ATOM 0 HD1 PHE A 76 -12.350 -7.512 3.096 1.00 8.46 H new ATOM 0 HD2 PHE A 76 -14.968 -8.211 -0.188 1.00 8.59 H new ATOM 0 HE1 PHE A 76 -11.636 -5.396 2.076 1.00 9.07 H new ATOM 0 HE2 PHE A 76 -14.253 -6.100 -1.211 1.00 9.23 H new ATOM 0 HZ PHE A 76 -12.587 -4.686 -0.082 1.00 9.66 H new ATOM 1132 N ARG A 77 -14.317 -10.878 -0.277 1.00 8.33 N ATOM 1133 CA ARG A 77 -14.409 -11.111 -1.710 1.00 8.76 C ATOM 1134 C ARG A 77 -14.881 -9.846 -2.420 1.00 8.37 C ATOM 1135 O ARG A 77 -15.990 -9.364 -2.181 1.00 8.58 O ATOM 1136 CB ARG A 77 -15.361 -12.269 -1.998 1.00 9.53 C ATOM 1137 CG ARG A 77 -15.048 -13.521 -1.196 1.00 10.38 C ATOM 1138 CD ARG A 77 -16.101 -14.591 -1.408 1.00 11.13 C ATOM 1139 NE ARG A 77 -15.976 -15.689 -0.453 1.00 11.57 N ATOM 1140 CZ ARG A 77 -16.243 -16.961 -0.747 1.00 12.50 C ATOM 1141 NH1 ARG A 77 -16.650 -17.292 -1.967 1.00 13.10 N ATOM 1142 NH2 ARG A 77 -16.105 -17.899 0.174 1.00 12.92 N ATOM 0 H ARG A 77 -15.216 -10.846 0.204 1.00 8.33 H new ATOM 0 HA ARG A 77 -13.420 -11.373 -2.086 1.00 8.76 H new ATOM 0 HB2 ARG A 77 -16.381 -11.953 -1.781 1.00 9.53 H new ATOM 0 HB3 ARG A 77 -15.320 -12.508 -3.061 1.00 9.53 H new ATOM 0 HG2 ARG A 77 -14.071 -13.907 -1.487 1.00 10.38 H new ATOM 0 HG3 ARG A 77 -14.989 -13.271 -0.137 1.00 10.38 H new ATOM 0 HD2 ARG A 77 -17.092 -14.145 -1.318 1.00 11.13 H new ATOM 0 HD3 ARG A 77 -16.018 -14.983 -2.422 1.00 11.13 H new ATOM 0 HE ARG A 77 -15.666 -15.469 0.494 1.00 11.57 H new ATOM 0 HH11 ARG A 77 -16.759 -16.572 -2.681 1.00 13.10 H new ATOM 0 HH12 ARG A 77 -16.854 -18.266 -2.190 1.00 13.10 H new ATOM 0 HH21 ARG A 77 -15.793 -17.650 1.113 1.00 12.92 H new ATOM 0 HH22 ARG A 77 -16.310 -18.872 -0.054 1.00 12.92 H new ATOM 1156 N PHE A 78 -14.030 -9.312 -3.282 1.00 8.00 N ATOM 1157 CA PHE A 78 -14.339 -8.100 -4.025 1.00 7.81 C ATOM 1158 C PHE A 78 -14.619 -8.443 -5.483 1.00 7.97 C ATOM 1159 O PHE A 78 -14.050 -9.394 -6.021 1.00 8.21 O ATOM 1160 CB PHE A 78 -13.166 -7.118 -3.925 1.00 8.16 C ATOM 1161 CG PHE A 78 -13.538 -5.682 -4.180 1.00 8.43 C ATOM 1162 CD1 PHE A 78 -14.385 -5.008 -3.315 1.00 8.53 C ATOM 1163 CD2 PHE A 78 -13.032 -5.006 -5.278 1.00 8.83 C ATOM 1164 CE1 PHE A 78 -14.721 -3.688 -3.541 1.00 8.94 C ATOM 1165 CE2 PHE A 78 -13.365 -3.684 -5.511 1.00 9.26 C ATOM 1166 CZ PHE A 78 -14.211 -3.025 -4.640 1.00 9.28 C ATOM 0 H PHE A 78 -13.111 -9.704 -3.486 1.00 8.00 H new ATOM 0 HA PHE A 78 -15.227 -7.633 -3.599 1.00 7.81 H new ATOM 0 HB2 PHE A 78 -12.725 -7.196 -2.931 1.00 8.16 H new ATOM 0 HB3 PHE A 78 -12.397 -7.414 -4.639 1.00 8.16 H new ATOM 0 HD1 PHE A 78 -14.787 -5.521 -2.454 1.00 8.53 H new ATOM 0 HD2 PHE A 78 -12.369 -5.517 -5.960 1.00 8.83 H new ATOM 0 HE1 PHE A 78 -15.382 -3.174 -2.859 1.00 8.94 H new ATOM 0 HE2 PHE A 78 -12.965 -3.168 -6.371 1.00 9.26 H new ATOM 0 HZ PHE A 78 -14.473 -1.993 -4.818 1.00 9.28 H new ATOM 1176 N ARG A 79 -15.503 -7.682 -6.110 1.00 7.99 N ATOM 1177 CA ARG A 79 -15.849 -7.913 -7.505 1.00 8.38 C ATOM 1178 C ARG A 79 -14.902 -7.161 -8.431 1.00 8.66 C ATOM 1179 O ARG A 79 -14.566 -6.004 -8.185 1.00 8.73 O ATOM 1180 CB ARG A 79 -17.290 -7.482 -7.788 1.00 8.53 C ATOM 1181 CG ARG A 79 -17.891 -8.156 -9.012 1.00 9.41 C ATOM 1182 CD ARG A 79 -19.267 -7.601 -9.343 1.00 9.82 C ATOM 1183 NE ARG A 79 -19.196 -6.233 -9.857 1.00 10.05 N ATOM 1184 CZ ARG A 79 -20.110 -5.297 -9.606 1.00 10.46 C ATOM 1185 NH1 ARG A 79 -21.169 -5.583 -8.860 1.00 10.67 N ATOM 1186 NH2 ARG A 79 -19.960 -4.077 -10.108 1.00 10.87 N ATOM 0 H ARG A 79 -15.994 -6.900 -5.676 1.00 7.99 H new ATOM 0 HA ARG A 79 -15.755 -8.982 -7.694 1.00 8.38 H new ATOM 0 HB2 ARG A 79 -17.907 -7.708 -6.918 1.00 8.53 H new ATOM 0 HB3 ARG A 79 -17.318 -6.401 -7.927 1.00 8.53 H new ATOM 0 HG2 ARG A 79 -17.228 -8.017 -9.866 1.00 9.41 H new ATOM 0 HG3 ARG A 79 -17.964 -9.229 -8.837 1.00 9.41 H new ATOM 0 HD2 ARG A 79 -19.748 -8.242 -10.082 1.00 9.82 H new ATOM 0 HD3 ARG A 79 -19.891 -7.621 -8.449 1.00 9.82 H new ATOM 0 HE ARG A 79 -18.399 -5.981 -10.442 1.00 10.05 H new ATOM 0 HH11 ARG A 79 -21.285 -6.521 -8.477 1.00 10.67 H new ATOM 0 HH12 ARG A 79 -21.867 -4.865 -8.669 1.00 10.67 H new ATOM 0 HH21 ARG A 79 -19.147 -3.859 -10.684 1.00 10.87 H new ATOM 0 HH22 ARG A 79 -20.658 -3.358 -9.918 1.00 10.87 H new ATOM 1200 N SER A 80 -14.465 -7.830 -9.484 1.00 9.00 N ATOM 1201 CA SER A 80 -13.574 -7.225 -10.459 1.00 9.50 C ATOM 1202 C SER A 80 -14.377 -6.700 -11.644 1.00 9.93 C ATOM 1203 O SER A 80 -15.610 -6.743 -11.640 1.00 10.23 O ATOM 1204 CB SER A 80 -12.562 -8.259 -10.950 1.00 10.33 C ATOM 1205 OG SER A 80 -13.193 -9.221 -11.775 1.00 10.77 O ATOM 0 H SER A 80 -14.715 -8.798 -9.686 1.00 9.00 H new ATOM 0 HA SER A 80 -13.046 -6.397 -9.986 1.00 9.50 H new ATOM 0 HB2 SER A 80 -11.766 -7.762 -11.505 1.00 10.33 H new ATOM 0 HB3 SER A 80 -12.096 -8.753 -10.097 1.00 10.33 H new ATOM 0 HG SER A 80 -12.514 -9.711 -12.285 1.00 10.77 H new ATOM 1211 N LYS A 81 -13.675 -6.224 -12.665 1.00 10.16 N ATOM 1212 CA LYS A 81 -14.318 -5.717 -13.866 1.00 10.81 C ATOM 1213 C LYS A 81 -14.929 -6.873 -14.654 1.00 11.44 C ATOM 1214 O LYS A 81 -15.744 -6.674 -15.554 1.00 11.77 O ATOM 1215 CB LYS A 81 -13.308 -4.956 -14.730 1.00 11.28 C ATOM 1216 CG LYS A 81 -13.949 -4.119 -15.823 1.00 11.83 C ATOM 1217 CD LYS A 81 -14.953 -3.135 -15.248 1.00 11.83 C ATOM 1218 CE LYS A 81 -15.735 -2.435 -16.343 1.00 12.62 C ATOM 1219 NZ LYS A 81 -16.849 -1.620 -15.792 1.00 12.66 N ATOM 0 H LYS A 81 -12.656 -6.179 -12.683 1.00 10.16 H new ATOM 0 HA LYS A 81 -15.112 -5.028 -13.579 1.00 10.81 H new ATOM 0 HB2 LYS A 81 -12.712 -4.306 -14.089 1.00 11.28 H new ATOM 0 HB3 LYS A 81 -12.622 -5.670 -15.186 1.00 11.28 H new ATOM 0 HG2 LYS A 81 -13.177 -3.577 -16.369 1.00 11.83 H new ATOM 0 HG3 LYS A 81 -14.447 -4.772 -16.540 1.00 11.83 H new ATOM 0 HD2 LYS A 81 -15.642 -3.661 -14.587 1.00 11.83 H new ATOM 0 HD3 LYS A 81 -14.432 -2.394 -14.641 1.00 11.83 H new ATOM 0 HE2 LYS A 81 -15.064 -1.794 -16.915 1.00 12.62 H new ATOM 0 HE3 LYS A 81 -16.135 -3.176 -17.035 1.00 12.62 H new ATOM 0 HZ1 LYS A 81 -17.618 -1.567 -16.490 1.00 12.66 H new ATOM 0 HZ2 LYS A 81 -17.203 -2.061 -14.919 1.00 12.66 H new ATOM 0 HZ3 LYS A 81 -16.506 -0.661 -15.581 1.00 12.66 H new ATOM 1233 N ASN A 82 -14.531 -8.087 -14.299 1.00 11.74 N ATOM 1234 CA ASN A 82 -15.039 -9.287 -14.950 1.00 12.49 C ATOM 1235 C ASN A 82 -16.242 -9.813 -14.184 1.00 12.28 C ATOM 1236 O ASN A 82 -16.793 -10.862 -14.516 1.00 12.86 O ATOM 1237 CB ASN A 82 -13.959 -10.370 -15.005 1.00 13.32 C ATOM 1238 CG ASN A 82 -12.701 -9.921 -15.721 1.00 13.91 C ATOM 1239 OD1 ASN A 82 -12.757 -9.232 -16.742 1.00 14.05 O ATOM 1240 ND2 ASN A 82 -11.555 -10.295 -15.178 1.00 14.42 N ATOM 0 H ASN A 82 -13.853 -8.267 -13.559 1.00 11.74 H new ATOM 0 HA ASN A 82 -15.332 -9.031 -15.968 1.00 12.49 H new ATOM 0 HB2 ASN A 82 -13.703 -10.671 -13.989 1.00 13.32 H new ATOM 0 HB3 ASN A 82 -14.361 -11.250 -15.507 1.00 13.32 H new ATOM 0 HD21 ASN A 82 -10.672 -10.013 -15.605 1.00 14.42 H new ATOM 0 HD22 ASN A 82 -11.553 -10.865 -14.332 1.00 14.42 H new ATOM 1247 N GLN A 83 -16.628 -9.071 -13.146 1.00 11.60 N ATOM 1248 CA GLN A 83 -17.754 -9.429 -12.288 1.00 11.56 C ATOM 1249 C GLN A 83 -17.452 -10.691 -11.478 1.00 11.14 C ATOM 1250 O GLN A 83 -18.362 -11.354 -10.985 1.00 11.21 O ATOM 1251 CB GLN A 83 -19.041 -9.602 -13.102 1.00 12.34 C ATOM 1252 CG GLN A 83 -19.869 -8.328 -13.225 1.00 12.60 C ATOM 1253 CD GLN A 83 -19.135 -7.205 -13.935 1.00 12.46 C ATOM 1254 OE1 GLN A 83 -18.483 -6.369 -13.304 1.00 12.29 O ATOM 1255 NE2 GLN A 83 -19.242 -7.175 -15.252 1.00 12.69 N ATOM 0 H GLN A 83 -16.166 -8.202 -12.877 1.00 11.60 H new ATOM 0 HA GLN A 83 -17.907 -8.607 -11.589 1.00 11.56 H new ATOM 0 HB2 GLN A 83 -18.783 -9.954 -14.101 1.00 12.34 H new ATOM 0 HB3 GLN A 83 -19.651 -10.377 -12.638 1.00 12.34 H new ATOM 0 HG2 GLN A 83 -20.789 -8.551 -13.765 1.00 12.60 H new ATOM 0 HG3 GLN A 83 -20.158 -7.992 -12.229 1.00 12.60 H new ATOM 0 HE21 GLN A 83 -19.791 -7.886 -15.735 1.00 12.69 H new ATOM 0 HE22 GLN A 83 -18.775 -6.441 -15.785 1.00 12.69 H new ATOM 1264 N GLU A 84 -16.169 -11.004 -11.330 1.00 10.85 N ATOM 1265 CA GLU A 84 -15.752 -12.172 -10.570 1.00 10.56 C ATOM 1266 C GLU A 84 -15.405 -11.751 -9.146 1.00 10.07 C ATOM 1267 O GLU A 84 -15.034 -10.600 -8.912 1.00 10.08 O ATOM 1268 CB GLU A 84 -14.555 -12.856 -11.245 1.00 10.45 C ATOM 1269 CG GLU A 84 -13.220 -12.170 -10.998 1.00 10.43 C ATOM 1270 CD GLU A 84 -12.269 -12.294 -12.172 1.00 10.44 C ATOM 1271 OE1 GLU A 84 -12.037 -13.427 -12.642 1.00 10.71 O ATOM 1272 OE2 GLU A 84 -11.744 -11.257 -12.629 1.00 10.24 O ATOM 0 H GLU A 84 -15.401 -10.463 -11.728 1.00 10.85 H new ATOM 0 HA GLU A 84 -16.570 -12.891 -10.538 1.00 10.56 H new ATOM 0 HB2 GLU A 84 -14.492 -13.885 -10.891 1.00 10.45 H new ATOM 0 HB3 GLU A 84 -14.735 -12.899 -12.319 1.00 10.45 H new ATOM 0 HG2 GLU A 84 -13.393 -11.115 -10.786 1.00 10.43 H new ATOM 0 HG3 GLU A 84 -12.754 -12.601 -10.112 1.00 10.43 H new ATOM 1279 N TRP A 85 -15.532 -12.670 -8.203 1.00 9.78 N ATOM 1280 CA TRP A 85 -15.237 -12.369 -6.810 1.00 9.50 C ATOM 1281 C TRP A 85 -13.854 -12.885 -6.429 1.00 9.40 C ATOM 1282 O TRP A 85 -13.620 -14.093 -6.385 1.00 9.53 O ATOM 1283 CB TRP A 85 -16.301 -12.986 -5.898 1.00 9.93 C ATOM 1284 CG TRP A 85 -17.703 -12.620 -6.286 1.00 10.24 C ATOM 1285 CD1 TRP A 85 -18.597 -13.404 -6.954 1.00 10.93 C ATOM 1286 CD2 TRP A 85 -18.368 -11.376 -6.034 1.00 10.07 C ATOM 1287 NE1 TRP A 85 -19.779 -12.726 -7.131 1.00 11.20 N ATOM 1288 CE2 TRP A 85 -19.663 -11.480 -6.577 1.00 10.68 C ATOM 1289 CE3 TRP A 85 -17.997 -10.188 -5.403 1.00 9.65 C ATOM 1290 CZ2 TRP A 85 -20.586 -10.440 -6.505 1.00 10.85 C ATOM 1291 CZ3 TRP A 85 -18.914 -9.157 -5.334 1.00 9.84 C ATOM 1292 CH2 TRP A 85 -20.195 -9.289 -5.881 1.00 10.42 C ATOM 0 H TRP A 85 -15.836 -13.628 -8.375 1.00 9.78 H new ATOM 0 HA TRP A 85 -15.248 -11.287 -6.683 1.00 9.50 H new ATOM 0 HB2 TRP A 85 -16.199 -14.071 -5.915 1.00 9.93 H new ATOM 0 HB3 TRP A 85 -16.120 -12.665 -4.872 1.00 9.93 H new ATOM 0 HD1 TRP A 85 -18.404 -14.411 -7.294 1.00 10.93 H new ATOM 0 HE1 TRP A 85 -20.608 -13.092 -7.599 1.00 11.20 H new ATOM 0 HE3 TRP A 85 -17.011 -10.077 -4.976 1.00 9.65 H new ATOM 0 HZ2 TRP A 85 -21.575 -10.539 -6.927 1.00 10.85 H new ATOM 0 HZ3 TRP A 85 -18.637 -8.233 -4.849 1.00 9.84 H new ATOM 0 HH2 TRP A 85 -20.889 -8.464 -5.809 1.00 10.42 H new ATOM 1303 N LEU A 86 -12.939 -11.967 -6.168 1.00 9.37 N ATOM 1304 CA LEU A 86 -11.575 -12.322 -5.795 1.00 9.51 C ATOM 1305 C LEU A 86 -11.315 -11.991 -4.329 1.00 8.86 C ATOM 1306 O LEU A 86 -11.980 -11.129 -3.752 1.00 8.45 O ATOM 1307 CB LEU A 86 -10.574 -11.592 -6.693 1.00 10.04 C ATOM 1308 CG LEU A 86 -10.810 -10.088 -6.848 1.00 10.26 C ATOM 1309 CD1 LEU A 86 -9.911 -9.301 -5.908 1.00 10.30 C ATOM 1310 CD2 LEU A 86 -10.586 -9.660 -8.289 1.00 11.12 C ATOM 0 H LEU A 86 -13.115 -10.963 -6.207 1.00 9.37 H new ATOM 0 HA LEU A 86 -11.448 -13.396 -5.931 1.00 9.51 H new ATOM 0 HB2 LEU A 86 -9.572 -11.746 -6.293 1.00 10.04 H new ATOM 0 HB3 LEU A 86 -10.596 -12.050 -7.682 1.00 10.04 H new ATOM 0 HG LEU A 86 -11.846 -9.875 -6.583 1.00 10.26 H new ATOM 0 HD11 LEU A 86 -10.096 -8.234 -6.036 1.00 10.30 H new ATOM 0 HD12 LEU A 86 -10.124 -9.586 -4.878 1.00 10.30 H new ATOM 0 HD13 LEU A 86 -8.867 -9.518 -6.136 1.00 10.30 H new ATOM 0 HD21 LEU A 86 -10.758 -8.588 -8.381 1.00 11.12 H new ATOM 0 HD22 LEU A 86 -9.561 -9.889 -8.582 1.00 11.12 H new ATOM 0 HD23 LEU A 86 -11.278 -10.196 -8.939 1.00 11.12 H new ATOM 1322 N TRP A 87 -10.349 -12.674 -3.731 1.00 8.98 N ATOM 1323 CA TRP A 87 -10.009 -12.450 -2.333 1.00 8.61 C ATOM 1324 C TRP A 87 -9.097 -11.240 -2.186 1.00 8.55 C ATOM 1325 O TRP A 87 -7.955 -11.237 -2.661 1.00 9.23 O ATOM 1326 CB TRP A 87 -9.350 -13.694 -1.735 1.00 9.13 C ATOM 1327 CG TRP A 87 -10.281 -14.861 -1.653 1.00 9.35 C ATOM 1328 CD1 TRP A 87 -10.577 -15.744 -2.648 1.00 9.76 C ATOM 1329 CD2 TRP A 87 -11.050 -15.264 -0.515 1.00 9.44 C ATOM 1330 NE1 TRP A 87 -11.482 -16.672 -2.199 1.00 10.06 N ATOM 1331 CE2 TRP A 87 -11.786 -16.401 -0.893 1.00 9.89 C ATOM 1332 CE3 TRP A 87 -11.187 -14.774 0.787 1.00 9.42 C ATOM 1333 CZ2 TRP A 87 -12.644 -17.057 -0.015 1.00 10.28 C ATOM 1334 CZ3 TRP A 87 -12.038 -15.427 1.656 1.00 9.85 C ATOM 1335 CH2 TRP A 87 -12.758 -16.558 1.252 1.00 10.26 C ATOM 0 H TRP A 87 -9.786 -13.389 -4.193 1.00 8.98 H new ATOM 0 HA TRP A 87 -10.931 -12.251 -1.786 1.00 8.61 H new ATOM 0 HB2 TRP A 87 -8.485 -13.967 -2.339 1.00 9.13 H new ATOM 0 HB3 TRP A 87 -8.980 -13.459 -0.737 1.00 9.13 H new ATOM 0 HD1 TRP A 87 -10.160 -15.717 -3.644 1.00 9.76 H new ATOM 0 HE1 TRP A 87 -11.866 -17.440 -2.750 1.00 10.06 H new ATOM 0 HE3 TRP A 87 -10.637 -13.901 1.107 1.00 9.42 H new ATOM 0 HZ2 TRP A 87 -13.200 -17.930 -0.324 1.00 10.28 H new ATOM 0 HZ3 TRP A 87 -12.150 -15.059 2.665 1.00 9.85 H new ATOM 0 HH2 TRP A 87 -13.416 -17.046 1.956 1.00 10.26 H new ATOM 1346 N MET A 88 -9.614 -10.216 -1.530 1.00 7.94 N ATOM 1347 CA MET A 88 -8.875 -8.984 -1.316 1.00 7.99 C ATOM 1348 C MET A 88 -8.600 -8.767 0.163 1.00 7.92 C ATOM 1349 O MET A 88 -9.499 -8.896 0.995 1.00 7.76 O ATOM 1350 CB MET A 88 -9.668 -7.797 -1.867 1.00 8.19 C ATOM 1351 CG MET A 88 -8.925 -6.473 -1.785 1.00 8.29 C ATOM 1352 SD MET A 88 -7.768 -6.250 -3.148 1.00 8.99 S ATOM 1353 CE MET A 88 -8.903 -6.090 -4.524 1.00 9.32 C ATOM 0 H MET A 88 -10.553 -10.214 -1.132 1.00 7.94 H new ATOM 0 HA MET A 88 -7.923 -9.063 -1.840 1.00 7.99 H new ATOM 0 HB2 MET A 88 -9.925 -7.995 -2.908 1.00 8.19 H new ATOM 0 HB3 MET A 88 -10.606 -7.712 -1.318 1.00 8.19 H new ATOM 0 HG2 MET A 88 -9.645 -5.655 -1.785 1.00 8.29 H new ATOM 0 HG3 MET A 88 -8.384 -6.421 -0.840 1.00 8.29 H new ATOM 0 HE1 MET A 88 -8.581 -6.738 -5.339 1.00 9.32 H new ATOM 0 HE2 MET A 88 -9.905 -6.378 -4.205 1.00 9.32 H new ATOM 0 HE3 MET A 88 -8.915 -5.055 -4.867 1.00 9.32 H new ATOM 1363 N ARG A 89 -7.353 -8.457 0.484 1.00 8.22 N ATOM 1364 CA ARG A 89 -6.959 -8.191 1.857 1.00 8.32 C ATOM 1365 C ARG A 89 -6.849 -6.685 2.054 1.00 8.38 C ATOM 1366 O ARG A 89 -5.753 -6.119 2.062 1.00 8.80 O ATOM 1367 CB ARG A 89 -5.628 -8.870 2.184 1.00 8.70 C ATOM 1368 CG ARG A 89 -5.375 -9.030 3.673 1.00 8.73 C ATOM 1369 CD ARG A 89 -3.897 -8.915 4.001 1.00 9.56 C ATOM 1370 NE ARG A 89 -3.439 -7.525 3.992 1.00 9.63 N ATOM 1371 CZ ARG A 89 -2.426 -7.069 4.733 1.00 10.18 C ATOM 1372 NH1 ARG A 89 -1.779 -7.886 5.559 1.00 10.66 N ATOM 1373 NH2 ARG A 89 -2.083 -5.791 4.663 1.00 10.44 N ATOM 0 H ARG A 89 -6.593 -8.383 -0.193 1.00 8.22 H new ATOM 0 HA ARG A 89 -7.712 -8.597 2.532 1.00 8.32 H new ATOM 0 HB2 ARG A 89 -5.606 -9.853 1.713 1.00 8.70 H new ATOM 0 HB3 ARG A 89 -4.816 -8.289 1.747 1.00 8.70 H new ATOM 0 HG2 ARG A 89 -5.931 -8.270 4.221 1.00 8.73 H new ATOM 0 HG3 ARG A 89 -5.748 -9.999 4.005 1.00 8.73 H new ATOM 0 HD2 ARG A 89 -3.708 -9.352 4.981 1.00 9.56 H new ATOM 0 HD3 ARG A 89 -3.320 -9.491 3.278 1.00 9.56 H new ATOM 0 HE ARG A 89 -3.923 -6.865 3.383 1.00 9.63 H new ATOM 0 HH11 ARG A 89 -2.056 -8.865 5.628 1.00 10.66 H new ATOM 0 HH12 ARG A 89 -1.006 -7.533 6.123 1.00 10.66 H new ATOM 0 HH21 ARG A 89 -2.592 -5.159 4.045 1.00 10.44 H new ATOM 0 HH22 ARG A 89 -1.310 -5.439 5.227 1.00 10.44 H new ATOM 1387 N THR A 90 -7.998 -6.045 2.181 1.00 8.13 N ATOM 1388 CA THR A 90 -8.074 -4.605 2.350 1.00 8.31 C ATOM 1389 C THR A 90 -7.500 -4.154 3.690 1.00 7.80 C ATOM 1390 O THR A 90 -8.074 -4.398 4.752 1.00 7.13 O ATOM 1391 CB THR A 90 -9.529 -4.131 2.203 1.00 8.83 C ATOM 1392 OG1 THR A 90 -9.955 -4.327 0.851 1.00 9.37 O ATOM 1393 CG2 THR A 90 -9.685 -2.666 2.576 1.00 9.12 C ATOM 0 H THR A 90 -8.906 -6.510 2.170 1.00 8.13 H new ATOM 0 HA THR A 90 -7.466 -4.150 1.568 1.00 8.31 H new ATOM 0 HB THR A 90 -10.146 -4.717 2.885 1.00 8.83 H new ATOM 0 HG1 THR A 90 -9.729 -3.536 0.319 1.00 9.37 H new ATOM 0 HG21 THR A 90 -10.727 -2.370 2.459 1.00 9.12 H new ATOM 0 HG22 THR A 90 -9.381 -2.520 3.612 1.00 9.12 H new ATOM 0 HG23 THR A 90 -9.059 -2.056 1.925 1.00 9.12 H new ATOM 1401 N SER A 91 -6.356 -3.498 3.621 1.00 8.27 N ATOM 1402 CA SER A 91 -5.680 -2.990 4.800 1.00 8.04 C ATOM 1403 C SER A 91 -6.158 -1.568 5.087 1.00 8.00 C ATOM 1404 O SER A 91 -5.582 -0.596 4.596 1.00 8.20 O ATOM 1405 CB SER A 91 -4.167 -3.022 4.570 1.00 7.83 C ATOM 1406 OG SER A 91 -3.821 -4.024 3.622 1.00 8.08 O ATOM 0 H SER A 91 -5.870 -3.303 2.746 1.00 8.27 H new ATOM 0 HA SER A 91 -5.913 -3.614 5.663 1.00 8.04 H new ATOM 0 HB2 SER A 91 -3.828 -2.048 4.217 1.00 7.83 H new ATOM 0 HB3 SER A 91 -3.655 -3.215 5.513 1.00 7.83 H new ATOM 0 HG SER A 91 -4.067 -3.722 2.723 1.00 8.08 H new ATOM 1412 N SER A 92 -7.228 -1.461 5.863 1.00 7.99 N ATOM 1413 CA SER A 92 -7.819 -0.172 6.200 1.00 8.16 C ATOM 1414 C SER A 92 -6.975 0.593 7.216 1.00 8.34 C ATOM 1415 O SER A 92 -6.566 0.043 8.236 1.00 8.27 O ATOM 1416 CB SER A 92 -9.233 -0.384 6.742 1.00 8.49 C ATOM 1417 OG SER A 92 -9.989 -1.216 5.872 1.00 8.65 O ATOM 0 H SER A 92 -7.709 -2.260 6.275 1.00 7.99 H new ATOM 0 HA SER A 92 -7.858 0.429 5.291 1.00 8.16 H new ATOM 0 HB2 SER A 92 -9.183 -0.836 7.732 1.00 8.49 H new ATOM 0 HB3 SER A 