USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1112 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 132 THR OG1 : rot 136:sc= 1.04 USER MOD Set 1.2: A 133 LYS NZ :NH3+ 159:sc= 1.22 (180deg=0) USER MOD Set 2.1: A 16 TYR OH : rot -126:sc= -0.259 USER MOD Set 2.2: A 20 GLN : amide:sc= 0.26 K(o=0.67,f=-1.2) USER MOD Set 2.3: A 52 GLN : amide:sc= 0.666 K(o=0.67,f=-1.2) USER MOD Set 3.1: A 36 THR OG1 : rot -104:sc= 0.267 USER MOD Set 3.2: A 39 LYS NZ :NH3+ -178:sc= -2.75! (180deg=-3.24!) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.381 K(o=-0.38,f=-3.8!) USER MOD Single : A 9 SER OG : rot 76:sc= 0.996 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -75:sc= 0.691 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 76:sc=-0.00854 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 55 HIS : no HD1:sc= -0.436 X(o=-0.44,f=-0.045) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.919 X(o=-0.92,f=-0.92) USER MOD Single : A 62 MET CE :methyl -148:sc= -0.0623 (180deg=-0.564) USER MOD Single : A 65 LYS NZ :NH3+ -164:sc= -0.0333 (180deg=-0.286) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN :FLIP amide:sc= -2.06 F(o=-6.7!,f=-2.1) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 166:sc= 0 (180deg=-0.888) USER MOD Single : A 83 HIS :FLIP no HD1:sc= -0.0723 F(o=-1.7,f=-0.072) USER MOD Single : A 97 THR OG1 : rot 71:sc= 0.628 USER MOD Single : A 100 SER OG : rot -78:sc= 0.834 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= 0.46 K(o=0.46,f=-2.4!) USER MOD Single : A 110 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.081) USER MOD Single : A 111 THR OG1 : rot 79:sc= 0.726 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 114 GLN : amide:sc= -0.364 X(o=-0.36,f=-0.053) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 64:sc= 0.994 USER MOD Single : A 126 THR OG1 : rot 76:sc= -1.09 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -0.0427 X(o=-0.043,f=-0.0016) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 35 N ASP A 3 3.695 -3.196 -4.942 1.00 64.43 N ATOM 36 CA ASP A 3 4.380 -3.421 -6.216 1.00 73.11 C ATOM 37 C ASP A 3 3.425 -4.040 -7.254 1.00 65.41 C ATOM 38 O ASP A 3 2.431 -4.680 -6.898 1.00 1.40 O ATOM 39 CB ASP A 3 5.588 -4.339 -5.987 1.00 53.44 C ATOM 40 CG ASP A 3 6.453 -4.498 -7.226 1.00 73.22 C ATOM 41 OD1 ASP A 3 7.372 -3.675 -7.425 1.00 74.34 O ATOM 42 OD2 ASP A 3 6.221 -5.439 -8.004 1.00 42.02 O ATOM 0 HA ASP A 3 4.721 -2.462 -6.607 1.00 73.11 H new ATOM 0 HB2 ASP A 3 6.195 -3.937 -5.176 1.00 53.44 H new ATOM 0 HB3 ASP A 3 5.237 -5.320 -5.667 1.00 53.44 H new ATOM 47 N GLU A 4 3.737 -3.850 -8.536 1.00 42.43 N ATOM 48 CA GLU A 4 2.935 -4.412 -9.632 1.00 64.32 C ATOM 49 C GLU A 4 2.763 -5.932 -9.474 1.00 42.50 C ATOM 50 O GLU A 4 1.667 -6.471 -9.645 1.00 43.00 O ATOM 51 CB GLU A 4 3.606 -4.104 -10.979 1.00 32.41 C ATOM 52 CG GLU A 4 2.818 -4.590 -12.192 1.00 65.34 C ATOM 53 CD GLU A 4 3.564 -4.371 -13.495 1.00 55.43 C ATOM 54 OE1 GLU A 4 3.570 -3.231 -14.003 1.00 23.25 O ATOM 55 OE2 GLU A 4 4.158 -5.339 -14.015 1.00 34.25 O ATOM 0 H GLU A 4 4.544 -3.308 -8.846 1.00 42.43 H new ATOM 0 HA GLU A 4 1.947 -3.952 -9.600 1.00 64.32 H new ATOM 0 HB2 GLU A 4 3.753 -3.027 -11.062 1.00 32.41 H new ATOM 0 HB3 GLU A 4 4.595 -4.563 -10.994 1.00 32.41 H new ATOM 0 HG2 GLU A 4 2.598 -5.651 -12.077 1.00 65.34 H new ATOM 0 HG3 GLU A 4 1.862 -4.069 -12.233 1.00 65.34 H new ATOM 62 N LEU A 5 3.859 -6.608 -9.131 1.00 4.52 N ATOM 63 CA LEU A 5 3.856 -8.058 -8.896 1.00 43.31 C ATOM 64 C LEU A 5 2.895 -8.441 -7.758 1.00 51.43 C ATOM 65 O LEU A 5 2.258 -9.498 -7.792 1.00 10.21 O ATOM 66 CB LEU A 5 5.281 -8.524 -8.568 1.00 34.40 C ATOM 67 CG LEU A 5 5.451 -10.021 -8.266 1.00 73.02 C ATOM 68 CD1 LEU A 5 5.054 -10.874 -9.471 1.00 25.24 C ATOM 69 CD2 LEU A 5 6.889 -10.308 -7.843 1.00 50.03 C ATOM 0 H LEU A 5 4.772 -6.171 -9.008 1.00 4.52 H new ATOM 0 HA LEU A 5 3.507 -8.554 -9.802 1.00 43.31 H new ATOM 0 HB2 LEU A 5 5.927 -8.268 -9.408 1.00 34.40 H new ATOM 0 HB3 LEU A 5 5.637 -7.958 -7.707 1.00 34.40 H new ATOM 0 HG LEU A 5 4.786 -10.286 -7.444 1.00 73.02 H new ATOM 0 HD11 LEU A 5 5.184 -11.929 -9.229 1.00 25.24 H new ATOM 0 HD12 LEU A 5 4.010 -10.686 -9.722 1.00 25.24 H new ATOM 0 HD13 LEU A 5 5.684 -10.617 -10.322 1.00 25.24 H new ATOM 0 HD21 LEU A 5 7.001 -11.371 -7.631 1.00 50.03 H new ATOM 0 HD22 LEU A 5 7.568 -10.025 -8.647 1.00 50.03 H new ATOM 0 HD23 LEU A 5 7.127 -9.733 -6.948 1.00 50.03 H new ATOM 81 N TYR A 6 2.794 -7.574 -6.752 1.00 64.11 N ATOM 82 CA TYR A 6 1.871 -7.790 -5.634 1.00 34.12 C ATOM 83 C TYR A 6 0.415 -7.708 -6.120 1.00 63.50 C ATOM 84 O TYR A 6 -0.407 -8.554 -5.782 1.00 5.33 O ATOM 85 CB TYR A 6 2.122 -6.752 -4.527 1.00 15.02 C ATOM 86 CG TYR A 6 1.345 -7.001 -3.241 1.00 25.23 C ATOM 87 CD1 TYR A 6 0.030 -6.560 -3.088 1.00 65.34 C ATOM 88 CD2 TYR A 6 1.932 -7.674 -2.175 1.00 22.33 C ATOM 89 CE1 TYR A 6 -0.669 -6.787 -1.915 1.00 32.05 C ATOM 90 CE2 TYR A 6 1.240 -7.903 -1.002 1.00 40.35 C ATOM 91 CZ TYR A 6 -0.058 -7.459 -0.876 1.00 50.24 C ATOM 92 OH TYR A 6 -0.750 -7.691 0.293 1.00 22.42 O ATOM 0 H TYR A 6 3.339 -6.714 -6.686 1.00 64.11 H new ATOM 0 HA TYR A 6 2.046 -8.785 -5.226 1.00 34.12 H new ATOM 0 HB2 TYR A 6 3.187 -6.736 -4.296 1.00 15.02 H new ATOM 0 HB3 TYR A 6 1.864 -5.764 -4.907 1.00 15.02 H new ATOM 0 HD1 TYR A 6 -0.451 -6.033 -3.899 1.00 65.34 H new ATOM 0 HD2 TYR A 6 2.949 -8.025 -2.266 1.00 22.33 H new ATOM 0 HE1 TYR A 6 -1.687 -6.440 -1.814 1.00 32.05 H new ATOM 0 HE2 TYR A 6 1.715 -8.428 -0.186 1.00 40.35 H new ATOM 0 HH TYR A 6 -0.176 -8.177 0.922 1.00 22.42 H new ATOM 102 N ARG A 7 0.109 -6.683 -6.923 1.00 15.41 N ATOM 103 CA ARG A 7 -1.235 -6.523 -7.505 1.00 15.35 C ATOM 104 C ARG A 7 -1.602 -7.721 -8.395 1.00 23.51 C ATOM 105 O ARG A 7 -2.721 -8.232 -8.340 1.00 1.33 O ATOM 106 CB ARG A 7 -1.312 -5.225 -8.323 1.00 75.15 C ATOM 107 CG ARG A 7 -1.085 -3.958 -7.502 1.00 34.31 C ATOM 108 CD ARG A 7 -2.165 -3.769 -6.436 1.00 62.13 C ATOM 109 NE ARG A 7 -3.494 -3.611 -7.020 1.00 50.22 N ATOM 110 CZ ARG A 7 -4.606 -3.942 -6.420 1.00 70.22 C ATOM 111 NH1 ARG A 7 -4.599 -4.427 -5.221 1.00 44.14 N ATOM 112 NH2 ARG A 7 -5.734 -3.771 -7.023 1.00 31.11 N ATOM 0 H ARG A 7 0.770 -5.952 -7.186 1.00 15.41 H new ATOM 0 HA ARG A 7 -1.950 -6.474 -6.683 1.00 15.35 H new ATOM 0 HB2 ARG A 7 -0.570 -5.266 -9.121 1.00 75.15 H new ATOM 0 HB3 ARG A 7 -2.290 -5.166 -8.800 1.00 75.15 H new ATOM 0 HG2 ARG A 7 -0.107 -4.006 -7.023 1.00 34.31 H new ATOM 0 HG3 ARG A 7 -1.074 -3.093 -8.165 1.00 34.31 H new ATOM 0 HD2 ARG A 7 -2.165 -4.628 -5.765 1.00 62.13 H new ATOM 0 HD3 ARG A 7 -1.928 -2.893 -5.833 1.00 62.13 H new ATOM 0 HE ARG A 7 -3.558 -3.216 -7.958 1.00 50.22 H new ATOM 0 HH11 ARG A 7 -3.715 -4.557 -4.728 1.00 44.14 H new ATOM 0 HH12 ARG A 7 -5.477 -4.680 -4.768 1.00 44.14 H new ATOM 0 HH21 ARG A 7 -5.755 -3.379 -7.964 1.00 31.11 H new ATOM 0 HH22 ARG A 7 -6.605 -4.028 -6.558 1.00 31.11 H new ATOM 126 N GLN A 8 -0.644 -8.155 -9.215 1.00 12.11 N ATOM 127 CA GLN A 8 -0.816 -9.333 -10.077 1.00 31.13 C ATOM 128 C GLN A 8 -1.194 -10.574 -9.251 1.00 33.21 C ATOM 129 O GLN A 8 -2.211 -11.227 -9.502 1.00 15.21 O ATOM 130 CB GLN A 8 0.497 -9.595 -10.837 1.00 23.23 C ATOM 131 CG GLN A 8 0.515 -10.865 -11.692 1.00 71.34 C ATOM 132 CD GLN A 8 -0.271 -10.741 -12.989 1.00 23.13 C ATOM 133 OE1 GLN A 8 -1.273 -10.034 -13.073 1.00 41.41 O ATOM 134 NE2 GLN A 8 0.193 -11.417 -14.022 1.00 2.14 N ATOM 0 H GLN A 8 0.268 -7.706 -9.303 1.00 12.11 H new ATOM 0 HA GLN A 8 -1.625 -9.137 -10.781 1.00 31.13 H new ATOM 0 HB2 GLN A 8 0.702 -8.740 -11.481 1.00 23.23 H new ATOM 0 HB3 GLN A 8 1.311 -9.652 -10.114 1.00 23.23 H new ATOM 0 HG2 GLN A 8 1.549 -11.119 -11.927 1.00 71.34 H new ATOM 0 HG3 GLN A 8 0.108 -11.691 -11.109 1.00 71.34 H new ATOM 0 HE21 GLN A 8 1.027 -11.995 -13.920 1.00 2.14 H new ATOM 0 HE22 GLN A 8 -0.282 -11.362 -14.923 1.00 2.14 H new ATOM 143 N SER A 9 -0.377 -10.865 -8.241 1.00 24.33 N ATOM 144 CA SER A 9 -0.582 -12.036 -7.379 1.00 33.01 C ATOM 145 C SER A 9 -1.882 -11.919 -6.571 1.00 3.33 C ATOM 146 O SER A 9 -2.645 -12.879 -6.463 1.00 50.12 O ATOM 147 CB SER A 9 0.611 -12.201 -6.427 1.00 22.11 C ATOM 148 OG SER A 9 1.838 -12.274 -7.145 1.00 55.44 O ATOM 0 H SER A 9 0.439 -10.305 -7.995 1.00 24.33 H new ATOM 0 HA SER A 9 -0.662 -12.914 -8.020 1.00 33.01 H new ATOM 0 HB2 SER A 9 0.643 -11.362 -5.732 1.00 22.11 H new ATOM 0 HB3 SER A 9 0.481 -13.104 -5.831 1.00 22.11 H new ATOM 0 HG SER A 9 2.095 -11.377 -7.446 1.00 55.44 H new ATOM 154 N LEU A 10 -2.129 -10.734 -6.016 1.00 15.54 N ATOM 155 CA LEU A 10 -3.331 -10.480 -5.214 1.00 60.32 C ATOM 156 C LEU A 10 -4.612 -10.710 -6.029 1.00 15.20 C ATOM 157 O LEU A 10 -5.551 -11.338 -5.551 1.00 21.40 O ATOM 158 CB LEU A 10 -3.307 -9.047 -4.659 1.00 75.44 C ATOM 159 CG LEU A 10 -4.504 -8.661 -3.772 1.00 44.50 C ATOM 160 CD1 LEU A 10 -4.618 -9.600 -2.574 1.00 2.34 C ATOM 161 CD2 LEU A 10 -4.384 -7.211 -3.311 1.00 1.24 C ATOM 0 H LEU A 10 -1.510 -9.928 -6.106 1.00 15.54 H new ATOM 0 HA LEU A 10 -3.332 -11.186 -4.384 1.00 60.32 H new ATOM 0 HB2 LEU A 10 -2.392 -8.915 -4.082 1.00 75.44 H new ATOM 0 HB3 LEU A 10 -3.259 -8.352 -5.497 1.00 75.44 H new ATOM 0 HG LEU A 10 -5.413 -8.759 -4.366 1.00 44.50 H new ATOM 0 HD11 LEU A 10 -5.471 -9.307 -1.962 1.00 2.34 H new ATOM 0 HD12 LEU A 10 -4.757 -10.622 -2.925 1.00 2.34 H new ATOM 0 HD13 LEU A 10 -3.707 -9.542 -1.978 1.00 2.34 H new ATOM 0 HD21 LEU A 10 -5.239 -6.956 -2.685 1.00 1.24 H new ATOM 0 HD22 LEU A 10 -3.465 -7.086 -2.738 1.00 1.24 H new ATOM 0 HD23 LEU A 10 -4.362 -6.554 -4.180 1.00 1.24 H new ATOM 173 N GLU A 11 -4.637 -10.206 -7.262 1.00 15.01 N ATOM 174 CA GLU A 11 -5.783 -10.403 -8.160 1.00 71.14 C ATOM 175 C GLU A 11 -6.071 -11.901 -8.375 1.00 74.03 C ATOM 176 O GLU A 11 -7.202 -12.369 -8.198 1.00 23.24 O ATOM 177 CB GLU A 11 -5.507 -9.720 -9.513 1.00 41.52 C ATOM 178 CG GLU A 11 -6.551 -10.002 -10.594 1.00 52.45 C ATOM 179 CD GLU A 11 -7.888 -9.315 -10.350 1.00 11.22 C ATOM 180 OE1 GLU A 11 -8.607 -9.702 -9.409 1.00 71.13 O ATOM 181 OE2 GLU A 11 -8.247 -8.408 -11.129 1.00 42.24 O ATOM 0 H GLU A 11 -3.878 -9.657 -7.666 1.00 15.01 H new ATOM 0 HA GLU A 11 -6.662 -9.954 -7.697 1.00 71.14 H new ATOM 0 HB2 GLU A 11 -5.448 -8.643 -9.356 1.00 41.52 H new ATOM 0 HB3 GLU A 11 -4.531 -10.043 -9.876 1.00 41.52 H new ATOM 0 HG2 GLU A 11 -6.158 -9.680 -11.558 1.00 52.45 H new ATOM 0 HG3 GLU A 11 -6.712 -11.078 -10.659 1.00 52.45 H new ATOM 188 N ILE A 12 -5.031 -12.647 -8.742 1.00 23.33 N ATOM 189 CA ILE A 12 -5.151 -14.089 -8.994 1.00 74.24 C ATOM 190 C ILE A 12 -5.644 -14.845 -7.743 1.00 54.12 C ATOM 191 O ILE A 12 -6.644 -15.571 -7.787 1.00 31.14 O ATOM 192 CB ILE A 12 -3.789 -14.675 -9.451 1.00 23.31 C ATOM 193 CG1 ILE A 12 -3.282 -13.935 -10.703 1.00 61.41 C ATOM 194 CG2 ILE A 12 -3.907 -16.174 -9.722 1.00 11.40 C ATOM 195 CD1 ILE A 12 -1.904 -14.370 -11.161 1.00 2.12 C ATOM 0 H ILE A 12 -4.089 -12.278 -8.873 1.00 23.33 H new ATOM 0 HA ILE A 12 -5.888 -14.220 -9.786 1.00 74.24 H new ATOM 0 HB ILE A 12 -3.066 -14.533 -8.648 1.00 23.31 H new ATOM 0 HG12 ILE A 12 -3.990 -14.092 -11.517 1.00 61.41 H new ATOM 0 HG13 ILE A 12 -3.264 -12.865 -10.497 1.00 61.41 H new ATOM 0 HG21 ILE A 12 -2.940 -16.563 -10.041 1.00 11.40 H new ATOM 0 HG22 ILE A 12 -4.221 -16.685 -8.812 1.00 11.40 H new ATOM 0 HG23 ILE A 12 -4.644 -16.345 -10.507 1.00 11.40 H new ATOM 0 HD11 ILE A 12 -1.619 -13.803 -12.047 1.00 2.12 H new ATOM 0 HD12 ILE A 12 -1.182 -14.187 -10.365 1.00 2.12 H new ATOM 0 HD13 ILE A 12 -1.919 -15.433 -11.400 1.00 2.12 H new ATOM 207 N ILE A 13 -4.943 -14.654 -6.629 1.00 23.32 N ATOM 208 CA ILE A 13 -5.285 -15.314 -5.365 1.00 11.04 C ATOM 209 C ILE A 13 -6.686 -14.906 -4.866 1.00 45.42 C ATOM 210 O ILE A 13 -7.464 -15.748 -4.415 1.00 72.42 O ATOM 211 CB ILE A 13 -4.222 -14.996 -4.278 1.00 62.30 C ATOM 212 CG1 ILE A 13 -2.840 -15.505 -4.728 1.00 1.25 C ATOM 213 CG2 ILE A 13 -4.614 -15.603 -2.930 1.00 22.54 C ATOM 214 CD1 ILE A 13 -1.705 -15.147 -3.788 1.00 4.21 C ATOM 0 H ILE A 13 -4.128 -14.043 -6.573 1.00 23.32 H new ATOM 0 HA ILE A 13 -5.296 -16.388 -5.553 1.00 11.04 H new ATOM 0 HB ILE A 13 -4.172 -13.915 -4.150 1.00 62.30 H new ATOM 0 HG12 ILE A 13 -2.882 -16.589 -4.832 1.00 1.25 H new ATOM 0 HG13 ILE A 13 -2.620 -15.099 -5.715 1.00 1.25 H new ATOM 0 HG21 ILE A 13 -3.852 -15.365 -2.188 1.00 22.54 H new ATOM 0 HG22 ILE A 13 -5.572 -15.192 -2.611 1.00 22.54 H new ATOM 0 HG23 ILE A 13 -4.698 -16.685 -3.029 1.00 22.54 H new ATOM 0 HD11 ILE A 13 -0.769 -15.544 -4.180 1.00 4.21 H new ATOM 0 HD12 ILE A 13 -1.632 -14.063 -3.702 1.00 4.21 H new ATOM 0 HD13 ILE A 13 -1.897 -15.577 -2.805 1.00 4.21 H new ATOM 226 N SER A 14 -7.006 -13.615 -4.971 1.00 71.13 N ATOM 227 CA SER A 14 -8.309 -13.089 -4.521 1.00 35.53 C ATOM 228 C SER A 14 -9.480 -13.831 -5.175 1.00 35.21 C ATOM 229 O SER A 14 -10.366 -14.350 -4.487 1.00 62.14 O ATOM 230 CB SER A 14 -8.424 -11.586 -4.827 1.00 22.24 C ATOM 231 OG SER A 14 -9.699 -11.076 -4.462 1.00 51.33 O ATOM 0 H SER A 14 -6.384 -12.908 -5.364 1.00 71.13 H new ATOM 0 HA SER A 14 -8.360 -13.247 -3.444 1.00 35.53 H new ATOM 0 HB2 SER A 14 -7.646 -11.044 -4.289 1.00 22.24 H new ATOM 0 HB3 SER A 14 -8.254 -11.416 -5.890 1.00 22.24 H new ATOM 0 HG SER A 14 -9.739 -10.119 -4.668 1.00 51.33 H new ATOM 237 N ARG A 15 -9.477 -13.893 -6.506 1.00 53.24 N ATOM 238 CA ARG A 15 -10.561 -14.556 -7.240 1.00 54.12 C ATOM 239 C ARG A 15 -10.637 -16.053 -6.902 1.00 55.30 C ATOM 240 O ARG A 15 -11.728 -16.604 -6.761 1.00 34.22 O ATOM 241 CB ARG A 15 -10.404 -14.361 -8.755 1.00 3.11 C ATOM 242 CG ARG A 15 -10.372 -12.897 -9.184 1.00 62.51 C ATOM 243 CD ARG A 15 -10.476 -12.743 -10.698 1.00 12.53 C ATOM 244 NE ARG A 15 -10.235 -11.367 -11.124 1.00 41.12 N ATOM 245 CZ ARG A 15 -10.590 -10.883 -12.283 1.00 42.12 C ATOM 246 NH1 ARG A 15 -11.330 -11.577 -13.086 1.00 52.23 N ATOM 247 NH2 ARG A 15 -10.238 -9.683 -12.614 1.00 22.45 N ATOM 0 H ARG A 15 -8.745 -13.497 -7.096 1.00 53.24 H new ATOM 0 HA ARG A 15 -11.495 -14.090 -6.926 1.00 54.12 H new ATOM 0 HB2 ARG A 15 -9.484 -14.847 -9.082 1.00 3.11 H new ATOM 0 HB3 ARG A 15 -11.227 -14.862 -9.264 1.00 3.11 H new ATOM 0 HG2 ARG A 15 -11.193 -12.362 -8.708 1.00 62.51 H new ATOM 0 HG3 ARG A 15 -9.447 -12.437 -8.835 1.00 62.51 H new ATOM 0 HD2 ARG A 15 -9.756 -13.404 -11.180 1.00 12.53 H new ATOM 0 HD3 ARG A 15 -11.467 -13.057 -11.027 1.00 12.53 H new ATOM 0 HE ARG A 15 -9.758 -10.743 -10.473 1.00 41.12 H new ATOM 0 HH11 ARG A 15 -11.641 -12.510 -12.815 1.00 52.23 H new ATOM 0 HH12 ARG A 15 -11.603 -11.191 -13.990 1.00 52.23 H new ATOM 0 HH21 ARG A 15 -9.685 -9.118 -11.970 1.00 22.45 H new ATOM 0 HH22 ARG A 15 -10.514 -9.302 -13.519 1.00 22.45 H new ATOM 261 N TYR A 16 -9.479 -16.704 -6.755 1.00 45.45 N ATOM 262 CA TYR A 16 -9.442 -18.130 -6.397 1.00 53.51 C ATOM 263 C TYR A 16 -10.130 -18.390 -5.044 1.00 15.23 C ATOM 264 O TYR A 16 -10.973 -19.282 -4.919 1.00 2.22 O ATOM 265 CB TYR A 16 -7.995 -18.642 -6.356 1.00 5.44 C ATOM 266 CG TYR A 16 -7.889 -20.139 -6.120 1.00 30.41 C ATOM 267 CD1 TYR A 16 -8.371 -21.044 -7.060 1.00 54.14 C ATOM 268 CD2 TYR A 16 -7.310 -20.648 -4.962 1.00 42.41 C ATOM 269 CE1 TYR A 16 -8.278 -22.405 -6.852 1.00 71.11 C ATOM 270 CE2 TYR A 16 -7.214 -22.010 -4.749 1.00 21.32 C ATOM 271 CZ TYR A 16 -7.699 -22.883 -5.697 1.00 63.03 C ATOM 272 OH TYR A 16 -7.602 -24.241 -5.493 1.00 24.54 O ATOM 0 H TYR A 16 -8.562 -16.274 -6.876 1.00 45.45 H new ATOM 0 HA TYR A 16 -9.989 -18.674 -7.167 1.00 53.51 H new ATOM 0 HB2 TYR A 16 -7.504 -18.395 -7.297 1.00 5.44 H new ATOM 0 HB3 TYR A 16 -7.455 -18.119 -5.567 1.00 5.44 H new ATOM 0 HD1 TYR A 16 -8.826 -20.675 -7.968 1.00 54.14 H new ATOM 0 HD2 TYR A 16 -6.929 -19.966 -4.216 1.00 42.41 H new ATOM 0 HE1 TYR A 16 -8.658 -23.093 -7.592 1.00 71.11 H new ATOM 0 HE2 TYR A 16 -6.761 -22.388 -3.844 1.00 21.32 H new ATOM 0 HH TYR A 16 -8.000 -24.471 -4.628 1.00 24.54 H new ATOM 282 N LEU A 17 -9.773 -17.605 -4.031 1.00 2.32 N ATOM 283 CA LEU A 17 -10.401 -17.727 -2.710 1.00 12.42 C ATOM 284 C LEU A 17 -11.906 -17.414 -2.778 1.00 52.33 C ATOM 285 O LEU A 17 -12.716 -18.067 -2.118 1.00 33.50 O ATOM 286 CB LEU A 17 -9.704 -16.808 -1.690 1.00 15.42 C ATOM 287 CG LEU A 17 -8.416 -17.375 -1.054 1.00 73.32 C ATOM 288 CD1 LEU A 17 -7.392 -17.779 -2.112 1.00 71.12 C ATOM 289 CD2 LEU A 17 -7.809 -16.368 -0.081 1.00 5.41 C ATOM 0 H LEU A 17 -9.057 -16.881 -4.094 1.00 2.32 H new ATOM 0 HA LEU A 17 -10.287 -18.760 -2.381 1.00 12.42 H new ATOM 0 HB2 LEU A 17 -9.461 -15.867 -2.183 1.00 15.42 H new ATOM 0 HB3 LEU A 17 -10.411 -16.578 -0.893 1.00 15.42 H new ATOM 0 HG LEU A 17 -8.692 -18.274 -0.503 1.00 73.32 H new ATOM 0 HD11 LEU A 17 -6.501 -18.173 -1.624 1.00 71.12 H new ATOM 0 HD12 LEU A 17 -7.820 -18.545 -2.759 1.00 71.12 H new ATOM 0 HD13 LEU A 17 -7.123 -16.908 -2.710 1.00 71.12 H new ATOM 0 HD21 LEU A 17 -6.902 -16.786 0.357 1.00 5.41 H new ATOM 0 HD22 LEU A 17 -7.564 -15.449 -0.614 1.00 5.41 H new ATOM 0 HD23 LEU A 17 -8.526 -16.149 0.710 1.00 5.41 H new ATOM 301 N ARG A 18 -12.272 -16.425 -3.593 1.00 52.44 N ATOM 302 CA ARG A 18 -13.681 -16.064 -3.788 1.00 23.15 C ATOM 303 C ARG A 18 -14.475 -17.189 -4.479 1.00 12.14 C ATOM 304 O ARG A 18 -15.597 -17.501 -4.072 1.00 1.45 O ATOM 305 CB ARG A 18 -13.798 -14.764 -4.600 1.00 60.24 C ATOM 306 CG ARG A 18 -13.405 -13.502 -3.828 1.00 24.41 C ATOM 307 CD ARG A 18 -14.366 -13.210 -2.673 1.00 52.21 C ATOM 308 NE ARG A 18 -15.760 -13.145 -3.121 1.00 1.40 N ATOM 309 CZ ARG A 18 -16.732 -12.581 -2.451 1.00 4.14 C ATOM 310 NH1 ARG A 18 -16.502 -11.934 -1.353 1.00 62.32 N ATOM 311 NH2 ARG A 18 -17.937 -12.640 -2.909 1.00 62.45 N ATOM 0 H ARG A 18 -11.615 -15.858 -4.130 1.00 52.44 H new ATOM 0 HA ARG A 18 -14.113 -15.911 -2.799 1.00 23.15 H new ATOM 0 HB2 ARG A 18 -13.168 -14.845 -5.486 1.00 60.24 H new ATOM 0 HB3 ARG A 18 -14.826 -14.658 -4.948 1.00 60.24 H new ATOM 0 HG2 ARG A 18 -12.394 -13.617 -3.437 1.00 24.41 H new ATOM 0 HG3 ARG A 18 -13.389 -12.651 -4.509 1.00 24.41 H new ATOM 0 HD2 ARG A 18 -14.265 -13.985 -1.913 1.00 52.21 H new ATOM 0 HD3 ARG A 18 -14.092 -12.265 -2.203 1.00 52.21 H new ATOM 0 HE ARG A 18 -15.989 -13.570 -4.020 1.00 1.40 H new ATOM 0 HH11 ARG A 18 -15.550 -11.857 -0.996 1.00 62.32 H new ATOM 0 HH12 ARG A 18 -17.273 -11.501 -0.845 1.00 62.32 H new ATOM 0 HH21 ARG A 18 -18.126 -13.124 -3.787 1.00 62.45 H new ATOM 0 HH22 ARG A 18 -18.701 -12.203 -2.393 1.00 62.45 H new ATOM 325 N GLU A 19 -13.898 -17.806 -5.515 1.00 0.12 N ATOM 326 CA GLU A 19 -14.601 -18.857 -6.263 1.00 44.13 C ATOM 327 C GLU A 19 -14.769 -20.130 -5.424 1.00 64.23 C ATOM 328 O GLU A 19 -15.812 -20.777 -5.470 1.00 42.52 O ATOM 329 CB GLU A 19 -13.890 -19.199 -7.585 1.00 74.30 C ATOM 330 CG GLU A 19 -12.556 -19.928 -7.425 1.00 21.01 C ATOM 331 CD GLU A 19 -12.232 -20.818 -8.616 1.00 61.21 C ATOM 332 OE1 GLU A 19 -12.775 -21.941 -8.677 1.00 24.53 O ATOM 333 OE2 GLU A 19 -11.449 -20.405 -9.494 1.00 15.02 O ATOM 0 H GLU A 19 -12.958 -17.601 -5.853 1.00 0.12 H new ATOM 0 HA GLU A 19 -15.588 -18.457 -6.497 1.00 44.13 H new ATOM 0 HB2 GLU A 19 -14.555 -19.816 -8.190 1.00 74.30 H new ATOM 0 HB3 GLU A 19 -13.719 -18.276 -8.139 1.00 74.30 H new ATOM 0 HG2 GLU A 19 -11.759 -19.196 -7.295 1.00 21.01 H new ATOM 0 HG3 GLU A 19 -12.583 -20.534 -6.519 1.00 21.01 H new ATOM 340 N GLN A 20 -13.740 -20.486 -4.655 1.00 31.04 N ATOM 341 CA GLN A 20 -13.803 -21.665 -3.785 1.00 12.24 C ATOM 342 C GLN A 20 -14.740 -21.429 -2.586 1.00 21.51 C ATOM 343 O GLN A 20 -15.323 -22.371 -2.046 1.00 3.12 O ATOM 344 CB GLN A 20 -12.399 -22.037 -3.288 1.00 61.42 C ATOM 345 CG GLN A 20 -11.438 -22.490 -4.388 1.00 62.24 C ATOM 346 CD GLN A 20 -11.928 -23.721 -5.134 1.00 15.24 C ATOM 347 OE1 GLN A 20 -11.704 -24.848 -4.706 1.00 74.02 O ATOM 348 NE2 GLN A 20 -12.573 -23.523 -6.267 1.00 42.43 N ATOM 0 H GLN A 20 -12.856 -19.979 -4.615 1.00 31.04 H new ATOM 0 HA GLN A 20 -14.206 -22.490 -4.373 1.00 12.24 H new ATOM 0 HB2 GLN A 20 -11.968 -21.176 -2.778 1.00 61.42 H new ATOM 0 HB3 GLN A 20 -12.488 -22.834 -2.549 1.00 61.42 H new ATOM 0 HG2 GLN A 20 -11.296 -21.675 -5.097 1.00 62.24 H new ATOM 0 HG3 GLN A 20 -10.464 -22.703 -3.947 1.00 62.24 H new ATOM 0 HE21 GLN A 20 -12.744 -22.573 -6.597 1.00 42.43 H new ATOM 0 HE22 GLN A 20 -12.901 -24.320 -6.813 1.00 42.43 H new ATOM 357 N ALA A 21 -14.873 -20.168 -2.172 1.00 3.41 N ATOM 358 CA ALA A 21 -15.770 -19.805 -1.068 1.00 23.04 C ATOM 359 C ALA A 21 -17.243 -19.794 -1.507 1.00 31.24 C ATOM 360 O ALA A 21 -18.119 -20.258 -0.779 1.00 62.20 O ATOM 361 CB ALA A 21 -15.379 -18.446 -0.492 1.00 32.12 C ATOM 0 H ALA A 21 -14.372 -19.380 -2.583 1.00 3.41 H new ATOM 0 HA ALA A 21 -15.663 -20.566 -0.295 1.00 23.04 H new ATOM 0 HB1 ALA A 21 -16.053 -18.190 0.326 1.00 32.12 H new ATOM 0 HB2 ALA A 21 -14.356 -18.490 -0.119 1.00 32.12 H new ATOM 0 HB3 ALA A 21 -15.449 -17.687 -1.271 1.00 32.12 H new ATOM 367 N THR A 22 -17.509 -19.257 -2.697 1.00 31.24 N ATOM 368 CA THR A 22 -18.882 -19.158 -3.221 1.00 20.00 C ATOM 369 C THR A 22 -19.298 -20.416 -4.000 1.00 32.20 C ATOM 370 O THR A 22 -20.475 -20.781 -4.036 1.00 25.44 O ATOM 371 CB THR A 22 -19.034 -17.936 -4.160 1.00 4.11 C ATOM 372 OG1 THR A 22 -18.161 -18.084 -5.296 1.00 33.51 O ATOM 373 CG2 THR A 22 -18.715 -16.631 -3.428 1.00 63.11 C ATOM 0 H THR A 22 -16.795 -18.882 -3.321 1.00 31.24 H new ATOM 0 HA THR A 22 -19.529 -19.047 -2.351 1.00 20.00 H new ATOM 0 HB THR A 22 -20.070 -17.892 -4.496 1.00 4.11 H new ATOM 0 HG1 THR A 22 -17.236 -17.910 -5.023 1.00 33.51 H new ATOM 0 HG21 THR A 22 -18.831 -15.792 -4.114 1.00 63.11 H new ATOM 0 HG22 THR A 22 -19.398 -16.509 -2.587 1.00 63.11 H new ATOM 0 HG23 THR A 22 -17.689 -16.661 -3.061 1.00 63.11 H new ATOM 381 N GLY A 23 -18.326 -21.076 -4.617 1.00 33.44 N ATOM 382 CA GLY A 23 -18.611 -22.217 -5.484 1.00 20.01 C ATOM 383 C GLY A 23 -18.792 -21.807 -6.946 1.00 42.31 C ATOM 384 O GLY A 23 -19.249 -22.602 -7.775 1.00 31.14 O ATOM 0 H GLY A 23 -17.336 -20.844 -4.535 1.00 33.44 H new ATOM 0 HA2 GLY A 23 -17.797 -22.938 -5.410 1.00 20.01 H new ATOM 0 HA3 GLY A 23 -19.514 -22.718 -5.135 1.00 20.01 H new ATOM 541 N GLY A 34 -2.980 -10.261 -18.907 1.00 34.44 N ATOM 542 CA GLY A 34 -4.150 -10.915 -19.489 1.00 11.44 C ATOM 543 C GLY A 34 -4.023 -12.438 -19.520 1.00 13.22 C ATOM 544 O GLY A 34 -4.620 -13.139 -18.700 1.00 5.05 O ATOM 0 HA2 GLY A 34 -5.036 -10.640 -18.917 1.00 11.44 H new ATOM 0 HA3 GLY A 34 -4.299 -10.547 -20.504 1.00 11.44 H new ATOM 548 N ALA A 35 -3.228 -12.954 -20.460 1.00 51.32 N ATOM 549 CA ALA A 35 -3.044 -14.403 -20.609 1.00 4.01 C ATOM 550 C ALA A 35 -2.331 -15.024 -19.398 1.00 62.04 C ATOM 551 O ALA A 35 -2.791 -16.021 -18.843 1.00 51.23 O ATOM 552 CB ALA A 35 -2.270 -14.709 -21.887 1.00 75.22 C ATOM 0 H ALA A 35 -2.701 -12.393 -21.129 1.00 51.32 H new ATOM 0 HA ALA A 35 -4.036 -14.851 -20.670 1.00 4.01 H new ATOM 0 HB1 ALA A 35 -2.141 -15.787 -21.985 1.00 75.22 H new ATOM 0 HB2 ALA A 35 -2.823 -14.330 -22.747 1.00 75.22 H new ATOM 0 HB3 ALA A 35 -1.292 -14.229 -21.844 1.00 75.22 H new ATOM 558 N THR A 36 -1.211 -14.425 -18.987 1.00 15.44 N ATOM 559 CA THR A 36 -0.412 -14.955 -17.870 1.00 62.25 C ATOM 560 C THR A 36 -1.212 -15.029 -16.569 1.00 12.14 C ATOM 561 O THR A 36 -1.268 -16.075 -15.922 1.00 75.35 O ATOM 562 CB THR A 36 0.869 -14.121 -17.621 1.00 62.24 C ATOM 563 OG1 THR A 36 1.734 -14.206 -18.761 1.00 61.22 O ATOM 564 CG2 THR A 36 1.612 -14.614 -16.380 1.00 52.33 C ATOM 0 H THR A 36 -0.834 -13.575 -19.407 1.00 15.44 H new ATOM 0 HA THR A 36 -0.129 -15.964 -18.170 1.00 62.25 H new ATOM 0 HB THR A 36 0.573 -13.084 -17.459 1.00 62.24 H new ATOM 0 HG1 THR A 36 2.475 -14.817 -18.565 1.00 61.22 H new ATOM 0 HG21 THR A 36 2.507 -14.011 -16.228 1.00 52.33 H new ATOM 0 HG22 THR A 36 0.963 -14.526 -15.509 1.00 52.33 H new ATOM 0 HG23 THR A 36 1.896 -15.657 -16.517 1.00 52.33 H new ATOM 572 N SER A 37 -1.831 -13.919 -16.197 1.00 2.52 N ATOM 573 CA SER A 37 -2.611 -13.843 -14.958 1.00 2.13 C ATOM 574 C SER A 37 -3.780 -14.836 -14.969 1.00 1.25 C ATOM 575 O SER A 37 -4.016 -15.546 -13.988 1.00 75.05 O ATOM 576 CB SER A 37 -3.139 -12.421 -14.769 1.00 50.22 C ATOM 577 OG SER A 37 -3.886 -12.019 -15.903 1.00 20.30 O ATOM 0 H SER A 37 -1.812 -13.052 -16.734 1.00 2.52 H new ATOM 0 HA SER A 37 -1.955 -14.106 -14.128 1.00 2.13 H new ATOM 0 HB2 SER A 37 -3.765 -12.374 -13.878 1.00 50.22 H new ATOM 0 HB3 SER A 37 -2.307 -11.735 -14.611 1.00 50.22 H new ATOM 0 HG SER A 37 -4.220 -11.107 -15.769 1.00 20.30 H new ATOM 583 N ARG A 38 -4.509 -14.892 -16.085 1.00 54.03 N ATOM 584 CA ARG A 38 -5.638 -15.817 -16.212 1.00 22.00 C ATOM 585 C ARG A 38 -5.182 -17.285 -16.179 1.00 65.24 C ATOM 586 O ARG A 38 -5.779 -18.100 -15.479 1.00 22.31 O ATOM 587 CB ARG A 38 -6.443 -15.548 -17.495 1.00 71.03 C ATOM 588 CG ARG A 38 -7.641 -16.494 -17.671 1.00 44.33 C ATOM 589 CD ARG A 38 -7.497 -17.395 -18.897 1.00 40.14 C ATOM 590 NE ARG A 38 -8.348 -18.583 -18.809 1.00 32.12 N ATOM 591 CZ ARG A 38 -8.544 -19.422 -19.790 1.00 62.12 C ATOM 592 NH1 ARG A 38 -8.033 -19.201 -20.960 1.00 55.31 N ATOM 593 NH2 ARG A 38 -9.258 -20.482 -19.595 1.00 75.02 N ATOM 0 H ARG A 38 -4.341 -14.313 -16.908 1.00 54.03 H new ATOM 0 HA ARG A 38 -6.283 -15.641 -15.351 1.00 22.00 H new ATOM 0 HB2 ARG A 38 -6.801 -14.519 -17.482 1.00 71.03 H new ATOM 0 HB3 ARG A 38 -5.783 -15.645 -18.357 1.00 71.03 H new ATOM 0 HG2 ARG A 38 -7.746 -17.112 -16.780 1.00 44.33 H new ATOM 0 HG3 ARG A 38 -8.554 -15.906 -17.761 1.00 44.33 H new ATOM 0 HD2 ARG A 38 -7.754 -16.831 -19.793 1.00 40.14 H new ATOM 0 HD3 ARG A 38 -6.456 -17.702 -19.001 1.00 40.14 H new ATOM 0 HE ARG A 38 -8.819 -18.767 -17.923 1.00 32.12 H new ATOM 0 HH11 ARG A 38 -7.471 -18.365 -21.122 1.00 55.31 H new ATOM 0 HH12 ARG A 38 -8.192 -19.863 -21.719 1.00 55.31 H new ATOM 0 HH21 ARG A 38 -9.666 -20.660 -18.677 1.00 75.02 H new ATOM 0 HH22 ARG A 38 -9.413 -21.140 -20.359 1.00 75.02 H new ATOM 607 N LYS A 39 -4.131 -17.630 -16.933 1.00 33.24 N ATOM 608 CA LYS A 39 -3.664 -19.020 -16.981 1.00 11.43 C ATOM 609 C LYS A 39 -3.080 -19.468 -15.632 1.00 64.34 C ATOM 610 O LYS A 39 -3.126 -20.651 -15.295 1.00 73.15 O ATOM 611 CB LYS A 39 -2.642 -19.227 -18.107 1.00 62.03 C ATOM 612 CG LYS A 39 -1.268 -18.607 -17.868 1.00 1.43 C ATOM 613 CD LYS A 39 -0.332 -18.915 -19.034 1.00 41.34 C ATOM 614 CE LYS A 39 1.148 -18.726 -18.691 1.00 60.44 C ATOM 615 NZ LYS A 39 1.506 -17.307 -18.426 1.00 44.22 N ATOM 0 H LYS A 39 -3.597 -16.979 -17.508 1.00 33.24 H new ATOM 0 HA LYS A 39 -4.533 -19.643 -17.192 1.00 11.43 H new ATOM 0 HB2 LYS A 39 -2.515 -20.298 -18.267 1.00 62.03 H new ATOM 0 HB3 LYS A 39 -3.053 -18.813 -19.028 1.00 62.03 H new ATOM 0 HG2 LYS A 39 -1.365 -17.528 -17.747 1.00 1.43 H new ATOM 0 HG3 LYS A 39 -0.844 -18.994 -16.942 1.00 1.43 H new ATOM 0 HD2 LYS A 39 -0.494 -19.943 -19.359 1.00 41.34 H new ATOM 0 HD3 LYS A 39 -0.588 -18.271 -19.875 1.00 41.34 H new ATOM 0 HE2 LYS A 39 1.392 -19.326 -17.814 1.00 60.44 H new ATOM 0 HE3 LYS A 39 1.757 -19.101 -19.514 1.00 60.44 H new ATOM 0 HZ1 LYS A 39 2.525 -17.236 -18.233 