92 -9.732 0.579 6.856 1.00 8.49 H new ATOM 0 HG SER A 92 -10.171 -0.736 5.037 1.00 8.65 H new ATOM 1423 N PHE A 93 -6.717 1.858 6.918 1.00 8.79 N ATOM 1424 CA PHE A 93 -5.935 2.718 7.789 1.00 9.24 C ATOM 1425 C PHE A 93 -6.668 4.039 8.022 1.00 9.05 C ATOM 1426 O PHE A 93 -7.003 4.749 7.071 1.00 8.84 O ATOM 1427 CB PHE A 93 -4.558 2.969 7.165 1.00 9.87 C ATOM 1428 CG PHE A 93 -3.724 3.978 7.903 1.00 10.37 C ATOM 1429 CD1 PHE A 93 -3.212 3.690 9.155 1.00 10.90 C ATOM 1430 CD2 PHE A 93 -3.450 5.215 7.337 1.00 10.50 C ATOM 1431 CE1 PHE A 93 -2.444 4.617 9.833 1.00 11.50 C ATOM 1432 CE2 PHE A 93 -2.683 6.144 8.010 1.00 11.09 C ATOM 1433 CZ PHE A 93 -2.179 5.845 9.259 1.00 11.56 C ATOM 0 H PHE A 93 -7.044 2.315 6.067 1.00 8.79 H new ATOM 0 HA PHE A 93 -5.800 2.226 8.753 1.00 9.24 H new ATOM 0 HB2 PHE A 93 -4.013 2.026 7.121 1.00 9.87 H new ATOM 0 HB3 PHE A 93 -4.693 3.307 6.138 1.00 9.87 H new ATOM 0 HD1 PHE A 93 -3.415 2.730 9.607 1.00 10.90 H new ATOM 0 HD2 PHE A 93 -3.841 5.453 6.359 1.00 10.50 H new ATOM 0 HE1 PHE A 93 -2.051 4.382 10.811 1.00 11.50 H new ATOM 0 HE2 PHE A 93 -2.478 7.104 7.560 1.00 11.09 H new ATOM 0 HZ PHE A 93 -1.578 6.570 9.787 1.00 11.56 H new ATOM 1443 N THR A 94 -6.930 4.353 9.282 1.00 9.35 N ATOM 1444 CA THR A 94 -7.621 5.580 9.638 1.00 9.46 C ATOM 1445 C THR A 94 -6.710 6.795 9.489 1.00 9.94 C ATOM 1446 O THR A 94 -5.664 6.885 10.140 1.00 10.16 O ATOM 1447 CB THR A 94 -8.140 5.508 11.086 1.00 9.25 C ATOM 1448 OG1 THR A 94 -7.815 4.227 11.658 1.00 9.37 O ATOM 1449 CG2 THR A 94 -9.644 5.724 11.131 1.00 9.37 C ATOM 0 H THR A 94 -6.672 3.770 10.078 1.00 9.35 H new ATOM 0 HA THR A 94 -8.463 5.689 8.954 1.00 9.46 H new ATOM 0 HB THR A 94 -7.659 6.297 11.664 1.00 9.25 H new ATOM 0 HG1 THR A 94 -8.616 3.840 12.070 1.00 9.37 H new ATOM 0 HG21 THR A 94 -9.989 5.669 12.164 1.00 9.37 H new ATOM 0 HG22 THR A 94 -9.883 6.705 10.720 1.00 9.37 H new ATOM 0 HG23 THR A 94 -10.140 4.953 10.541 1.00 9.37 H new ATOM 1457 N PHE A 95 -7.098 7.723 8.623 1.00 10.31 N ATOM 1458 CA PHE A 95 -6.317 8.929 8.404 1.00 10.96 C ATOM 1459 C PHE A 95 -6.946 10.100 9.150 1.00 11.35 C ATOM 1460 O PHE A 95 -8.000 10.610 8.758 1.00 11.51 O ATOM 1461 CB PHE A 95 -6.211 9.244 6.911 1.00 11.11 C ATOM 1462 CG PHE A 95 -4.896 9.857 6.527 1.00 11.84 C ATOM 1463 CD1 PHE A 95 -3.741 9.094 6.518 1.00 12.08 C ATOM 1464 CD2 PHE A 95 -4.814 11.194 6.180 1.00 11.76 C ATOM 1465 CE1 PHE A 95 -2.527 9.653 6.168 1.00 12.25 C ATOM 1466 CE2 PHE A 95 -3.603 11.759 5.830 1.00 11.93 C ATOM 1467 CZ PHE A 95 -2.459 10.989 5.824 1.00 12.11 C ATOM 0 H PHE A 95 -7.948 7.662 8.063 1.00 10.31 H new ATOM 0 HA PHE A 95 -5.310 8.764 8.788 1.00 10.96 H new ATOM 0 HB2 PHE A 95 -6.356 8.326 6.342 1.00 11.11 H new ATOM 0 HB3 PHE A 95 -7.016 9.923 6.632 1.00 11.11 H new ATOM 0 HD1 PHE A 95 -3.789 8.049 6.788 1.00 12.08 H new ATOM 0 HD2 PHE A 95 -5.706 11.802 6.183 1.00 11.76 H new ATOM 0 HE1 PHE A 95 -1.633 9.047 6.163 1.00 12.25 H new ATOM 0 HE2 PHE A 95 -3.552 12.804 5.561 1.00 11.93 H new ATOM 0 HZ PHE A 95 -1.512 11.430 5.551 1.00 12.11 H new ATOM 1477 N GLN A 96 -6.305 10.513 10.230 1.00 11.67 N ATOM 1478 CA GLN A 96 -6.812 11.610 11.039 1.00 12.26 C ATOM 1479 C GLN A 96 -6.024 12.889 10.794 1.00 12.40 C ATOM 1480 O GLN A 96 -4.848 12.848 10.426 1.00 12.58 O ATOM 1481 CB GLN A 96 -6.743 11.256 12.522 1.00 12.87 C ATOM 1482 CG GLN A 96 -7.736 10.188 12.944 1.00 13.00 C ATOM 1483 CD GLN A 96 -7.068 9.036 13.663 1.00 13.42 C ATOM 1484 OE1 GLN A 96 -6.749 8.011 13.060 1.00 13.10 O ATOM 1485 NE2 GLN A 96 -6.829 9.203 14.952 1.00 14.24 N ATOM 0 H GLN A 96 -5.433 10.106 10.567 1.00 11.67 H new ATOM 0 HA GLN A 96 -7.850 11.776 10.749 1.00 12.26 H new ATOM 0 HB2 GLN A 96 -5.735 10.915 12.758 1.00 12.87 H new ATOM 0 HB3 GLN A 96 -6.921 12.157 13.110 1.00 12.87 H new ATOM 0 HG2 GLN A 96 -8.489 10.632 13.595 1.00 13.00 H new ATOM 0 HG3 GLN A 96 -8.257 9.811 12.064 1.00 13.00 H new ATOM 0 HE21 GLN A 96 -7.109 10.068 15.415 1.00 14.24 H new ATOM 0 HE22 GLN A 96 -6.364 8.467 15.484 1.00 14.24 H new ATOM 1494 N ASN A 97 -6.687 14.016 10.986 1.00 12.50 N ATOM 1495 CA ASN A 97 -6.061 15.317 10.822 1.00 12.84 C ATOM 1496 C ASN A 97 -5.383 15.706 12.135 1.00 13.26 C ATOM 1497 O ASN A 97 -5.976 15.571 13.204 1.00 13.46 O ATOM 1498 CB ASN A 97 -7.115 16.358 10.426 1.00 12.77 C ATOM 1499 CG ASN A 97 -6.514 17.617 9.831 1.00 13.20 C ATOM 1500 OD1 ASN A 97 -6.034 18.491 10.550 1.00 13.83 O ATOM 1501 ND2 ASN A 97 -6.546 17.731 8.512 1.00 13.02 N ATOM 0 H ASN A 97 -7.669 14.056 11.259 1.00 12.50 H new ATOM 0 HA ASN A 97 -5.313 15.275 10.030 1.00 12.84 H new ATOM 0 HB2 ASN A 97 -7.802 15.915 9.705 1.00 12.77 H new ATOM 0 HB3 ASN A 97 -7.703 16.623 11.305 1.00 12.77 H new ATOM 0 HD21 ASN A 97 -6.165 18.564 8.063 1.00 13.02 H new ATOM 0 HD22 ASN A 97 -6.952 16.986 7.945 1.00 13.02 H new ATOM 1508 N PRO A 98 -4.127 16.177 12.083 1.00 13.57 N ATOM 1509 CA PRO A 98 -3.368 16.559 13.285 1.00 14.16 C ATOM 1510 C PRO A 98 -3.862 17.850 13.947 1.00 14.64 C ATOM 1511 O PRO A 98 -3.173 18.424 14.789 1.00 15.34 O ATOM 1512 CB PRO A 98 -1.943 16.745 12.758 1.00 14.43 C ATOM 1513 CG PRO A 98 -2.112 17.098 11.322 1.00 14.13 C ATOM 1514 CD PRO A 98 -3.337 16.365 10.850 1.00 13.56 C ATOM 0 HA PRO A 98 -3.468 15.805 14.066 1.00 14.16 H new ATOM 0 HB2 PRO A 98 -1.420 17.533 13.300 1.00 14.43 H new ATOM 0 HB3 PRO A 98 -1.356 15.834 12.875 1.00 14.43 H new ATOM 0 HG2 PRO A 98 -2.230 18.174 11.197 1.00 14.13 H new ATOM 0 HG3 PRO A 98 -1.236 16.805 10.744 1.00 14.13 H new ATOM 0 HD2 PRO A 98 -3.887 16.941 10.106 1.00 13.56 H new ATOM 0 HD3 PRO A 98 -3.081 15.411 10.389 1.00 13.56 H new ATOM 1522 N TYR A 99 -5.048 18.304 13.572 1.00 14.40 N ATOM 1523 CA TYR A 99 -5.608 19.523 14.144 1.00 14.96 C ATOM 1524 C TYR A 99 -6.377 19.203 15.422 1.00 14.99 C ATOM 1525 O TYR A 99 -6.128 19.791 16.472 1.00 15.65 O ATOM 1526 CB TYR A 99 -6.520 20.220 13.135 1.00 15.01 C ATOM 1527 CG TYR A 99 -6.791 21.674 13.453 1.00 14.39 C ATOM 1528 CD1 TYR A 99 -5.902 22.668 13.066 1.00 14.95 C ATOM 1529 CD2 TYR A 99 -7.940 22.049 14.130 1.00 14.52 C ATOM 1530 CE1 TYR A 99 -6.154 23.999 13.347 1.00 15.60 C ATOM 1531 CE2 TYR A 99 -8.201 23.374 14.417 1.00 15.18 C ATOM 1532 CZ TYR A 99 -7.306 24.345 14.024 1.00 16.89 C ATOM 1533 OH TYR A 99 -7.571 25.669 14.305 1.00 16.50 O ATOM 0 H TYR A 99 -5.641 17.850 12.877 1.00 14.40 H new ATOM 0 HA TYR A 99 -4.788 20.198 14.390 1.00 14.96 H new ATOM 0 HB2 TYR A 99 -6.068 20.153 12.145 1.00 15.01 H new ATOM 0 HB3 TYR A 99 -7.469 19.686 13.089 1.00 15.01 H new ATOM 0 HD1 TYR A 99 -5.000 22.398 12.537 1.00 14.95 H new ATOM 0 HD2 TYR A 99 -8.645 21.291 14.439 1.00 14.52 H new ATOM 0 HE1 TYR A 99 -5.454 24.762 13.039 1.00 15.60 H new ATOM 0 HE2 TYR A 99 -9.102 23.648 14.947 1.00 15.18 H new ATOM 0 HH TYR A 99 -8.423 25.737 14.785 1.00 16.50 H new ATOM 1543 N SER A 100 -7.328 18.287 15.317 1.00 14.39 N ATOM 1544 CA SER A 100 -8.127 17.866 16.458 1.00 14.53 C ATOM 1545 C SER A 100 -8.403 16.367 16.383 1.00 14.18 C ATOM 1546 O SER A 100 -9.339 15.865 17.013 1.00 14.16 O ATOM 1547 CB SER A 100 -9.445 18.642 16.492 1.00 14.72 C ATOM 1548 OG SER A 100 -9.217 20.043 16.447 1.00 14.89 O ATOM 0 H SER A 100 -7.567 17.817 14.444 1.00 14.39 H new ATOM 0 HA SER A 100 -7.571 18.075 17.372 1.00 14.53 H new ATOM 0 HB2 SER A 100 -10.067 18.345 15.648 1.00 14.72 H new ATOM 0 HB3 SER A 100 -9.996 18.389 17.398 1.00 14.72 H new ATOM 0 HG SER A 100 -10.076 20.515 16.468 1.00 14.89 H new ATOM 1554 N ASP A 101 -7.579 15.665 15.602 1.00 14.07 N ATOM 1555 CA ASP A 101 -7.695 14.215 15.414 1.00 13.92 C ATOM 1556 C ASP A 101 -8.970 13.874 14.644 1.00 13.12 C ATOM 1557 O ASP A 101 -9.576 12.822 14.841 1.00 13.21 O ATOM 1558 CB ASP A 101 -7.669 13.487 16.766 1.00 14.53 C ATOM 1559 CG ASP A 101 -7.390 12.003 16.634 1.00 14.57 C ATOM 1560 OD1 ASP A 101 -6.268 11.641 16.226 1.00 14.77 O ATOM 1561 OD2 ASP A 101 -8.283 11.189 16.953 1.00 14.75 O ATOM 0 H ASP A 101 -6.810 16.086 15.080 1.00 14.07 H new ATOM 0 HA ASP A 101 -6.839 13.877 14.829 1.00 13.92 H new ATOM 0 HB2 ASP A 101 -6.907 13.939 17.401 1.00 14.53 H new ATOM 0 HB3 ASP A 101 -8.627 13.628 17.267 1.00 14.53 H new ATOM 1566 N GLU A 102 -9.368 14.771 13.751 1.00 12.49 N ATOM 1567 CA GLU A 102 -10.569 14.569 12.954 1.00 11.85 C ATOM 1568 C GLU A 102 -10.296 13.566 11.842 1.00 11.00 C ATOM 1569 O GLU A 102 -9.392 13.765 11.033 1.00 10.88 O ATOM 1570 CB GLU A 102 -11.054 15.890 12.341 1.00 11.92 C ATOM 1571 CG GLU A 102 -10.835 17.109 13.223 1.00 12.55 C ATOM 1572 CD GLU A 102 -9.563 17.856 12.881 1.00 12.62 C ATOM 1573 OE1 GLU A 102 -8.469 17.325 13.158 1.00 12.95 O ATOM 1574 OE2 GLU A 102 -9.655 18.980 12.339 1.00 12.82 O ATOM 0 H GLU A 102 -8.877 15.644 13.561 1.00 12.49 H new ATOM 0 HA GLU A 102 -11.348 14.184 13.612 1.00 11.85 H new ATOM 0 HB2 GLU A 102 -10.541 16.046 11.392 1.00 11.92 H new ATOM 0 HB3 GLU A 102 -12.117 15.804 12.118 1.00 11.92 H new ATOM 0 HG2 GLU A 102 -11.686 17.783 13.122 1.00 12.55 H new ATOM 0 HG3 GLU A 102 -10.798 16.796 14.266 1.00 12.55 H new ATOM 1581 N ILE A 103 -11.066 12.487 11.807 1.00 10.60 N ATOM 1582 CA ILE A 103 -10.892 11.476 10.777 1.00 9.97 C ATOM 1583 C ILE A 103 -11.352 12.020 9.430 1.00 9.53 C ATOM 1584 O ILE A 103 -12.550 12.213 9.205 1.00 9.56 O ATOM 1585 CB ILE A 103 -11.666 10.176 11.091 1.00 10.32 C ATOM 1586 CG1 ILE A 103 -11.306 9.654 12.488 1.00 10.72 C ATOM 1587 CG2 ILE A 103 -11.368 9.120 10.033 1.00 10.45 C ATOM 1588 CD1 ILE A 103 -12.059 8.399 12.880 1.00 11.11 C ATOM 0 H ILE A 103 -11.811 12.291 12.475 1.00 10.60 H new ATOM 0 HA ILE A 103 -9.830 11.233 10.745 1.00 9.97 H new ATOM 0 HB ILE A 103 -12.733 10.396 11.076 1.00 10.32 H new ATOM 0 HG12 ILE A 103 -10.236 9.452 12.526 1.00 10.72 H new ATOM 0 HG13 ILE A 103 -11.510 10.434 13.222 1.00 10.72 H new ATOM 0 HG21 ILE A 103 -11.919 8.208 10.264 1.00 10.45 H new ATOM 0 HG22 ILE A 103 -11.673 9.490 9.054 1.00 10.45 H new ATOM 0 HG23 ILE A 103 -10.299 8.906 10.023 1.00 10.45 H new ATOM 0 HD11 ILE A 103 -11.753 8.088 13.879 1.00 11.11 H new ATOM 0 HD12 ILE A 103 -13.130 8.601 12.875 1.00 11.11 H new ATOM 0 HD13 ILE A 103 -11.836 7.604 12.169 1.00 11.11 H new ATOM 1600 N GLU A 104 -10.396 12.282 8.551 1.00 9.35 N ATOM 1601 CA GLU A 104 -10.697 12.808 7.226 1.00 9.23 C ATOM 1602 C GLU A 104 -11.313 11.725 6.357 1.00 8.49 C ATOM 1603 O GLU A 104 -12.402 11.894 5.805 1.00 7.95 O ATOM 1604 CB GLU A 104 -9.426 13.342 6.561 1.00 9.71 C ATOM 1605 CG GLU A 104 -8.660 14.342 7.408 1.00 10.37 C ATOM 1606 CD GLU A 104 -7.425 14.865 6.707 1.00 11.10 C ATOM 1607 OE1 GLU A 104 -6.446 14.108 6.569 1.00 11.22 O ATOM 1608 OE2 GLU A 104 -7.428 16.040 6.287 1.00 11.65 O ATOM 0 H GLU A 104 -9.402 12.139 8.731 1.00 9.35 H new ATOM 0 HA GLU A 104 -11.409 13.626 7.336 1.00 9.23 H new ATOM 0 HB2 GLU A 104 -8.771 12.503 6.326 1.00 9.71 H new ATOM 0 HB3 GLU A 104 -9.693 13.812 5.615 1.00 9.71 H new ATOM 0 HG2 GLU A 104 -9.313 15.178 7.659 1.00 10.37 H new ATOM 0 HG3 GLU A 104 -8.370 13.871 8.347 1.00 10.37 H new ATOM 1615 N TYR A 105 -10.612 10.604 6.253 1.00 8.69 N ATOM 1616 CA TYR A 105 -11.067 9.482 5.450 1.00 8.30 C ATOM 1617 C TYR A 105 -10.321 8.217 5.850 1.00 8.30 C ATOM 1618 O TYR A 105 -9.463 8.244 6.737 1.00 8.50 O ATOM 1619 CB TYR A 105 -10.873 9.771 3.953 1.00 8.40 C ATOM 1620 CG TYR A 105 -9.507 10.324 3.602 1.00 8.90 C ATOM 1621 CD1 TYR A 105 -8.418 9.483 3.414 1.00 9.14 C ATOM 1622 CD2 TYR A 105 -9.311 11.692 3.456 1.00 9.14 C ATOM 1623 CE1 TYR A 105 -7.175 9.989 3.091 1.00 9.56 C ATOM 1624 CE2 TYR A 105 -8.071 12.204 3.132 1.00 9.54 C ATOM 1625 CZ TYR A 105 -7.006 11.349 2.952 1.00 9.84 C ATOM 1626 OH TYR A 105 -5.768 11.853 2.623 1.00 10.30 O ATOM 0 H TYR A 105 -9.719 10.449 6.720 1.00 8.69 H new ATOM 0 HA TYR A 105 -12.132 9.334 5.632 1.00 8.30 H new ATOM 0 HB2 TYR A 105 -11.036 8.851 3.392 1.00 8.40 H new ATOM 0 HB3 TYR A 105 -11.635 10.480 3.629 1.00 8.40 H new ATOM 0 HD1 TYR A 105 -8.546 8.416 3.522 1.00 9.14 H new ATOM 0 HD2 TYR A 105 -10.143 12.366 3.598 1.00 9.14 H new ATOM 0 HE1 TYR A 105 -6.338 9.321 2.948 1.00 9.56 H new ATOM 0 HE2 TYR A 105 -7.936 13.270 3.020 1.00 9.54 H new ATOM 0 HH TYR A 105 -5.818 12.830 2.563 1.00 10.30 H new ATOM 1636 N ILE A 106 -10.647 7.116 5.197 1.00 8.31 N ATOM 1637 CA ILE A 106 -10.011 5.843 5.485 1.00 8.58 C ATOM 1638 C ILE A 106 -9.218 5.358 4.277 1.00 7.97 C ATOM 1639 O ILE A 106 -9.779 5.125 3.201 1.00 7.37 O ATOM 1640 CB ILE A 106 -11.047 4.764 5.886 1.00 9.05 C ATOM 1641 CG1 ILE A 106 -11.931 5.272 7.032 1.00 9.92 C ATOM 1642 CG2 ILE A 106 -10.343 3.471 6.286 1.00 9.27 C ATOM 1643 CD1 ILE A 106 -13.090 4.354 7.360 1.00 10.29 C ATOM 0 H ILE A 106 -11.352 7.078 4.460 1.00 8.31 H new ATOM 0 HA ILE A 106 -9.337 6.002 6.326 1.00 8.58 H new ATOM 0 HB ILE A 106 -11.683 4.557 5.025 1.00 9.05 H new ATOM 0 HG12 ILE A 106 -11.317 5.400 7.923 1.00 9.92 H new ATOM 0 HG13 ILE A 106 -12.321 6.255 6.770 1.00 9.92 H new ATOM 0 HG21 ILE A 106 -11.086 2.724 6.565 1.00 9.27 H new ATOM 0 HG22 ILE A 106 -9.755 3.102 5.446 1.00 9.27 H new ATOM 0 HG23 ILE A 106 -9.685 3.662 7.134 1.00 9.27 H new ATOM 0 HD11 ILE A 106 -13.670 4.779 8.180 1.00 10.29 H new ATOM 0 HD12 ILE A 106 -13.728 4.245 6.483 1.00 10.29 H new ATOM 0 HD13 ILE A 106 -12.708 3.377 7.654 1.00 10.29 H new ATOM 1655 N ILE A 107 -7.913 5.224 4.455 1.00 8.33 N ATOM 1656 CA ILE A 107 -7.040 4.760 3.392 1.00 8.06 C ATOM 1657 C ILE A 107 -6.942 3.245 3.441 1.00 8.29 C ATOM 1658 O ILE A 107 -6.255 2.684 4.290 1.00 8.62 O ATOM 1659 CB ILE A 107 -5.626 5.369 3.503 1.00 8.25 C ATOM 1660 CG1 ILE A 107 -5.698 6.895 3.437 1.00 8.19 C ATOM 1661 CG2 ILE A 107 -4.722 4.824 2.406 1.00 8.99 C ATOM 1662 CD1 ILE A 107 -4.343 7.569 3.399 1.00 8.61 C ATOM 0 H ILE A 107 -7.434 5.432 5.331 1.00 8.33 H new ATOM 0 HA ILE A 107 -7.470 5.081 2.443 1.00 8.06 H new ATOM 0 HB ILE A 107 -5.200 5.086 4.466 1.00 8.25 H new ATOM 0 HG12 ILE A 107 -6.263 7.185 2.551 1.00 8.19 H new ATOM 0 HG13 ILE A 107 -6.252 7.261 4.302 1.00 8.19 H new ATOM 0 HG21 ILE A 107 -3.729 5.265 2.500 1.00 8.99 H new ATOM 0 HG22 ILE A 107 -4.649 3.741 2.500 1.00 8.99 H new ATOM 0 HG23 ILE A 107 -5.140 5.076 1.431 1.00 8.99 H new ATOM 0 HD11 ILE A 107 -4.475 8.650 3.353 1.00 8.61 H new ATOM 0 HD12 ILE A 107 -3.783 7.310 4.297 1.00 8.61 H new ATOM 0 HD13 ILE A 107 -3.794 7.233 2.519 1.00 8.61 H new ATOM 1674 N CYS A 108 -7.648 2.588 2.543 1.00 8.31 N ATOM 1675 CA CYS A 108 -7.649 1.139 2.500 1.00 8.72 C ATOM 1676 C CYS A 108 -6.667 0.603 1.469 1.00 8.90 C ATOM 1677 O CYS A 108 -6.834 0.800 0.267 1.00 8.95 O ATOM 1678 CB CYS A 108 -9.055 0.626 2.204 1.00 8.88 C ATOM 1679 SG CYS A 108 -10.225 0.882 3.558 1.00 9.83 S ATOM 0 H CYS A 108 -8.229 3.034 1.833 1.00 8.31 H new ATOM 0 HA CYS A 108 -7.329 0.778 3.478 1.00 8.72 H new ATOM 0 HB2 CYS A 108 -9.433 1.124 1.311 1.00 8.88 H new ATOM 0 HB3 CYS A 108 -9.003 -0.439 1.978 1.00 8.88 H new ATOM 0 HG CYS A 108 -11.125 1.747 3.196 1.00 9.83 H new ATOM 1685 N THR A 109 -5.628 -0.051 1.952 1.00 9.18 N ATOM 1686 CA THR A 109 -4.636 -0.647 1.084 1.00 9.57 C ATOM 1687 C THR A 109 -5.169 -1.980 0.579 1.00 9.52 C ATOM 1688 O THR A 109 -5.110 -2.990 1.282 1.00 9.93 O ATOM 1689 CB THR A 109 -3.307 -0.862 1.828 1.00 10.24 C ATOM 1690 OG1 THR A 109 -3.091 0.216 2.753 1.00 10.47 O ATOM 1691 CG2 THR A 109 -2.148 -0.938 0.848 1.00 10.84 C ATOM 0 H THR A 109 -5.450 -0.182 2.948 1.00 9.18 H new ATOM 0 HA THR A 109 -4.445 0.025 0.247 1.00 9.57 H new ATOM 0 HB THR A 109 -3.362 -1.805 2.372 1.00 10.24 H new ATOM 0 HG1 THR A 109 -2.245 0.076 3.227 1.00 10.47 H new ATOM 0 HG21 THR A 109 -1.218 -1.090 1.396 1.00 10.84 H new ATOM 0 HG22 THR A 109 -2.306 -1.770 0.162 1.00 10.84 H new ATOM 0 HG23 THR A 109 -2.088 -0.008 0.283 1.00 10.84 H new ATOM 1699 N ASN A 110 -5.713 -1.971 -0.624 1.00 9.26 N ATOM 1700 CA ASN A 110 -6.296 -3.169 -1.207 1.00 9.45 C ATOM 1701 C ASN A 110 -5.231 -4.076 -1.800 1.00 9.54 C ATOM 1702 O ASN A 110 -4.741 -3.834 -2.900 1.00 9.73 O ATOM 1703 CB ASN A 110 -7.318 -2.796 -2.282 1.00 10.33 C ATOM 1704 CG ASN A 110 -8.718 -2.629 -1.724 1.00 10.50 C ATOM 1705 OD1 ASN A 110 -8.902 -2.255 -0.568 1.00 10.11 O ATOM 1706 ND2 ASN A 110 -9.720 -2.908 -2.546 1.00 11.26 N ATOM 0 H ASN A 110 -5.764 -1.145 -1.220 1.00 9.26 H new ATOM 0 HA ASN A 110 -6.797 -3.713 -0.407 1.00 9.45 H new ATOM 0 HB2 ASN A 110 -7.010 -1.868 -2.764 1.00 10.33 H new ATOM 0 HB3 ASN A 110 -7.328 -3.567 -3.052 1.00 10.33 H new ATOM 0 HD21 ASN A 110 -10.684 -2.815 -2.225 1.00 11.26 H new ATOM 0 HD22 ASN A 110 -9.527 -3.216 -3.499 1.00 11.26 H new ATOM 1713 N THR A 111 -4.867 -5.104 -1.052 1.00 9.61 N ATOM 1714 CA THR A 111 -3.881 -6.067 -1.499 1.00 9.91 C ATOM 1715 C THR A 111 -4.567 -7.379 -1.878 1.00 10.65 C ATOM 1716 O THR A 111 -5.076 -8.095 -1.013 1.00 11.22 O ATOM 1717 CB THR A 111 -2.829 -6.338 -0.404 1.00 9.68 C ATOM 1718 OG1 THR A 111 -2.484 -5.113 0.259 1.00 9.38 O ATOM 1719 CG2 THR A 111 -1.577 -6.964 -1.001 1.00 9.85 C ATOM 0 H THR A 111 -5.245 -5.292 -0.124 1.00 9.61 H new ATOM 0 HA THR A 111 -3.375 -5.649 -2.370 1.00 9.91 H new ATOM 0 HB THR A 111 -3.258 -7.034 0.317 1.00 9.68 H new ATOM 0 HG1 THR A 111 -1.653 -4.758 -0.121 1.00 9.38 H new ATOM 0 HG21 THR A 111 -0.849 -7.146 -0.211 1.00 9.85 H new ATOM 0 HG22 THR A 111 -1.836 -7.908 -1.481 1.00 9.85 H new ATOM 0 HG23 THR A 111 -1.148 -6.287 -1.740 1.00 9.85 H new ATOM 1727 N ASN A 112 -4.595 -7.678 -3.166 1.00 10.79 N ATOM 1728 CA ASN A 112 -5.225 -8.899 -3.654 1.00 11.60 C ATOM 1729 C ASN A 112 -4.350 -10.109 -3.364 1.00 12.13 C ATOM 1730 O ASN A 112 -3.136 -10.077 -3.575 1.00 12.20 O ATOM 1731 CB ASN A 112 -5.506 -8.808 -5.161 1.00 11.56 C ATOM 1732 CG ASN A 112 -5.686 -10.174 -5.811 1.00 12.27 C ATOM 1733 OD1 ASN A 112 -4.758 -10.723 -6.403 1.00 12.78 O ATOM 1734 ND2 ASN A 112 -6.882 -10.731 -5.702 1.00 12.44 N ATOM 0 H ASN A 112 -4.189 -7.092 -3.896 1.00 10.79 H new ATOM 0 HA ASN A 112 -6.173 -9.015 -3.129 1.00 11.60 H new ATOM 0 HB2 ASN A 112 -6.404 -8.212 -5.323 1.00 11.56 H new ATOM 0 HB3 ASN A 112 -4.684 -8.284 -5.648 1.00 11.56 H new ATOM 0 HD21 ASN A 112 -7.058 -11.646 -6.117 1.00 12.44 H new ATOM 0 HD22 ASN A 112 -7.627 -10.245 -5.203 1.00 12.44 H new ATOM 1741 N VAL A 113 -4.973 -11.169 -2.870 1.00 12.66 N ATOM 1742 CA VAL A 113 -4.260 -12.399 -2.559 1.00 13.37 C ATOM 1743 C VAL A 113 -4.678 -13.500 -3.527 1.00 13.66 C ATOM 1744 O VAL A 113 -3.838 -14.157 -4.143 1.00 13.93 O ATOM 1745 CB VAL A 113 -4.526 -12.857 -1.107 1.00 14.08 C ATOM 1746 CG1 VAL A 113 -3.891 -14.214 -0.841 1.00 14.64 C ATOM 1747 CG2 VAL A 113 -4.011 -11.821 -0.116 1.00 14.08 C ATOM 0 H VAL A 113 -5.974 -11.202 -2.676 1.00 12.66 H new ATOM 0 HA VAL A 113 -3.193 -12.201 -2.662 1.00 13.37 H new ATOM 0 HB VAL A 113 -5.603 -12.955 -0.974 1.00 14.08 H new ATOM 0 HG11 VAL A 113 -4.092 -14.515 0.187 1.00 14.64 H new ATOM 0 HG12 VAL A 113 -4.311 -14.952 -1.524 1.00 14.64 H new ATOM 0 HG13 VAL A 113 -2.814 -14.148 -0.996 1.00 14.64 H new ATOM 0 HG21 VAL A 113 -4.207 -12.161 0.901 1.00 14.08 H new ATOM 0 HG22 VAL A 113 -2.938 -11.688 -0.253 1.00 14.08 H new ATOM 0 HG23 VAL A 113 -4.519 -10.872 -0.285 1.00 14.08 H new ATOM 1757 N LYS A 114 -5.982 -13.683 -3.668 1.00 13.72 N ATOM 1758 CA LYS A 114 -6.521 -14.699 -4.555 1.00 14.09 C ATOM 1759 C LYS A 114 -7.608 -14.100 -5.433 1.00 14.38 C ATOM 1760 O LYS A 114 -7.262 -13.355 -6.372 1.00 14.73 O ATOM 1761 CB LYS A 114 -7.079 -15.874 -3.747 1.00 14.21 C ATOM 1762 CG LYS A 114 -6.015 -16.653 -2.990 1.00 14.60 C ATOM 1763 CD LYS A 114 -6.626 -17.573 -1.946 1.00 14.94 C ATOM 1764 CE LYS A 114 -7.498 -18.643 -2.579 1.00 15.49 C ATOM 1765 NZ LYS A 114 -8.039 -19.586 -1.566 1.00 16.02 N ATOM 0 H LYS A 114 -6.689 -13.137 -3.176 1.00 13.72 H new ATOM 0 HA LYS A 114 -5.717 -15.069 -5.191 1.00 14.09 H new ATOM 0 HB2 LYS A 114 -7.816 -15.498 -3.037 1.00 14.21 H new ATOM 0 HB3 LYS A 114 -7.602 -16.552 -4.421 1.00 14.21 H new ATOM 0 HG2 LYS A 114 -5.426 -17.242 -3.693 1.00 14.60 H new ATOM 0 HG3 LYS A 114 -5.330 -15.957 -2.505 1.00 14.60 H new ATOM 0 HD2 LYS A 114 -5.832 -18.046 -1.369 1.00 14.94 H new ATOM 0 HD3 LYS A 114 -7.221 -16.985 -1.247 1.00 14.94 H new ATOM 0 HE2 LYS A 114 -8.323 -18.171 -3.113 1.00 15.49 H new ATOM 0 HE3 LYS A 114 -6.916 -19.196 -3.316 1.00 15.49 H new ATOM 0 HZ1 LYS A 114 -8.629 -20.301 -2.037 1.00 16.02 H new ATOM 0 HZ2 LYS A 114 -7.252 -20.056 -1.074 1.00 16.02 H new ATOM 0 HZ3 LYS A 114 -8.615 -19.062 -0.877 1.00 16.02 H new TER 1779 LYS A 114 ATOM 1780 N CYS B 7 0.731 -15.284 9.606 1.00 7.31 N ATOM 1781 CA CYS B 7 0.990 -15.655 8.198 1.00 7.09 C ATOM 1782 C CYS B 7 0.842 -14.431 7.303 1.00 6.74 C ATOM 1783 O CYS B 7 -0.271 -14.000 6.994 1.00 6.90 O ATOM 1784 CB CYS B 7 0.020 -16.757 7.754 1.00 7.27 C ATOM 1785 SG CYS B 7 -0.011 -18.197 8.850 1.00 7.49 S ATOM 0 HA CYS B 7 2.009 -16.033 8.113 1.00 7.09 H new ATOM 0 HB2 CYS B 7 -0.985 -16.339 7.692 1.00 7.27 H new ATOM 0 HB3 CYS B 7 0.292 -17.083 6.750 1.00 7.27 H new ATOM 0 HG CYS B 7 -0.859 -19.071 8.395 1.00 7.49 H new ATOM 1791 N GLN B 8 1.967 -13.849 6.914 1.00 6.40 N ATOM 1792 CA GLN B 8 1.956 -12.671 6.060 1.00 6.15 C ATOM 1793 C GLN B 8 2.795 -12.907 4.810 1.00 5.98 C ATOM 1794 O GLN B 8 3.887 -13.468 4.889 1.00 5.98 O ATOM 1795 CB GLN B 8 2.480 -11.448 6.823 1.00 6.04 C ATOM 1796 CG GLN B 8 1.573 -11.001 7.958 1.00 6.41 C ATOM 1797 CD GLN B 8 0.269 -10.398 7.469 1.00 6.68 C ATOM 1798 OE1 GLN B 8 0.167 -9.190 7.266 1.00 6.77 O ATOM 1799 NE2 GLN B 8 -0.735 -11.236 7.265 1.00 7.12 N ATOM 0 H GLN B 8 2.898 -14.173 7.176 1.00 6.40 H new ATOM 0 HA GLN B 8 0.926 -12.480 5.758 1.00 6.15 H new ATOM 0 HB2 GLN B 8 3.466 -11.678 7.227 1.00 6.04 H new ATOM 0 HB3 GLN B 8 2.607 -10.621 6.124 1.00 6.04 H new ATOM 0 HG2 GLN B 8 1.355 -11.855 8.600 1.00 6.41 H new ATOM 0 HG3 GLN B 8 2.099 -10.269 8.570 1.00 6.41 H new ATOM 0 HE21 GLN B 8 -0.612 -12.232 7.445 1.00 7.12 H new ATOM 0 HE22 GLN B 8 -1.632 -10.885 6.928 1.00 7.12 H new ATOM 1808 N PRO B 9 2.282 -12.504 3.640 1.00 5.94 N ATOM 1809 CA PRO B 9 2.991 -12.661 2.367 1.00 5.86 C ATOM 1810 C PRO B 9 4.320 -11.903 2.345 1.00 5.25 C ATOM 1811 O PRO B 9 4.495 -10.914 3.062 1.00 4.75 O ATOM 1812 CB PRO B 9 2.024 -12.064 1.333 1.00 6.04 C ATOM 1813 CG PRO B 9 0.691 -12.072 2.000 1.00 6.18 C ATOM 1814 CD PRO B 9 0.963 -11.882 3.463 1.00 6.07 C ATOM 0 HA PRO B 9 3.248 -13.703 2.176 1.00 5.86 H new ATOM 0 HB2 PRO B 9 2.320 -11.053 1.054 1.00 6.04 H new ATOM 0 HB3 PRO B 9 2.011 -12.656 0.418 1.00 6.04 H new ATOM 0 HG2 PRO B 9 0.056 -11.275 1.614 1.00 6.18 H new ATOM 0 HG3 PRO B 9 0.169 -13.011 1.818 1.00 6.18 H new ATOM 0 HD2 PRO B 9 0.975 -10.827 3.737 1.00 6.07 H new ATOM 0 HD3 PRO B 9 0.204 -12.363 4.080 1.00 6.07 H new ATOM 1822 N THR B 10 5.245 -12.368 1.512 1.00 5.38 N ATOM 1823 CA THR B 10 6.556 -11.746 1.381 1.00 4.87 C ATOM 1824 C THR B 10 6.491 -10.542 0.435 1.00 4.51 C ATOM 1825 O THR B 10 7.332 -10.373 -0.452 1.00 4.85 O ATOM 1826 CB THR B 10 7.582 -12.764 0.855 1.00 5.16 C ATOM 1827 OG1 THR B 10 6.955 -14.049 0.705 1.00 5.81 O ATOM 1828 CG2 THR B 10 8.762 -12.883 1.807 1.00 5.01 C ATOM 0 H THR B 10 5.108 -13.182 0.912 1.00 5.38 H new ATOM 0 HA THR B 10 6.868 -11.402 2.367 1.00 4.87 H new ATOM 0 HB THR B 10 7.948 -12.417 -0.111 1.00 5.16 H new ATOM 0 HG1 THR B 10 7.610 -14.695 0.368 1.00 5.81 H new ATOM 0 HG21 THR B 10 9.475 -13.608 1.414 1.00 5.01 H new ATOM 0 HG22 THR B 10 9.249 -11.913 1.906 1.00 5.01 H new ATOM 0 HG23 THR B 10 8.409 -13.213 2.784 1.00 5.01 H new ATOM 1836 N GLU B 11 5.483 -9.712 0.649 1.00 4.02 N ATOM 1837 CA GLU B 11 5.254 -8.525 -0.155 1.00 3.81 C ATOM 1838 C GLU B 11 4.458 -7.525 0.672 1.00 3.79 C ATOM 1839 O GLU B 11 3.319 -7.803 1.044 1.00 4.04 O ATOM 1840 CB GLU B 11 4.498 -8.901 -1.435 1.00 4.37 C ATOM 1841 CG GLU B 11 4.067 -7.714 -2.278 1.00 4.33 C ATOM 1842 CD GLU B 11 3.015 -8.273 -3.444 1.00 5.46 C ATOM 1843 OE1 GLU B 11 3.081 -9.362 -2.841 1.00 5.61 O ATOM 1844 OE2 GLU B 11 3.898 -7.396 -3.340 1.00 5.85 O ATOM 0 H GLU B 11 4.796 -9.845 1.391 1.00 4.02 H new ATOM 0 HA GLU B 11 6.204 -8.076 -0.445 1.00 3.81 H new ATOM 0 HB2 GLU B 11 5.131 -9.550 -2.040 1.00 4.37 H new ATOM 0 HB3 GLU B 11 3.615 -9.479 -1.165 1.00 4.37 H new ATOM 0 HG2 GLU B 11 3.583 -6.960 -1.657 1.00 4.33 H new ATOM 0 HG3 GLU B 11 4.932 -7.239 -2.740 1.00 4.33 H new ATOM 1851 N PHE B 12 5.053 -6.378 0.976 1.00 3.64 N ATOM 1852 CA PHE B 12 4.375 -5.379 1.795 1.00 3.90 C ATOM 1853 C PHE B 12 4.564 -3.964 1.264 1.00 3.61 C ATOM 1854 O PHE B 12 5.538 -3.666 0.574 1.00 3.37 O ATOM 1855 CB PHE B 12 4.870 -5.454 3.244 1.00 3.97 C ATOM 1856 CG PHE B 12 6.306 -5.041 3.434 1.00 5.41 C ATOM 1857 CD1 PHE B 12 7.340 -5.913 3.133 1.00 5.81 C ATOM 1858 CD2 PHE B 12 6.618 -3.781 3.919 1.00 5.41 C ATOM 1859 CE1 PHE B 12 8.658 -5.536 3.311 1.00 6.08 C ATOM 1860 CE2 PHE B 12 7.932 -3.398 4.099 1.00 5.75 C ATOM 1861 CZ PHE B 12 8.954 -4.276 3.794 1.00 4.19 C ATOM 0 H PHE B 12 5.991 -6.118 0.673 1.00 3.64 H new ATOM 0 HA PHE B 12 3.310 -5.607 1.754 1.00 3.90 H new ATOM 0 HB2 PHE B 12 4.237 -4.819 3.864 1.00 3.97 H new ATOM 0 HB3 PHE B 12 4.748 -6.475 3.604 1.00 3.97 H new ATOM 0 HD1 PHE B 12 7.113 -6.899 2.755 1.00 5.81 H new ATOM 0 HD2 PHE B 12 5.823 -3.090 4.159 1.00 5.41 H new ATOM 0 HE1 PHE B 12 9.455 -6.225 3.073 1.00 6.08 H new ATOM 0 HE2 PHE B 12 8.161 -2.413 4.478 1.00 5.75 H new ATOM 0 HZ PHE B 12 9.983 -3.978 3.933 1.00 4.19 H new ATOM 1871 N ILE B 13 3.629 -3.096 1.615 1.00 4.06 N ATOM 1872 CA ILE B 13 3.673 -1.704 1.200 1.00 4.31 C ATOM 1873 C ILE B 13 4.543 -0.881 2.154 1.00 4.64 C ATOM 1874 O ILE B 13 4.272 -0.795 3.355 1.00 5.17 O ATOM 1875 CB ILE B 13 2.247 -1.098 1.128 1.00 4.65 C ATOM 1876 CG1 ILE B 13 2.305 0.429 1.014 1.00 5.25 C ATOM 1877 CG2 ILE B 13 1.417 -1.513 2.336 1.00 4.81 C ATOM 1878 CD1 ILE B 13 0.944 1.082 0.881 1.00 5.57 C ATOM 0 H ILE B 13 2.823 -3.335 2.192 1.00 4.06 H new ATOM 0 HA ILE B 13 4.114 -1.670 0.204 1.00 4.31 H new ATOM 0 HB ILE B 13 1.764 -1.488 0.232 1.00 4.65 H new ATOM 0 HG12 ILE B 13 2.807 0.831 1.894 1.00 5.25 H new ATOM 0 HG13 ILE B 13 2.913 0.697 0.150 1.00 5.25 H new ATOM 0 HG21 ILE B 13 0.422 -1.075 2.261 1.00 4.81 H new ATOM 0 HG22 ILE B 13 1.334 -2.599 2.365 1.00 4.81 H new ATOM 0 HG23 ILE B 13 1.900 -1.162 3.248 1.00 4.81 H new ATOM 0 HD11 ILE B 13 1.065 2.163 0.805 1.00 5.57 H new ATOM 0 HD12 ILE B 13 0.447 0.709 -0.015 1.00 5.57 H new ATOM 0 HD13 ILE B 13 0.340 0.845 1.757 1.00 5.57 H new ATOM 1890 N SER B 14 5.603 -0.298 1.617 1.00 4.50 N ATOM 1891 CA SER B 14 6.508 0.522 2.408 1.00 4.98 C ATOM 1892 C SER B 14 6.290 2.000 2.087 1.00 5.30 C ATOM 1893 O SER B 14 6.757 2.497 1.059 1.00 4.82 O ATOM 1894 CB SER B 14 7.962 0.127 2.130 1.00 4.87 C ATOM 1895 OG SER B 14 8.058 -1.224 1.702 1.00 4.53 O ATOM 0 H SER B 14 5.859 -0.378 0.633 1.00 4.50 H new ATOM 0 HA SER B 14 6.300 0.357 3.465 1.00 4.98 H new ATOM 0 HB2 SER B 14 8.379 0.783 1.366 1.00 4.87 H new ATOM 0 HB3 SER B 14 8.558 0.268 3.032 1.00 4.87 H new ATOM 0 HG SER B 14 7.751 -1.296 0.774 1.00 4.53 H new ATOM 1901 N ARG B 15 5.566 2.693 2.956 1.00 6.21 N ATOM 1902 CA ARG B 15 5.286 4.108 2.758 1.00 6.71 C ATOM 1903 C ARG B 15 6.390 4.947 3.386 1.00 7.20 C ATOM 1904 O ARG B 15 6.474 5.071 4.610 1.00 7.59 O ATOM 1905 CB ARG B 15 3.927 4.474 3.366 1.00 7.25 C ATOM 1906 CG ARG B 15 2.805 3.551 2.929 1.00 7.11 C ATOM 1907 CD ARG B 15 1.655 3.556 3.921 1.00 7.81 C ATOM 1908 NE ARG B 15 0.721 4.653 3.676 1.00 7.98 N ATOM 1909 CZ ARG B 15 -0.600 4.502 3.609 1.00 8.52 C ATOM 1910 NH1 ARG B 15 -1.147 3.306 3.805 1.00 8.97 N ATOM 1911 NH2 ARG B 15 -1.372 5.544 3.337 1.00 8.77 N ATOM 0 H ARG B 15 5.162 2.298 3.805 1.00 6.21 H new ATOM 0 HA ARG B 15 5.251 4.314 1.688 1.00 6.71 H new ATOM 0 HB2 ARG B 15 4.005 4.450 4.453 1.00 7.25 H new ATOM 0 HB3 ARG B 15 3.676 5.497 3.087 1.00 7.25 H new ATOM 0 HG2 ARG B 15 2.441 3.859 1.949 1.00 7.11 H new ATOM 0 HG3 ARG B 15 3.189 2.537 2.822 1.00 7.11 H new ATOM 0 HD2 ARG B 15 1.122 2.607 3.862 1.00 7.81 H new ATOM 0 HD3 ARG B 15 2.051 3.637 4.933 1.00 7.81 H new ATOM 0 HE ARG B 15 1.104 5.590 3.549 1.00 7.98 H new ATOM 0 HH11 ARG B 15 -0.554 2.501 4.007 1.00 8.97 H new ATOM 0 HH12 ARG B 15 -2.159 3.194 3.753 1.00 8.97 H new ATOM 0 HH21 ARG B 15 -0.954 6.461 3.179 1.00 8.77 H new ATOM 0 HH22 ARG B 15 -2.384 5.429 3.285 1.00 8.77 H new ATOM 1925 N HIS B 16 7.245 5.500 2.545 1.00 7.22 N ATOM 1926 CA HIS B 16 8.353 6.318 3.013 1.00 7.74 C ATOM 1927 C HIS B 16 8.414 7.619 2.228 1.00 8.16 C ATOM 1928 O HIS B 16 7.937 7.686 1.097 1.00 8.31 O ATOM 1929 CB HIS B 16 9.680 5.556 2.883 1.00 7.44 C ATOM 1930 CG HIS B 16 10.092 5.272 1.472 1.00 7.53 C ATOM 1931 ND1 HIS B 16 10.721 6.196 0.669 1.00 7.88 N ATOM 1932 CD2 HIS B 16 9.963 4.155 0.724 1.00 7.45 C ATOM 1933 CE1 HIS B 16 10.960 5.661 -0.511 1.00 7.94 C ATOM 1934 NE2 HIS B 16 10.511 4.421 -0.505 1.00 7.70 N ATOM 0 H HIS B 16 7.194 5.398 1.531 1.00 7.22 H new ATOM 0 HA HIS B 16 8.190 6.550 4.066 1.00 7.74 H new ATOM 0 HB2 HIS B 16 10.466 6.133 3.369 1.00 7.44 H new ATOM 0 HB3 HIS B 16 9.598 4.612 3.422 1.00 7.44 H new ATOM 0 HD1 HIS B 16 10.964 7.147 0.945 1.00 7.88 H new ATOM 0 HD2 HIS B 16 9.512 3.225 1.036 1.00 7.45 H new ATOM 0 HE1 HIS B 16 11.442 6.154 -1.342 1.00 7.94 H new ATOM 1943 N ASN B 17 9.008 8.642 2.821 1.00 8.44 N ATOM 1944 CA ASN B 17 9.130 9.934 2.159 1.00 8.93 C ATOM 1945 C ASN B 17 10.205 9.877 1.072 1.00 8.16 C ATOM 1946 O ASN B 17 10.913 8.873 0.944 1.00 7.25 O ATOM 1947 CB ASN B 17 9.426 11.042 3.179 1.00 9.72 C ATOM 1948 CG ASN B 17 10.903 11.214 3.495 1.00 10.00 C ATOM 1949 OD1 ASN B 17 11.661 10.248 3.580 1.00 9.52 O ATOM 1950 ND2 ASN B 17 11.324 12.459 3.652 1.00 10.83 N ATOM 0 H ASN B 17 9.413 8.605 3.757 1.00 8.44 H new ATOM 0 HA ASN B 17 8.180 10.171 1.681 1.00 8.93 H new ATOM 0 HB2 ASN B 17 9.034 11.985 2.799 1.00 9.72 H new ATOM 0 HB3 ASN B 17 8.890 10.823 4.103 1.00 9.72 H new ATOM 0 HD21 ASN B 17 12.307 12.644 3.851 1.00 10.83 H new ATOM 0 HD22 ASN B 17 10.665 13.234 3.574 1.00 10.83 H new ATOM 1957 N ILE B 18 10.324 10.952 0.299 1.00 8.56 N ATOM 1958 CA ILE B 18 11.295 11.028 -0.797 1.00 7.97 C ATOM 1959 C ILE B 18 12.733 10.789 -0.334 1.00 8.14 C ATOM 1960 O ILE B 18 13.548 10.261 -1.089 1.00 8.11 O ATOM 1961 CB ILE B 18 11.223 12.389 -1.518 1.00 8.20 C ATOM 1962 CG1 ILE B 18 11.196 13.533 -0.499 1.00 8.36 C ATOM 1963 CG2 ILE B 18 10.003 12.438 -2.424 1.00 8.89 C ATOM 1964 CD1 ILE B 18 11.296 14.907 -1.123 1.00 8.53 C ATOM 0 H ILE B 18 9.756 11.792 0.410 1.00 8.56 H new ATOM 0 HA ILE B 18 11.021 10.229 -1.487 1.00 7.97 H new ATOM 0 HB ILE B 18 12.113 12.509 -2.136 1.00 8.20 H new ATOM 0 HG12 ILE B 18 10.273 13.472 0.078 1.00 8.36 H new ATOM 0 HG13 ILE B 18 12.020 13.402 0.203 1.00 8.36 H new ATOM 0 HG21 ILE B 18 9.963 13.404 -2.928 1.00 8.89 H new ATOM 0 HG22 ILE B 18 10.070 11.643 -3.167 1.00 8.89 H new ATOM 0 HG23 ILE B 18 9.101 12.302 -1.827 1.00 8.89 H new ATOM 0 HD11 ILE B 18 11.270 15.665 -0.340 1.00 8.53 H new ATOM 0 HD12 ILE B 18 12.232 14.988 -1.676 1.00 8.53 H new ATOM 0 HD13 ILE B 18 10.458 15.060 -1.803 1.00 8.53 H new ATOM 1976 N GLU B 19 13.039 11.171 0.899 1.00 8.43 N ATOM 1977 CA GLU B 19 14.382 10.992 1.441 1.00 8.81 C ATOM 1978 C GLU B 19 14.677 9.520 1.713 1.00 8.59 C ATOM 1979 O GLU B 19 15.830 9.089 1.689 1.00 8.52 O ATOM 1980 CB GLU B 19 14.543 11.800 2.725 1.00 9.86 C ATOM 1981 CG GLU B 19 14.492 13.302 2.513 1.00 10.25 C ATOM 1982 CD GLU B 19 14.455 14.062 3.819 1.00 11.31 C ATOM 1983 OE1 GLU B 19 15.218 13.704 4.742 1.00 11.62 O ATOM 1984 OE2 GLU B 19 13.645 15.005 3.942 1.00 11.92 O ATOM 0 H GLU B 19 12.378 11.606 1.543 1.00 8.43 H new ATOM 0 HA GLU B 19 15.094 11.350 0.698 1.00 8.81 H new ATOM 0 HB2 GLU B 19 13.757 11.514 3.424 1.00 9.86 H new ATOM 0 HB3 GLU B 19 15.494 11.540 3.190 1.00 9.86 H new ATOM 0 HG2 GLU B 19 15.362 13.616 1.937 1.00 10.25 H new ATOM 0 HG3 GLU B 19 13.611 13.554 1.923 1.00 10.25 H new ATOM 1991 N GLY B 20 13.631 8.751 1.980 1.00 8.56 N ATOM 1992 CA GLY B 20 13.804 7.338 2.242 1.00 8.44 C ATOM 1993 C GLY B 20 13.362 6.945 3.634 1.00 8.57 C ATOM 1994 O GLY B 20 13.394 5.767 3.984 1.00 8.52 O ATOM 0 H GLY B 20 12.667 9.081 2.020 1.00 8.56 H new ATOM 0 HA2 GLY B 20 13.236 6.764 1.509 1.00 8.44 H new ATOM 0 HA3 GLY B 20 14.853 7.074 2.110 1.00 8.44 H new ATOM 1998 N ILE B 21 12.949 7.933 4.417 1.00 8.85 N ATOM 1999 CA ILE B 21 12.493 7.700 5.782 1.00 9.05 C ATOM 2000 C ILE B 21 11.097 7.086 5.772 1.00 8.72 C ATOM 2001 O ILE B 21 10.169 7.645 5.185 1.00 8.95 O ATOM 2002 CB ILE B 21 12.458 9.014 6.595 1.00 9.94 C ATOM 2003 CG1 ILE B 21 13.857 9.639 6.683 1.00 9.95 C ATOM 2004 CG2 ILE B 21 11.897 8.771 7.989 1.00 10.87 C ATOM 2005 CD1 ILE B 21 14.801 8.913 7.622 1.00 10.51 C ATOM 0 H ILE B 21 12.920 8.911 4.128 1.00 8.85 H new ATOM 0 HA ILE B 21 13.198 7.015 6.252 1.00 9.05 H new ATOM 0 HB ILE B 21 11.802 9.713 6.076 1.00 9.94 H new ATOM 0 HG12 ILE B 21 14.298 9.659 5.686 1.00 9.95 H new ATOM 0 HG13 ILE B 21 13.761 10.674 7.010 1.00 9.95 H new ATOM 0 HG21 ILE B 21 11.882 9.709 8.544 1.00 10.87 H new ATOM 0 HG22 ILE B 21 10.883 8.379 7.910 1.00 10.87 H new ATOM 0 HG23 ILE B 21 12.524 8.050 8.513 1.00 10.87 H new ATOM 0 HD11 ILE B 21 15.768 9.417 7.628 1.00 10.51 H new ATOM 0 HD12 ILE B 21 14.385 8.915 8.629 1.00 10.51 H new ATOM 0 HD13 ILE B 21 14.930 7.885 7.285 1.00 10.51 H new ATOM 2017 N PHE B 22 10.958 5.928 6.402 1.00 8.23 N ATOM 2018 CA PHE B 22 9.673 5.240 6.462 1.00 7.87 C ATOM 2019 C PHE B 22 8.727 5.921 7.444 1.00 7.79 C ATOM 2020 O PHE B 22 9.098 6.208 8.585 1.00 8.12 O ATOM 2021 CB PHE B 22 9.864 3.781 6.869 1.00 7.86 C ATOM 2022 CG PHE B 22 10.618 2.956 5.868 1.00 7.34 C ATOM 2023 CD1 PHE B 22 9.972 2.421 4.767 1.00 7.10 C ATOM 2024 CD2 PHE B 22 11.970 2.707 6.035 1.00 7.19 C ATOM 2025 CE1 PHE B 22 10.661 1.653 3.850 1.00 6.75 C ATOM 2026 CE2 PHE B 22 12.664 1.937 5.122 1.00 6.90 C ATOM 2027 CZ PHE B 22 12.007 1.410 4.028 1.00 6.69 C ATOM 0 H PHE B 22 11.718 5.444 6.879 1.00 8.23 H new ATOM 0 HA PHE B 22 9.232 5.283 5.466 1.00 7.87 H new ATOM 0 HB2 PHE B 22 10.392 3.748 7.822 1.00 7.86 H new ATOM 0 HB3 PHE B 22 8.885 3.330 7.031 1.00 7.86 H new ATOM 0 HD1 PHE B 22 8.918 2.606 4.624 1.00 7.10 H new ATOM 0 HD2 PHE B 22 12.488 3.119 6.889 1.00 7.19 H new ATOM 0 HE1 PHE B 22 10.146 1.243 2.994 1.00 6.75 H new ATOM 0 HE2 PHE B 22 13.718 1.748 5.264 1.00 6.90 H new ATOM 0 HZ PHE B 22 12.547 0.808 3.312 1.00 6.69 H new ATOM 2037 N THR B 23 7.510 6.178 6.993 1.00 7.44 N ATOM 2038 CA THR B 23 6.501 6.812 7.825 1.00 7.38 C ATOM 2039 C THR B 23 5.504 5.772 8.335 1.00 7.22 C ATOM 2040 O THR B 23 5.082 5.808 9.496 1.00 7.91 O ATOM 2041 CB THR B 23 5.749 7.906 7.041 1.00 7.22 C ATOM 2042 OG1 THR B 23 6.691 8.772 6.392 1.00 7.16 O ATOM 2043 CG2 THR B 23 4.853 8.718 7.962 1.00 7.36 C ATOM 0 H THR B 23 7.196 5.955 6.049 1.00 7.44 H new ATOM 0 HA THR B 23 7.007 7.274 8.673 1.00 7.38 H new ATOM 0 HB THR B 23 5.122 7.422 6.292 1.00 7.22 H new ATOM 0 HG1 THR B 23 6.209 9.465 5.894 1.00 7.16 H new ATOM 0 HG21 THR B 23 4.334 9.483 7.384 1.00 7.36 H new ATOM 0 HG22 THR B 23 4.122 8.060 8.432 1.00 7.36 H new ATOM 0 HG23 THR B 23 5.459 9.195 8.732 1.00 7.36 H new ATOM 2051 N PHE B 24 5.144 4.836 7.464 1.00 6.39 N ATOM 2052 CA PHE B 24 4.206 3.781 7.813 1.00 6.27 C ATOM 2053 C PHE B 24 4.485 2.540 6.973 1.00 5.44 C ATOM 2054 O PHE B 24 4.684 2.635 5.763 1.00 4.71 O ATOM 2055 CB PHE B 24 2.763 4.259 7.606 1.00 6.55 C ATOM 2056 CG PHE B 24 1.723 3.288 8.087 1.00 6.80 C ATOM 2057 CD1 PHE B 24 1.667 2.919 9.420 1.00 7.52 C ATOM 2058 CD2 PHE B 24 0.803 2.748 7.207 1.00 6.51 C ATOM 2059 CE1 PHE B 24 0.712 2.028 9.867 1.00 7.89 C ATOM 2060 CE2 PHE B 24 -0.156 1.856 7.646 1.00 6.98 C ATOM 2061 CZ PHE B 24 -0.200 1.496 8.978 1.00 7.64 C ATOM 0 H PHE B 24 5.491 4.789 6.506 1.00 6.39 H new ATOM 0 HA PHE B 24 4.334 3.528 8.865 1.00 6.27 H new ATOM 0 HB2 PHE B 24 2.627 5.208 8.125 1.00 6.55 H new ATOM 0 HB3 PHE B 24 2.603 4.451 6.545 1.00 6.55 H new ATOM 0 HD1 PHE B 24 2.379 3.333 10.119 1.00 7.52 H new ATOM 0 HD2 PHE B 24 0.835 3.027 6.164 1.00 6.51 H new ATOM 0 HE1 PHE B 24 0.679 1.748 10.910 1.00 7.89 H new ATOM 0 HE2 PHE B 24 -0.869 1.441 6.949 1.00 6.98 H new ATOM 0 HZ PHE B 24 -0.948 0.798 9.324 1.00 7.64 H new ATOM 2071 N VAL B 25 4.513 1.384 7.617 1.00 5.71 N ATOM 2072 CA VAL B 25 4.774 0.128 6.931 1.00 5.22 C ATOM 2073 C VAL B 25 3.743 -0.921 7.324 1.00 5.47 C ATOM 2074 O VAL B 25 3.118 -0.823 8.380 1.00 5.85 O ATOM 2075 CB VAL B 25 6.191 -0.409 7.236 1.00 5.58 C ATOM 2076 CG1 VAL B 25 7.226 0.286 6.366 1.00 5.20 C ATOM 2077 CG2 VAL B 25 6.527 -0.232 8.708 1.00 6.10 C ATOM 0 H VAL B 25 4.357 1.289 8.621 1.00 5.71 H new ATOM 0 HA VAL B 25 4.705 0.328 5.862 1.00 5.22 H new ATOM 0 HB VAL B 25 6.208 -1.474 7.006 1.00 5.58 H new ATOM 0 HG11 VAL B 25 8.217 -0.106 6.596 1.00 5.20 H new ATOM 0 HG12 VAL B 25 6.999 0.105 5.315 1.00 5.20 H new ATOM 0 HG13 VAL B 25 7.205 1.358 6.562 1.00 5.20 H new ATOM 0 HG21 VAL B 25 7.528 -0.616 8.901 1.00 6.10 H new ATOM 0 HG22 VAL B 25 6.489 0.827 8.965 1.00 6.10 H new ATOM 0 HG23 VAL B 25 5.805 -0.779 9.314 1.00 6.10 H new ATOM 2087 N ASP B 26 3.561 -1.908 6.462 1.00 5.31 N ATOM 2088 CA ASP B 26 2.605 -2.982 6.709 1.00 5.56 C ATOM 2089 C ASP B 26 3.217 -4.042 7.621 1.00 6.58 C ATOM 2090 O ASP B 26 4.436 -4.163 7.709 1.00 7.15 O ATOM 2091 CB ASP B 26 2.176 -3.617 5.385 1.00 4.87 C ATOM 2092 CG ASP B 26 0.949 -4.497 5.522 1.00 4.97 C ATOM 2093 OD1 ASP B 26 1.087 -5.663 5.942 1.00 5.05 O ATOM 2094 OD2 ASP B 26 -0.155 -4.042 5.173 1.00 5.22 O ATOM 0 H ASP B 26 4.065 -1.990 5.579 1.00 5.31 H new ATOM 0 HA ASP B 26 1.729 -2.561 7.203 1.00 5.56 H new ATOM 0 HB2 ASP B 26 1.973 -2.829 4.659 1.00 4.87 H new ATOM 0 HB3 ASP B 26 3.000 -4.210 4.989 1.00 4.87 H new ATOM 2099 N HIS B 27 2.362 -4.827 8.268 1.00 6.95 N ATOM 2100 CA HIS B 27 2.809 -5.879 9.181 1.00 8.01 C ATOM 2101 C HIS B 27 3.518 -7.007 8.431 1.00 8.33 C ATOM 2102 O HIS B 27 4.243 -7.804 9.029 1.00 8.59 O ATOM 2103 CB HIS B 27 1.619 -6.447 9.961 1.00 8.34 C ATOM 2104 CG HIS B 27 1.075 -5.513 11.001 1.00 8.39 C ATOM 2105 ND1 HIS B 27 -0.251 -5.138 11.060 1.00 8.80 N ATOM 2106 CD2 HIS B 27 1.687 -4.875 12.025 1.00 8.34 C ATOM 2107 CE1 HIS B 27 -0.428 -4.310 12.073 1.00 8.97 C ATOM 2108 NE2 HIS B 27 0.731 -4.134 12.674 1.00 8.70 N ATOM 0 H HIS B 27 1.349 -4.755 8.178 1.00 6.95 H new ATOM 0 HA HIS B 27 3.519 -5.432 9.876 1.00 8.01 H new ATOM 0 HB2 HIS B 27 0.823 -6.698 9.260 1.00 8.34 H new ATOM 0 HB3 HIS B 27 1.923 -7.376 10.444 1.00 8.34 H new ATOM 0 HD2 HIS B 27 2.734 -4.937 12.284 1.00 8.34 H new ATOM 0 HE1 HIS B 27 -1.364 -3.854 12.360 1.00 8.97 H new ATOM 0 HE2 HIS B 27 0.892 -3.543 13.490 1.00 8.70 H new ATOM 2117 N ARG B 28 3.308 -7.064 7.118 1.00 8.41 N ATOM 2118 CA ARG B 28 3.921 -8.088 6.273 1.00 8.82 C ATOM 2119 C ARG B 28 5.453 -7.984 6.269 1.00 9.34 C ATOM 2120 O ARG B 28 6.142 -8.932 5.888 1.00 9.76 O ATOM 2121 CB ARG B 28 3.396 -7.975 4.837 1.00 8.65 C ATOM 2122 CG ARG B 28 1.982 -8.499 4.648 1.00 9.09 C ATOM 2123 CD ARG B 28 1.391 -8.047 3.319 1.00 9.23 C ATOM 2124 NE ARG B 28 0.874 -6.681 3.385 1.00 9.07 N ATOM 2125 CZ ARG B 28 0.669 -5.898 2.321 1.00 9.17 C ATOM 2126 NH1 ARG B 28 1.037 -6.286 1.109 1.00 9.42 N ATOM 2127 NH2 ARG B 28 0.126 -4.700 2.472 1.00 9.14 N ATOM 0 H ARG B 28 2.713 -6.408 6.612 1.00 8.41 H new ATOM 0 HA ARG B 28 3.649 -9.058 6.689 1.00 8.82 H new ATOM 0 HB2 ARG B 28 3.428 -6.929 4.532 1.00 8.65 H new ATOM 0 HB3 ARG B 28 4.066 -8.521 4.173 1.00 8.65 H new ATOM 0 HG2 ARG B 28 1.988 -9.588 4.693 1.00 9.09 H new ATOM 0 HG3 ARG B 28 1.351 -8.149 5.465 1.00 9.09 H new ATOM 0 HD2 ARG B 28 2.154 -8.108 2.543 1.00 9.23 H new ATOM 0 HD3 ARG B 28 0.588 -8.725 3.030 1.00 9.23 H new ATOM 0 HE ARG B 28 0.655 -6.300 4.305 1.00 9.07 H new ATOM 0 HH11 ARG B 28 1.484 -7.194 0.978 1.00 9.42 H new ATOM 0 HH12 ARG B 28 0.874 -5.677 0.307 1.00 9.42 H new ATOM 0 HH21 ARG B 28 -0.137 -4.373 3.402 1.00 9.14 H new ATOM 0 HH22 ARG B 28 -0.029 -4.104 1.659 1.00 9.14 H new ATOM 2141 N CYS B 29 5.985 -6.843 6.704 1.00 9.40 N ATOM 2142 CA CYS B 29 7.432 -6.628 6.732 1.00 9.95 C ATOM 2143 C CYS B 29 8.137 -7.650 7.624 1.00 10.96 C ATOM 2144 O CYS B 29 9.239 -8.112 7.307 1.00 11.56 O ATOM 2145 CB CYS B 29 7.749 -5.216 7.226 1.00 9.64 C ATOM 2146 SG CYS B 29 7.194 -4.885 8.914 1.00 9.41 S ATOM 0 H CYS B 29 5.436 -6.053 7.042 1.00 9.40 H new ATOM 0 HA CYS B 29 7.800 -6.752 5.713 1.00 9.95 H new ATOM 0 HB2 CYS B 29 8.826 -5.056 7.171 1.00 9.64 H new ATOM 0 HB3 CYS B 29 7.285 -4.494 6.554 1.00 9.64 H new ATOM 0 HG CYS B 29 8.115 -5.253 9.754 1.00 9.41 H new ATOM 2152 N VAL B 30 7.483 -8.014 8.720 1.00 11.19 N ATOM 2153 CA VAL B 30 8.038 -8.968 9.674 1.00 12.16 C ATOM 2154 C VAL B 30 8.234 -10.342 9.036 1.00 12.13 C ATOM 2155 O VAL B 30 9.160 -11.074 9.383 1.00 12.06 O ATOM 2156 CB VAL B 30 7.136 -9.098 10.919 1.00 12.71 C ATOM 2157 CG1 VAL B 30 7.753 -10.035 11.948 1.00 13.64 C ATOM 2158 CG2 VAL B 30 6.873 -7.731 11.532 1.00 12.09 C ATOM 0 H VAL B 30 6.560 -7.660 8.972 1.00 11.19 H new ATOM 0 HA VAL B 30 9.011 -8.585 9.982 1.00 12.16 H new ATOM 0 HB VAL B 30 6.185 -9.526 10.602 1.00 12.71 H new ATOM 0 HG11 VAL B 30 7.096 -10.107 12.814 1.00 13.64 H new ATOM 0 HG12 VAL B 30 7.883 -11.024 11.508 1.00 13.64 H new ATOM 0 HG13 VAL B 30 8.722 -9.646 12.260 1.00 13.64 H new ATOM 0 HG21 VAL B 30 6.235 -7.842 12.409 1.00 12.09 H new ATOM 0 HG22 VAL B 30 7.819 -7.276 11.826 1.00 12.09 H new ATOM 0 HG23 VAL B 30 6.376 -7.094 10.800 1.00 12.09 H new ATOM 2168 N ALA B 31 7.378 -10.680 8.087 1.00 12.22 N ATOM 2169 CA ALA B 31 7.467 -11.968 7.416 1.00 12.23 C ATOM 2170 C ALA B 31 8.338 -11.883 6.166 1.00 12.35 C ATOM 2171 O ALA B 31 8.859 -12.893 5.690 1.00 12.90 O ATOM 2172 CB ALA B 31 6.079 -12.470 7.059 1.00 12.06 C ATOM 0 H ALA B 31 6.616 -10.084 7.764 1.00 12.22 H new ATOM 0 HA ALA B 31 7.935 -12.674 8.102 1.00 12.23 H new ATOM 0 HB1 ALA B 31 6.159 -13.434 6.557 1.00 12.06 H new ATOM 0 HB2 ALA B 31 5.487 -12.581 7.968 1.00 12.06 H new ATOM 0 HB3 ALA B 31 5.593 -11.755 6.395 1.00 12.06 H new ATOM 2178 N THR B 32 8.505 -10.676 5.643 1.00 11.87 N ATOM 2179 CA THR B 32 9.302 -10.471 4.441 1.00 11.93 C ATOM 2180 C THR B 32 10.798 -10.377 4.752 1.00 12.13 C ATOM 2181 O THR B 32 11.596 -11.152 4.222 1.00 12.07 O ATOM 2182 CB THR B 32 8.851 -9.204 3.688 1.00 11.28 C ATOM 2183 OG1 THR B 32 7.433 -9.242 3.479 1.00 10.74 O ATOM 2184 CG2 THR B 32 9.557 -9.083 2.346 1.00 11.32 C ATOM 0 H THR B 32 8.100 -9.825 6.032 1.00 11.87 H new ATOM 0 HA THR B 32 9.141 -11.343 3.807 1.00 11.93 H new ATOM 0 HB THR B 32 9.113 -8.338 4.296 1.00 11.28 H new ATOM 0 HG1 THR B 32 6.973 -9.133 4.337 1.00 10.74 H new ATOM 0 HG21 THR B 32 9.219 -8.180 1.837 1.00 11.32 H new ATOM 0 HG22 THR B 32 10.634 -9.029 2.505 1.00 11.32 H new ATOM 0 HG23 THR B 32 9.324 -9.954 1.733 1.00 11.32 H new ATOM 2192 N VAL B 33 11.179 -9.440 5.611 1.00 12.47 N ATOM 2193 CA VAL B 33 12.586 -9.266 5.959 1.00 12.77 C ATOM 2194 C VAL B 33 12.840 -9.525 7.440 1.00 13.33 C ATOM 2195 O VAL B 33 13.989 -9.627 7.873 1.00 13.87 O ATOM 2196 CB VAL B 33 13.101 -7.854 5.601 1.00 12.98 C ATOM 2197 CG1 VAL B 33 13.606 -7.818 4.167 1.00 12.95 C ATOM 2198 CG2 VAL B 33 12.016 -6.807 5.812 1.00 13.04 C ATOM 0 H VAL B 33 10.542 -8.794 6.076 1.00 12.47 H new ATOM 0 HA VAL B 33 13.132 -10.002 5.369 1.00 12.77 H new ATOM 0 HB VAL B 33 13.931 -7.618 6.267 1.00 12.98 H new ATOM 0 HG11 VAL B 33 13.965 -6.816 3.933 1.00 12.95 H new ATOM 0 HG12 VAL B 33 14.421 -8.532 4.050 1.00 12.95 H new ATOM 0 HG13 VAL B 33 12.794 -8.081 3.489 1.00 12.95 H new ATOM 0 HG21 VAL B 33 12.405 -5.822 5.553 1.00 13.04 H new ATOM 0 HG22 VAL B 33 11.160 -7.037 5.178 1.00 13.04 H new ATOM 0 HG23 VAL B 33 11.705 -6.811 6.857 1.00 13.04 H new ATOM 2208 N GLY B 34 11.769 -9.622 8.217 1.00 13.22 N ATOM 2209 CA GLY B 34 11.911 -9.871 9.639 1.00 13.79 C ATOM 2210 C GLY B 34 12.014 -8.590 10.441 1.00 13.48 C ATOM 2211 O GLY B 34 12.120 -8.622 11.664 1.00 13.67 O ATOM 0 H GLY B 34 10.807 -9.533 7.890 1.00 13.22 H new ATOM 0 HA2 GLY B 34 11.057 -10.449 9.991 1.00 13.79 H new ATOM 0 HA3 GLY B 34 12.800 -10.478 9.812 1.00 13.79 H new ATOM 2215 N TYR B 35 11.978 -7.465 9.748 1.00 13.06 N ATOM 2216 CA TYR B 35 12.070 -6.168 10.394 1.00 12.84 C ATOM 2217 C TYR B 35 10.736 -5.762 10.993 1.00 12.88 C ATOM 2218 O TYR B 35 9.695 -5.864 10.338 1.00 12.93 O ATOM 2219 CB TYR B 35 12.497 -5.095 9.395 1.00 12.71 C ATOM 2220 CG TYR B 35 13.978 -5.048 9.116 1.00 13.12 C ATOM 2221 CD1 TYR B 35 14.905 -5.113 10.146 1.00 13.55 C ATOM 2222 CD2 TYR B 35 14.444 -4.921 7.817 1.00 13.47 C ATOM 2223 CE1 TYR B 35 16.259 -5.054 9.883 1.00 14.27 C ATOM 2224 CE2 TYR B 35 15.791 -4.863 7.549 1.00 14.23 C ATOM 2225 CZ TYR B 35 16.694 -4.930 8.581 1.00 14.46 C ATOM 2226 OH TYR B 35 18.035 -4.871 8.305 1.00 15.38 O ATOM 0 H TYR B 35 11.885 -7.424 8.733 1.00 13.06 H new ATOM 0 HA TYR B 35 12.815 -6.254 11.185 1.00 12.84 H new ATOM 0 HB2 TYR B 35 11.969 -5.261 8.456 1.00 12.71 H new ATOM 0 HB3 TYR B 35 12.181 -4.122 9.770 1.00 12.71 H new ATOM 0 HD1 TYR B 35 14.563 -5.211 11.166 1.00 13.55 H new ATOM 0 HD2 TYR B 35 13.737 -4.867 7.002 1.00 13.47 H new ATOM 0 HE1 TYR B 35 16.973 -5.105 10.692 1.00 14.27 H new ATOM 0 HE2 TYR B 35 16.138 -4.765 6.531 1.00 14.23 H new ATOM 0 HH TYR B 35 18.166 -4.785 7.338 1.00 15.38 H new ATOM 2236 N GLN B 36 10.770 -5.312 12.234 1.00 12.95 N ATOM 2237 CA GLN B 36 9.567 -4.851 12.895 1.00 13.09 C ATOM 2238 C GLN B 36 9.234 -3.465 12.354 1.00 13.29 C ATOM 2239 O GLN B 36 10.140 -2.708 12.009 1.00 13.05 O ATOM 2240 CB GLN B 36 9.759 -4.806 14.415 1.00 13.40 C ATOM 2241 CG GLN B 36 9.985 -6.171 15.053 1.00 13.22 C ATOM 2242 CD GLN B 36 8.796 -7.102 14.899 1.00 13.36 C ATOM 2243 OE1 GLN B 36 7.652 -6.663 14.777 1.00 13.78 O ATOM 2244 NE2 GLN B 36 9.059 -8.400 14.924 1.00 13.13 N ATOM 0 H GLN B 36 11.616 -5.257 12.802 1.00 12.95 H new ATOM 0 HA GLN B 36 8.747 -5.540 12.694 1.00 13.09 H new ATOM 0 HB2 GLN B 36 10.610 -4.164 14.644 1.00 13.40 H new ATOM 0 HB3 GLN B 36 8.881 -4.346 14.868 1.00 13.40 H new ATOM 0 HG2 GLN B 36 10.863 -6.635 14.604 1.00 13.22 H new ATOM 0 HG3 GLN B 36 10.201 -6.039 16.113 1.00 13.22 H new ATOM 0 HE21 GLN B 36 10.021 -8.724 15.027 1.00 13.13 H new ATOM 0 HE22 GLN B 36 8.300 -9.076 14.841 1.00 13.13 H new ATOM 2253 N PRO B 37 7.945 -3.115 12.257 1.00 13.77 N ATOM 2254 CA PRO B 37 7.517 -1.809 11.736 1.00 14.06 C ATOM 2255 C PRO B 37 8.249 -0.637 12.394 1.00 14.37 C ATOM 2256 O PRO B 37 8.648 0.321 11.725 1.00 14.17 O ATOM 2257 CB PRO B 37 6.027 -1.773 12.073 1.00 14.71 C ATOM 2258 CG PRO B 37 5.614 -3.203 12.097 1.00 14.52 C ATOM 2259 CD PRO B 37 6.795 -3.964 12.630 1.00 14.10 C ATOM 0 HA PRO B 37 7.734 -1.704 10.673 1.00 14.06 H new ATOM 0 HB2 PRO B 37 5.849 -1.293 13.035 1.00 14.71 H new ATOM 0 HB3 PRO B 37 5.465 -1.210 11.327 1.00 14.71 H new ATOM 0 HG2 PRO B 37 4.739 -3.346 12.731 1.00 14.52 H new ATOM 0 HG3 PRO B 37 5.345 -3.549 11.099 1.00 14.52 H new ATOM 0 HD2 PRO B 37 6.730 -4.102 13.709 1.00 14.10 H new ATOM 0 HD3 PRO B 37 6.867 -4.957 12.186 1.00 14.10 H new ATOM 2267 N GLN B 38 8.457 -0.743 13.700 1.00 14.87 N ATOM 2268 CA GLN B 38 9.123 0.299 14.472 1.00 15.23 C ATOM 2269 C GLN B 38 10.598 0.457 14.094 1.00 14.56 C ATOM 2270 O GLN B 38 11.211 1.476 14.412 1.00 14.37 O ATOM 2271 CB GLN B 38 9.005 0.007 15.968 1.00 16.33 C ATOM 2272 CG GLN B 38 7.595 0.165 16.508 1.00 17.13 C ATOM 2273 CD GLN B 38 6.800 -1.126 16.483 1.00 17.26 C ATOM 2274 OE1 GLN B 38 7.020 -1.996 15.641 1.00 17.15 O ATOM 2275 NE2 GLN B 38 5.862 -1.254 17.406 1.00 17.54 N ATOM 0 H GLN B 38 8.170 -1.551 14.253 1.00 14.87 H new ATOM 0 HA GLN B 38 8.621 1.237 14.236 1.00 15.23 H new ATOM 0 HB2 GLN B 38 9.347 -1.010 16.159 1.00 16.33 H new ATOM 0 HB3 GLN B 38 9.671 0.675 16.514 1.00 16.33 H new ATOM 0 HG2 GLN B 38 7.644 0.535 17.532 1.00 17.13 H new ATOM 0 HG3 GLN B 38 7.070 0.919 15.922 1.00 17.13 H new ATOM 0 HE21 GLN B 38 5.711 -0.509 18.086 1.00 17.54 H new ATOM 0 HE22 GLN B 38 5.289 -2.097 17.438 1.00 17.54 H new ATOM 2284 N GLU B 39 11.162 -0.540 13.421 1.00 14.24 N ATOM 2285 CA GLU B 39 12.564 -0.483 13.017 1.00 13.70 C ATOM 2286 C GLU B 39 12.732 0.393 11.780 1.00 13.37 C ATOM 2287 O GLU B 39 13.756 1.051 11.607 1.00 13.53 O ATOM 2288 CB GLU B 39 13.109 -1.882 12.730 1.00 13.16 C ATOM 2289 CG GLU B 39 13.096 -2.803 13.937 1.00 13.35 C ATOM 2290 CD GLU B 39 13.935 -4.042 13.723 1.00 12.51 C ATOM 2291 OE1 GLU B 39 15.180 -3.942 13.805 1.00 12.54 O ATOM 2292 OE2 GLU B 39 13.354 -5.123 13.485 1.00 12.57 O ATOM 0 H GLU B 39 10.675 -1.392 13.145 1.00 14.24 H new ATOM 0 HA GLU B 39 13.128 -0.049 13.842 1.00 13.70 H new ATOM 0 HB2 GLU B 39 12.520 -2.335 11.932 1.00 13.16 H new ATOM 0 HB3 GLU B 39 14.131 -1.795 12.362 1.00 13.16 H new ATOM 0 HG2 GLU B 39 13.466 -2.262 14.808 1.00 13.35 H new ATOM 0 HG3 GLU B 39 12.069 -3.096 14.157 1.00 13.35 H new ATOM 2299 N LEU B 40 11.720 0.396 10.928 1.00 12.99 N ATOM 2300 CA LEU B 40 11.756 1.185 9.705 1.00 12.68 C ATOM 2301 C LEU B 40 11.355 2.631 9.976 1.00 12.42 C ATOM 2302 O LEU B 40 11.827 3.553 9.310 1.00 12.12 O ATOM 2303 CB LEU B 40 10.827 0.581 8.644 1.00 13.01 C ATOM 2304 CG LEU B 40 11.308 -0.721 7.989 1.00 13.16 C ATOM 2305 CD1 LEU B 40 12.814 -0.704 7.774 1.00 13.20 C ATOM 2306 CD2 LEU B 40 10.898 -1.925 8.821 1.00 14.03 C ATOM 0 H LEU B 40 10.862 -0.139 11.060 1.00 12.99 H new ATOM 0 HA LEU B 40 12.780 1.171 9.331 1.00 12.68 H new ATOM 0 HB2 LEU B 40 9.856 0.396 9.103 1.00 13.01 H new ATOM 0 HB3 LEU B 40 10.673 1.323 7.860 1.00 13.01 H new ATOM 0 HG LEU B 40 10.831 -0.800 7.012 1.00 13.16 H new ATOM 0 HD11 LEU B 40 13.126 -1.639 7.309 1.00 13.20 H new ATOM 0 HD12 LEU B 40 13.079 0.131 7.125 1.00 13.20 H new ATOM 0 HD13 LEU B 40 13.317 -0.591 8.734 1.00 13.20 H new ATOM 0 HD21 LEU B 40 11.249 -2.837 8.339 1.00 14.03 H new ATOM 0 HD22 LEU B 40 11.339 -1.848 9.815 1.00 14.03 H new ATOM 0 HD23 LEU B 40 9.812 -1.955 8.907 1.00 14.03 H new ATOM 2318 N LEU B 41 10.489 2.825 10.963 1.00 12.56 N ATOM 2319 CA LEU B 41 10.007 4.156 11.315 1.00 12.35 C ATOM 2320 C LEU B 41 11.144 5.065 11.767 1.00 11.89 C ATOM 2321 O LEU B 41 11.652 4.937 12.884 1.00 11.86 O ATOM 2322 CB LEU B 41 8.946 4.065 12.415 1.00 13.17 C ATOM 2323 CG LEU B 41 7.738 3.182 12.089 1.00 13.46 C ATOM 2324 CD1 LEU B 41 6.703 3.260 13.198 1.00 13.62 C ATOM 2325 CD2 LEU B 41 7.124 3.579 10.756 1.00 13.49 C ATOM 0 H LEU B 41 10.104 2.074 11.536 1.00 12.56 H new ATOM 0 HA LEU B 41 9.563 4.591 10.419 1.00 12.35 H new ATOM 0 HB2 LEU B 41 9.418 3.686 13.321 1.00 13.17 H new ATOM 0 HB3 LEU B 41 8.590 5.071 12.638 1.00 13.17 H new ATOM 0 HG LEU B 41 8.082 2.151 12.012 1.00 13.46 H new ATOM 0 HD11 LEU B 41 5.853 2.626 12.947 1.00 13.62 H new ATOM 0 HD12 LEU B 41 7.146 2.920 14.134 1.00 13.62 H new ATOM 0 HD13 LEU B 41 6.366 4.291 13.310 1.00 13.62 H new ATOM 0 HD21 LEU B 41 6.268 2.939 10.545 1.00 13.49 H new ATOM 0 HD22 LEU B 41 6.798 4.618 10.801 1.00 13.49 H new ATOM 0 HD23 LEU B 41 7.866 3.465 9.965 1.00 13.49 H new ATOM 2337 N GLY B 42 11.538 5.984 10.896 1.00 11.62 N ATOM 2338 CA GLY B 42 12.604 6.913 11.225 1.00 11.31 C ATOM 2339 C GLY B 42 13.932 6.522 10.617 1.00 11.25 