1.00 44.22 H new ATOM 0 HZ2 LYS A 39 1.270 -16.728 -19.257 1.00 44.22 H new ATOM 0 HZ3 LYS A 39 0.973 -16.963 -17.602 1.00 44.22 H new ATOM 629 N ALA A 40 -2.532 -18.524 -14.867 1.00 74.42 N ATOM 630 CA ALA A 40 -2.067 -18.810 -13.507 1.00 23.34 C ATOM 631 C ALA A 40 -3.244 -19.229 -12.613 1.00 5.33 C ATOM 632 O ALA A 40 -3.205 -20.274 -11.965 1.00 12.34 O ATOM 633 CB ALA A 40 -1.354 -17.595 -12.923 1.00 71.44 C ATOM 0 H ALA A 40 -2.399 -17.557 -15.163 1.00 74.42 H new ATOM 0 HA ALA A 40 -1.359 -19.637 -13.549 1.00 23.34 H new ATOM 0 HB1 ALA A 40 -1.015 -17.823 -11.913 1.00 71.44 H new ATOM 0 HB2 ALA A 40 -0.496 -17.343 -13.546 1.00 71.44 H new ATOM 0 HB3 ALA A 40 -2.041 -16.750 -12.893 1.00 71.44 H new ATOM 639 N LEU A 41 -4.298 -18.409 -12.604 1.00 65.13 N ATOM 640 CA LEU A 41 -5.538 -18.731 -11.881 1.00 72.51 C ATOM 641 C LEU A 41 -6.152 -20.047 -12.388 1.00 3.10 C ATOM 642 O LEU A 41 -6.567 -20.905 -11.604 1.00 25.13 O ATOM 643 CB LEU A 41 -6.551 -17.585 -12.049 1.00 1.21 C ATOM 644 CG LEU A 41 -7.916 -17.801 -11.370 1.00 42.43 C ATOM 645 CD1 LEU A 41 -7.754 -17.947 -9.861 1.00 35.32 C ATOM 646 CD2 LEU A 41 -8.875 -16.659 -11.707 1.00 43.21 C ATOM 0 H LEU A 41 -4.320 -17.513 -13.090 1.00 65.13 H new ATOM 0 HA LEU A 41 -5.295 -18.854 -10.826 1.00 72.51 H new ATOM 0 HB2 LEU A 41 -6.108 -16.671 -11.653 1.00 1.21 H new ATOM 0 HB3 LEU A 41 -6.716 -17.423 -13.114 1.00 1.21 H new ATOM 0 HG LEU A 41 -8.344 -18.727 -11.754 1.00 42.43 H new ATOM 0 HD11 LEU A 41 -8.731 -18.099 -9.403 1.00 35.32 H new ATOM 0 HD12 LEU A 41 -7.115 -18.803 -9.645 1.00 35.32 H new ATOM 0 HD13 LEU A 41 -7.299 -17.044 -9.455 1.00 35.32 H new ATOM 0 HD21 LEU A 41 -9.833 -16.832 -11.217 1.00 43.21 H new ATOM 0 HD22 LEU A 41 -8.454 -15.716 -11.359 1.00 43.21 H new ATOM 0 HD23 LEU A 41 -9.022 -16.614 -12.786 1.00 43.21 H new ATOM 658 N GLU A 42 -6.193 -20.195 -13.709 1.00 11.44 N ATOM 659 CA GLU A 42 -6.752 -21.386 -14.353 1.00 54.14 C ATOM 660 C GLU A 42 -6.003 -22.658 -13.915 1.00 54.41 C ATOM 661 O GLU A 42 -6.610 -23.701 -13.658 1.00 52.31 O ATOM 662 CB GLU A 42 -6.678 -21.229 -15.880 1.00 64.44 C ATOM 663 CG GLU A 42 -7.505 -22.248 -16.653 1.00 74.25 C ATOM 664 CD GLU A 42 -9.003 -22.078 -16.426 1.00 2.23 C ATOM 665 OE1 GLU A 42 -9.585 -21.112 -16.968 1.00 1.33 O ATOM 666 OE2 GLU A 42 -9.602 -22.897 -15.696 1.00 42.34 O ATOM 0 H GLU A 42 -5.842 -19.497 -14.364 1.00 11.44 H new ATOM 0 HA GLU A 42 -7.793 -21.487 -14.047 1.00 54.14 H new ATOM 0 HB2 GLU A 42 -7.014 -20.227 -16.148 1.00 64.44 H new ATOM 0 HB3 GLU A 42 -5.637 -21.310 -16.192 1.00 64.44 H new ATOM 0 HG2 GLU A 42 -7.289 -22.154 -17.717 1.00 74.25 H new ATOM 0 HG3 GLU A 42 -7.208 -23.253 -16.355 1.00 74.25 H new ATOM 673 N THR A 43 -4.677 -22.561 -13.824 1.00 53.24 N ATOM 674 CA THR A 43 -3.849 -23.681 -13.357 1.00 24.34 C ATOM 675 C THR A 43 -4.021 -23.901 -11.847 1.00 1.15 C ATOM 676 O THR A 43 -4.066 -25.040 -11.378 1.00 12.15 O ATOM 677 CB THR A 43 -2.349 -23.460 -13.676 1.00 54.32 C ATOM 678 OG1 THR A 43 -2.168 -23.295 -15.090 1.00 53.11 O ATOM 679 CG2 THR A 43 -1.493 -24.631 -13.193 1.00 43.34 C ATOM 0 H THR A 43 -4.151 -21.722 -14.066 1.00 53.24 H new ATOM 0 HA THR A 43 -4.189 -24.568 -13.892 1.00 24.34 H new ATOM 0 HB THR A 43 -2.029 -22.560 -13.150 1.00 54.32 H new ATOM 0 HG1 THR A 43 -2.461 -22.398 -15.355 1.00 53.11 H new ATOM 0 HG21 THR A 43 -0.447 -24.441 -13.434 1.00 43.34 H new ATOM 0 HG22 THR A 43 -1.603 -24.741 -12.114 1.00 43.34 H new ATOM 0 HG23 THR A 43 -1.818 -25.547 -13.686 1.00 43.34 H new ATOM 687 N LEU A 44 -4.135 -22.803 -11.092 1.00 2.21 N ATOM 688 CA LEU A 44 -4.361 -22.873 -9.641 1.00 44.14 C ATOM 689 C LEU A 44 -5.576 -23.738 -9.292 1.00 10.32 C ATOM 690 O LEU A 44 -5.501 -24.581 -8.408 1.00 72.21 O ATOM 691 CB LEU A 44 -4.544 -21.468 -9.041 1.00 12.03 C ATOM 692 CG LEU A 44 -3.248 -20.693 -8.759 1.00 31.13 C ATOM 693 CD1 LEU A 44 -3.559 -19.282 -8.267 1.00 24.44 C ATOM 694 CD2 LEU A 44 -2.390 -21.437 -7.736 1.00 42.42 C ATOM 0 H LEU A 44 -4.075 -21.854 -11.460 1.00 2.21 H new ATOM 0 HA LEU A 44 -3.474 -23.336 -9.209 1.00 44.14 H new ATOM 0 HB2 LEU A 44 -5.158 -20.879 -9.722 1.00 12.03 H new ATOM 0 HB3 LEU A 44 -5.101 -21.560 -8.109 1.00 12.03 H new ATOM 0 HG LEU A 44 -2.688 -20.616 -9.691 1.00 31.13 H new ATOM 0 HD11 LEU A 44 -2.627 -18.751 -8.073 1.00 24.44 H new ATOM 0 HD12 LEU A 44 -4.129 -18.749 -9.028 1.00 24.44 H new ATOM 0 HD13 LEU A 44 -4.143 -19.337 -7.348 1.00 24.44 H new ATOM 0 HD21 LEU A 44 -1.476 -20.873 -7.549 1.00 42.42 H new ATOM 0 HD22 LEU A 44 -2.946 -21.546 -6.805 1.00 42.42 H new ATOM 0 HD23 LEU A 44 -2.135 -22.423 -8.124 1.00 42.42 H new ATOM 706 N ARG A 45 -6.692 -23.526 -9.982 1.00 20.12 N ATOM 707 CA ARG A 45 -7.905 -24.311 -9.723 1.00 24.45 C ATOM 708 C ARG A 45 -7.779 -25.741 -10.280 1.00 71.01 C ATOM 709 O ARG A 45 -8.351 -26.684 -9.731 1.00 0.32 O ATOM 710 CB ARG A 45 -9.138 -23.592 -10.295 1.00 42.01 C ATOM 711 CG ARG A 45 -9.202 -23.544 -11.818 1.00 2.21 C ATOM 712 CD ARG A 45 -10.285 -22.581 -12.307 1.00 65.42 C ATOM 713 NE ARG A 45 -11.482 -22.629 -11.470 1.00 35.14 N ATOM 714 CZ ARG A 45 -12.502 -23.418 -11.669 1.00 34.14 C ATOM 715 NH1 ARG A 45 -12.529 -24.238 -12.669 1.00 43.13 N ATOM 716 NH2 ARG A 45 -13.497 -23.387 -10.850 1.00 74.31 N ATOM 0 H ARG A 45 -6.787 -22.826 -10.718 1.00 20.12 H new ATOM 0 HA ARG A 45 -8.031 -24.398 -8.644 1.00 24.45 H new ATOM 0 HB2 ARG A 45 -10.035 -24.088 -9.923 1.00 42.01 H new ATOM 0 HB3 ARG A 45 -9.156 -22.572 -9.912 1.00 42.01 H new ATOM 0 HG2 ARG A 45 -8.234 -23.235 -12.214 1.00 2.21 H new ATOM 0 HG3 ARG A 45 -9.401 -24.543 -12.206 1.00 2.21 H new ATOM 0 HD2 ARG A 45 -9.889 -21.565 -12.315 1.00 65.42 H new ATOM 0 HD3 ARG A 45 -10.552 -22.828 -13.335 1.00 65.42 H new ATOM 0 HE ARG A 45 -11.523 -21.998 -10.670 1.00 35.14 H new ATOM 0 HH11 ARG A 45 -11.744 -24.276 -13.319 1.00 43.13 H new ATOM 0 HH12 ARG A 45 -13.336 -24.847 -12.808 1.00 43.13 H new ATOM 0 HH21 ARG A 45 -13.483 -22.749 -10.054 1.00 74.31 H new ATOM 0 HH22 ARG A 45 -14.299 -24.000 -10.998 1.00 74.31 H new ATOM 730 N ARG A 46 -7.004 -25.897 -11.357 1.00 71.34 N ATOM 731 CA ARG A 46 -6.748 -27.216 -11.952 1.00 10.02 C ATOM 732 C ARG A 46 -5.995 -28.136 -10.975 1.00 44.32 C ATOM 733 O ARG A 46 -6.342 -29.306 -10.817 1.00 35.42 O ATOM 734 CB ARG A 46 -5.941 -27.055 -13.252 1.00 14.22 C ATOM 735 CG ARG A 46 -5.490 -28.365 -13.909 1.00 42.40 C ATOM 736 CD ARG A 46 -6.657 -29.210 -14.422 1.00 11.34 C ATOM 737 NE ARG A 46 -7.387 -29.883 -13.345 1.00 2.11 N ATOM 738 CZ ARG A 46 -8.505 -30.533 -13.513 1.00 65.25 C ATOM 739 NH1 ARG A 46 -9.044 -30.616 -14.688 1.00 72.31 N ATOM 740 NH2 ARG A 46 -9.074 -31.105 -12.503 1.00 34.43 N ATOM 0 H ARG A 46 -6.541 -25.125 -11.837 1.00 71.34 H new ATOM 0 HA ARG A 46 -7.709 -27.679 -12.175 1.00 10.02 H new ATOM 0 HB2 ARG A 46 -6.544 -26.497 -13.968 1.00 14.22 H new ATOM 0 HB3 ARG A 46 -5.059 -26.451 -13.040 1.00 14.22 H new ATOM 0 HG2 ARG A 46 -4.821 -28.137 -14.739 1.00 42.40 H new ATOM 0 HG3 ARG A 46 -4.916 -28.948 -13.188 1.00 42.40 H new ATOM 0 HD2 ARG A 46 -7.345 -28.572 -14.978 1.00 11.34 H new ATOM 0 HD3 ARG A 46 -6.279 -29.957 -15.121 1.00 11.34 H new ATOM 0 HE ARG A 46 -6.996 -29.841 -12.404 1.00 2.11 H new ATOM 0 HH11 ARG A 46 -8.594 -30.172 -15.488 1.00 72.31 H new ATOM 0 HH12 ARG A 46 -9.919 -31.126 -14.813 1.00 72.31 H new ATOM 0 HH21 ARG A 46 -8.648 -31.047 -11.578 1.00 34.43 H new ATOM 0 HH22 ARG A 46 -9.949 -31.614 -12.631 1.00 34.43 H new ATOM 754 N VAL A 47 -4.965 -27.603 -10.325 1.00 33.50 N ATOM 755 CA VAL A 47 -4.185 -28.379 -9.351 1.00 50.51 C ATOM 756 C VAL A 47 -4.754 -28.233 -7.930 1.00 54.25 C ATOM 757 O VAL A 47 -4.669 -29.154 -7.113 1.00 71.44 O ATOM 758 CB VAL A 47 -2.693 -27.958 -9.361 1.00 43.01 C ATOM 759 CG1 VAL A 47 -2.088 -28.166 -10.747 1.00 61.43 C ATOM 760 CG2 VAL A 47 -2.523 -26.505 -8.911 1.00 50.04 C ATOM 0 H VAL A 47 -4.648 -26.642 -10.450 1.00 33.50 H new ATOM 0 HA VAL A 47 -4.257 -29.425 -9.649 1.00 50.51 H new ATOM 0 HB VAL A 47 -2.161 -28.591 -8.651 1.00 43.01 H new ATOM 0 HG11 VAL A 47 -1.040 -27.865 -10.736 1.00 61.43 H new ATOM 0 HG12 VAL A 47 -2.160 -29.218 -11.021 1.00 61.43 H new ATOM 0 HG13 VAL A 47 -2.631 -27.563 -11.475 1.00 61.43 H new ATOM 0 HG21 VAL A 47 -1.466 -26.240 -8.929 1.00 50.04 H new ATOM 0 HG22 VAL A 47 -3.073 -25.849 -9.585 1.00 50.04 H new ATOM 0 HG23 VAL A 47 -2.909 -26.390 -7.898 1.00 50.04 H new ATOM 770 N GLY A 48 -5.350 -27.074 -7.658 1.00 52.41 N ATOM 771 CA GLY A 48 -5.914 -26.790 -6.345 1.00 21.20 C ATOM 772 C GLY A 48 -7.012 -27.764 -5.948 1.00 32.35 C ATOM 773 O GLY A 48 -7.036 -28.241 -4.815 1.00 61.04 O ATOM 0 H GLY A 48 -5.454 -26.316 -8.333 1.00 52.41 H new ATOM 0 HA2 GLY A 48 -5.120 -26.823 -5.599 1.00 21.20 H new ATOM 0 HA3 GLY A 48 -6.315 -25.776 -6.339 1.00 21.20 H new ATOM 777 N ASP A 49 -7.919 -28.064 -6.882 1.00 4.20 N ATOM 778 CA ASP A 49 -8.973 -29.055 -6.643 1.00 21.03 C ATOM 779 C ASP A 49 -8.381 -30.369 -6.106 1.00 50.20 C ATOM 780 O ASP A 49 -8.730 -30.819 -5.013 