C ATOM 2340 O GLY B 42 14.955 7.148 10.894 1.00 11.52 O ATOM 0 H GLY B 42 11.138 6.104 9.965 1.00 11.62 H new ATOM 0 HA2 GLY B 42 12.331 7.910 10.879 1.00 11.31 H new ATOM 0 HA3 GLY B 42 12.709 6.970 12.308 1.00 11.31 H new ATOM 2344 N LYS B 43 13.923 5.487 9.792 1.00 10.99 N ATOM 2345 CA LYS B 43 15.137 5.018 9.145 1.00 11.02 C ATOM 2346 C LYS B 43 15.012 5.117 7.631 1.00 10.14 C ATOM 2347 O LYS B 43 13.904 5.151 7.094 1.00 9.53 O ATOM 2348 CB LYS B 43 15.430 3.571 9.551 1.00 11.75 C ATOM 2349 CG LYS B 43 16.039 3.431 10.938 1.00 12.72 C ATOM 2350 CD LYS B 43 17.521 3.767 10.933 1.00 13.24 C ATOM 2351 CE LYS B 43 17.763 5.235 11.243 1.00 13.72 C ATOM 2352 NZ LYS B 43 19.159 5.640 10.944 1.00 13.82 N ATOM 0 H LYS B 43 13.086 4.955 9.554 1.00 10.99 H new ATOM 0 HA LYS B 43 15.963 5.652 9.468 1.00 11.02 H new ATOM 0 HB2 LYS B 43 14.503 2.998 9.512 1.00 11.75 H new ATOM 0 HB3 LYS B 43 16.108 3.129 8.821 1.00 11.75 H new ATOM 0 HG2 LYS B 43 15.518 4.089 11.633 1.00 12.72 H new ATOM 0 HG3 LYS B 43 15.897 2.412 11.297 1.00 12.72 H new ATOM 0 HD2 LYS B 43 18.037 3.149 11.668 1.00 13.24 H new ATOM 0 HD3 LYS B 43 17.946 3.525 9.959 1.00 13.24 H new ATOM 0 HE2 LYS B 43 17.075 5.847 10.661 1.00 13.72 H new ATOM 0 HE3 LYS B 43 17.547 5.425 12.294 1.00 13.72 H new ATOM 0 HZ1 LYS B 43 19.466 6.359 11.629 1.00 13.82 H new ATOM 0 HZ2 LYS B 43 19.783 4.810 11.010 1.00 13.82 H new ATOM 0 HZ3 LYS B 43 19.208 6.035 9.983 1.00 13.82 H new ATOM 2366 N ASN B 44 16.150 5.175 6.951 1.00 10.16 N ATOM 2367 CA ASN B 44 16.167 5.261 5.498 1.00 9.44 C ATOM 2368 C ASN B 44 16.280 3.872 4.892 1.00 9.58 C ATOM 2369 O ASN B 44 17.061 3.044 5.359 1.00 10.05 O ATOM 2370 CB ASN B 44 17.341 6.119 4.999 1.00 8.98 C ATOM 2371 CG ASN B 44 17.203 7.588 5.350 1.00 8.84 C ATOM 2372 OD1 ASN B 44 17.661 8.030 6.399 1.00 9.30 O ATOM 2373 ND2 ASN B 44 16.597 8.362 4.464 1.00 8.30 N ATOM 0 H ASN B 44 17.074 5.164 7.384 1.00 10.16 H new ATOM 0 HA ASN B 44 15.233 5.730 5.187 1.00 9.44 H new ATOM 0 HB2 ASN B 44 18.268 5.736 5.425 1.00 8.98 H new ATOM 0 HB3 ASN B 44 17.422 6.017 3.917 1.00 8.98 H new ATOM 0 HD21 ASN B 44 16.499 9.361 4.643 1.00 8.30 H new ATOM 0 HD22 ASN B 44 16.228 7.959 3.602 1.00 8.30 H new ATOM 2380 N ILE B 45 15.504 3.625 3.848 1.00 9.27 N ATOM 2381 CA ILE B 45 15.518 2.336 3.159 1.00 9.41 C ATOM 2382 C ILE B 45 16.911 2.027 2.604 1.00 9.62 C ATOM 2383 O ILE B 45 17.320 0.869 2.519 1.00 9.60 O ATOM 2384 CB ILE B 45 14.472 2.316 2.016 1.00 9.37 C ATOM 2385 CG1 ILE B 45 14.518 0.988 1.251 1.00 9.51 C ATOM 2386 CG2 ILE B 45 14.685 3.488 1.069 1.00 9.43 C ATOM 2387 CD1 ILE B 45 13.363 0.796 0.288 1.00 9.46 C ATOM 0 H ILE B 45 14.851 4.303 3.454 1.00 9.27 H new ATOM 0 HA ILE B 45 15.258 1.566 3.885 1.00 9.41 H new ATOM 0 HB ILE B 45 13.483 2.413 2.465 1.00 9.37 H new ATOM 0 HG12 ILE B 45 15.455 0.931 0.696 1.00 9.51 H new ATOM 0 HG13 ILE B 45 14.522 0.167 1.968 1.00 9.51 H new ATOM 0 HG21 ILE B 45 13.940 3.454 0.274 1.00 9.43 H new ATOM 0 HG22 ILE B 45 14.586 4.423 1.620 1.00 9.43 H new ATOM 0 HG23 ILE B 45 15.682 3.427 0.634 1.00 9.43 H new ATOM 0 HD11 ILE B 45 13.465 -0.165 -0.215 1.00 9.46 H new ATOM 0 HD12 ILE B 45 12.423 0.819 0.839 1.00 9.46 H new ATOM 0 HD13 ILE B 45 13.370 1.596 -0.452 1.00 9.46 H new ATOM 2399 N VAL B 46 17.651 3.078 2.271 1.00 9.93 N ATOM 2400 CA VAL B 46 18.994 2.934 1.723 1.00 10.30 C ATOM 2401 C VAL B 46 19.978 2.418 2.781 1.00 10.43 C ATOM 2402 O VAL B 46 21.016 1.845 2.449 1.00 10.29 O ATOM 2403 CB VAL B 46 19.498 4.278 1.137 1.00 10.71 C ATOM 2404 CG1 VAL B 46 19.779 5.291 2.241 1.00 11.50 C ATOM 2405 CG2 VAL B 46 20.731 4.065 0.270 1.00 11.12 C ATOM 0 H VAL B 46 17.341 4.045 2.372 1.00 9.93 H new ATOM 0 HA VAL B 46 18.941 2.199 0.920 1.00 10.30 H new ATOM 0 HB VAL B 46 18.706 4.683 0.507 1.00 10.71 H new ATOM 0 HG11 VAL B 46 20.131 6.223 1.799 1.00 11.50 H new ATOM 0 HG12 VAL B 46 18.865 5.479 2.804 1.00 11.50 H new ATOM 0 HG13 VAL B 46 20.543 4.896 2.911 1.00 11.50 H new ATOM 0 HG21 VAL B 46 21.065 5.023 -0.129 1.00 11.12 H new ATOM 0 HG22 VAL B 46 21.527 3.625 0.871 1.00 11.12 H new ATOM 0 HG23 VAL B 46 20.485 3.395 -0.554 1.00 11.12 H new ATOM 2415 N GLU B 47 19.626 2.590 4.051 1.00 10.71 N ATOM 2416 CA GLU B 47 20.481 2.151 5.153 1.00 10.91 C ATOM 2417 C GLU B 47 20.442 0.632 5.302 1.00 11.16 C ATOM 2418 O GLU B 47 21.340 0.031 5.891 1.00 11.89 O ATOM 2419 CB GLU B 47 20.046 2.809 6.464 1.00 10.79 C ATOM 2420 CG GLU B 47 20.087 4.328 6.430 1.00 10.56 C ATOM 2421 CD GLU B 47 19.829 4.942 7.790 1.00 10.89 C ATOM 2422 OE1 GLU B 47 20.785 5.062 8.583 1.00 11.17 O ATOM 2423 OE2 GLU B 47 18.669 5.302 8.082 1.00 10.95 O ATOM 0 H GLU B 47 18.754 3.030 4.345 1.00 10.71 H new ATOM 0 HA GLU B 47 21.503 2.453 4.924 1.00 10.91 H new ATOM 0 HB2 GLU B 47 19.032 2.487 6.702 1.00 10.79 H new ATOM 0 HB3 GLU B 47 20.690 2.455 7.269 1.00 10.79 H new ATOM 0 HG2 GLU B 47 21.061 4.655 6.066 1.00 10.56 H new ATOM 0 HG3 GLU B 47 19.343 4.693 5.722 1.00 10.56 H new ATOM 2430 N PHE B 48 19.395 0.017 4.770 1.00 10.58 N ATOM 2431 CA PHE B 48 19.239 -1.428 4.838 1.00 10.76 C ATOM 2432 C PHE B 48 19.376 -2.030 3.447 1.00 9.96 C ATOM 2433 O PHE B 48 18.955 -3.158 3.199 1.00 9.35 O ATOM 2434 CB PHE B 48 17.876 -1.801 5.432 1.00 11.00 C ATOM 2435 CG PHE B 48 17.550 -1.082 6.708 1.00 11.61 C ATOM 2436 CD1 PHE B 48 18.099 -1.494 7.910 1.00 12.05 C ATOM 2437 CD2 PHE B 48 16.692 0.006 6.705 1.00 11.83 C ATOM 2438 CE1 PHE B 48 17.798 -0.834 9.086 1.00 12.71 C ATOM 2439 CE2 PHE B 48 16.389 0.669 7.876 1.00 12.47 C ATOM 2440 CZ PHE B 48 16.942 0.249 9.069 1.00 13.60 C ATOM 0 H PHE B 48 18.638 0.499 4.285 1.00 10.58 H new ATOM 0 HA PHE B 48 20.020 -1.828 5.485 1.00 10.76 H new ATOM 0 HB2 PHE B 48 17.100 -1.586 4.697 1.00 11.00 H new ATOM 0 HB3 PHE B 48 17.853 -2.875 5.616 1.00 11.00 H new ATOM 0 HD1 PHE B 48 18.770 -2.340 7.929 1.00 12.05 H new ATOM 0 HD2 PHE B 48 16.255 0.339 5.775 1.00 11.83 H new ATOM 0 HE1 PHE B 48 18.232 -1.165 10.018 1.00 12.71 H new ATOM 0 HE2 PHE B 48 15.719 1.516 7.859 1.00 12.47 H new ATOM 0 HZ PHE B 48 16.706 0.766 9.987 1.00 13.60 H new ATOM 2450 N CYS B 49 19.972 -1.268 2.546 1.00 10.07 N ATOM 2451 CA CYS B 49 20.159 -1.715 1.176 1.00 9.47 C ATOM 2452 C CYS B 49 21.598 -2.155 0.947 1.00 9.93 C ATOM 2453 O CYS B 49 22.514 -1.685 1.622 1.00 10.81 O ATOM 2454 CB CYS B 49 19.789 -0.589 0.207 1.00 9.48 C ATOM 2455 SG CYS B 49 19.979 -1.012 -1.541 1.00 9.00 S ATOM 0 H CYS B 49 20.336 -0.335 2.739 1.00 10.07 H new ATOM 0 HA CYS B 49 19.507 -2.570 0.995 1.00 9.47 H new ATOM 0 HB2 CYS B 49 18.754 -0.297 0.387 1.00 9.48 H new ATOM 0 HB3 CYS B 49 20.408 0.281 0.427 1.00 9.48 H new ATOM 0 HG CYS B 49 19.025 -1.819 -1.898 1.00 9.00 H new ATOM 2461 N HIS B 50 21.778 -3.083 0.014 1.00 9.34 N ATOM 2462 CA HIS B 50 23.101 -3.586 -0.337 1.00 9.67 C ATOM 2463 C HIS B 50 23.989 -2.422 -0.774 1.00 9.57 C ATOM 2464 O HIS B 50 23.578 -1.615 -1.599 1.00 9.10 O ATOM 2465 CB HIS B 50 22.963 -4.609 -1.468 1.00 9.86 C ATOM 2466 CG HIS B 50 24.126 -5.539 -1.624 1.00 10.44 C ATOM 2467 ND1 HIS B 50 24.716 -5.795 -2.838 1.00 10.42 N ATOM 2468 CD2 HIS B 50 24.782 -6.307 -0.722 1.00 11.13 C ATOM 2469 CE1 HIS B 50 25.683 -6.680 -2.680 1.00 11.06 C ATOM 2470 NE2 HIS B 50 25.742 -7.005 -1.404 1.00 11.49 N ATOM 0 H HIS B 50 21.017 -3.506 -0.517 1.00 9.34 H new ATOM 0 HA HIS B 50 23.559 -4.069 0.526 1.00 9.67 H new ATOM 0 HB2 HIS B 50 22.064 -5.201 -1.295 1.00 9.86 H new ATOM 0 HB3 HIS B 50 22.816 -4.074 -2.406 1.00 9.86 H new ATOM 0 HD1 HIS B 50 24.448 -5.367 -3.725 1.00 10.42 H new ATOM 0 HD2 HIS B 50 24.584 -6.359 0.339 1.00 11.13 H new ATOM 0 HE1 HIS B 50 26.317 -7.071 -3.462 1.00 11.06 H new ATOM 2479 N PRO B 51 25.206 -2.313 -0.216 1.00 10.07 N ATOM 2480 CA PRO B 51 26.143 -1.227 -0.541 1.00 10.05 C ATOM 2481 C PRO B 51 26.284 -0.968 -2.046 1.00 9.24 C ATOM 2482 O PRO B 51 26.236 0.178 -2.494 1.00 9.13 O ATOM 2483 CB PRO B 51 27.459 -1.725 0.052 1.00 10.76 C ATOM 2484 CG PRO B 51 27.048 -2.566 1.208 1.00 11.35 C ATOM 2485 CD PRO B 51 25.765 -3.232 0.794 1.00 10.77 C ATOM 0 HA PRO B 51 25.805 -0.270 -0.144 1.00 10.05 H new ATOM 0 HB2 PRO B 51 28.030 -2.301 -0.676 1.00 10.76 H new ATOM 0 HB3 PRO B 51 28.091 -0.896 0.369 1.00 10.76 H new ATOM 0 HG2 PRO B 51 27.813 -3.305 1.446 1.00 11.35 H new ATOM 0 HG3 PRO B 51 26.903 -1.959 2.101 1.00 11.35 H new ATOM 0 HD2 PRO B 51 25.944 -4.223 0.378 1.00 10.77 H new ATOM 0 HD3 PRO B 51 25.088 -3.358 1.639 1.00 10.77 H new ATOM 2493 N GLU B 52 26.434 -2.033 -2.821 1.00 8.71 N ATOM 2494 CA GLU B 52 26.583 -1.916 -4.271 1.00 7.99 C ATOM 2495 C GLU B 52 25.235 -1.769 -4.979 1.00 7.30 C ATOM 2496 O GLU B 52 25.169 -1.777 -6.209 1.00 7.14 O ATOM 2497 CB GLU B 52 27.326 -3.134 -4.827 1.00 7.73 C ATOM 2498 CG GLU B 52 28.625 -3.438 -4.102 1.00 8.39 C ATOM 2499 CD GLU B 52 28.459 -4.507 -3.041 1.00 8.75 C ATOM 2500 OE1 GLU B 52 27.843 -4.226 -1.994 1.00 8.56 O ATOM 2501 OE2 GLU B 52 28.947 -5.636 -3.249 1.00 9.28 O ATOM 0 H GLU B 52 26.456 -2.991 -2.472 1.00 8.71 H new ATOM 0 HA GLU B 52 27.161 -1.012 -4.463 1.00 7.99 H new ATOM 0 HB2 GLU B 52 26.674 -4.005 -4.767 1.00 7.73 H new ATOM 0 HB3 GLU B 52 27.539 -2.968 -5.883 1.00 7.73 H new ATOM 0 HG2 GLU B 52 29.374 -3.761 -4.825 1.00 8.39 H new ATOM 0 HG3 GLU B 52 29.001 -2.526 -3.639 1.00 8.39 H new ATOM 2508 N ASP B 53 24.165 -1.633 -4.212 1.00 6.93 N ATOM 2509 CA ASP B 53 22.828 -1.484 -4.781 1.00 6.34 C ATOM 2510 C ASP B 53 22.158 -0.220 -4.248 1.00 5.91 C ATOM 2511 O ASP B 53 21.027 0.106 -4.620 1.00 5.54 O ATOM 2512 CB ASP B 53 21.968 -2.714 -4.466 1.00 6.55 C ATOM 2513 CG ASP B 53 22.406 -3.945 -5.235 1.00 6.92 C ATOM 2514 OD1 ASP B 53 23.336 -4.649 -4.775 1.00 7.52 O ATOM 2515 OD2 ASP B 53 21.833 -4.220 -6.310 1.00 6.70 O ATOM 0 H ASP B 53 24.193 -1.622 -3.192 1.00 6.93 H new ATOM 0 HA ASP B 53 22.925 -1.397 -5.863 1.00 6.34 H new ATOM 0 HB2 ASP B 53 22.016 -2.922 -3.397 1.00 6.55 H new ATOM 0 HB3 ASP B 53 20.927 -2.495 -4.702 1.00 6.55 H new ATOM 2520 N GLN B 54 22.871 0.492 -3.381 1.00 6.02 N ATOM 2521 CA GLN B 54 22.363 1.720 -2.780 1.00 5.71 C ATOM 2522 C GLN B 54 22.145 2.800 -3.837 1.00 5.50 C ATOM 2523 O GLN B 54 21.097 3.447 -3.869 1.00 5.31 O ATOM 2524 CB GLN B 54 23.330 2.229 -1.708 1.00 5.84 C ATOM 2525 CG GLN B 54 23.254 1.461 -0.400 1.00 6.08 C ATOM 2526 CD GLN B 54 24.220 1.990 0.644 1.00 6.24 C ATOM 2527 OE1 GLN B 54 25.309 2.470 0.321 1.00 6.57 O ATOM 2528 NE2 GLN B 54 23.823 1.912 1.903 1.00 6.11 N ATOM 0 H GLN B 54 23.810 0.236 -3.077 1.00 6.02 H new ATOM 0 HA GLN B 54 21.403 1.493 -2.317 1.00 5.71 H new ATOM 0 HB2 GLN B 54 24.348 2.172 -2.094 1.00 5.84 H new ATOM 0 HB3 GLN B 54 23.121 3.281 -1.514 1.00 5.84 H new ATOM 0 HG2 GLN B 54 22.238 1.515 -0.010 1.00 6.08 H new ATOM 0 HG3 GLN B 54 23.468 0.409 -0.588 1.00 6.08 H new ATOM 0 HE21 GLN B 54 22.914 1.507 2.127 1.00 6.11 H new ATOM 0 HE22 GLN B 54 24.426 2.256 2.650 1.00 6.11 H new ATOM 2537 N GLN B 55 23.136 2.980 -4.701 1.00 5.71 N ATOM 2538 CA GLN B 55 23.059 3.977 -5.762 1.00 5.60 C ATOM 2539 C GLN B 55 21.898 3.667 -6.699 1.00 4.67 C ATOM 2540 O GLN B 55 21.159 4.566 -7.104 1.00 4.24 O ATOM 2541 CB GLN B 55 24.377 4.028 -6.541 1.00 6.32 C ATOM 2542 CG GLN B 55 24.448 5.147 -7.570 1.00 6.58 C ATOM 2543 CD GLN B 55 24.204 6.520 -6.970 1.00 6.45 C ATOM 2544 OE1 GLN B 55 24.480 6.759 -5.795 1.00 6.54 O ATOM 2545 NE2 GLN B 55 23.689 7.434 -7.776 1.00 6.35 N ATOM 0 H GLN B 55 24.005 2.447 -4.688 1.00 5.71 H new ATOM 0 HA GLN B 55 22.886 4.953 -5.310 1.00 5.60 H new ATOM 0 HB2 GLN B 55 25.199 4.145 -5.835 1.00 6.32 H new ATOM 0 HB3 GLN B 55 24.525 3.074 -7.047 1.00 6.32 H new ATOM 0 HG2 GLN B 55 25.428 5.134 -8.046 1.00 6.58 H new ATOM 0 HG3 GLN B 55 23.711 4.962 -8.352 1.00 6.58 H new ATOM 0 HE21 GLN B 55 23.474 7.197 -8.744 1.00 6.35 H new ATOM 0 HE22 GLN B 55 23.507 8.376 -7.429 1.00 6.35 H new ATOM 2554 N LEU B 56 21.738 2.390 -7.028 1.00 4.60 N ATOM 2555 CA LEU B 56 20.657 1.949 -7.902 1.00 4.04 C ATOM 2556 C LEU B 56 19.306 2.314 -7.297 1.00 4.15 C ATOM 2557 O LEU B 56 18.404 2.776 -8.000 1.00 4.24 O ATOM 2558 CB LEU B 56 20.743 0.439 -8.128 1.00 3.86 C ATOM 2559 CG LEU B 56 19.610 -0.159 -8.962 1.00 3.93 C ATOM 2560 CD1 LEU B 56 19.624 0.405 -10.373 1.00 3.88 C ATOM 2561 CD2 LEU B 56 19.720 -1.674 -8.993 1.00 4.08 C ATOM 0 H LEU B 56 22.346 1.639 -6.701 1.00 4.60 H new ATOM 0 HA LEU B 56 20.757 2.454 -8.863 1.00 4.04 H new ATOM 0 HB2 LEU B 56 21.691 0.214 -8.617 1.00 3.86 H new ATOM 0 HB3 LEU B 56 20.760 -0.057 -7.158 1.00 3.86 H new ATOM 0 HG LEU B 56 18.662 0.112 -8.497 1.00 3.93 H new ATOM 0 HD11 LEU B 56 18.809 -0.034 -10.949 1.00 3.88 H new ATOM 0 HD12 LEU B 56 19.498 1.487 -10.334 1.00 3.88 H new ATOM 0 HD13 LEU B 56 20.575 0.168 -10.850 1.00 3.88 H new ATOM 0 HD21 LEU B 56 18.907 -2.086 -9.590 1.00 4.08 H new ATOM 0 HD22 LEU B 56 20.675 -1.961 -9.434 1.00 4.08 H new ATOM 0 HD23 LEU B 56 19.658 -2.064 -7.977 1.00 4.08 H new ATOM 2573 N LEU B 57 19.178 2.114 -5.990 1.00 4.29 N ATOM 2574 CA LEU B 57 17.944 2.434 -5.286 1.00 4.67 C ATOM 2575 C LEU B 57 17.667 3.931 -5.371 1.00 4.68 C ATOM 2576 O LEU B 57 16.571 4.352 -5.745 1.00 4.66 O ATOM 2577 CB LEU B 57 18.041 2.014 -3.817 1.00 5.46 C ATOM 2578 CG LEU B 57 16.989 1.009 -3.344 1.00 5.72 C ATOM 2579 CD1 LEU B 57 16.906 1.014 -1.826 1.00 6.40 C ATOM 2580 CD2 LEU B 57 15.630 1.315 -3.954 1.00 5.94 C ATOM 0 H LEU B 57 19.915 1.732 -5.397 1.00 4.29 H new ATOM 0 HA LEU B 57 17.127 1.887 -5.757 1.00 4.67 H new ATOM 0 HB2 LEU B 57 19.029 1.586 -3.645 1.00 5.46 H new ATOM 0 HB3 LEU B 57 17.968 2.908 -3.197 1.00 5.46 H new ATOM 0 HG LEU B 57 17.290 0.015 -3.676 1.00 5.72 H new ATOM 0 HD11 LEU B 57 16.154 0.295 -1.500 1.00 6.40 H new ATOM 0 HD12 LEU B 57 17.875 0.741 -1.408 1.00 6.40 H new ATOM 0 HD13 LEU B 57 16.629 2.010 -1.480 1.00 6.40 H new ATOM 0 HD21 LEU B 57 14.900 0.586 -3.602 1.00 5.94 H new ATOM 0 HD22 LEU B 57 15.315 2.316 -3.658 1.00 5.94 H new ATOM 0 HD23 LEU B 57 15.699 1.263 -5.041 1.00 5.94 H new ATOM 2592 N ARG B 58 18.683 4.718 -5.042 1.00 4.80 N ATOM 2593 CA ARG B 58 18.588 6.173 -5.065 1.00 4.96 C ATOM 2594 C ARG B 58 18.207 6.681 -6.455 1.00 4.70 C ATOM 2595 O ARG B 58 17.320 7.525 -6.598 1.00 4.35 O ATOM 2596 CB ARG B 58 19.924 6.778 -4.625 1.00 5.25 C ATOM 2597 CG ARG B 58 19.982 8.297 -4.699 1.00 5.73 C ATOM 2598 CD ARG B 58 21.324 8.816 -4.213 1.00 6.55 C ATOM 2599 NE ARG B 58 21.464 10.258 -4.406 1.00 7.05 N ATOM 2600 CZ ARG B 58 22.597 10.926 -4.198 1.00 7.71 C ATOM 2601 NH1 ARG B 58 23.692 10.280 -3.818 1.00 8.02 N ATOM 2602 NH2 ARG B 58 22.638 12.241 -4.373 1.00 8.18 N ATOM 0 H ARG B 58 19.596 4.367 -4.752 1.00 4.80 H new ATOM 0 HA ARG B 58 17.803 6.481 -4.374 1.00 4.96 H new ATOM 0 HB2 ARG B 58 20.129 6.468 -3.600 1.00 5.25 H new ATOM 0 HB3 ARG B 58 20.718 6.366 -5.247 1.00 5.25 H new ATOM 0 HG2 ARG B 58 19.813 8.621 -5.726 1.00 5.73 H new ATOM 0 HG3 ARG B 58 19.182 8.725 -4.094 1.00 5.73 H new ATOM 0 HD2 ARG B 58 21.441 8.580 -3.155 1.00 6.55 H new ATOM 0 HD3 ARG B 58 22.124 8.301 -4.745 1.00 6.55 H new ATOM 0 HE ARG B 58 20.647 10.783 -4.718 1.00 7.05 H new ATOM 0 HH11 ARG B 58 23.667 9.269 -3.684 1.00 8.02 H new ATOM 0 HH12 ARG B 58 24.558 10.794 -3.659 1.00 8.02 H new ATOM 0 HH21 ARG B 58 21.800 12.743 -4.668 1.00 8.18 H new ATOM 0 HH22 ARG B 58 23.507 12.750 -4.213 1.00 8.18 H new ATOM 2616 N ASP B 59 18.870 6.147 -7.474 1.00 5.14 N ATOM 2617 CA ASP B 59 18.611 6.548 -8.856 1.00 5.25 C ATOM 2618 C ASP B 59 17.181 6.215 -9.268 1.00 5.09 C ATOM 2619 O ASP B 59 16.529 6.991 -9.970 1.00 5.01 O ATOM 2620 CB ASP B 59 19.597 5.864 -9.801 1.00 6.03 C ATOM 2621 CG ASP B 59 19.516 6.407 -11.213 1.00 6.00 C ATOM 2622 OD1 ASP B 59 19.795 7.609 -11.406 1.00 6.07 O ATOM 2623 OD2 ASP B 59 19.193 5.635 -12.139 1.00 6.01 O ATOM 0 H ASP B 59 19.592 5.434 -7.371 1.00 5.14 H new ATOM 0 HA ASP B 59 18.743 7.628 -8.921 1.00 5.25 H new ATOM 0 HB2 ASP B 59 20.610 5.996 -9.422 1.00 6.03 H new ATOM 0 HB3 ASP B 59 19.399 4.792 -9.815 1.00 6.03 H new ATOM 2628 N SER B 60 16.695 5.065 -8.817 1.00 5.19 N ATOM 2629 CA SER B 60 15.342 4.628 -9.134 1.00 5.23 C ATOM 2630 C SER B 60 14.305 5.513 -8.443 1.00 5.38 C ATOM 2631 O SER B 60 13.255 5.815 -9.013 1.00 5.59 O ATOM 2632 CB SER B 60 15.151 3.164 -8.730 1.00 5.37 C ATOM 2633 OG SER B 60 16.126 2.335 -9.350 1.00 5.26 O ATOM 0 H SER B 60 17.220 4.417 -8.229 1.00 5.19 H new ATOM 0 HA SER B 60 15.197 4.717 -10.211 1.00 5.23 H new ATOM 0 HB2 SER B 60 15.223 3.069 -7.647 1.00 5.37 H new ATOM 0 HB3 SER B 60 14.152 2.832 -9.013 1.00 5.37 H new ATOM 0 HG SER B 60 16.948 2.341 -8.816 1.00 5.26 H new ATOM 2639 N PHE B 61 14.607 5.943 -7.221 1.00 5.36 N ATOM 2640 CA PHE B 61 13.698 6.801 -6.470 1.00 5.54 C ATOM 2641 C PHE B 61 13.490 8.128 -7.190 1.00 5.60 C ATOM 2642 O PHE B 61 12.363 8.585 -7.350 1.00 5.81 O ATOM 2643 CB PHE B 61 14.227 7.055 -5.057 1.00 5.66 C ATOM 2644 CG PHE B 61 14.035 5.891 -4.125 1.00 6.31 C ATOM 2645 CD1 PHE B 61 12.911 5.085 -4.221 1.00 6.46 C ATOM 2646 CD2 PHE B 61 14.978 5.606 -3.151 1.00 6.89 C ATOM 2647 CE1 PHE B 61 12.734 4.016 -3.365 1.00 7.15 C ATOM 2648 CE2 PHE B 61 14.805 4.538 -2.292 1.00 7.61 C ATOM 2649 CZ PHE B 61 13.681 3.742 -2.399 1.00 7.73 C ATOM 0 H PHE B 61 15.472 5.712 -6.732 1.00 5.36 H new ATOM 0 HA PHE B 61 12.740 6.285 -6.396 1.00 5.54 H new ATOM 0 HB2 PHE B 61 15.289 7.294 -5.113 1.00 5.66 H new ATOM 0 HB3 PHE B 61 13.725 7.929 -4.642 1.00 5.66 H new ATOM 0 HD1 PHE B 61 12.166 5.296 -4.974 1.00 6.46 H new ATOM 0 HD2 PHE B 61 15.858 6.226 -3.062 1.00 6.89 H new ATOM 0 HE1 PHE B 61 11.855 3.395 -3.451 1.00 7.15 H new ATOM 0 HE2 PHE B 61 15.548 4.326 -1.537 1.00 7.61 H new ATOM 0 HZ PHE B 61 13.544 2.907 -1.728 1.00 7.73 H new ATOM 2659 N GLN B 62 14.580 8.733 -7.640 1.00 5.57 N ATOM 2660 CA GLN B 62 14.501 10.005 -8.348 1.00 5.90 C ATOM 2661 C GLN B 62 13.803 9.827 -9.693 1.00 6.02 C ATOM 2662 O GLN B 62 13.173 10.754 -10.208 1.00 5.80 O ATOM 2663 CB GLN B 62 15.895 10.600 -8.546 1.00 6.31 C ATOM 2664 CG GLN B 62 16.545 11.069 -7.255 1.00 6.71 C ATOM 2665 CD GLN B 62 15.682 12.057 -6.493 1.00 6.63 C ATOM 2666 OE1 GLN B 62 14.904 11.678 -5.617 1.00 6.49 O ATOM 2667 NE2 GLN B 62 15.813 13.332 -6.821 1.00 6.89 N ATOM 0 H GLN B 62 15.526 8.367 -7.529 1.00 5.57 H new ATOM 0 HA GLN B 62 13.915 10.696 -7.743 1.00 5.90 H new ATOM 0 HB2 GLN B 62 16.536 9.854 -9.016 1.00 6.31 H new ATOM 0 HB3 GLN B 62 15.827 11.441 -9.236 1.00 6.31 H new ATOM 0 HG2 GLN B 62 16.749 10.206 -6.621 1.00 6.71 H new ATOM 0 HG3 GLN B 62 17.505 11.531 -7.483 1.00 6.71 H new ATOM 0 HE21 GLN B 62 16.469 13.606 -7.553 1.00 6.89 H new ATOM 0 HE22 GLN B 62 15.258 14.041 -6.342 1.00 6.89 H new ATOM 2676 N GLN B 63 13.905 8.626 -10.248 1.00 6.58 N ATOM 2677 CA GLN B 63 13.279 8.319 -11.525 1.00 6.98 C ATOM 2678 C GLN B 63 11.765 8.208 -11.377 1.00 7.01 C ATOM 2679 O GLN B 63 11.021 8.713 -12.213 1.00 7.34 O ATOM 2680 CB GLN B 63 13.838 7.023 -12.105 1.00 7.70 C ATOM 2681 CG GLN B 63 15.008 7.237 -13.045 1.00 7.92 C ATOM 2682 CD GLN B 63 15.433 5.957 -13.731 1.00 8.79 C ATOM 2683 OE1 GLN B 63 14.900 5.598 -14.781 1.00 9.40 O ATOM 2684 NE2 GLN B 63 16.395 5.263 -13.148 1.00 8.92 N ATOM 0 H GLN B 63 14.417 7.848 -9.832 1.00 6.58 H new ATOM 0 HA GLN B 63 13.505 9.137 -12.209 1.00 6.98 H new ATOM 0 HB2 GLN B 63 14.153 6.374 -11.288 1.00 7.70 H new ATOM 0 HB3 GLN B 63 13.044 6.501 -12.639 1.00 7.70 H new ATOM 0 HG2 GLN B 63 14.736 7.977 -13.797 1.00 7.92 H new ATOM 0 HG3 GLN B 63 15.851 7.645 -12.486 1.00 7.92 H new ATOM 0 HE21 GLN B 63 16.809 5.597 -12.278 1.00 8.92 H new ATOM 0 HE22 GLN B 63 16.723 4.393 -13.568 1.00 8.92 H new ATOM 2693 N VAL B 64 11.312 7.562 -10.307 1.00 6.75 N ATOM 2694 CA VAL B 64 9.878 7.405 -10.072 1.00 6.88 C ATOM 2695 C VAL B 64 9.232 8.765 -9.804 1.00 6.48 C ATOM 2696 O VAL B 64 8.037 8.956 -10.047 1.00 6.34 O ATOM 2697 CB VAL B 64 9.574 6.418 -8.916 1.00 7.00 C ATOM 2698 CG1 VAL B 64 9.739 7.076 -7.554 1.00 6.47 C ATOM 2699 CG2 VAL B 64 8.175 5.841 -9.069 1.00 7.57 C ATOM 0 H VAL B 64 11.909 7.142 -9.595 1.00 6.75 H new ATOM 0 HA VAL B 64 9.447 6.977 -10.977 1.00 6.88 H new ATOM 0 HB VAL B 64 10.298 5.606 -8.973 1.00 7.00 H new ATOM 0 HG11 VAL B 64 9.517 6.351 -6.771 1.00 6.47 H new ATOM 0 HG12 VAL B 64 10.764 7.429 -7.442 1.00 6.47 H new ATOM 0 HG13 VAL B 64 9.054 7.920 -7.472 1.00 6.47 H new ATOM 0 HG21 VAL B 64 7.975 5.150 -8.250 1.00 7.57 H new ATOM 0 HG22 VAL B 64 7.444 6.649 -9.048 1.00 7.57 H new ATOM 0 HG23 VAL B 64 8.102 5.310 -10.018 1.00 7.57 H new ATOM 2709 N VAL B 65 10.034 9.710 -9.320 1.00 6.45 N ATOM 2710 CA VAL B 65 9.556 11.059 -9.053 1.00 6.37 C ATOM 2711 C VAL B 65 9.323 11.782 -10.377 1.00 6.93 C ATOM 2712 O VAL B 65 8.416 12.604 -10.504 1.00 7.43 O ATOM 2713 CB VAL B 65 10.556 11.855 -8.181 1.00 6.49 C ATOM 2714 CG1 VAL B 65 10.105 13.297 -8.004 1.00 6.77 C ATOM 2715 CG2 VAL B 65 10.728 11.187 -6.827 1.00 6.40 C ATOM 0 H VAL B 65 11.020 9.563 -9.105 1.00 6.45 H new ATOM 0 HA VAL B 65 8.620 10.989 -8.498 1.00 6.37 H new ATOM 0 HB VAL B 65 11.517 11.862 -8.695 1.00 6.49 H new ATOM 0 HG11 VAL B 65 10.828 13.831 -7.387 1.00 6.77 H new ATOM 0 HG12 VAL B 65 10.035 13.779 -8.979 1.00 6.77 H new ATOM 0 HG13 VAL B 65 9.129 13.316 -7.519 1.00 6.77 H new ATOM 0 HG21 VAL B 65 11.435 11.759 -6.226 1.00 6.40 H new ATOM 0 HG22 VAL B 65 9.766 11.147 -6.316 1.00 6.40 H new ATOM 0 HG23 VAL B 65 11.107 10.175 -6.966 1.00 6.40 H new ATOM 2725 N LYS B 66 10.141 11.444 -11.369 1.00 6.93 N ATOM 2726 CA LYS B 66 10.029 12.032 -12.697 1.00 7.52 C ATOM 2727 C LYS B 66 8.791 11.500 -13.404 1.00 7.28 C ATOM 2728 O LYS B 66 8.142 12.215 -14.170 1.00 7.59 O ATOM 2729 CB LYS B 66 11.272 11.719 -13.533 1.00 8.01 C ATOM 2730 CG LYS B 66 12.516 12.468 -13.089 1.00 8.37 C ATOM 2731 CD LYS B 66 13.701 12.154 -13.986 1.00 8.79 C ATOM 2732 CE LYS B 66 13.452 12.601 -15.419 1.00 9.69 C ATOM 2733 NZ LYS B 66 14.554 12.188 -16.325 1.00 10.21 N ATOM 0 H LYS B 66 10.893 10.761 -11.276 1.00 6.93 H new ATOM 0 HA LYS B 66 9.944 13.113 -12.585 1.00 7.52 H new ATOM 0 HB2 LYS B 66 11.469 10.648 -13.487 1.00 8.01 H new ATOM 0 HB3 LYS B 66 11.067 11.961 -14.576 1.00 8.01 H new ATOM 0 HG2 LYS B 66 12.321 13.540 -13.103 1.00 8.37 H new ATOM 0 HG3 LYS B 66 12.756 12.201 -12.060 1.00 8.37 H new ATOM 0 HD2 LYS B 66 14.592 12.649 -13.599 1.00 8.79 H new ATOM 0 HD3 LYS B 66 13.898 11.082 -13.968 1.00 8.79 H new ATOM 0 HE2 LYS B 66 12.512 12.178 -15.774 1.00 9.69 H new ATOM 0 HE3 LYS B 66 13.345 13.685 -15.448 1.00 9.69 H new ATOM 0 HZ1 LYS B 66 14.348 12.511 -17.292 1.00 10.21 H new ATOM 0 HZ2 LYS B 66 15.447 12.612 -16.001 1.00 10.21 H new ATOM 0 HZ3 LYS B 66 14.640 11.152 -16.317 1.00 10.21 H new ATOM 2747 N LEU B 67 8.475 10.236 -13.143 1.00 6.76 N ATOM 2748 CA LEU B 67 7.312 9.599 -13.742 1.00 6.53 C ATOM 2749 C LEU B 67 6.035 10.208 -13.175 1.00 6.28 C ATOM 2750 O LEU B 67 5.152 10.622 -13.926 1.00 6.36 O ATOM 2751 CB LEU B 67 7.325 8.088 -13.478 1.00 6.25 C ATOM 2752 CG LEU B 67 8.659 7.381 -13.727 1.00 6.32 C ATOM 2753 CD1 LEU B 67 8.557 5.909 -13.358 1.00 5.80 C ATOM 2754 CD2 LEU B 67 9.082 7.533 -15.179 1.00 7.20 C ATOM 0 H LEU B 67 9.011 9.633 -12.519 1.00 6.76 H new ATOM 0 HA LEU B 67 7.346 9.765 -14.819 1.00 6.53 H new ATOM 0 HB2 LEU B 67 7.032 7.916 -12.442 1.00 6.25 H new ATOM 0 HB3 LEU B 67 6.565 7.622 -14.106 1.00 6.25 H new ATOM 0 HG LEU B 67 9.417 7.846 -13.096 1.00 6.32 H new ATOM 0 HD11 LEU B 67 9.514 5.421 -13.541 1.00 5.80 H new ATOM 0 HD12 LEU B 67 8.298 5.815 -12.303 1.00 5.80 H new ATOM 0 HD13 LEU B 67 7.786 5.434 -13.965 1.00 5.80 H new ATOM 0 HD21 LEU B 67 10.033 7.024 -15.336 1.00 7.20 H new ATOM 0 HD22 LEU B 67 8.323 7.094 -15.827 1.00 7.20 H new ATOM 0 HD23 LEU B 67 9.194 8.591 -15.417 1.00 7.20 H new ATOM 2766 N LYS B 68 5.968 10.256 -11.841 1.00 6.08 N ATOM 2767 CA LYS B 68 4.828 10.814 -11.110 1.00 6.00 C ATOM 2768 C LYS B 68 3.522 10.090 -11.429 1.00 5.93 C ATOM 2769 O LYS B 68 2.904 10.311 -12.470 1.00 6.24 O ATOM 2770 CB LYS B 68 4.683 12.316 -11.382 1.00 6.26 C ATOM 2771 CG LYS B 68 5.198 13.185 -10.245 1.00 6.39 C ATOM 2772 CD LYS B 68 4.754 14.630 -10.405 1.00 6.79 C ATOM 2773 CE LYS B 68 4.971 15.421 -9.126 1.00 7.05 C ATOM 2774 NZ LYS B 68 4.455 16.809 -9.234 1.00 7.58 N ATOM 0 H LYS B 68 6.709 9.906 -11.234 1.00 6.08 H new ATOM 0 HA LYS B 68 5.033 10.665 -10.050 1.00 6.00 H new ATOM 0 HB2 LYS B 68 5.223 12.567 -12.295 1.00 6.26 H new ATOM 0 HB3 LYS B 68 3.633 12.546 -11.559 1.00 6.26 H new ATOM 0 HG2 LYS B 68 4.835 12.795 -9.294 1.00 6.39 H new ATOM 0 HG3 LYS B 68 6.287 13.139 -10.214 1.00 6.39 H new ATOM 0 HD2 LYS B 68 5.308 15.094 -11.220 1.00 6.79 H new ATOM 0 HD3 LYS B 68 3.699 14.660 -10.679 1.00 6.79 H new ATOM 0 HE2 LYS B 68 4.476 14.914 -8.298 1.00 7.05 H new ATOM 0 HE3 LYS B 68 6.035 15.447 -8.893 1.00 7.05 H new ATOM 0 HZ1 LYS B 68 4.102 17.121 -8.307 1.00 7.58 H new ATOM 0 HZ2 LYS B 68 5.221 17.441 -9.543 1.00 7.58 H new ATOM 0 HZ3 LYS B 68 3.680 16.838 -9.927 1.00 7.58 H new ATOM 2788 N GLY B 69 3.101 9.228 -10.516 1.00 5.57 N ATOM 2789 CA GLY B 69 1.870 8.491 -10.709 1.00 5.53 C ATOM 2790 C GLY B 69 2.095 7.171 -11.408 1.00 5.28 C ATOM 2791 O GLY B 69 1.156 6.564 -11.925 1.00 5.43 O ATOM 0 H GLY B 69 3.590 9.026 -9.644 1.00 5.57 H new ATOM 0 HA2 GLY B 69 1.401 8.312 -9.741 1.00 5.53 H new ATOM 0 HA3 GLY B 69 1.175 9.095 -11.293 1.00 5.53 H new ATOM 2795 N GLN B 70 3.340 6.729 -11.429 1.00 4.96 N ATOM 2796 CA GLN B 70 3.695 5.472 -12.064 1.00 4.76 C ATOM 2797 C GLN B 70 4.456 4.586 -11.090 1.00 4.34 C ATOM 2798 O GLN B 70 4.976 5.067 -10.082 1.00 3.78 O ATOM 2799 CB GLN B 70 4.523 5.725 -13.326 1.00 4.98 C ATOM 2800 CG GLN B 70 3.686 6.083 -14.543 1.00 5.08 C ATOM 2801 CD GLN B 70 2.727 4.976 -14.930 1.00 5.18 C ATOM 2802 OE1 GLN B 70 3.069 4.090 -15.711 1.00 5.27 O ATOM 2803 NE2 GLN B 70 1.520 5.018 -14.390 1.00 5.43 N ATOM 0 H GLN B 70 4.127 7.226 -11.011 1.00 4.96 H new ATOM 0 HA GLN B 70 2.779 4.957 -12.355 1.00 4.76 H new ATOM 0 HB2 GLN B 70 5.229 6.532 -13.131 1.00 4.98 H new ATOM 0 HB3 GLN B 70 5.111 4.835 -13.549 1.00 4.98 H new ATOM 0 HG2 GLN B 70 3.122 6.993 -14.338 1.00 5.08 H new ATOM 0 HG3 GLN B 70 4.346 6.299 -15.383 1.00 5.08 H new ATOM 0 HE21 GLN B 70 1.275 5.770 -13.746 1.00 5.43 H new ATOM 0 HE22 GLN B 70 0.834 4.298 -14.618 1.00 5.43 H new ATOM 2812 N VAL B 71 4.522 3.298 -11.395 1.00 4.77 N ATOM 2813 CA VAL B 71 5.201 2.341 -10.538 1.00 4.57 C ATOM 2814 C VAL B 71 6.523 1.895 -11.152 1.00 4.76 C ATOM 2815 O VAL B 71 6.556 1.359 -12.260 1.00 5.54 O ATOM 2816 CB VAL B 71 4.329 1.094 -10.279 1.00 5.23 C ATOM 2817 CG1 VAL B 71 4.982 0.183 -9.249 1.00 5.54 C ATOM 2818 CG2 VAL B 71 2.930 1.489 -9.830 1.00 5.65 C ATOM 0 H VAL B 71 4.110 2.891 -12.235 1.00 4.77 H new ATOM 0 HA VAL B 71 5.390 2.848 -9.592 1.00 4.57 H new ATOM 0 HB VAL B 71 4.242 0.546 -11.217 1.00 5.23 H new ATOM 0 HG11 VAL B 71 4.350 -0.689 -9.082 1.00 5.54 H new ATOM 0 HG12 VAL B 71 5.957 -0.140 -9.615 1.00 5.54 H new ATOM 0 HG13 VAL B 71 5.107 0.725 -8.312 1.00 5.54 H new ATOM 0 HG21 VAL B 71 2.337 0.591 -9.655 1.00 5.65 H new ATOM 0 HG22 VAL B 71 2.993 2.068 -8.909 1.00 5.65 H new ATOM 0 HG23 VAL B 71 2.456 2.091 -10.605 1.00 5.65 H new ATOM 2828 N LEU B 72 7.604 2.124 -10.430 1.00 4.15 N ATOM 2829 CA LEU B 72 8.925 1.725 -10.877 1.00 4.35 C ATOM 2830 C LEU B 72 9.481 0.679 -9.924 1.00 4.51 C ATOM 2831 O LEU B 72 9.883 0.994 -8.801 1.00 4.34 O ATOM 2832 CB LEU B 72 9.860 2.934 -10.953 1.00 3.90 C ATOM 2833 CG LEU B 72 11.168 2.686 -11.704 1.00 3.93 C ATOM 2834 CD1 LEU B 72 10.896 2.437 -13.179 1.00 4.31 C ATOM 2835 CD2 LEU B 72 12.115 3.861 -11.526 1.00 4.11 C ATOM 0 H LEU B 72 7.592 2.589 -9.522 1.00 4.15 H new ATOM 0 HA LEU B 72 8.850 1.299 -11.877 1.00 4.35 H new ATOM 0 HB2 LEU B 72 9.330 3.755 -11.436 1.00 3.90 H new ATOM 0 HB3 LEU B 72 10.095 3.258 -9.939 1.00 3.90 H new ATOM 0 HG LEU B 72 11.642 1.797 -11.287 1.00 3.93 H new ATOM 0 HD11 LEU B 72 11.838 2.262 -13.698 1.00 4.31 H new ATOM 0 HD12 LEU B 72 10.254 1.563 -13.288 1.00 4.31 H new ATOM 0 HD13 LEU B 72 10.400 3.307 -13.610 1.00 4.31 H new ATOM 0 HD21 LEU B 72 13.041 3.667 -12.067 1.00 4.11 H new ATOM 0 HD22 LEU B 72 11.649 4.766 -11.916 1.00 4.11 H new ATOM 0 HD23 LEU B 72 12.335 3.994 -10.467 1.00 4.11 H new ATOM 2847 N SER B 73 9.465 -0.568 -10.362 1.00 5.01 N ATOM 2848 CA SER B 73 9.950 -1.667 -9.549 1.00 5.35 C ATOM 2849 C SER B 73 11.457 -1.848 -9.715 1.00 5.09 C ATOM 2850 O SER B 73 11.946 -2.124 -10.814 1.00 5.62 O ATOM 2851 CB SER B 73 9.213 -2.950 -9.928 1.00 6.05 C ATOM 2852 OG SER B 73 7.851 -2.684 -10.234 1.00 6.35 O ATOM 0 H SER B 73 9.119 -0.844 -11.281 1.00 5.01 H new ATOM 0 HA SER B 73 9.756 -1.438 -8.501 1.00 5.35 H new ATOM 0 HB2 SER B 73 9.699 -3.412 -10.787 1.00 6.05 H new ATOM 0 HB3 SER B 73 9.272 -3.664 -9.106 1.00 6.05 H new ATOM 0 HG SER B 73 7.401 -3.520 -10.475 1.00 6.35 H new ATOM 2858 N VAL B 74 12.185 -1.681 -8.624 1.00 4.34 N ATOM 2859 CA VAL B 74 13.630 -1.827 -8.636 1.00 4.11 C ATOM 2860 C VAL B 74 14.031 -3.161 -8.008 1.00 3.81 C ATOM 2861 O VAL B 74 13.571 -3.510 -6.920 1.00 3.69 O ATOM 2862 CB VAL B 74 14.325 -0.650 -7.907 1.00 3.94 C ATOM 2863 CG1 VAL B 74 13.713 -0.415 -6.534 1.00 3.77 C ATOM 2864 CG2 VAL B 74 15.824 -0.888 -7.794 1.00 3.75 C ATOM 0 H VAL B 74 11.795 -1.442 -7.712 1.00 4.34 H new ATOM 0 HA VAL B 74 13.961 -1.812 -9.674 1.00 4.11 H new ATOM 0 HB VAL B 74 14.167 0.248 -8.504 1.00 3.94 H new ATOM 0 HG11 VAL B 74 14.221 0.417 -6.047 1.00 3.77 H new ATOM 0 HG12 VAL B 74 12.654 -0.180 -6.643 1.00 3.77 H new ATOM 0 HG13 VAL B 74 13.824 -1.314 -5.927 1.00 3.77 H new ATOM 0 HG21 VAL B 74 16.288 -0.047 -7.278 1.00 3.75 H new ATOM 0 HG22 VAL B 74 16.006 -1.804 -7.231 1.00 3.75 H new ATOM 0 HG23 VAL B 74 16.253 -0.984 -8.791 1.00 3.75 H new ATOM 2874 N MET B 75 14.857 -3.913 -8.716 1.00 3.91 N ATOM 2875 CA MET B 75 15.316 -5.209 -8.238 1.00 3.74 C ATOM 2876 C MET B 75 16.721 -5.093 -7.657 1.00 3.48 C ATOM 2877 O MET B 75 17.667 -4.743 -8.367 1.00 3.88 O ATOM 2878 CB MET B 75 15.300 -6.226 -9.384 1.00 4.24 C ATOM 2879 CG MET B 75 15.746 -7.620 -8.979 1.00 4.67 C ATOM 2880 SD MET B 75 14.558 -8.443 -7.902 1.00 5.41 S ATOM 2881 CE MET B 75 15.125 -10.137 -8.028 1.00 5.42 C ATOM 0 H MET B 75 15.226 -3.647 -9.629 1.00 3.91 H new ATOM 0 HA MET B 75 14.643 -5.551 -7.452 1.00 3.74 H new ATOM 0 HB2 MET B 75 14.291 -6.283 -9.792 1.00 4.24 H new ATOM 0 HB3 MET B 75 15.947 -5.867 -10.184 1.00 4.24 H new ATOM 0 HG2 MET B 75 15.898 -8.223 -9.874 1.00 4.67 H new ATOM 0 HG3 MET B 75 16.708 -7.556 -8.471 1.00 4.67 H new ATOM 0 HE1 MET B 75 14.750 -10.710 -7.180 1.00 5.42 H new ATOM 0 HE2 MET B 75 14.756 -10.576 -8.955 1.00 5.42 H new ATOM 0 HE3 MET B 75 16.215 -10.157 -8.026 1.00 5.42 H new ATOM 2891 N PHE B 76 16.850 -5.371 -6.370 1.00 3.08 N ATOM 2892 CA PHE B 76 18.139 -5.301 -5.694 1.00 3.15 C ATOM 2893 C PHE B 76 18.150 -6.229 -4.483 1.00 3.14 C ATOM 2894 O PHE B 76 17.219 -7.012 -4.285 1.00 3.00 O ATOM 2895 CB PHE B 76 18.443 -3.858 -5.262 1.00 3.19 C ATOM 2896 CG PHE B 76 17.497 -3.317 -4.225 1.00 3.34 C ATOM 2897 CD1 PHE B 76 16.269 -2.797 -4.595 1.00 3.27 C ATOM 2898 CD2 PHE B 76 17.836 -3.327 -2.879 1.00 3.47 C ATOM 2899 CE1 PHE B 76 15.399 -2.301 -3.648 1.00 3.36 C ATOM 2900 CE2 PHE B 76 16.967 -2.833 -1.926 1.00 3.54 C ATOM 2901 CZ PHE B 76 15.747 -2.320 -2.312 1.00 2.78 C ATOM 0 H PHE B 76 16.075 -5.649 -5.768 1.00 3.08 H new ATOM 0 HA PHE B 76 18.913 -5.623 -6.390 1.00 3.15 H new ATOM 0 HB2 PHE B 76 19.459 -3.813 -4.870 1.00 3.19 H new ATOM 0 HB3 PHE B 76 18.411 -3.213 -6.140 1.00 3.19 H new ATOM 0 HD1 PHE B 76 15.989 -2.780 -5.638 1.00 3.27 H new ATOM 0 HD2 PHE B 76 18.792 -3.726 -2.573 1.00 3.47 H new ATOM 0 HE1 PHE B 76 14.444 -1.897 -3.951 1.00 3.36 H new ATOM 0 HE2 PHE B 76 17.242 -2.849 -0.882 1.00 3.54 H new ATOM 0 HZ PHE B 76 15.064 -1.933 -1.570 1.00 2.78 H new ATOM 2911 N ARG B 77 19.200 -6.144 -3.678 1.00 3.59 N ATOM 2912 CA ARG B 77 19.309 -6.972 -2.488 1.00 3.88 C ATOM 2913 C ARG B 77 19.120 -6.133 -1.232 1.00 4.20 C ATOM 2914 O ARG B 77 19.882 -5.201 -0.972 1.00 4.62 O ATOM 2915 CB ARG B 77 20.653 -7.696 -2.452 1.00 4.60 C ATOM 2916 CG ARG B 77 20.590 -9.087 -3.049 1.00 4.59 C ATOM 2917 CD ARG B 77 21.856 -9.875 -2.769 1.00 5.39 C ATOM 2918 NE ARG B 77 22.917 -9.578 -3.729 1.00 5.55 N ATOM 2919 CZ ARG B 77 23.917 -10.415 -4.004 1.00 6.25 C ATOM 2920 NH1 ARG B 77 24.006 -11.578 -3.367 1.00 6.80 N ATOM 2921 NH2 ARG B 77 24.835 -10.085 -4.902 1.00 6.51 N ATOM 0 H ARG B 77 19.986 -5.511 -3.828 1.00 3.59 H new ATOM 0 HA ARG B 77 18.519 -7.722 -2.523 1.00 3.88 H new ATOM 0 HB2 ARG B 77 21.392 -7.106 -2.995 1.00 4.60 H new ATOM 0 HB3 ARG B 77 20.995 -7.764 -1.419 1.00 4.60 H new ATOM 0 HG2 ARG B 77 19.732 -9.620 -2.640 1.00 4.59 H new ATOM 0 HG3 ARG B 77 20.437 -9.014 -4.126 1.00 4.59 H new ATOM 0 HD2 ARG B 77 22.207 -9.649 -1.762 1.00 5.39 H new ATOM 0 HD3 ARG B 77 21.632 -10.941 -2.797 1.00 5.39 H new ATOM 0 HE ARG B 77 22.891 -8.682 -4.215 1.00 5.55 H new ATOM 0 HH11 ARG B 77 23.309 -11.831 -2.667 1.00 6.80 H new ATOM 0 HH12 ARG B 77 24.772 -12.218 -3.578 1.00 6.80 H new ATOM 0 HH21 ARG B 77 24.777 -9.188 -5.385 1.00 6.51 H new ATOM 0 HH22 ARG B 77 25.599 -10.728 -5.110 1.00 6.51 H new ATOM 2935 N PHE B 78 18.100 -6.478 -0.466 1.00 4.21 N ATOM 2936 CA PHE B 78 17.776 -5.774 0.767 1.00 4.81 C ATOM 2937 C PHE B 78 18.253 -6.580 1.969 1.00 5.56 C ATOM 2938 O PHE B 78 18.229 -7.813 1.945 1.00 5.79 O ATOM 2939 CB PHE B 78 16.262 -5.548 0.845 1.00 4.67 C ATOM 2940 CG PHE B 78 15.843 -4.460 1.797 1.00 4.78 C ATOM 2941 CD1 PHE B 78 16.079 -3.129 1.495 1.00 5.01 C ATOM 2942 CD2 PHE B 78 15.201 -4.769 2.986 1.00 4.79 C ATOM 2943 CE1 PHE B 78 15.685 -2.128 2.362 1.00 5.19 C ATOM 2944 CE2 PHE B 78 14.803 -3.772 3.856 1.00 5.05 C ATOM 2945 CZ PHE B 78 15.046 -2.448 3.543 1.00 5.22 C ATOM 0 H PHE B 78 17.472 -7.253 -0.679 1.00 4.21 H new ATOM 0 HA PHE B 78 18.281 -4.808 0.775 1.00 4.81 H new ATOM 0 HB2 PHE B 78 15.892 -5.305 -0.151 1.00 4.67 H new ATOM 0 HB3 PHE B 78 15.783 -6.480 1.144 1.00 4.67 H new ATOM 0 HD1 PHE B 78 16.576 -2.871 0.572 1.00 5.01 H new ATOM 0 HD2 PHE B 78 15.009 -5.802 3.236 1.00 4.79 H new ATOM 0 HE1 PHE B 78 15.877 -1.094 2.115 1.00 5.19 H new ATOM 0 HE2 PHE B 78 14.303 -4.027 4.779 1.00 5.05 H new ATOM 0 HZ PHE B 78 14.737 -1.666 4.221 1.00 5.22 H new ATOM 2955 N ARG B 79 18.702 -5.888 3.006 1.00 6.05 N ATOM 2956 CA ARG B 79 19.183 -6.543 4.214 1.00 6.84 C ATOM 2957 C ARG B 79 18.018 -6.958 5.094 1.00 6.93 C ATOM 2958 O ARG B 79 17.065 -6.204 5.270 1.00 7.29 O ATOM 2959 CB ARG B 79 20.104 -5.608 5.002 1.00 7.82 C ATOM 2960 CG ARG B 79 21.051 -6.333 5.947 1.00 8.65 C ATOM 2961 CD ARG B 79 21.711 -5.374 6.926 1.00 9.63 C ATOM 2962 NE ARG B 79 20.797 -4.969 7.992 1.00 10.06 N ATOM 2963 CZ ARG B 79 21.000 -3.931 8.805 1.00 10.62 C ATOM 2964 NH1 ARG B 79 22.097 -3.194 8.697 1.00 10.80 N ATOM 2965 NH2 ARG B 79 20.098 -3.637 9.731 1.00 11.08 N ATOM 0 H ARG B 79 18.743 -4.869 3.035 1.00 6.05 H new ATOM 0 HA ARG B 79 19.742 -7.430 3.916 1.00 6.84 H new ATOM 0 HB2 ARG B 79 20.690 -5.014 4.301 1.00 7.82 H new ATOM 0 HB3 ARG B 79 19.494 -4.912 5.577 1.00 7.82 H new ATOM 0 HG2 ARG B 79 20.501 -7.096 6.499 1.00 8.65 H new ATOM 0 HG3 ARG B 79 21.818 -6.848 5.369 1.00 8.65 H new ATOM 0 HD2 ARG B 79 22.590 -5.848 7.362 1.00 9.63 H new ATOM 0 HD3 ARG B 79 22.058 -4.490 6.390 1.00 9.63 H new ATOM 0 HE ARG B 79 19.947 -5.517 8.123 1.00 10.06 H new ATOM 0 HH11 ARG B 79 22.795 -3.419 7.988 1.00 10.80 H new ATOM 0 HH12 ARG B 79 22.243 -2.402 9.323 1.00 10.80 H new ATOM 0 HH21 ARG B 79 19.254 -4.203 9.819 1.00 11.08 H new ATOM 0 HH22 ARG B 79 20.248 -2.845 10.355 1.00 11.08 H new ATOM 2979 N SER B 80 18.088 -8.163 5.630 1.00 6.76 N ATOM 2980 CA SER B 80 17.047 -8.661 6.507 1.00 7.04 C ATOM 2981 C SER B 80 17.474 -8.501 7.960 1.00 7.47 C ATOM 2982 O SER B 80 18.546 -7.960 8.245 1.00 7.38 O ATOM 2983 CB SER B 80 16.774 -10.136 6.205 1.00 6.83 C ATOM 2984 OG SER B 80 17.890 -10.936 6.563 1.00 7.21 O ATOM 0 H SER B 80 18.857 -8.815 5.472 1.00 6.76 H new ATOM 0 HA SER B 80 16.135 -8.088 6.338 1.00 7.04 H new ATOM 0 HB2 SER B 80 15.892 -10.467 6.753 1.00 6.83 H new ATOM 0 HB3 SER B 80 16.556 -10.261 5.144 1.00 6.83 H new ATOM 0 HG SER B 80 17.604 -11.867 6.671 1.00 7.21 H new ATOM 2990 N LYS B 81 16.644 -8.987 8.877 1.00 8.04 N ATOM 2991 CA LYS B 81 16.955 -8.918 10.300 1.00 8.55 C ATOM 2992 C LYS B 81 18.106 -9.873 10.623 1.00 8.41 C ATOM 2993 O LYS B 81 18.682 -9.844 11.712 1.00 8.72 O ATOM 2994 CB LYS B 81 15.715 -9.269 11.131 1.00 9.27 C ATOM 2995 CG LYS B 81 15.842 -8.893 12.599 1.00 10.06 C ATOM 2996 CD LYS B 81 16.096 -7.405 12.768 1.00 10.72 C ATOM 2997 CE LYS B 81 16.662 -7.086 14.142 1.00 11.62 C ATOM 2998 NZ LYS B 81 17.119 -5.678 14.234 1.00 12.24 N ATOM 0 H LYS B 81 15.752 -9.432 8.661 1.00 8.04 H new ATOM 0 HA LYS B 81 17.259 -7.902 10.551 1.00 8.55 H new ATOM 0 HB2 LYS B 81 14.848 -8.761 10.708 1.00 9.27 H new ATOM 0 HB3 LYS B 81 15.527 -10.340 11.053 1.00 9.27 H new ATOM 0 HG2 LYS B 81 14.930 -9.171 13.128 1.00 10.06 H new ATOM 0 HG3 LYS B 81 16.658 -9.457 13.052 1.00 10.06 H new ATOM 0 HD2 LYS B 81 16.790 -7.064 12.000 1.00 10.72 H new ATOM 0 HD3 LYS B 81 15.165 -6.858 12.621 1.00 10.72 H new ATOM 0 HE2 LYS B 81 15.902 -7.272 14.901 1.00 11.62 H new ATOM 0 HE3 LYS B 81 17.496 -7.754 14.356 1.00 11.62 H new ATOM 0 HZ1 LYS B 81 17.275 -5.428 15.231 1.00 12.24 H new ATOM 0 HZ2 LYS B 81 18.008 -5.566 13.706 1.00 12.24 H new ATOM 0 HZ3 LYS B 81 16.395 -5.051 13.829 1.00 12.24 H new ATOM 3012 N ASN B 82 18.442 -10.709 9.650 1.00 8.00 N ATOM 3013 CA ASN B 82 19.519 -11.678 9.795 1.00 7.89 C ATOM 3014 C ASN B 82 20.801 -11.117 9.197 1.00 7.36 C ATOM 3015 O ASN B 82 21.822 -11.803 9.136 1.00 7.24 O ATOM 3016 CB ASN B 82 19.156 -12.987 9.091 1.00 7.92 C ATOM 3017 CG ASN B 82 17.764 -13.472 9.440 1.00 8.51 C ATOM 3018 OD1 ASN B 82 17.345 -13.420 10.597 1.00 9.25 O ATOM 3019 ND2 ASN B 82 17.032 -13.937 8.440 1.00 8.28 N ATOM 0 H ASN B 82 17.978 -10.735 8.742 1.00 8.00 H new ATOM 0 HA ASN B 82 19.669 -11.877 10.856 1.00 7.89 H new ATOM 0 HB2 ASN B 82 19.228 -12.847 8.012 1.00 7.92 H new ATOM 0 HB3 ASN B 82 19.882 -13.754 9.362 1.00 7.92 H new ATOM 0 HD21 ASN B 82 16.083 -14.269 8.614 1.00 8.28 H new ATOM 0 HD22 ASN B 82 17.417 -13.963 7.496 1.00 8.28 H new ATOM 3026 N GLN B 83 20.722 -9.864 8.738 1.00 7.14 N ATOM 3027 CA GLN B 83 21.853 -9.161 8.129 1.00 6.77 C ATOM 3028 C GLN B 83 22.242 -9.788 6.793 1.00 6.51 C ATOM 3029 O GLN B 83 23.338 -9.554 6.282 1.00 6.48 O ATOM 3030 CB GLN B 83 23.061 -9.130 9.072 1.00 7.42 C ATOM 3031 CG GLN B 83 23.071 -7.946 10.029 1.00 7.60 C ATOM 3032 CD GLN B 83 21.826 -7.862 10.888 1.00 7.62 C ATOM 3033 OE1 GLN B 83 21.011 -6.951 10.738 1.00 7.12 O ATOM 3034 NE2 GLN B 83 21.662 -8.819 11.786 1.00 8.30 N ATOM 0 H GLN B 83 19.868 -9.308 8.779 1.00 7.14 H new ATOM 0 HA GLN B 83 21.534 -8.135 7.945 1.00 6.77 H new ATOM 0 HB2 GLN B 83 23.080 -10.053 9.652 1.00 7.42 H new ATOM 0 HB3 GLN B 83 23.973 -9.110 8.476 1.00 7.42 H new ATOM 0 HG2 GLN B 83 23.946 -8.017 10.675 1.00 7.60 H new ATOM 0 HG3 GLN B 83 23.172 -7.025 9.456 1.00 7.60 H new ATOM 0 HE21 GLN B 83 22.361 -9.556 11.879 1.00 8.30 H new ATOM 0 HE22 GLN B 83 20.837 -8.820 12.386 1.00 8.30 H new ATOM 3043 N GLU B 84 21.339 -10.576 6.229 1.00 6.48 N ATOM 3044 CA GLU B 84 21.591 -11.212 4.945 1.00 6.41 C ATOM 3045 C GLU B 84 21.000 -10.354 3.836 1.00 6.26 C ATOM 3046 O GLU B 84 20.123 -9.528 4.088 1.00 6.30 O ATOM 3047 CB GLU B 84 21.001 -12.628 4.913 1.00 6.62 C ATOM 3048 CG GLU B 84 19.512 -12.676 4.617 1.00 6.46 C ATOM 3049 CD GLU B 84 18.904 -14.033 4.899 1.00 6.60 C ATOM 3050 OE1 GLU B 84 19.063 -14.946 4.062 1.00 6.74 O ATOM 3051 OE2 GLU B 84 18.261 -14.192 5.958 1.00 6.78 O ATOM 0 H GLU B 84 20.429 -10.790 6.638 1.00 6.48 H new ATOM 0 HA GLU B 84 22.667 -11.301 4.794 1.00 6.41 H new ATOM 0 HB2 GLU B 84 21.529 -13.212 4.159 1.00 6.62 H new ATOM 0 HB3 GLU B 84 21.184 -13.108 5.874 1.00 6.62 H new ATOM 0 HG2 GLU B 84 19.002 -11.922 5.217 1.00 6.46 H new ATOM 0 HG3 GLU B 84 19.345 -12.418 3.571 1.00 6.46 H new ATOM 3058 N TRP B 85 21.486 -10.534 2.622 1.00 6.19 N ATOM 3059 CA TRP B 85 20.995 -9.758 1.496 1.00 6.19 C ATOM 3060 C TRP B 85 20.117 -10.617 0.594 1.00 6.20 C ATOM 3061 O TRP B 85 20.612 -11.499 -0.108 1.00 6.38 O ATOM 3062 CB TRP B 85 22.161 -9.172 0.695 1.00 6.55 C ATOM 3063 CG TRP B 85 23.200 -8.492 1.542 1.00 6.95 C ATOM 3064 CD1 TRP B 85 24.403 -9.009 1.934 1.00 7.63 C ATOM 3065 CD2 TRP B 85 23.130 -7.173 2.100 1.00 6.78 C ATOM 3066 NE1 TRP B 85 25.085 -8.091 2.694 1.00 7.89 N ATOM 3067 CE2 TRP B 85 24.324 -6.960 2.814 1.00 7.40 C ATOM 3068 CE3 TRP B 85 22.176 -6.152 2.064 1.00 6.23 C ATOM 3069 CZ2 TRP B 85 24.589 -5.769 3.483 1.00 7.53 C ATOM 3070 CZ3 TRP B 85 22.442 -4.970 2.730 1.00 6.39 C ATOM 3071 CH2 TRP B 85 23.638 -4.788 3.432 1.00 7.05 C ATOM 0 H TRP B 85 22.217 -11.207 2.390 1.00 6.19 H new ATOM 0 HA TRP B 85 20.394 -8.937 1.887 1.00 6.19 H new ATOM 0 HB2 TRP B 85 22.636 -9.971 0.126 1.00 6.55 H new ATOM 0 HB3 TRP B 85 21.769 -8.456 -0.027 1.00 6.55 H new ATOM 0 HD1 TRP B 85 24.764 -9.995 1.683 1.00 7.63 H new ATOM 0 HE1 TRP B 85 26.009 -8.230 3.103 1.00 7.89 H new ATOM 0 HE3 TRP B 85 21.249 -6.284 1.526 1.00 6.23 H new ATOM 0 HZ2 TRP B 85 25.513 -5.625 4.023 1.00 7.53 H new ATOM 0 HZ3 TRP B 85 21.713 -4.173 2.708 1.00 6.39 H new ATOM 0 HH2 TRP B 85 23.814 -3.854 3.944 1.00 7.05 H new ATOM 3082 N LEU B 86 18.819 -10.355 0.615 1.00 6.05 N ATOM 3083 CA LEU B 86 17.872 -11.101 -0.202 1.00 6.08 C ATOM 3084 C LEU B 86 17.410 -10.250 -1.378 1.00 5.83 C ATOM 3085 O LEU B 86 17.400 -9.022 -1.296 1.00 5.96 O ATOM 3086 CB LEU B 86 16.672 -11.556 0.643 1.00 6.32 C ATOM 3087 CG LEU B 86 16.052 -10.486 1.548 1.00 6.76 C ATOM 3088 CD1 LEU B 86 14.921 -9.758 0.836 1.00 6.60 C ATOM 3089 CD2 LEU B 86 15.552 -11.113 2.841 1.00 6.97 C ATOM 0 H LEU B 86 18.395 -9.628 1.192 1.00 6.05 H new ATOM 0 HA LEU B 86 18.370 -11.989 -0.591 1.00 6.08 H new ATOM 0 HB2 LEU B 86 15.899 -11.930 -0.029 1.00 6.32 H new ATOM 0 HB3 LEU B 86 16.986 -12.394 1.265 1.00 6.32 H new ATOM 0 HG LEU B 86 16.824 -9.755 1.789 1.00 6.76 H new ATOM 0 HD11 LEU B 86 14.498 -9.004 1.500 1.00 6.60 H new ATOM 0 HD12 LEU B 86 15.307 -9.275 -0.062 1.00 6.60 H new ATOM 0 HD13 LEU B 86 14.146 -10.473 0.559 1.00 6.60 H new ATOM 0 HD21 LEU B 86 15.114 -10.341 3.474 1.00 6.97 H new ATOM 0 HD22 LEU B 86 14.798 -11.866 2.612 1.00 6.97 H new ATOM 0 HD23 LEU B 86 16.385 -11.582 3.364 1.00 6.97 H new ATOM 3101 N TRP B 87 17.028 -10.899 -2.469 1.00 5.64 N ATOM 3102 CA TRP B 87 16.577 -10.184 -3.658 1.00 5.53 C ATOM 3103 C TRP B 87 15.126 -9.755 -3.513 1.00 4.89 C ATOM 3104 O TRP B 87 14.228 -10.589 -3.350 1.00 4.93 O ATOM 3105 CB TRP B 87 16.748 -11.048 -4.906 1.00 6.09 C ATOM 3106 CG TRP B 87 18.176 -11.207 -5.319 1.00 6.88 C ATOM 3107 CD1 TRP B 87 19.003 -12.249 -5.022 1.00 7.60 C ATOM 3108 CD2 TRP B 87 18.949 -10.291 -6.102 1.00 7.12 C ATOM 3109 NE1 TRP B 87 20.242 -12.041 -5.575 1.00 8.31 N ATOM 3110 CE2 TRP B 87 20.234 -10.846 -6.244 1.00 8.03 C ATOM 3111 CE3 TRP B 87 18.676 -9.059 -6.699 1.00 6.72 C ATOM 3112 CZ2 TRP B 87 21.245 -10.206 -6.958 1.00 8.55 C ATOM 3113 CZ3 TRP B 87 19.680 -8.425 -7.405 1.00 7.21 C ATOM 3114 CH2 TRP B 87 20.950 -9.000 -7.531 1.00 8.12 C ATOM 0 H TRP B 87 17.021 -11.915 -2.557 1.00 5.64 H new ATOM 0 HA TRP B 87 17.193 -9.291 -3.766 1.00 5.53 H new ATOM 0 HB2 TRP B 87 16.318 -12.032 -4.721 1.00 6.09 H new ATOM 0 HB3 TRP B 87 16.186 -10.604 -5.728 1.00 6.09 H new ATOM 0 HD1 TRP B 87 18.724 -13.113 -4.437 1.00 7.60 H new ATOM 0 HE1 TRP B 87 21.039 -12.673 -5.500 1.00 8.31 H new ATOM 0 HE3 TRP B 87 17.698 -8.610 -6.611 1.00 6.72 H new ATOM 0 HZ2 TRP B 87 22.226 -10.647 -7.055 1.00 8.55 H new ATOM 0 HZ3 TRP B 87 19.482 -7.469 -7.868 1.00 7.21 H new ATOM 0 HH2 TRP B 87 21.713 -8.480 -8.092 1.00 8.12 H new ATOM 3125 N MET B 88 14.898 -8.457 -3.585 1.00 4.38 N ATOM 3126 CA MET B 88 13.561 -7.911 -3.447 1.00 3.86 C ATOM 3127 C MET B 88 13.266 -6.911 -4.556 1.00 4.20 C ATOM 3128 O MET B 88 14.134 -6.133 -4.955 1.00 4.46 O ATOM 3129 CB MET B 88 13.410 -7.239 -2.079 1.00 3.90 C ATOM 3130 CG MET B 88 11.996 -6.772 -1.779 1.00 3.23 C ATOM 3131 SD MET B 88 11.399 -7.352 -0.179 1.00 2.82 S ATOM 3132 CE MET B 88 12.491 -6.464 0.925 1.00 3.18 C ATOM 0 H MET B 88 15.625 -7.758 -3.739 1.00 4.38 H new ATOM 0 HA MET B 88 12.845 -8.729 -3.526 1.00 3.86 H new ATOM 0 HB2 MET B 88 13.724 -7.938 -1.304 1.00 3.90 H new ATOM 0 HB3 MET B 88 14.084 -6.384 -2.028 1.00 3.90 H new ATOM 0 HG2 MET B 88 11.965 -5.683 -1.801 1.00 3.23 H new ATOM 0 HG3 MET B 88 11.326 -7.126 -2.563 1.00 3.23 H new ATOM 0 HE1 MET B 88 12.082 -6.484 1.935 1.00 3.18 H new ATOM 0 HE2 MET B 88 13.474 -6.935 0.922 1.00 3.18 H new ATOM 0 HE3 MET B 88 12.583 -5.430 0.592 1.00 3.18 H new ATOM 3142 N ARG B 89 12.043 -6.953 -5.058 1.00 4.41 N ATOM 3143 CA ARG B 89 11.607 -6.052 -6.110 1.00 5.04 C ATOM 3144 C ARG B 89 10.735 -4.957 -5.508 1.00 5.07 C ATOM 3145 O ARG B 89 9.527 -5.134 -5.325 1.00 5.15 O ATOM 3146 CB ARG B 89 10.826 -6.819 -7.179 1.00 5.18 C ATOM 3147 CG ARG B 89 10.478 -5.981 -8.397 1.00 5.63 C ATOM 3148 CD ARG B 89 9.164 -6.420 -9.015 1.00 5.93 C ATOM 3149 NE ARG B 89 8.013 -6.004 -8.215 1.00 5.96 N ATOM 3150 CZ ARG B 89 6.795 -6.530 -8.332 1.00 6.42 C ATOM 3151 NH1 ARG B 89 6.572 -7.513 -9.197 1.00 6.87 N ATOM 3152 NH2 ARG B 89 5.806 -6.074 -7.580 1.00 6.59 N ATOM 0 H ARG B 89 11.327 -7.610 -4.749 1.00 4.41 H new ATOM 0 HA ARG B 89 12.481 -5.602 -6.580 1.00 5.04 H new ATOM 0 HB2 ARG B 89 11.413 -7.681 -7.497 1.00 5.18 H new ATOM 0 HB3 ARG B 89 9.906 -7.204 -6.739 1.00 5.18 H new ATOM 0 HG2 ARG B 89 10.415 -4.931 -8.112 1.00 5.63 H new ATOM 0 HG3 ARG B 89 11.275 -6.063 -9.136 1.00 5.63 H new ATOM 0 HD2 ARG B 89 9.078 -6.002 -10.018 1.00 5.93 H new ATOM 0 HD3 ARG B 89 9.158 -7.505 -9.121 1.00 5.93 H new ATOM 0 HE ARG B 89 8.151 -5.266 -7.525 1.00 5.96 H new ATOM 0 HH11 ARG B 89 7.335 -7.867 -9.774 1.00 6.87 H new ATOM 0 HH12 ARG B 89 5.638 -7.914 -9.284 1.00 6.87 H new ATOM 0 HH21 ARG B 89 5.978 -5.322 -6.913 1.00 6.59 H new ATOM 0 HH22 ARG B 89 4.872 -6.475 -7.667 1.00 6.59 H new ATOM 3166 N THR B 90 11.354 -3.841 -5.178 1.00 5.17 N ATOM 3167 CA THR B 90 10.646 -2.724 -4.582 1.00 5.29 C ATOM 3168 C THR B 90 9.879 -1.929 -5.635 1.00 5.66 C ATOM 3169 O THR B 90 10.464 -1.189 -6.427 1.00 6.18 O ATOM 3170 CB THR B 90 11.626 -1.800 -3.844 1.00 5.07 C ATOM 3171 OG1 THR B 90 12.534 -2.591 -3.076 1.00 5.02 O ATOM 3172 CG2 THR B 90 10.890 -0.841 -2.927 1.00 4.69 C ATOM 0 H THR B 90 12.352 -3.683 -5.313 1.00 5.17 H new ATOM 0 HA THR B 90 9.929 -3.129 -3.868 1.00 5.29 H new ATOM 0 HB THR B 90 12.171 -1.214 -4.584 1.00 5.07 H new ATOM 0 HG1 THR B 90 12.057 -2.998 -2.323 1.00 5.02 H new ATOM 0 HG21 THR B 90 11.610 -0.200 -2.418 1.00 4.69 H new ATOM 0 HG22 THR B 90 10.208 -0.226 -3.515 1.00 4.69 H new ATOM 0 HG23 THR B 90 10.323 -1.407 -2.188 1.00 4.69 H new ATOM 3180 N SER B 91 8.568 -2.104 -5.642 1.00 5.49 N ATOM 3181 CA SER B 91 7.696 -1.413 -6.579 1.00 5.86 C ATOM 3182 C SER B 91 7.353 -0.023 -6.045 1.00 5.46 C ATOM 3183 O SER B 91 6.425 0.133 -5.252 1.00 4.98 O ATOM 3184 CB SER B 91 6.424 -2.237 -6.798 1.00 6.04 C ATOM 3185 OG SER B 91 6.634 -3.600 -6.444 1.00 6.30 O ATOM 0 H SER B 91 8.078 -2.727 -5.000 1.00 5.49 H new ATOM 0 HA SER B 91 8.208 -1.297 -7.534 1.00 5.86 H new ATOM 0 HB2 SER B 91 5.611 -1.823 -6.202 1.00 6.04 H new ATOM 0 HB3 SER B 91 6.119 -2.171 -7.842 1.00 6.04 H new ATOM 0 HG SER B 91 6.675 -3.682 -5.468 1.00 6.30 H new ATOM 3191 N SER B 92 8.111 0.975 -6.473 1.00 5.80 N ATOM 3192 CA SER B 92 7.914 2.346 -6.018 1.00 5.57 C ATOM 3193 C SER B 92 6.841 3.068 -6.830 1.00 5.56 C ATOM 3194 O SER B 92 6.890 3.091 -8.055 1.00 5.52 O ATOM 3195 CB SER B 92 9.238 3.106 -6.107 1.00 6.27 C ATOM 3196 OG SER B 92 10.292 2.351 -5.527 1.00 6.65 O ATOM 0 H SER B 92 8.874 0.861 -7.140 1.00 5.80 H new ATOM 0 HA SER B 92 7.572 2.312 -4.984 1.00 5.57 H new ATOM 0 HB2 SER B 92 9.470 3.321 -7.150 1.00 6.27 H new ATOM 0 HB3 SER B 92 9.147 4.065 -5.596 1.00 6.27 H new ATOM 0 HG SER B 92 10.060 2.122 -4.603 1.00 6.65 H new ATOM 3202 N PHE B 93 5.867 3.639 -6.136 1.00 5.71 N ATOM 3203 CA PHE B 93 4.789 4.384 -6.773 1.00 5.89 C ATOM 3204 C PHE B 93 4.705 5.788 -6.178 1.00 6.45 C ATOM 3205 O PHE B 93 4.712 5.957 -4.956 1.00 6.45 O ATOM 3206 CB PHE B 93 3.455 3.649 -6.587 1.00 5.69 C ATOM 3207 CG PHE B 93 2.253 4.416 -7.072 1.00 5.63 C ATOM 3208 CD1 PHE B 93 1.941 4.466 -8.421 1.00 5.74 C ATOM 3209 CD2 PHE B 93 1.436 5.088 -6.176 1.00 5.63 C ATOM 3210 CE1 PHE B 93 0.838 5.168 -8.867 1.00 5.78 C ATOM 3211 CE2 PHE B 93 0.332 5.793 -6.617 1.00 5.68 C ATOM 3212 CZ PHE B 93 0.033 5.833 -7.965 1.00 5.73 C ATOM 0 H PHE B 93 5.801 3.600 -5.119 1.00 5.71 H new ATOM 0 HA PHE B 93 4.997 4.464 -7.840 1.00 5.89 H new ATOM 0 HB2 PHE B 93 3.501 2.697 -7.115 1.00 5.69 H new ATOM 0 HB3 PHE B 93 3.323 3.421 -5.529 1.00 5.69 H new ATOM 0 HD1 PHE B 93 2.568 3.950 -9.133 1.00 5.74 H new ATOM 0 HD2 PHE B 93 1.665 5.060 -5.121 1.00 5.63 H new ATOM 0 HE1 PHE B 93 0.606 5.196 -9.921 1.00 5.78 H new ATOM 0 HE2 PHE B 93 -0.296 6.312 -5.908 1.00 5.68 H new ATOM 0 HZ PHE B 93 -0.829 6.384 -8.312 1.00 5.73 H new ATOM 3222 N THR B 94 4.648 6.791 -7.039 1.00 7.02 N ATOM 3223 CA THR B 94 4.558 8.172 -6.594 1.00 7.65 C ATOM 3224 C THR B 94 3.100 8.592 -6.421 1.00 7.67 C ATOM 3225 O THR B 94 2.345 8.645 -7.393 1.00 8.38 O ATOM 3226 CB THR B 94 5.246 9.114 -7.597 1.00 8.72 C ATOM 3227 OG1 THR B 94 5.482 8.424 -8.836 1.00 8.98 O ATOM 3228 CG2 THR B 94 6.563 9.624 -7.039 1.00 9.17 C ATOM 0 H THR B 94 4.663 6.674 -8.052 1.00 7.02 H new ATOM 0 HA THR B 94 5.065 8.243 -5.632 1.00 7.65 H new ATOM 0 HB THR B 94 4.589 9.965 -7.774 1.00 8.72 H new ATOM 0 HG1 THR B 94 6.362 8.674 -9.187 1.00 8.98 H new ATOM 0 HG21 THR B 94 7.033 10.288 -7.764 1.00 9.17 H new ATOM 0 HG22 THR B 94 6.379 10.169 -6.113 1.00 9.17 H new ATOM 0 HG23 THR B 94 7.224 8.781 -6.838 1.00 9.17 H new ATOM 3236 N PHE B 95 2.704 8.872 -5.186 1.00 7.03 N ATOM 3237 CA PHE B 95 1.337 9.288 -4.912 1.00 7.23 C ATOM 3238 C PHE B 95 1.273 10.795 -4.696 1.00 7.66 C ATOM 3239 O PHE B 95 1.958 11.341 -3.825 1.00 7.94 O ATOM 3240 CB PHE B 95 0.778 8.559 -3.688 1.00 6.55 C ATOM 3241 CG PHE B 95 -0.716 8.369 -3.732 1.00 6.95 C ATOM 3242 CD1 PHE B 95 -1.574 9.450 -3.608 1.00 7.38 C ATOM 3243 CD2 PHE B 95 -1.262 7.106 -3.902 1.00 6.97 C ATOM 3244 CE1 PHE B 95 -2.944 9.276 -3.654 1.00 7.77 C ATOM 3245 CE2 PHE B 95 -2.630 6.925 -3.948 1.00 7.38 C ATOM 3246 CZ PHE B 95 -3.474 8.010 -3.824 1.00 8.33 C ATOM 0 H PHE B 95 3.306 8.819 -4.364 1.00 7.03 H new ATOM 0 HA PHE B 95 0.726 9.028 -5.776 1.00 7.23 H new ATOM 0 HB2 PHE B 95 1.258 7.584 -3.605 1.00 6.55 H new ATOM 0 HB3 PHE B 95 1.039 9.120 -2.790 1.00 6.55 H new ATOM 0 HD1 PHE B 95 -1.167 10.441 -3.474 1.00 7.38 H new ATOM 0 HD2 PHE B 95 -0.608 6.252 -4.000 1.00 6.97 H new ATOM 0 HE1 PHE B 95 -3.600 10.128 -3.557 1.00 7.77 H new ATOM 0 HE2 PHE B 95 -3.040 5.935 -4.081 1.00 7.38 H new ATOM 0 HZ PHE B 95 -4.544 7.871 -3.860 1.00 8.33 H new ATOM 3256 N GLN B 96 0.457 11.461 -5.497 1.00 7.77 N ATOM 3257 