1.00 24.03 O ATOM 781 CB ASP A 49 -9.758 -29.312 -7.939 1.00 20.14 C ATOM 782 CG ASP A 49 -10.783 -30.428 -7.795 1.00 41.43 C ATOM 783 OD1 ASP A 49 -11.864 -30.187 -7.220 1.00 64.21 O ATOM 784 OD2 ASP A 49 -10.509 -31.556 -8.260 1.00 1.03 O ATOM 0 H ASP A 49 -7.945 -27.637 -7.808 1.00 4.20 H new ATOM 0 HA ASP A 49 -9.653 -28.658 -5.889 1.00 21.03 H new ATOM 0 HB2 ASP A 49 -10.265 -28.395 -8.239 1.00 20.14 H new ATOM 0 HB3 ASP A 49 -9.060 -29.566 -8.737 1.00 20.14 H new ATOM 789 N GLY A 50 -7.458 -30.956 -6.869 1.00 24.42 N ATOM 790 CA GLY A 50 -6.827 -32.212 -6.470 1.00 45.44 C ATOM 791 C GLY A 50 -6.137 -32.143 -5.108 1.00 30.01 C ATOM 792 O GLY A 50 -6.289 -33.048 -4.279 1.00 31.24 O ATOM 0 H GLY A 50 -7.133 -30.584 -7.761 1.00 24.42 H new ATOM 0 HA2 GLY A 50 -7.583 -32.997 -6.446 1.00 45.44 H new ATOM 0 HA3 GLY A 50 -6.095 -32.497 -7.225 1.00 45.44 H new ATOM 796 N VAL A 51 -5.381 -31.072 -4.873 1.00 11.43 N ATOM 797 CA VAL A 51 -4.700 -30.869 -3.587 1.00 22.21 C ATOM 798 C VAL A 51 -5.707 -30.729 -2.431 1.00 64.55 C ATOM 799 O VAL A 51 -5.522 -31.307 -1.356 1.00 52.24 O ATOM 800 CB VAL A 51 -3.777 -29.620 -3.634 1.00 51.11 C ATOM 801 CG1 VAL A 51 -3.162 -29.330 -2.264 1.00 4.25 C ATOM 802 CG2 VAL A 51 -2.683 -29.809 -4.686 1.00 52.35 C ATOM 0 H VAL A 51 -5.222 -30.329 -5.554 1.00 11.43 H new ATOM 0 HA VAL A 51 -4.088 -31.753 -3.406 1.00 22.21 H new ATOM 0 HB VAL A 51 -4.387 -28.760 -3.912 1.00 51.11 H new ATOM 0 HG11 VAL A 51 -2.522 -28.450 -2.331 1.00 4.25 H new ATOM 0 HG12 VAL A 51 -3.956 -29.146 -1.540 1.00 4.25 H new ATOM 0 HG13 VAL A 51 -2.569 -30.186 -1.943 1.00 4.25 H new ATOM 0 HG21 VAL A 51 -2.043 -28.927 -4.708 1.00 52.35 H new ATOM 0 HG22 VAL A 51 -2.084 -30.685 -4.435 1.00 52.35 H new ATOM 0 HG23 VAL A 51 -3.140 -29.951 -5.665 1.00 52.35 H new ATOM 812 N GLN A 52 -6.778 -29.976 -2.666 1.00 52.30 N ATOM 813 CA GLN A 52 -7.828 -29.775 -1.661 1.00 44.43 C ATOM 814 C GLN A 52 -8.596 -31.073 -1.362 1.00 75.54 C ATOM 815 O GLN A 52 -9.129 -31.240 -0.269 1.00 50.13 O ATOM 816 CB GLN A 52 -8.797 -28.668 -2.109 1.00 15.51 C ATOM 817 CG GLN A 52 -8.208 -27.261 -2.006 1.00 11.20 C ATOM 818 CD GLN A 52 -9.109 -26.177 -2.585 1.00 13.03 C ATOM 819 OE1 GLN A 52 -8.636 -25.152 -3.060 1.00 41.12 O ATOM 820 NE2 GLN A 52 -10.413 -26.387 -2.551 1.00 44.12 N ATOM 0 H GLN A 52 -6.946 -29.491 -3.547 1.00 52.30 H new ATOM 0 HA GLN A 52 -7.339 -29.466 -0.737 1.00 44.43 H new ATOM 0 HB2 GLN A 52 -9.095 -28.853 -3.141 1.00 15.51 H new ATOM 0 HB3 GLN A 52 -9.701 -28.720 -1.502 1.00 15.51 H new ATOM 0 HG2 GLN A 52 -8.010 -27.035 -0.958 1.00 11.20 H new ATOM 0 HG3 GLN A 52 -7.249 -27.239 -2.524 1.00 11.20 H new ATOM 0 HE21 GLN A 52 -10.780 -27.250 -2.150 1.00 44.12 H new ATOM 0 HE22 GLN A 52 -11.052 -25.686 -2.926 1.00 44.12 H new ATOM 829 N ARG A 53 -8.663 -31.986 -2.328 1.00 23.35 N ATOM 830 CA ARG A 53 -9.296 -33.294 -2.096 1.00 22.43 C ATOM 831 C ARG A 53 -8.525 -34.106 -1.038 1.00 14.23 C ATOM 832 O ARG A 53 -9.122 -34.725 -0.157 1.00 33.43 O ATOM 833 CB ARG A 53 -9.383 -34.104 -3.401 1.00 32.45 C ATOM 834 CG ARG A 53 -10.142 -33.407 -4.526 1.00 43.11 C ATOM 835 CD ARG A 53 -11.572 -33.066 -4.129 1.00 32.24 C ATOM 836 NE ARG A 53 -12.269 -32.328 -5.178 1.00 73.51 N ATOM 837 CZ ARG A 53 -13.564 -32.296 -5.319 1.00 71.20 C ATOM 838 NH1 ARG A 53 -14.341 -32.941 -4.502 1.00 64.13 N ATOM 839 NH2 ARG A 53 -14.077 -31.604 -6.278 1.00 2.33 N ATOM 0 H ARG A 53 -8.294 -31.853 -3.269 1.00 23.35 H new ATOM 0 HA ARG A 53 -10.304 -33.104 -1.728 1.00 22.43 H new ATOM 0 HB2 ARG A 53 -8.373 -34.327 -3.744 1.00 32.45 H new ATOM 0 HB3 ARG A 53 -9.866 -35.058 -3.190 1.00 32.45 H new ATOM 0 HG2 ARG A 53 -9.617 -32.494 -4.805 1.00 43.11 H new ATOM 0 HG3 ARG A 53 -10.154 -34.050 -5.406 1.00 43.11 H new ATOM 0 HD2 ARG A 53 -12.116 -33.985 -3.909 1.00 32.24 H new ATOM 0 HD3 ARG A 53 -11.563 -32.474 -3.214 1.00 32.24 H new ATOM 0 HE ARG A 53 -11.705 -31.802 -5.845 1.00 73.51 H new ATOM 0 HH11 ARG A 53 -13.939 -33.483 -3.737 1.00 64.13 H new ATOM 0 HH12 ARG A 53 -15.353 -32.906 -4.626 1.00 64.13 H new ATOM 0 HH21 ARG A 53 -13.471 -31.089 -6.916 1.00 2.33 H new ATOM 0 HH22 ARG A 53 -15.089 -31.571 -6.398 1.00 2.33 H new ATOM 853 N ASN A 54 -7.194 -34.087 -1.133 1.00 72.33 N ATOM 854 CA ASN A 54 -6.329 -34.868 -0.232 1.00 51.20 C ATOM 855 C ASN A 54 -6.057 -34.136 1.096 1.00 61.40 C ATOM 856 O ASN A 54 -6.209 -34.704 2.179 1.00 12.21 O ATOM 857 CB ASN A 54 -4.990 -35.161 -0.923 1.00 24.44 C ATOM 858 CG ASN A 54 -5.155 -35.864 -2.260 1.00 42.02 C ATOM 859 OD1 ASN A 54 -6.088 -36.631 -2.462 1.00 51.03 O ATOM 860 ND2 ASN A 54 -4.248 -35.610 -3.184 1.00 42.22 N ATOM 0 H ASN A 54 -6.685 -33.538 -1.826 1.00 72.33 H new ATOM 0 HA ASN A 54 -6.855 -35.795 -0.005 1.00 51.20 H new ATOM 0 HB2 ASN A 54 -4.453 -34.225 -1.075 1.00 24.44 H new ATOM 0 HB3 ASN A 54 -4.376 -35.778 -0.267 1.00 24.44 H new ATOM 0 HD21 ASN A 54 -4.312 -36.058 -4.098 1.00 42.22 H new ATOM 0 HD22 ASN A 54 -3.483 -34.966 -2.984 1.00 42.22 H new ATOM 867 N HIS A 55 -5.649 -32.872 0.997 1.00 12.23 N ATOM 868 CA HIS A 55 -5.198 -32.096 2.163 1.00 72.04 C ATOM 869 C HIS A 55 -6.352 -31.633 3.070 1.00 0.43 C ATOM 870 O HIS A 55 -6.129 -31.329 4.240 1.00 22.11 O ATOM 871 CB HIS A 55 -4.371 -30.886 1.708 1.00 3.34 C ATOM 872 CG HIS A 55 -3.021 -31.246 1.162 1.00 53.20 C ATOM 873 ND1 HIS A 55 -1.843 -30.866 1.768 1.00 31.51 N ATOM 874 CD2 HIS A 55 -2.658 -31.942 0.056 1.00 2.10 C ATOM 875 CE1 HIS A 55 -0.822 -31.307 1.065 1.00 24.31 C ATOM 876 NE2 HIS A 55 -1.286 -31.965 0.023 1.00 63.22 N ATOM 0 H HIS A 55 -5.620 -32.356 0.118 1.00 12.23 H new ATOM 0 HA HIS A 55 -4.580 -32.767 2.760 1.00 72.04 H new ATOM 0 HB2 HIS A 55 -4.928 -30.343 0.945 1.00 3.34 H new ATOM 0 HB3 HIS A 55 -4.242 -30.208 2.552 1.00 3.34 H new ATOM 0 HD2 HIS A 55 -3.324 -32.394 -0.664 1.00 2.10 H new ATOM 0 HE1 HIS A 55 0.221 -31.155 1.302 1.00 24.31 H new ATOM 0 HE2 HIS A 55 -0.718 -32.418 -0.693 1.00 63.22 H new ATOM 885 N GLU A 56 -7.574 -31.581 2.536 1.00 25.41 N ATOM 886 CA GLU A 56 -8.736 -31.084 3.293 1.00 61.20 C ATOM 887 C GLU A 56 -8.861 -31.757 4.667 1.00 42.24 C ATOM 888 O GLU A 56 -8.949 -31.081 5.693 1.00 42.30 O ATOM 889 CB GLU A 56 -10.019 -31.314 2.489 1.00 4.52 C ATOM 890 CG GLU A 56 -11.296 -30.910 3.216 1.00 44.31 C ATOM 891 CD GLU A 56 -12.532 -31.095 2.355 1.00 64.13 C ATOM 892 OE1 GLU A 56 -12.951 -32.252 2.145 1.00 13.13 O ATOM 893 OE2 GLU A 56 -13.074 -30.086 1.856 1.00 51.34 O ATOM 0 H GLU A 56 -7.789 -31.876 1.584 1.00 25.41 H new ATOM 0 HA GLU A 56 -8.586 -30.017 3.459 1.00 61.20 H new ATOM 0 HB2 GLU A 56 -9.954 -30.755 1.556 1.00 4.52 H new ATOM 0 HB3 GLU A 56 -10.084 -32.369 2.225 1.00 4.52 H new ATOM 0 HG2 GLU A 56 -11.397 -31.503 4.125 1.00 44.31 H new ATOM 0 HG3 GLU A 56 -11.222 -29.867 3.523 1.00 44.31 H new ATOM 900 N THR A 57 -8.854 -33.087 4.680 1.00 52.15 N ATOM 901 CA THR A 57 -8.958 -33.856 5.929 1.00 32.44 C ATOM 902 C THR A 57 -7.862 -33.461 6.938 1.00 44.32 C ATOM 903 O THR A 57 -8.106 -33.390 8.143 1.00 34.03 O ATOM 904 CB THR A 57 -8.881 -35.381 5.658 1.00 42.33 C ATOM 905 OG1 THR A 57 -9.043 -36.122 6.877 1.00 61.02 O ATOM 906 CG2 THR A 57 -7.557 -35.763 5.001 1.00 24.01 C ATOM 0 H THR A 57 -8.777 -33.661 3.840 1.00 52.15 H new ATOM 0 HA THR A 57 -9.930 -33.617 6.361 1.00 32.44 H new ATOM 0 HB THR A 57 -9.693 -35.631 4.975 1.00 42.33 H new ATOM 0 HG1 THR A 57 -8.993 -37.082 6.685 1.00 61.02 H new ATOM 0 HG21 THR A 57 -7.535 -36.838 4.825 1.00 24.01 H new ATOM 0 HG22 THR A 57 -7.457 -35.237 4.051 1.00 24.01 H new ATOM 0 HG23 THR A 57 -6.732 -35.486 5.657 1.00 24.01 H new ATOM 914 N ALA A 58 -6.662 -33.176 6.434 1.00 70.23 N ATOM 915 CA ALA A 58 -5.532 -32.786 7.284 1.00 54.23 C ATOM 916 C ALA A 58 -5.686 -31.346 7.804 1.00 35.14 C ATOM 917 O ALA A 58 -5.383 -31.055 8.965 1.00 3.52 O ATOM 918 CB ALA A 58 -4.223 -32.941 6.517 1.00 74.21 C ATOM 0 H ALA A 58 -6.444 -33.207 5.438 1.00 70.23 H new ATOM 0 HA ALA A 58 -5.518 -33.447 8.150 1.00 54.23 H new ATOM 0 HB1 ALA A 58 -3.390 -32.649 7.156 1.00 74.21 H new ATOM 0 HB2 ALA A 58 -4.100 -33.981 6.213 1.00 74.21 H new ATOM 0 HB3 ALA A 58 -4.242 -32.304 5.632 1.00 74.21 H new ATOM 924 N PHE A 59 -6.160 -30.447 6.939 1.00 41.22 N ATOM 925 CA PHE A 59 -6.403 -29.053 7.327 1.00 60.41 C ATOM 926 C PHE A 59 -7.535 -28.945 8.358 1.00 32.02 C ATOM 927 O PHE A 59 -7.463 -28.132 9.280 1.00 42.21 O ATOM 928 CB PHE A 59 -6.727 -28.191 6.099 1.00 3.33 C ATOM 929 CG PHE A 59 -5.556 -27.966 5.173 1.00 11.41 C ATOM 930 CD1 PHE A 59 -4.276 -27.781 5.680 1.00 50.02 C ATOM 931 CD2 PHE A 59 -5.740 -27.913 3.799 1.00 65.33 C ATOM 932 CE1 PHE A 59 -3.207 -27.553 4.835 1.00 31.12 C ATOM 933 CE2 PHE A 59 -4.672 -27.687 2.950 1.00 31.34 C ATOM 934 CZ PHE A 59 -3.405 -27.507 3.469 1.00 21.52 C ATOM 0 H PHE A 59 -6.383 -30.657 5.966 1.00 41.22 H new ATOM 0 HA PHE A 59 -5.487 -28.681 7.786 1.00 60.41 H new ATOM 0 HB2 PHE A 59 -7.533 -28.665 5.539 1.00 3.33 H new ATOM 0 HB3 PHE A 59 -7.100 -27.224 6.436 1.00 3.33 H new ATOM 0 HD1 PHE A 59 -4.115 -27.816 6.747 1.00 50.02 H new ATOM 0 HD2 PHE A 59 -6.729 -28.050 3.387 1.00 65.33 H new ATOM 0 HE1 PHE A 59 -2.217 -27.411 5.242 1.00 31.12 H new ATOM 0 HE2 PHE A 59 -4.829 -27.651 1.882 1.00 31.34 H new ATOM 0 HZ PHE A 59 -2.570 -27.330 2.807 1.00 21.52 H new ATOM 944 N GLN A 60 -8.572 -29.772 8.199 1.00 24.45 N ATOM 945 CA GLN A 60 -9.687 -29.827 9.160 1.00 12.45 C ATOM 946 C GLN A 60 -9.171 -29.941 10.603 1.00 4.03 C ATOM 947 O GLN A 60 -9.576 -29.179 11.478 1.00 42.13 O ATOM 948 CB GLN A 60 -10.613 -31.019 8.852 1.00 74.52 C ATOM 949 CG GLN A 60 -11.432 -30.872 7.569 1.00 71.30 C ATOM 950 CD GLN A 60 -12.515 -29.804 7.667 1.00 72.33 C ATOM 951 OE1 GLN A 60 -13.050 -29.537 8.737 1.00 35.14 O ATOM 952 NE2 GLN A 60 -12.853 -29.198 6.548 1.00 4.33 N ATOM 0 H GLN A 60 -8.666 -30.416 7.413 1.00 24.45 H new ATOM 0 HA GLN A 60 -10.250 -28.899 9.061 1.00 12.45 H new ATOM 0 HB2 GLN A 60 -10.008 -31.923 8.780 1.00 74.52 H new ATOM 0 HB3 GLN A 60 -11.296 -31.158 9.690 1.00 74.52 H new ATOM 0 HG2 GLN A 60 -10.763 -30.627 6.744 1.00 71.30 H new ATOM 0 HG3 GLN A 60 -11.895 -31.829 7.330 1.00 71.30 H new ATOM 0 HE21 GLN A 60 -12.388 -29.444 5.674 1.00 4.33 H new ATOM 0 HE22 GLN A 60 -13.580 -28.483 6.555 1.00 4.33 H new ATOM 961 N GLY A 61 -8.253 -30.884 10.829 1.00 11.14 N ATOM 962 CA GLY A 61 -7.687 -31.093 12.158 1.00 32.10 C ATOM 963 C GLY A 61 -7.084 -29.831 12.774 1.00 53.11 C ATOM 964 O GLY A 61 -7.127 -29.647 13.991 1.00 12.12 O ATOM 0 H GLY A 61 -7.889 -31.511 10.111 1.00 11.14 H new ATOM 0 HA2 GLY A 61 -8.466 -31.473 12.819 1.00 32.10 H new ATOM 0 HA3 GLY A 61 -6.916 -31.862 12.098 1.00 32.10 H new ATOM 968 N MET A 62 -6.534 -28.947 11.938 1.00 63.25 N ATOM 969 CA MET A 62 -5.949 -27.694 12.423 1.00 72.44 C ATOM 970 C MET A 62 -7.010 -26.593 12.466 1.00 0.01 C ATOM 971 O MET A 62 -6.960 -25.692 13.300 1.00 73.22 O ATOM 972 CB MET A 62 -4.779 -27.252 11.533 1.00 40.04 C ATOM 973 CG MET A 62 -3.675 -28.293 11.402 1.00 61.14 C ATOM 974 SD MET A 62 -2.172 -27.627 10.657 1.00 42.51 S ATOM 975 CE MET A 62 -2.804 -26.953 9.120 1.00 24.30 C ATOM 0 H MET A 62 -6.481 -29.074 10.927 1.00 63.25 H new ATOM 0 HA MET A 62 -5.572 -27.868 13.431 1.00 72.44 H new ATOM 0 HB2 MET A 62 -5.160 -27.014 10.540 1.00 40.04 H new ATOM 0 HB3 MET A 62 -4.353 -26.334 11.939 1.00 40.04 H new ATOM 0 HG2 MET A 62 -3.440 -28.693 12.388 1.00 61.14 H new ATOM 0 HG3 MET A 62 -4.036 -29.125 10.798 1.00 61.14 H new ATOM 0 HE1 MET A 62 -2.040 -27.032 8.347 1.00 24.30 H new ATOM 0 HE2 MET A 62 -3.689 -27.511 8.814 1.00 24.30 H new ATOM 0 HE3 MET A 62 -3.068 -25.905 9.263 1.00 24.30 H new ATOM 985 N LEU A 63 -7.979 -26.687 11.565 1.00 1.21 N ATOM 986 CA LEU A 63 -9.046 -25.696 11.465 1.00 63.23 C ATOM 987 C LEU A 63 -9.889 -25.664 12.746 1.00 13.54 C ATOM 988 O LEU A 63 -10.415 -24.619 13.134 1.00 41.50 O ATOM 989 CB LEU A 63 -9.942 -26.008 10.258 1.00 5.32 C ATOM 990 CG LEU A 63 -10.724 -24.809 9.709 1.00 11.54 C ATOM 991 CD1 LEU A 63 -9.757 -23.777 9.136 1.00 23.24 C ATOM 992 CD2 LEU A 63 -11.736 -25.257 8.656 1.00 52.03 C ATOM 0 H LEU A 63 -8.049 -27.446 10.887 1.00 1.21 H new ATOM 0 HA LEU A 63 -8.588 -24.716 11.331 1.00 63.23 H new ATOM 0 HB2 LEU A 63 -9.322 -26.416 9.459 1.00 5.32 H new ATOM 0 HB3 LEU A 63 -10.650 -26.787 10.541 1.00 5.32 H new ATOM 0 HG LEU A 63 -11.280 -24.348 10.525 1.00 11.54 H new ATOM 0 HD11 LEU A 63 -10.319 -22.928 8.748 1.00 23.24 H new ATOM 0 HD12 LEU A 63 -9.081 -23.437 9.921 1.00 23.24 H new ATOM 0 HD13 LEU A 63 -9.179 -24.228 8.330 1.00 23.24 H new ATOM 0 HD21 LEU A 63 -12.279 -24.389 8.281 1.00 52.03 H new ATOM 0 HD22 LEU A 63 -11.213 -25.742 7.832 1.00 52.03 H new ATOM 0 HD23 LEU A 63 -12.439 -25.960 9.103 1.00 52.03 H new ATOM 1004 N ARG A 64 -9.994 -26.819 13.404 1.00 22.21 N ATOM 1005 CA ARG A 64 -10.788 -26.956 14.632 1.00 22.24 C ATOM 1006 C ARG A 64 -10.171 -26.184 15.814 1.00 50.13 C ATOM 1007 O ARG A 64 -10.833 -25.954 16.827 1.00 2.23 O ATOM 1008 CB ARG A 64 -10.937 -28.438 15.003 1.00 42.14 C ATOM 1009 CG ARG A 64 -11.411 -29.313 13.847 1.00 12.25 C ATOM 1010 CD ARG A 64 -11.771 -30.721 14.304 1.00 4.25 C ATOM 1011 NE ARG A 64 -12.917 -30.718 15.209 1.00 62.30 N ATOM 1012 CZ ARG A 64 -13.157 -31.643 16.095 1.00 72.14 C ATOM 1013 NH1 ARG A 64 -12.353 -32.649 16.226 1.00 3.45 N ATOM 1014 NH2 ARG A 64 -14.203 -31.557 16.851 1.00 34.04 N ATOM 0 H ARG A 64 -9.537 -27.681 13.107 1.00 22.21 H new ATOM 0 HA ARG A 64 -11.769 -26.525 14.431 1.00 22.24 H new ATOM 0 HB2 ARG A 64 -9.978 -28.812 15.361 1.00 42.14 H new ATOM 0 HB3 ARG A 64 -11.643 -28.528 15.829 1.00 42.14 H new ATOM 0 HG2 ARG A 64 -12.279 -28.852 13.376 1.00 12.25 H new ATOM 0 HG3 ARG A 64 -10.629 -29.367 13.090 1.00 12.25 H new ATOM 0 HD2 ARG A 64 -11.995 -31.340 13.435 1.00 4.25 H new ATOM 0 HD3 ARG A 64 -10.914 -31.172 14.804 1.00 4.25 H new ATOM 0 HE ARG A 64 -13.573 -29.940 15.143 1.00 62.30 H new ATOM 0 HH11 ARG A 64 -11.526 -32.721 15.634 1.00 3.45 H new ATOM 0 HH12 ARG A 64 -12.547 -33.370 16.921 1.00 3.45 H new ATOM 0 HH21 ARG A 64 -14.839 -30.766 16.753 1.00 34.04 H new ATOM 0 HH22 ARG A 64 -14.392 -32.281 17.545 1.00 34.04 H new ATOM 1028 N LYS A 65 -8.898 -25.806 15.694 1.00 51.13 N ATOM 1029 CA LYS A 65 -8.239 -24.991 16.728 1.00 42.15 C ATOM 1030 C LYS A 65 -7.981 -23.558 16.231 1.00 34.51 C ATOM 1031 O LYS A 65 -7.354 -22.750 16.920 1.00 10.41 O ATOM 1032 CB LYS A 65 -6.939 -25.671 17.219 1.00 23.14 C ATOM 1033 CG LYS A 65 -5.871 -25.943 16.149 1.00 4.51 C ATOM 1034 CD LYS A 65 -5.072 -24.690 15.782 1.00 34.23 C ATOM 1035 CE LYS A 65 -3.895 -25.002 14.861 1.00 72.04 C ATOM 1036 NZ LYS A 65 -2.889 -25.875 15.523 1.00 21.24 N ATOM 0 H LYS A 65 -8.303 -26.046 14.901 1.00 51.13 H new ATOM 0 HA LYS A 65 -8.914 -24.917 17.581 1.00 42.15 H new ATOM 0 HB2 LYS A 65 -6.496 -25.045 17.994 1.00 23.14 H new ATOM 0 HB3 LYS A 65 -7.204 -26.619 17.688 1.00 23.14 H new ATOM 0 HG2 LYS A 65 -5.188 -26.712 16.510 1.00 4.51 H new ATOM 0 HG3 LYS A 65 -6.351 -26.338 15.254 1.00 4.51 H new ATOM 0 HD2 LYS A 65 -5.731 -23.971 15.295 1.00 34.23 H new ATOM 0 HD3 LYS A 65 -4.703 -24.218 16.692 1.00 34.23 H new ATOM 0 HE2 LYS A 65 -4.260 -25.490 13.957 1.00 72.04 H new ATOM 0 HE3 LYS A 65 -3.420 -24.071 14.551 1.00 72.04 H new ATOM 0 HZ1 LYS A 65 -1.998 -25.845 14.988 1.00 21.24 H new ATOM 0 HZ2 LYS A 65 -2.722 -25.539 16.493 1.00 21.24 H new ATOM 0 HZ3 LYS A 65 -3.243 -26.852 15.552 1.00 21.24 H new ATOM 1050 N LEU A 66 -8.484 -23.248 15.037 1.00 62.41 N ATOM 1051 CA LEU A 66 -8.335 -21.912 14.448 1.00 2.22 C ATOM 1052 C LEU A 66 -9.640 -21.110 14.552 1.00 75.23 C ATOM 1053 O LEU A 66 -9.747 -20.196 15.370 1.00 32.13 O ATOM 1054 CB LEU A 66 -7.911 -22.022 12.973 1.00 30.24 C ATOM 1055 CG LEU A 66 -6.502 -22.585 12.725 1.00 32.41 C ATOM 1056 CD1 LEU A 66 -6.264 -22.802 11.231 1.00 52.11 C ATOM 1057 CD2 LEU A 66 -5.439 -21.656 13.315 1.00 61.41 C ATOM 0 H LEU A 66 -9.001 -23.906 14.454 1.00 62.41 H new ATOM 0 HA LEU A 66 -7.562 -21.386 15.008 1.00 2.22 H new ATOM 0 HB2 LEU A 66 -8.631 -22.653 12.453 1.00 30.24 H new ATOM 0 HB3 LEU A 66 -7.971 -21.032 12.522 1.00 30.24 H new ATOM 0 HG LEU A 66 -6.425 -23.550 13.225 1.00 32.41 H new ATOM 0 HD11 LEU A 66 -5.261 -23.201 11.076 1.00 52.11 H new ATOM 0 HD12 LEU A 66 -6.999 -23.508 10.844 1.00 52.11 H new ATOM 0 HD13 LEU A 66 -6.362 -21.852 10.705 1.00 52.11 H new ATOM 0 HD21 LEU A 66 -4.449 -22.072 13.129 1.00 61.41 H new ATOM 0 HD22 LEU A 66 -5.514 -20.674 12.848 1.00 61.41 H new ATOM 0 HD23 LEU A 66 -5.596 -21.559 14.389 1.00 61.41 H new ATOM 1069 N ASP A 67 -10.623 -21.479 13.721 1.00 44.24 N ATOM 1070 CA ASP A 67 -11.917 -20.778 13.635 1.00 34.10 C ATOM 1071 C ASP A 67 -11.786 -19.247 13.763 1.00 63.20 C ATOM 1072 O ASP A 67 -11.908 -18.677 14.849 1.00 14.24 O ATOM 1073 CB ASP A 67 -12.900 -21.334 14.665 1.00 4.54 C ATOM 1074 CG ASP A 67 -13.332 -22.744 14.315 1.00 61.12 C ATOM 1075 OD1 ASP A 67 -14.181 -22.899 13.411 1.00 55.13 O ATOM 1076 OD2 ASP A 67 -12.819 -23.702 14.917 1.00 74.20 O ATOM 0 H ASP A 67 -10.546 -22.274 13.086 1.00 44.24 H new ATOM 0 HA ASP A 67 -12.309 -20.966 12.635 1.00 34.10 H new ATOM 0 HB2 ASP A 67 -12.437 -21.328 15.652 1.00 4.54 H new ATOM 0 HB3 ASP A 67 -13.776 -20.687 14.720 1.00 4.54 H new ATOM 1081 N ILE A 68 -11.550 -18.599 12.629 1.00 25.01 N ATOM 1082 CA ILE A 68 -11.315 -17.155 12.577 1.00 72.21 C ATOM 1083 C ILE A 68 -12.563 -16.351 12.984 1.00 73.53 C ATOM 1084 O ILE A 68 -13.582 -16.362 12.289 1.00 35.20 O ATOM 1085 CB ILE A 68 -10.857 -16.723 11.154 1.00 40.13 C ATOM 1086 CG1 ILE A 68 -9.442 -17.251 10.834 1.00 75.45 C ATOM 1087 CG2 ILE A 68 -10.904 -15.205 10.994 1.00 32.31 C ATOM 1088 CD1 ILE A 68 -9.333 -18.761 10.739 1.00 70.23 C ATOM 0 H ILE A 68 -11.515 -19.056 11.718 1.00 25.01 H new ATOM 0 HA ILE A 68 -10.524 -16.937 13.295 1.00 72.21 H new ATOM 0 HB ILE A 68 -11.555 -17.165 10.443 1.00 40.13 H new ATOM 0 HG12 ILE A 68 -9.112 -16.817 9.890 1.00 75.45 H new ATOM 0 HG13 ILE A 68 -8.755 -16.899 11.604 1.00 75.45 H new ATOM 0 HG21 ILE A 68 -10.578 -14.935 9.990 1.00 32.31 H new ATOM 0 HG22 ILE A 68 -11.924 -14.854 11.152 1.00 32.31 H new ATOM 0 HG23 ILE A 68 -10.243 -14.741 11.727 1.00 32.31 H new ATOM 0 HD11 ILE A 68 -8.304 -19.038 10.511 1.00 70.23 H new ATOM 0 HD12 ILE A 68 -9.627 -19.208 11.689 1.00 70.23 H new ATOM 0 HD13 ILE A 68 -9.990 -19.124 9.948 1.00 70.23 H new ATOM 1100 N LYS A 69 -12.474 -15.652 14.115 1.00 1.32 N ATOM 1101 CA LYS A 69 -13.570 -14.800 14.594 1.00 12.11 C ATOM 1102 C LYS A 69 -13.324 -13.315 14.259 1.00 53.43 C ATOM 1103 O LYS A 69 -14.191 -12.471 14.493 1.00 12.20 O ATOM 1104 CB LYS A 69 -13.801 -15.011 16.106 1.00 21.23 C ATOM 1105 CG LYS A 69 -12.538 -14.945 16.973 1.00 22.20 C ATOM 1106 CD LYS A 69 -12.128 -13.515 17.327 1.00 52.34 C ATOM 1107 CE LYS A 69 -13.154 -12.827 18.222 1.00 23.14 C ATOM 1108 NZ LYS A 69 -12.719 -11.460 18.621 1.00 30.40 N ATOM 0 H LYS A 69 -11.653 -15.657 14.720 1.00 1.32 H new ATOM 0 HA LYS A 69 -14.479 -15.096 14.070 1.00 12.11 H new ATOM 0 HB2 LYS A 69 -14.505 -14.257 16.459 1.00 21.23 H new ATOM 0 HB3 LYS A 69 -14.274 -15.982 16.253 1.00 21.23 H new ATOM 0 HG2 LYS A 69 -12.706 -15.507 17.892 1.00 22.20 H new ATOM 0 HG3 LYS A 69 -11.717 -15.432 16.447 1.00 22.20 H new ATOM 0 HD2 LYS A 69 -11.161 -13.530 17.830 1.00 52.34 H new ATOM 0 HD3 LYS A 69 -12.002 -12.938 16.411 1.00 52.34 H new ATOM 0 HE2 LYS A 69 -14.108 -12.765 17.699 1.00 23.14 H new ATOM 0 HE3 LYS A 69 -13.319 -13.430 19.115 1.00 23.14 H new ATOM 0 HZ1 LYS A 69 -13.445 -11.028 19.228 1.00 30.40 H new ATOM 0 HZ2 LYS A 69 -11.821 -11.520 19.143 1.00 30.40 H new ATOM 0 HZ3 LYS A 69 -12.587 -10.876 17.771 1.00 30.40 H new ATOM 1122 N ASN A 70 -12.137 -13.005 13.717 1.00 5.52 N ATOM 1123 CA ASN A 70 -11.838 -11.659 13.192 1.00 53.43 C ATOM 1124 C ASN A 70 -10.471 -11.617 12.480 1.00 72.35 C ATOM 1125 O ASN A 70 -9.717 -12.592 12.498 1.00 51.23 O ATOM 1126 CB ASN A 70 -11.880 -10.592 14.304 1.00 5.44 C ATOM 1127 CG ASN A 70 -10.721 -10.680 15.287 1.00 65.45 C ATOM 1128 OD1 ASN A 70 -10.244 -11.875 15.564 1.00 42.31 O flip ATOM 1129 ND2 ASN A 70 -10.256 -9.671 15.801 1.00 62.22 N flip ATOM 0 H ASN A 70 -11.366 -13.667 13.629 1.00 5.52 H new ATOM 0 HA ASN A 70 -12.616 -11.430 12.463 1.00 53.43 H new ATOM 0 HB2 ASN A 70 -11.880 -9.603 13.845 1.00 5.44 H new ATOM 0 HB3 ASN A 70 -12.817 -10.689 14.852 1.00 5.44 H new ATOM 0 HD21 ASN A 70 -10.643 -8.756 15.570 1.00 62.22 H new ATOM 0 HD22 ASN A 70 -9.481 -9.745 16.460 1.00 62.22 H new ATOM 1136 N GLU A 71 -10.160 -10.468 11.873 1.00 73.42 N ATOM 1137 CA GLU A 71 -8.894 -10.261 11.146 1.00 71.50 C ATOM 1138 C GLU A 71 -7.661 -10.656 11.984 1.00 35.23 C ATOM 1139 O GLU A 71 -6.641 -11.089 11.443 1.00 34.14 O ATOM 1140 CB GLU A 71 -8.790 -8.790 10.716 1.00 42.12 C ATOM 1141 CG GLU A 71 -7.555 -8.461 9.880 1.00 15.51 C ATOM 1142 CD GLU A 71 -7.508 -6.999 9.463 1.00 3.20 C ATOM 1143 OE1 GLU A 71 -7.048 -6.161 10.268 1.00 44.20 O ATOM 1144 OE2 GLU A 71 -7.945 -6.678 8.338 1.00 13.34 O ATOM 0 H GLU A 71 -10.774 -9.654 11.869 1.00 73.42 H new ATOM 0 HA GLU A 71 -8.904 -10.910 10.271 1.00 71.50 H new ATOM 0 HB2 GLU A 71 -9.680 -8.528 10.145 1.00 42.12 H new ATOM 0 HB3 GLU A 71 -8.787 -8.163 11.608 1.00 42.12 H new ATOM 0 HG2 GLU A 71 -6.659 -8.702 10.451 1.00 15.51 H new ATOM 0 HG3 GLU A 71 -7.544 -9.090 8.990 1.00 15.51 H new ATOM 1151 N ASP A 72 -7.765 -10.511 13.304 1.00 0.43 N ATOM 1152 CA ASP A 72 -6.693 -10.916 14.220 1.00 71.34 C ATOM 1153 C ASP A 72 -6.267 -12.379 13.978 1.00 50.21 C ATOM 1154 O ASP A 72 -5.075 -12.705 13.975 1.00 62.00 O ATOM 1155 CB ASP A 72 -7.162 -10.732 15.668 1.00 32.22 C ATOM 1156 CG ASP A 72 -6.110 -11.131 16.686 1.00 50.13 C ATOM 1157 OD1 ASP A 72 -5.161 -10.349 16.905 1.00 10.53 O ATOM 1158 OD2 ASP A 72 -6.225 -12.228 17.269 1.00 71.04 O ATOM 0 H ASP A 72 -8.583 -10.115 13.767 1.00 0.43 H new ATOM 0 HA ASP A 72 -5.824 -10.285 14.033 1.00 71.34 H new ATOM 0 HB2 ASP A 72 -7.436 -9.689 15.826 1.00 32.22 H new ATOM 0 HB3 ASP A 72 -8.061 -11.326 15.831 1.00 32.22 H new ATOM 1163 N ASP A 73 -7.248 -13.250 13.760 1.00 13.02 N ATOM 1164 CA ASP A 73 -6.982 -14.666 13.501 1.00 62.30 C ATOM 1165 C ASP A 73 -6.406 -14.872 12.094 1.00 34.43 C ATOM 1166 O ASP A 73 -5.655 -15.814 11.853 1.00 14.31 O ATOM 1167 CB ASP A 73 -8.262 -15.479 13.672 1.00 40.41 C ATOM 1168 CG ASP A 73 -8.956 -15.171 14.981 1.00 5.43 C ATOM 1169 OD1 ASP A 73 -8.422 -15.545 16.045 1.00 14.41 O ATOM 1170 OD2 ASP A 73 -10.024 -14.529 14.949 1.00 55.40 O ATOM 0 H ASP A 73 -8.237 -13.002 13.757 1.00 13.02 H new ATOM 0 HA ASP A 73 -6.241 -15.011 14.222 1.00 62.30 H new ATOM 0 HB2 ASP A 73 -8.939 -15.269 12.844 1.00 40.41 H new ATOM 0 HB3 ASP A 73 -8.025 -16.542 13.628 1.00 40.41 H new ATOM 1175 N VAL A 74 -6.757 -13.983 11.167 1.00 60.13 N ATOM 1176 CA VAL A 74 -6.164 -13.997 9.826 1.00 2.34 C ATOM 1177 C VAL A 74 -4.648 -13.751 9.908 1.00 14.01 C ATOM 1178 O VAL A 74 -3.856 -14.396 9.217 1.00 64.45 O ATOM 1179 CB VAL A 74 -6.820 -12.935 8.906 1.00 20.21 C ATOM 1180 CG1 VAL A 74 -6.148 -12.914 7.537 1.00 71.33 C ATOM 1181 CG2 VAL A 74 -8.321 -13.193 8.770 1.00 74.23 C ATOM 0 H VAL A 74 -7.446 -13.246 11.316 1.00 60.13 H new ATOM 0 HA VAL A 74 -6.346 -14.981 9.395 1.00 2.34 H new ATOM 0 HB VAL A 74 -6.682 -11.956 9.365 1.00 20.21 H new ATOM 0 HG11 VAL A 74 -6.625 -12.162 6.909 1.00 71.33 H new ATOM 0 HG12 VAL A 74 -5.092 -12.672 7.654 1.00 71.33 H new ATOM 0 HG13 VAL A 74 -6.247 -13.893 7.068 1.00 71.33 H new ATOM 0 HG21 VAL A 74 -8.763 -12.437 8.121 1.00 74.23 H new ATOM 0 HG22 VAL A 74 -8.483 -14.181 8.339 1.00 74.23 H new ATOM 0 HG23 VAL A 74 -8.789 -13.145 9.753 1.00 74.23 H new ATOM 1191 N LYS A 75 -4.253 -12.824 10.776 1.00 54.12 N ATOM 1192 CA LYS A 75 -2.835 -12.568 11.049 1.00 64.43 C ATOM 1193 C LYS A 75 -2.186 -13.774 11.756 1.00 22.32 C ATOM 1194 O LYS A 75 -0.998 -14.049 11.582 1.00 31.32 O ATOM 1195 CB LYS A 75 -2.688 -11.292 11.888 1.00 34.15 C ATOM 1196 CG LYS A 75 -3.235 -10.050 11.184 1.00 74.34 C ATOM 1197 CD LYS A 75 -3.135 -8.799 12.051 1.00 10.25 C ATOM 1198 CE LYS A 75 -3.685 -7.573 11.327 1.00 31.02 C ATOM 1199 NZ LYS A 75 -3.652 -6.361 12.185 1.00 1.05 N ATOM 0 H LYS A 75 -4.894 -12.234 11.306 1.00 54.12 H new ATOM 0 HA LYS A 75 -2.315 -12.423 10.102 1.00 64.43 H new ATOM 0 HB2 LYS A 75 -3.209 -11.425 12.836 1.00 34.15 H new ATOM 0 HB3 LYS A 75 -1.635 -11.136 12.122 1.00 34.15 H new ATOM 0 HG2 LYS A 75 -2.686 -9.890 10.256 1.00 74.34 H new ATOM 0 HG3 LYS A 75 -4.277 -10.219 10.913 1.00 74.34 H new ATOM 0 HD2 LYS A 75 -3.686 -8.953 12.979 1.00 10.25 H new ATOM 0 HD3 LYS A 75 -2.094 -8.626 12.323 1.00 10.25 H new ATOM 0 HE2 LYS A 75 -3.103 -7.394 10.423 1.00 31.02 H new ATOM 0 HE3 LYS A 75 -4.710 -7.767 11.012 1.00 31.02 H new ATOM 0 HZ1 LYS A 75 -4.034 -5.551 11.656 1.00 1.05 H new ATOM 0 HZ2 LYS A 75 -4.228 -6.522 13.036 1.00 1.05 H new ATOM 0 HZ3 LYS A 75 -2.671 -6.160 12.465 1.00 1.05 H new ATOM 1213 N SER A 76 -2.981 -14.499 12.546 1.00 51.42 N ATOM 1214 CA SER A 76 -2.540 -15.777 13.132 1.00 40.02 C ATOM 1215 C SER A 76 -2.321 -16.827 12.032 1.00 5.25 C ATOM 1216 O SER A 76 -1.390 -17.635 12.096 1.00 25.25 O ATOM 1217 CB SER A 76 -3.571 -16.292 14.147 1.00 24.22 C ATOM 1218 OG SER A 76 -3.199 -17.549 14.694 1.00 40.14 O ATOM 0 H SER A 76 -3.932 -14.228 12.797 1.00 51.42 H new ATOM 0 HA SER A 76 -1.596 -15.604 13.648 1.00 40.02 H new ATOM 0 HB2 SER A 76 -3.681 -15.565 14.952 1.00 24.22 H new ATOM 0 HB3 SER A 76 -4.543 -16.381 13.662 1.00 24.22 H new ATOM 0 HG SER A 76 -3.880 -17.841 15.336 1.00 40.14 H new ATOM 1224 N LEU A 77 -3.187 -16.806 11.015 1.00 24.23 N ATOM 1225 CA LEU A 77 -3.021 -17.665 9.838 1.00 40.01 C ATOM 1226 C LEU A 77 -1.717 -17.337 9.102 1.00 24.15 C ATOM 1227 O LEU A 77 -1.036 -18.232 8.607 1.00 44.23 O ATOM 1228 CB LEU A 77 -4.205 -17.514 8.872 1.00 70.53 C ATOM 1229 CG LEU A 77 -5.571 -17.965 9.412 1.00 14.31 C ATOM 1230 CD1 LEU A 77 -6.657 -17.754 8.361 1.00 45.44 C ATOM 1231 CD2 LEU A 77 -5.521 -19.426 9.856 1.00 43.24 C ATOM 0 H LEU A 77 -4.010 -16.204 10.982 1.00 24.23 H new ATOM 0 HA LEU A 77 -2.982 -18.696 10.190 1.00 40.01 H new ATOM 0 HB2 LEU A 77 -4.279 -16.467 8.579 1.00 70.53 H new ATOM 0 HB3 LEU A 77 -3.987 -18.083 7.968 1.00 70.53 H new ATOM 0 HG LEU A 77 -5.815 -17.356 10.282 1.00 14.31 H new ATOM 0 HD11 LEU A 77 -7.618 -18.079 8.760 1.00 45.44 H new ATOM 0 HD12 LEU A 77 -6.711 -16.697 8.101 1.00 45.44 H new ATOM 0 HD13 LEU A 77 -6.419 -18.335 7.470 1.00 45.44 H new ATOM 0 HD21 LEU A 77 -6.498 -19.725 10.235 1.00 43.24 H new ATOM 0 HD22 LEU A 77 -5.253 -20.055 9.007 1.00 43.24 H new ATOM 0 HD23 LEU A 77 -4.776 -19.542 10.643 1.00 43.24 H new ATOM 1243 N SER A 78 -1.376 -16.045 9.039 1.00 51.23 N ATOM 1244 CA SER A 78 -0.126 -15.593 8.402 1.00 63.11 C ATOM 1245 C SER A 78 1.087 -16.338 8.971 1.00 72.31 C ATOM 1246 O SER A 78 1.987 -16.741 8.233 1.00 42.21 O ATOM 1247 CB SER A 78 0.060 -14.080 8.587 1.00 25.42 C ATOM 1248 OG SER A 78 1.313 -13.645 8.079 1.00 11.51 O ATOM 0 H SER A 78 -1.946 -15.290 9.421 1.00 