CA GLN B 96 0.298 12.903 -5.401 1.00 8.24 C ATOM 3258 C GLN B 96 -1.044 13.251 -4.779 1.00 8.05 C ATOM 3259 O GLN B 96 -2.028 12.531 -4.952 1.00 8.10 O ATOM 3260 CB GLN B 96 0.411 13.554 -6.780 1.00 8.94 C ATOM 3261 CG GLN B 96 1.819 13.547 -7.346 1.00 9.25 C ATOM 3262 CD GLN B 96 1.918 12.769 -8.640 1.00 9.90 C ATOM 3263 OE1 GLN B 96 2.257 11.589 -8.643 1.00 9.95 O ATOM 3264 NE2 GLN B 96 1.604 13.420 -9.748 1.00 10.53 N ATOM 0 H GLN B 96 -0.108 11.023 -6.225 1.00 7.77 H new ATOM 0 HA GLN B 96 1.095 13.287 -4.765 1.00 8.24 H new ATOM 0 HB2 GLN B 96 -0.252 13.035 -7.472 1.00 8.94 H new ATOM 0 HB3 GLN B 96 0.060 14.584 -6.715 1.00 8.94 H new ATOM 0 HG2 GLN B 96 2.144 14.573 -7.517 1.00 9.25 H new ATOM 0 HG3 GLN B 96 2.500 13.115 -6.613 1.00 9.25 H new ATOM 0 HE21 GLN B 96 1.327 14.401 -9.702 1.00 10.53 H new ATOM 0 HE22 GLN B 96 1.639 12.941 -10.648 1.00 10.53 H new ATOM 3273 N ASN B 97 -1.075 14.352 -4.047 1.00 7.96 N ATOM 3274 CA ASN B 97 -2.296 14.811 -3.405 1.00 7.92 C ATOM 3275 C ASN B 97 -3.120 15.642 -4.376 1.00 8.14 C ATOM 3276 O ASN B 97 -2.567 16.334 -5.231 1.00 8.43 O ATOM 3277 CB ASN B 97 -1.970 15.632 -2.157 1.00 7.98 C ATOM 3278 CG ASN B 97 -2.083 14.815 -0.887 1.00 8.09 C ATOM 3279 OD1 ASN B 97 -3.139 14.766 -0.257 1.00 8.16 O ATOM 3280 ND2 ASN B 97 -0.997 14.171 -0.504 1.00 8.31 N ATOM 0 H ASN B 97 -0.264 14.948 -3.882 1.00 7.96 H new ATOM 0 HA ASN B 97 -2.877 13.939 -3.105 1.00 7.92 H new ATOM 0 HB2 ASN B 97 -0.959 16.031 -2.241 1.00 7.98 H new ATOM 0 HB3 ASN B 97 -2.646 16.485 -2.099 1.00 7.98 H new ATOM 0 HD21 ASN B 97 -1.012 13.605 0.344 1.00 8.31 H new ATOM 0 HD22 ASN B 97 -0.142 14.239 -1.056 1.00 8.31 H new ATOM 3287 N PRO B 98 -4.454 15.584 -4.263 1.00 8.11 N ATOM 3288 CA PRO B 98 -5.359 16.333 -5.141 1.00 8.36 C ATOM 3289 C PRO B 98 -5.481 17.809 -4.755 1.00 8.56 C ATOM 3290 O PRO B 98 -6.584 18.340 -4.624 1.00 9.16 O ATOM 3291 CB PRO B 98 -6.692 15.613 -4.939 1.00 8.39 C ATOM 3292 CG PRO B 98 -6.635 15.115 -3.537 1.00 8.29 C ATOM 3293 CD PRO B 98 -5.194 14.770 -3.276 1.00 7.99 C ATOM 0 HA PRO B 98 -5.008 16.351 -6.173 1.00 8.36 H new ATOM 0 HB2 PRO B 98 -7.535 16.288 -5.087 1.00 8.39 H new ATOM 0 HB3 PRO B 98 -6.812 14.793 -5.647 1.00 8.39 H new ATOM 0 HG2 PRO B 98 -6.987 15.875 -2.839 1.00 8.29 H new ATOM 0 HG3 PRO B 98 -7.275 14.242 -3.407 1.00 8.29 H new ATOM 0 HD2 PRO B 98 -4.902 15.016 -2.255 1.00 7.99 H new ATOM 0 HD3 PRO B 98 -5.006 13.705 -3.414 1.00 7.99 H new ATOM 3301 N TYR B 99 -4.346 18.469 -4.572 1.00 8.20 N ATOM 3302 CA TYR B 99 -4.335 19.881 -4.210 1.00 8.49 C ATOM 3303 C TYR B 99 -3.426 20.661 -5.148 1.00 8.25 C ATOM 3304 O TYR B 99 -3.857 21.605 -5.808 1.00 8.70 O ATOM 3305 CB TYR B 99 -3.878 20.068 -2.760 1.00 8.61 C ATOM 3306 CG TYR B 99 -4.668 19.255 -1.759 1.00 9.49 C ATOM 3307 CD1 TYR B 99 -6.014 19.512 -1.530 1.00 9.80 C ATOM 3308 CD2 TYR B 99 -4.067 18.227 -1.048 1.00 9.79 C ATOM 3309 CE1 TYR B 99 -6.738 18.768 -0.619 1.00 10.36 C ATOM 3310 CE2 TYR B 99 -4.782 17.477 -0.136 1.00 10.35 C ATOM 3311 CZ TYR B 99 -6.117 17.750 0.075 1.00 10.60 C ATOM 3312 OH TYR B 99 -6.831 17.003 0.985 1.00 11.34 O ATOM 0 H TYR B 99 -3.421 18.050 -4.668 1.00 8.20 H new ATOM 0 HA TYR B 99 -5.352 20.263 -4.304 1.00 8.49 H new ATOM 0 HB2 TYR B 99 -2.825 19.797 -2.683 1.00 8.61 H new ATOM 0 HB3 TYR B 99 -3.955 21.123 -2.498 1.00 8.61 H new ATOM 0 HD1 TYR B 99 -6.503 20.307 -2.074 1.00 9.80 H new ATOM 0 HD2 TYR B 99 -3.022 18.010 -1.211 1.00 9.79 H new ATOM 0 HE1 TYR B 99 -7.783 18.982 -0.451 1.00 10.36 H new ATOM 0 HE2 TYR B 99 -4.298 16.680 0.410 1.00 10.35 H new ATOM 0 HH TYR B 99 -6.245 16.327 1.385 1.00 11.34 H new ATOM 3322 N SER B 100 -2.165 20.268 -5.199 1.00 7.67 N ATOM 3323 CA SER B 100 -1.198 20.929 -6.058 1.00 7.55 C ATOM 3324 C SER B 100 -0.303 19.904 -6.743 1.00 7.32 C ATOM 3325 O SER B 100 0.797 20.233 -7.188 1.00 7.75 O ATOM 3326 CB SER B 100 -0.342 21.902 -5.241 1.00 7.45 C ATOM 3327 OG SER B 100 -0.787 21.974 -3.894 1.00 7.36 O ATOM 0 H SER B 100 -1.786 19.493 -4.655 1.00 7.67 H new ATOM 0 HA SER B 100 -1.741 21.486 -6.821 1.00 7.55 H new ATOM 0 HB2 SER B 100 0.700 21.582 -5.266 1.00 7.45 H new ATOM 0 HB3 SER B 100 -0.382 22.893 -5.693 1.00 7.45 H new ATOM 0 HG SER B 100 -0.357 21.267 -3.369 1.00 7.36 H new ATOM 3333 N ASP B 101 -0.785 18.659 -6.817 1.00 6.80 N ATOM 3334 CA ASP B 101 -0.032 17.570 -7.439 1.00 6.71 C ATOM 3335 C ASP B 101 1.264 17.321 -6.665 1.00 6.51 C ATOM 3336 O ASP B 101 2.291 16.930 -7.226 1.00 6.46 O ATOM 3337 CB ASP B 101 0.254 17.892 -8.914 1.00 7.30 C ATOM 3338 CG ASP B 101 0.813 16.712 -9.681 1.00 8.84 C ATOM 3339 OD1 ASP B 101 0.100 15.699 -9.827 1.00 8.97 O ATOM 3340 OD2 ASP B 101 1.968 16.797 -10.151 1.00 9.08 O ATOM 0 H ASP B 101 -1.696 18.382 -6.452 1.00 6.80 H new ATOM 0 HA ASP B 101 -0.629 16.659 -7.406 1.00 6.71 H new ATOM 0 HB2 ASP B 101 -0.667 18.225 -9.392 1.00 7.30 H new ATOM 0 HB3 ASP B 101 0.960 18.721 -8.969 1.00 7.30 H new ATOM 3345 N GLU B 102 1.199 17.538 -5.360 1.00 6.62 N ATOM 3346 CA GLU B 102 2.353 17.356 -4.499 1.00 6.76 C ATOM 3347 C GLU B 102 2.473 15.904 -4.056 1.00 6.49 C ATOM 3348 O GLU B 102 1.472 15.248 -3.767 1.00 6.08 O ATOM 3349 CB GLU B 102 2.261 18.274 -3.274 1.00 6.92 C ATOM 3350 CG GLU B 102 1.031 18.034 -2.408 1.00 7.00 C ATOM 3351 CD GLU B 102 -0.157 18.875 -2.825 1.00 7.52 C ATOM 3352 OE1 GLU B 102 -0.915 18.447 -3.718 1.00 7.71 O ATOM 3353 OE2 GLU B 102 -0.335 19.974 -2.260 1.00 7.71 O ATOM 0 H GLU B 102 0.355 17.841 -4.875 1.00 6.62 H new ATOM 0 HA GLU B 102 3.244 17.619 -5.069 1.00 6.76 H new ATOM 0 HB2 GLU B 102 3.154 18.138 -2.664 1.00 6.92 H new ATOM 0 HB3 GLU B 102 2.259 19.311 -3.610 1.00 6.92 H new ATOM 0 HG2 GLU B 102 0.758 16.980 -2.457 1.00 7.00 H new ATOM 0 HG3 GLU B 102 1.277 18.252 -1.369 1.00 7.00 H new ATOM 3360 N ILE B 103 3.696 15.404 -4.011 1.00 6.89 N ATOM 3361 CA ILE B 103 3.941 14.031 -3.600 1.00 6.86 C ATOM 3362 C ILE B 103 4.030 13.949 -2.082 1.00 6.92 C ATOM 3363 O ILE B 103 4.905 14.570 -1.475 1.00 6.97 O ATOM 3364 CB ILE B 103 5.247 13.478 -4.211 1.00 7.13 C ATOM 3365 CG1 ILE B 103 5.303 13.777 -5.711 1.00 7.47 C ATOM 3366 CG2 ILE B 103 5.357 11.980 -3.962 1.00 6.71 C ATOM 3367 CD1 ILE B 103 6.657 13.515 -6.331 1.00 8.04 C ATOM 0 H ILE B 103 4.536 15.929 -4.254 1.00 6.89 H new ATOM 0 HA ILE B 103 3.108 13.428 -3.961 1.00 6.86 H new ATOM 0 HB ILE B 103 6.091 13.971 -3.729 1.00 7.13 H new ATOM 0 HG12 ILE B 103 4.555 13.170 -6.222 1.00 7.47 H new ATOM 0 HG13 ILE B 103 5.033 14.820 -5.875 1.00 7.47 H new ATOM 0 HG21 ILE B 103 6.283 11.606 -4.399 1.00 6.71 H new ATOM 0 HG22 ILE B 103 5.359 11.789 -2.889 1.00 6.71 H new ATOM 0 HG23 ILE B 103 4.508 11.472 -4.420 1.00 6.71 H new ATOM 0 HD11 ILE B 103 6.621 13.749 -7.395 1.00 8.04 H new ATOM 0 HD12 ILE B 103 7.406 14.141 -5.847 1.00 8.04 H new ATOM 0 HD13 ILE B 103 6.921 12.466 -6.199 1.00 8.04 H new ATOM 3379 N GLU B 104 3.118 13.204 -1.470 1.00 7.07 N ATOM 3380 CA GLU B 104 3.117 13.059 -0.020 1.00 7.39 C ATOM 3381 C GLU B 104 4.230 12.111 0.411 1.00 7.24 C ATOM 3382 O GLU B 104 4.990 12.406 1.333 1.00 7.56 O ATOM 3383 CB GLU B 104 1.754 12.567 0.492 1.00 7.11 C ATOM 3384 CG GLU B 104 1.081 11.523 -0.393 1.00 7.06 C ATOM 3385 CD GLU B 104 -0.243 11.038 0.173 1.00 8.47 C ATOM 3386 OE1 GLU B 104 -0.863 11.770 0.978 1.00 8.81 O ATOM 3387 OE2 GLU B 104 -0.669 9.919 -0.177 1.00 8.35 O ATOM 0 H GLU B 104 2.376 12.695 -1.950 1.00 7.07 H new ATOM 0 HA GLU B 104 3.298 14.039 0.421 1.00 7.39 H new ATOM 0 HB2 GLU B 104 1.885 12.148 1.490 1.00 7.11 H new ATOM 0 HB3 GLU B 104 1.087 13.424 0.591 1.00 7.11 H new ATOM 0 HG2 GLU B 104 0.915 11.946 -1.384 1.00 7.06 H new ATOM 0 HG3 GLU B 104 1.751 10.672 -0.518 1.00 7.06 H new ATOM 3394 N TYR B 105 4.328 10.985 -0.280 1.00 6.81 N ATOM 3395 CA TYR B 105 5.344 9.983 0.004 1.00 6.65 C ATOM 3396 C TYR B 105 5.432 9.001 -1.155 1.00 5.83 C ATOM 3397 O TYR B 105 4.616 9.045 -2.079 1.00 5.31 O ATOM 3398 CB TYR B 105 5.046 9.235 1.316 1.00 7.23 C ATOM 3399 CG TYR B 105 3.602 8.803 1.474 1.00 7.06 C ATOM 3400 CD1 TYR B 105 3.107 7.682 0.819 1.00 6.65 C ATOM 3401 CD2 TYR B 105 2.733 9.526 2.280 1.00 7.40 C ATOM 3402 CE1 TYR B 105 1.787 7.298 0.960 1.00 6.52 C ATOM 3403 CE2 TYR B 105 1.415 9.146 2.428 1.00 7.32 C ATOM 3404 CZ TYR B 105 0.946 8.034 1.767 1.00 6.94 C ATOM 3405 OH TYR B 105 -0.375 7.666 1.901 1.00 6.84 O ATOM 0 H TYR B 105 3.707 10.741 -1.051 1.00 6.81 H new ATOM 0 HA TYR B 105 6.301 10.491 0.124 1.00 6.65 H new ATOM 0 HB2 TYR B 105 5.685 8.353 1.371 1.00 7.23 H new ATOM 0 HB3 TYR B 105 5.315 9.876 2.155 1.00 7.23 H new ATOM 0 HD1 TYR B 105 3.765 7.101 0.189 1.00 6.65 H new ATOM 0 HD2 TYR B 105 3.095 10.401 2.800 1.00 7.40 H new ATOM 0 HE1 TYR B 105 1.416 6.426 0.441 1.00 6.52 H new ATOM 0 HE2 TYR B 105 0.754 9.719 3.061 1.00 7.32 H new ATOM 0 HH TYR B 105 -0.932 8.233 1.328 1.00 6.84 H new ATOM 3415 N ILE B 106 6.419 8.124 -1.107 1.00 5.84 N ATOM 3416 CA ILE B 106 6.602 7.133 -2.149 1.00 5.13 C ATOM 3417 C ILE B 106 6.182 5.762 -1.641 1.00 4.98 C ATOM 3418 O ILE B 106 6.775 5.226 -0.700 1.00 5.41 O ATOM 3419 CB ILE B 106 8.066 7.079 -2.641 1.00 5.45 C ATOM 3420 CG1 ILE B 106 8.539 8.477 -3.051 1.00 6.30 C ATOM 3421 CG2 ILE B 106 8.193 6.110 -3.811 1.00 4.84 C ATOM 3422 CD1 ILE B 106 9.992 8.538 -3.476 1.00 6.78 C ATOM 0 H ILE B 106 7.107 8.079 -0.355 1.00 5.84 H new ATOM 0 HA ILE B 106 5.976 7.423 -2.993 1.00 5.13 H new ATOM 0 HB ILE B 106 8.697 6.724 -1.826 1.00 5.45 H new ATOM 0 HG12 ILE B 106 7.916 8.834 -3.871 1.00 6.30 H new ATOM 0 HG13 ILE B 106 8.387 9.160 -2.215 1.00 6.30 H new ATOM 0 HG21 ILE B 106 9.229 6.081 -4.149 1.00 4.84 H new ATOM 0 HG22 ILE B 106 7.887 5.113 -3.493 1.00 4.84 H new ATOM 0 HG23 ILE B 106 7.554 6.442 -4.629 1.00 4.84 H new ATOM 0 HD11 ILE B 106 10.248 9.561 -3.751 1.00 6.78 H new ATOM 0 HD12 ILE B 106 10.626 8.214 -2.651 1.00 6.78 H new ATOM 0 HD13 ILE B 106 10.148 7.883 -4.333 1.00 6.78 H new ATOM 3434 N ILE B 107 5.146 5.214 -2.255 1.00 4.66 N ATOM 3435 CA ILE B 107 4.630 3.907 -1.886 1.00 4.86 C ATOM 3436 C ILE B 107 5.463 2.822 -2.545 1.00 4.29 C ATOM 3437 O ILE B 107 5.365 2.600 -3.746 1.00 3.98 O ATOM 3438 CB ILE B 107 3.158 3.749 -2.315 1.00 5.29 C ATOM 3439 CG1 ILE B 107 2.299 4.833 -1.662 1.00 6.01 C ATOM 3440 CG2 ILE B 107 2.642 2.361 -1.962 1.00 5.80 C ATOM 3441 CD1 ILE B 107 0.911 4.935 -2.246 1.00 6.31 C ATOM 0 H ILE B 107 4.641 5.661 -3.020 1.00 4.66 H new ATOM 0 HA ILE B 107 4.687 3.814 -0.801 1.00 4.86 H new ATOM 0 HB ILE B 107 3.095 3.865 -3.397 1.00 5.29 H new ATOM 0 HG12 ILE B 107 2.221 4.629 -0.594 1.00 6.01 H new ATOM 0 HG13 ILE B 107 2.800 5.795 -1.767 1.00 6.01 H new ATOM 0 HG21 ILE B 107 1.601 2.270 -2.273 1.00 5.80 H new ATOM 0 HG22 ILE B 107 3.241 1.609 -2.475 1.00 5.80 H new ATOM 0 HG23 ILE B 107 2.713 2.209 -0.885 1.00 5.80 H new ATOM 0 HD11 ILE B 107 0.358 5.724 -1.735 1.00 6.31 H new ATOM 0 HD12 ILE B 107 0.980 5.169 -3.308 1.00 6.31 H new ATOM 0 HD13 ILE B 107 0.391 3.986 -2.117 1.00 6.31 H new ATOM 3453 N CYS B 108 6.293 2.164 -1.765 1.00 4.36 N ATOM 3454 CA CYS B 108 7.148 1.122 -2.297 1.00 4.09 C ATOM 3455 C CYS B 108 6.693 -0.264 -1.863 1.00 4.49 C ATOM 3456 O CYS B 108 6.970 -0.698 -0.746 1.00 5.31 O ATOM 3457 CB CYS B 108 8.590 1.362 -1.864 1.00 3.74 C ATOM 3458 SG CYS B 108 9.363 2.792 -2.651 1.00 3.04 S ATOM 0 H CYS B 108 6.395 2.330 -0.764 1.00 4.36 H new ATOM 0 HA CYS B 108 7.082 1.162 -3.384 1.00 4.09 H new ATOM 0 HB2 CYS B 108 8.617 1.496 -0.783 1.00 3.74 H new ATOM 0 HB3 CYS B 108 9.179 0.473 -2.089 1.00 3.74 H new ATOM 0 HG CYS B 108 9.854 3.577 -1.738 1.00 3.04 H new ATOM 3464 N THR B 109 5.977 -0.948 -2.740 1.00 4.08 N ATOM 3465 CA THR B 109 5.526 -2.297 -2.458 1.00 4.65 C ATOM 3466 C THR B 109 6.715 -3.244 -2.606 1.00 5.11 C ATOM 3467 O THR B 109 7.172 -3.522 -3.718 1.00 5.24 O ATOM 3468 CB THR B 109 4.373 -2.721 -3.393 1.00 5.03 C ATOM 3469 OG1 THR B 109 3.255 -1.834 -3.227 1.00 4.85 O ATOM 3470 CG2 THR B 109 3.929 -4.150 -3.106 1.00 5.48 C ATOM 0 H THR B 109 5.696 -0.590 -3.653 1.00 4.08 H new ATOM 0 HA THR B 109 5.137 -2.337 -1.440 1.00 4.65 H new ATOM 0 HB THR B 109 4.737 -2.669 -4.419 1.00 5.03 H new ATOM 0 HG1 THR B 109 2.491 -2.334 -2.870 1.00 4.85 H new ATOM 0 HG21 THR B 109 3.116 -4.421 -3.780 1.00 5.48 H new ATOM 0 HG22 THR B 109 4.768 -4.829 -3.258 1.00 5.48 H new ATOM 0 HG23 THR B 109 3.585 -4.224 -2.074 1.00 5.48 H new ATOM 3478 N ASN B 110 7.229 -3.700 -1.477 1.00 5.49 N ATOM 3479 CA ASN B 110 8.388 -4.578 -1.446 1.00 6.04 C ATOM 3480 C ASN B 110 8.003 -6.023 -1.700 1.00 6.71 C ATOM 3481 O ASN B 110 7.504 -6.709 -0.810 1.00 6.90 O ATOM 3482 CB ASN B 110 9.089 -4.458 -0.092 1.00 6.01 C ATOM 3483 CG ASN B 110 10.354 -3.627 -0.161 1.00 6.09 C ATOM 3484 OD1 ASN B 110 11.121 -3.722 -1.116 1.00 6.05 O ATOM 3485 ND2 ASN B 110 10.577 -2.791 0.844 1.00 6.27 N ATOM 0 H ASN B 110 6.855 -3.473 -0.555 1.00 5.49 H new ATOM 0 HA ASN B 110 9.065 -4.269 -2.242 1.00 6.04 H new ATOM 0 HB2 ASN B 110 8.404 -4.011 0.629 1.00 6.01 H new ATOM 0 HB3 ASN B 110 9.333 -5.455 0.276 1.00 6.01 H new ATOM 0 HD21 ASN B 110 11.408 -2.200 0.841 1.00 6.27 H new ATOM 0 HD22 ASN B 110 9.917 -2.739 1.620 1.00 6.27 H new ATOM 3492 N THR B 111 8.230 -6.472 -2.919 1.00 7.16 N ATOM 3493 CA THR B 111 7.927 -7.838 -3.304 1.00 7.90 C ATOM 3494 C THR B 111 9.199 -8.676 -3.324 1.00 8.33 C ATOM 3495 O THR B 111 10.043 -8.509 -4.203 1.00 8.01 O ATOM 3496 CB THR B 111 7.272 -7.879 -4.698 1.00 8.30 C ATOM 3497 OG1 THR B 111 6.191 -6.938 -4.753 1.00 8.18 O ATOM 3498 CG2 THR B 111 6.765 -9.278 -5.024 1.00 8.61 C ATOM 0 H THR B 111 8.627 -5.904 -3.667 1.00 7.16 H new ATOM 0 HA THR B 111 7.232 -8.248 -2.571 1.00 7.90 H new ATOM 0 HB THR B 111 8.024 -7.611 -5.440 1.00 8.30 H new ATOM 0 HG1 THR B 111 5.390 -7.380 -5.105 1.00 8.18 H new ATOM 0 HG21 THR B 111 6.308 -9.278 -6.013 1.00 8.61 H new ATOM 0 HG22 THR B 111 7.599 -9.980 -5.010 1.00 8.61 H new ATOM 0 HG23 THR B 111 6.025 -9.579 -4.282 1.00 8.61 H new ATOM 3506 N ASN B 112 9.351 -9.559 -2.347 1.00 9.14 N ATOM 3507 CA ASN B 112 10.531 -10.412 -2.280 1.00 9.70 C ATOM 3508 C ASN B 112 10.498 -11.456 -3.388 1.00 10.21 C ATOM 3509 O ASN B 112 9.458 -12.062 -3.653 1.00 10.32 O ATOM 3510 CB ASN B 112 10.642 -11.103 -0.915 1.00 10.52 C ATOM 3511 CG ASN B 112 11.595 -12.288 -0.943 1.00 11.13 C ATOM 3512 OD1 ASN B 112 11.176 -13.440 -1.046 1.00 11.84 O ATOM 3513 ND2 ASN B 112 12.888 -12.014 -0.861 1.00 10.90 N ATOM 0 H ASN B 112 8.678 -9.704 -1.594 1.00 9.14 H new ATOM 0 HA ASN B 112 11.406 -9.777 -2.414 1.00 9.70 H new ATOM 0 HB2 ASN B 112 10.984 -10.382 -0.172 1.00 10.52 H new ATOM 0 HB3 ASN B 112 9.655 -11.441 -0.600 1.00 10.52 H new ATOM 0 HD21 ASN B 112 13.572 -12.770 -0.882 1.00 10.90 H new ATOM 0 HD22 ASN B 112 13.200 -11.047 -0.776 1.00 10.90 H new ATOM 3520 N VAL B 113 11.635 -11.647 -4.040 1.00 10.57 N ATOM 3521 CA VAL B 113 11.743 -12.621 -5.113 1.00 11.22 C ATOM 3522 C VAL B 113 12.673 -13.754 -4.697 1.00 11.42 C ATOM 3523 O VAL B 113 12.303 -14.927 -4.752 1.00 11.44 O ATOM 3524 CB VAL B 113 12.269 -11.981 -6.415 1.00 11.03 C ATOM 3525 CG1 VAL B 113 12.242 -12.986 -7.553 1.00 11.77 C ATOM 3526 CG2 VAL B 113 11.460 -10.743 -6.775 1.00 10.85 C ATOM 0 H VAL B 113 12.497 -11.139 -3.843 1.00 10.57 H new ATOM 0 HA VAL B 113 10.743 -13.010 -5.304 1.00 11.22 H new ATOM 0 HB VAL B 113 13.302 -11.675 -6.250 1.00 11.03 H new ATOM 0 HG11 VAL B 113 12.616 -12.516 -8.462 1.00 11.77 H new ATOM 0 HG12 VAL B 113 12.871 -13.839 -7.300 1.00 11.77 H new ATOM 0 HG13 VAL B 113 11.219 -13.325 -7.715 1.00 11.77 H new ATOM 0 HG21 VAL B 113 11.849 -10.309 -7.696 1.00 10.85 H new ATOM 0 HG22 VAL B 113 10.415 -11.020 -6.917 1.00 10.85 H new ATOM 0 HG23 VAL B 113 11.535 -10.012 -5.970 1.00 10.85 H new ATOM 3536 N LYS B 114 13.874 -13.395 -4.271 1.00 11.62 N ATOM 3537 CA LYS B 114 14.858 -14.376 -3.840 1.00 11.92 C ATOM 3538 C LYS B 114 15.402 -13.994 -2.469 1.00 12.21 C ATOM 3539 O LYS B 114 14.626 -14.038 -1.491 1.00 12.68 O ATOM 3540 CB LYS B 114 16.004 -14.481 -4.853 1.00 12.06 C ATOM 3541 CG LYS B 114 15.552 -14.749 -6.278 1.00 11.92 C ATOM 3542 CD LYS B 114 16.736 -14.956 -7.209 1.00 12.03 C ATOM 3543 CE LYS B 114 17.453 -16.265 -6.920 1.00 11.97 C ATOM 3544 NZ LYS B 114 18.661 -16.434 -7.768 1.00 12.15 N ATOM 0 H LYS B 114 14.192 -12.427 -4.214 1.00 11.62 H new ATOM 0 HA LYS B 114 14.372 -15.349 -3.775 1.00 11.92 H new ATOM 0 HB2 LYS B 114 16.577 -13.554 -4.834 1.00 12.06 H new ATOM 0 HB3 LYS B 114 16.678 -15.279 -4.541 1.00 12.06 H new ATOM 0 HG2 LYS B 114 14.913 -15.632 -6.298 1.00 11.92 H new ATOM 0 HG3 LYS B 114 14.950 -13.912 -6.633 1.00 11.92 H new ATOM 0 HD2 LYS B 114 16.392 -14.950 -8.243 1.00 12.03 H new ATOM 0 HD3 LYS B 114 17.434 -14.126 -7.100 1.00 12.03 H new ATOM 0 HE2 LYS B 114 17.740 -16.297 -5.869 1.00 11.97 H new ATOM 0 HE3 LYS B 114 16.771 -17.098 -7.090 1.00 11.97 H new ATOM 0 HZ1 LYS B 114 19.121 -17.338 -7.540 1.00 12.15 H new ATOM 0 HZ2 LYS B 114 18.385 -16.429 -8.771 1.00 12.15 H new ATOM 0 HZ3 LYS B 114 19.324 -15.653 -7.587 1.00 12.15 H new TER 3558 LYS B 114