51.23 H new ATOM 0 HA SER A 78 -0.200 -15.815 7.337 1.00 63.11 H new ATOM 0 HB2 SER A 78 -0.744 -13.548 8.079 1.00 25.42 H new ATOM 0 HB3 SER A 78 -0.012 -13.830 9.646 1.00 25.42 H new ATOM 0 HG SER A 78 1.401 -12.678 8.210 1.00 11.51 H new ATOM 1254 N ARG A 79 1.090 -16.538 10.288 1.00 71.00 N ATOM 1255 CA ARG A 79 2.139 -17.319 10.950 1.00 34.51 C ATOM 1256 C ARG A 79 2.249 -18.724 10.327 1.00 73.20 C ATOM 1257 O ARG A 79 3.344 -19.193 10.006 1.00 74.31 O ATOM 1258 CB ARG A 79 1.843 -17.434 12.453 1.00 13.33 C ATOM 1259 CG ARG A 79 1.717 -16.091 13.172 1.00 13.32 C ATOM 1260 CD ARG A 79 3.026 -15.308 13.160 1.00 2.05 C ATOM 1261 NE ARG A 79 2.896 -14.019 13.836 1.00 0.00 N ATOM 1262 CZ ARG A 79 3.762 -13.540 14.688 1.00 64.43 C ATOM 1263 NH1 ARG A 79 4.821 -14.214 15.011 1.00 5.24 N ATOM 1264 NH2 ARG A 79 3.560 -12.381 15.223 1.00 1.45 N ATOM 0 H ARG A 79 0.378 -16.171 10.920 1.00 71.00 H new ATOM 0 HA ARG A 79 3.089 -16.804 10.811 1.00 34.51 H new ATOM 0 HB2 ARG A 79 0.917 -17.994 12.588 1.00 13.33 H new ATOM 0 HB3 ARG A 79 2.637 -18.013 12.925 1.00 13.33 H new ATOM 0 HG2 ARG A 79 0.936 -15.498 12.696 1.00 13.32 H new ATOM 0 HG3 ARG A 79 1.406 -16.260 14.203 1.00 13.32 H new ATOM 0 HD2 ARG A 79 3.805 -15.896 13.646 1.00 2.05 H new ATOM 0 HD3 ARG A 79 3.343 -15.147 12.130 1.00 2.05 H new ATOM 0 HE ARG A 79 2.072 -13.455 13.628 1.00 0.00 H new ATOM 0 HH11 ARG A 79 4.987 -15.132 14.598 1.00 5.24 H new ATOM 0 HH12 ARG A 79 5.488 -13.827 15.678 1.00 5.24 H new ATOM 0 HH21 ARG A 79 2.727 -11.845 14.979 1.00 1.45 H new ATOM 0 HH22 ARG A 79 4.233 -12.002 15.889 1.00 1.45 H new ATOM 1278 N VAL A 80 1.103 -19.384 10.148 1.00 42.12 N ATOM 1279 CA VAL A 80 1.053 -20.706 9.504 1.00 42.14 C ATOM 1280 C VAL A 80 1.522 -20.625 8.042 1.00 23.32 C ATOM 1281 O VAL A 80 2.272 -21.481 7.568 1.00 51.44 O ATOM 1282 CB VAL A 80 -0.378 -21.309 9.553 1.00 41.24 C ATOM 1283 CG1 VAL A 80 -0.421 -22.680 8.877 1.00 52.44 C ATOM 1284 CG2 VAL A 80 -0.880 -21.401 10.994 1.00 54.41 C ATOM 0 H VAL A 80 0.193 -19.027 10.439 1.00 42.12 H new ATOM 0 HA VAL A 80 1.726 -21.357 10.061 1.00 42.14 H new ATOM 0 HB VAL A 80 -1.041 -20.641 9.002 1.00 41.24 H new ATOM 0 HG11 VAL A 80 -1.434 -23.078 8.926 1.00 52.44 H new ATOM 0 HG12 VAL A 80 -0.120 -22.581 7.834 1.00 52.44 H new ATOM 0 HG13 VAL A 80 0.261 -23.359 9.388 1.00 52.44 H new ATOM 0 HG21 VAL A 80 -1.884 -21.826 11.003 1.00 54.41 H new ATOM 0 HG22 VAL A 80 -0.211 -22.038 11.572 1.00 54.41 H new ATOM 0 HG23 VAL A 80 -0.904 -20.405 11.435 1.00 54.41 H new ATOM 1294 N MET A 81 1.088 -19.576 7.346 1.00 73.52 N ATOM 1295 CA MET A 81 1.480 -19.339 5.952 1.00 32.51 C ATOM 1296 C MET A 81 3.010 -19.278 5.807 1.00 2.51 C ATOM 1297 O MET A 81 3.584 -19.837 4.871 1.00 34.01 O ATOM 1298 CB MET A 81 0.838 -18.041 5.446 1.00 2.34 C ATOM 1299 CG MET A 81 -0.681 -18.082 5.482 1.00 35.10 C ATOM 1300 SD MET A 81 -1.344 -19.520 4.620 1.00 21.41 S ATOM 1301 CE MET A 81 -3.071 -19.425 5.074 1.00 74.55 C ATOM 0 H MET A 81 0.459 -18.869 7.726 1.00 73.52 H new ATOM 0 HA MET A 81 1.124 -20.173 5.347 1.00 32.51 H new ATOM 0 HB2 MET A 81 1.189 -17.207 6.053 1.00 2.34 H new ATOM 0 HB3 MET A 81 1.168 -17.852 4.424 1.00 2.34 H new ATOM 0 HG2 MET A 81 -1.018 -18.095 6.519 1.00 35.10 H new ATOM 0 HG3 MET A 81 -1.078 -17.174 5.029 1.00 35.10 H new ATOM 0 HE1 MET A 81 -3.653 -20.086 4.431 1.00 74.55 H new ATOM 0 HE2 MET A 81 -3.191 -19.731 6.113 1.00 74.55 H new ATOM 0 HE3 MET A 81 -3.423 -18.400 4.955 1.00 74.55 H new ATOM 1311 N ILE A 82 3.663 -18.606 6.753 1.00 63.42 N ATOM 1312 CA ILE A 82 5.128 -18.563 6.801 1.00 1.44 C ATOM 1313 C ILE A 82 5.713 -19.968 7.042 1.00 33.03 C ATOM 1314 O ILE A 82 6.744 -20.330 6.473 1.00 74.33 O ATOM 1315 CB ILE A 82 5.624 -17.595 7.906 1.00 30.14 C ATOM 1316 CG1 ILE A 82 5.087 -16.176 7.646 1.00 14.34 C ATOM 1317 CG2 ILE A 82 7.154 -17.590 7.986 1.00 62.42 C ATOM 1318 CD1 ILE A 82 5.422 -15.183 8.737 1.00 34.43 C ATOM 0 H ILE A 82 3.203 -18.083 7.498 1.00 63.42 H new ATOM 0 HA ILE A 82 5.474 -18.197 5.834 1.00 1.44 H new ATOM 0 HB ILE A 82 5.242 -17.943 8.866 1.00 30.14 H new ATOM 0 HG12 ILE A 82 5.492 -15.813 6.701 1.00 14.34 H new ATOM 0 HG13 ILE A 82 4.004 -16.223 7.532 1.00 14.34 H new ATOM 0 HG21 ILE A 82 7.475 -16.903 8.769 1.00 62.42 H new ATOM 0 HG22 ILE A 82 7.510 -18.594 8.216 1.00 62.42 H new ATOM 0 HG23 ILE A 82 7.567 -17.269 7.030 1.00 62.42 H new ATOM 0 HD11 ILE A 82 5.009 -14.207 8.480 1.00 34.43 H new ATOM 0 HD12 ILE A 82 4.994 -15.521 9.681 1.00 34.43 H new ATOM 0 HD13 ILE A 82 6.505 -15.104 8.837 1.00 34.43 H new ATOM 1330 N HIS A 83 5.037 -20.767 7.874 1.00 22.01 N ATOM 1331 CA HIS A 83 5.469 -22.148 8.134 1.00 0.15 C ATOM 1332 C HIS A 83 5.370 -23.016 6.865 1.00 2.42 C ATOM 1333 O HIS A 83 6.125 -23.977 6.703 1.00 33.35 O ATOM 1334 CB HIS A 83 4.648 -22.781 9.269 1.00 54.30 C ATOM 1335 CG HIS A 83 4.858 -22.137 10.606 1.00 70.43 C ATOM 1336 ND1 HIS A 83 3.976 -21.602 11.483 1.00 31.33 N flip ATOM 1337 CD2 HIS A 83 6.101 -21.985 11.182 1.00 62.01 C flip ATOM 1338 CE1 HIS A 83 4.697 -21.142 12.554 1.00 2.02 C flip ATOM 1339 NE2 HIS A 83 5.974 -21.385 12.349 1.00 3.42 N flip ATOM 0 H HIS A 83 4.195 -20.486 8.376 1.00 22.01 H new ATOM 0 HA HIS A 83 6.514 -22.106 8.441 1.00 0.15 H new ATOM 0 HB2 HIS A 83 3.590 -22.726 9.013 1.00 54.30 H new ATOM 0 HB3 HIS A 83 4.903 -23.838 9.342 1.00 54.30 H new ATOM 0 HD2 HIS A 83 7.034 -22.308 10.745 1.00 62.01 H new ATOM 0 HE1 HIS A 83 4.283 -20.658 13.426 1.00 2.02 H new ATOM 0 HE2 HIS A 83 6.736 -21.149 12.985 1.00 3.42 H new ATOM 1348 N VAL A 84 4.437 -22.677 5.971 1.00 51.32 N ATOM 1349 CA VAL A 84 4.313 -23.372 4.680 1.00 11.14 C ATOM 1350 C VAL A 84 5.589 -23.201 3.837 1.00 24.13 C ATOM 1351 O VAL A 84 6.054 -24.142 3.187 1.00 1.03 O ATOM 1352 CB VAL A 84 3.089 -22.863 3.869 1.00 24.00 C ATOM 1353 CG1 VAL A 84 2.984 -23.580 2.521 1.00 43.21 C ATOM 1354 CG2 VAL A 84 1.798 -23.030 4.673 1.00 21.52 C ATOM 0 H VAL A 84 3.758 -21.929 6.113 1.00 51.32 H new ATOM 0 HA VAL A 84 4.167 -24.429 4.903 1.00 11.14 H new ATOM 0 HB VAL A 84 3.235 -21.801 3.674 1.00 24.00 H new ATOM 0 HG11 VAL A 84 2.119 -23.204 1.975 1.00 43.21 H new ATOM 0 HG12 VAL A 84 3.888 -23.396 1.940 1.00 43.21 H new ATOM 0 HG13 VAL A 84 2.871 -24.651 2.687 1.00 43.21 H new ATOM 0 HG21 VAL A 84 0.954 -22.667 4.086 1.00 21.52 H new ATOM 0 HG22 VAL A 84 1.650 -24.084 4.909 1.00 21.52 H new ATOM 0 HG23 VAL A 84 1.869 -22.458 5.598 1.00 21.52 H new ATOM 1364 N PHE A 85 6.164 -21.999 3.873 1.00 21.21 N ATOM 1365 CA PHE A 85 7.406 -21.702 3.144 1.00 4.02 C ATOM 1366 C PHE A 85 8.658 -22.008 3.987 1.00 40.21 C ATOM 1367 O PHE A 85 9.721 -21.417 3.779 1.00 53.43 O ATOM 1368 CB PHE A 85 7.422 -20.233 2.700 1.00 2.11 C ATOM 1369 CG PHE A 85 6.397 -19.909 1.645 1.00 32.53 C ATOM 1370 CD1 PHE A 85 6.281 -20.700 0.509 1.00 31.32 C ATOM 1371 CD2 PHE A 85 5.551 -18.817 1.784 1.00 71.44 C ATOM 1372 CE1 PHE A 85 5.346 -20.409 -0.462 1.00 71.21 C ATOM 1373 CE2 PHE A 85 4.616 -18.522 0.813 1.00 34.14 C ATOM 1374 CZ PHE A 85 4.513 -19.320 -0.310 1.00 54.21 C ATOM 0 H PHE A 85 5.791 -21.210 4.400 1.00 21.21 H new ATOM 0 HA PHE A 85 7.431 -22.349 2.267 1.00 4.02 H new ATOM 0 HB2 PHE A 85 7.250 -19.598 3.569 1.00 2.11 H new ATOM 0 HB3 PHE A 85 8.413 -19.989 2.318 1.00 2.11 H new ATOM 0 HD1 PHE A 85 6.931 -21.553 0.385 1.00 31.32 H new ATOM 0 HD2 PHE A 85 5.625 -18.192 2.661 1.00 71.44 H new ATOM 0 HE1 PHE A 85 5.266 -21.033 -1.340 1.00 71.21 H new ATOM 0 HE2 PHE A 85 3.965 -17.668 0.931 1.00 34.14 H new ATOM 0 HZ PHE A 85 3.780 -19.091 -1.069 1.00 54.21 H new ATOM 1458 N TRP A 92 7.029 -25.714 -6.677 1.00 2.14 N ATOM 1459 CA TRP A 92 5.884 -24.792 -6.737 1.00 62.45 C ATOM 1460 C TRP A 92 4.665 -25.330 -5.963 1.00 41.43 C ATOM 1461 O TRP A 92 3.699 -24.603 -5.727 1.00 11.44 O ATOM 1462 CB TRP A 92 5.511 -24.503 -8.198 1.00 63.51 C ATOM 1463 CG TRP A 92 6.598 -23.789 -8.957 1.00 63.02 C ATOM 1464 CD1 TRP A 92 7.382 -24.298 -9.954 1.00 24.23 C ATOM 1465 CD2 TRP A 92 7.028 -22.435 -8.763 1.00 65.35 C ATOM 1466 NE1 TRP A 92 8.268 -23.341 -10.392 1.00 23.12 N ATOM 1467 CE2 TRP A 92 8.070 -22.191 -9.676 1.00 23.54 C ATOM 1468 CE3 TRP A 92 6.631 -21.405 -7.905 1.00 4.21 C ATOM 1469 CZ2 TRP A 92 8.719 -20.962 -9.756 1.00 52.33 C ATOM 1470 CZ3 TRP A 92 7.275 -20.185 -7.985 1.00 0.32 C ATOM 1471 CH2 TRP A 92 8.311 -19.973 -8.904 1.00 33.35 C ATOM 0 HA TRP A 92 6.186 -23.862 -6.255 1.00 62.45 H new ATOM 0 HB2 TRP A 92 5.283 -25.443 -8.701 1.00 63.51 H new ATOM 0 HB3 TRP A 92 4.603 -23.900 -8.222 1.00 63.51 H new ATOM 0 HD1 TRP A 92 7.316 -25.304 -10.341 1.00 24.23 H new ATOM 0 HE1 TRP A 92 8.960 -23.468 -11.130 1.00 23.12 H new ATOM 0 HE3 TRP A 92 5.835 -21.560 -7.192 1.00 4.21 H new ATOM 0 HZ2 TRP A 92 9.516 -20.796 -10.465 1.00 52.33 H new ATOM 0 HZ3 TRP A 92 6.975 -19.382 -7.328 1.00 0.32 H new ATOM 0 HH2 TRP A 92 8.797 -19.009 -8.940 1.00 33.35 H new ATOM 1482 N GLY A 93 4.721 -26.602 -5.563 1.00 53.11 N ATOM 1483 CA GLY A 93 3.676 -27.183 -4.723 1.00 34.24 C ATOM 1484 C GLY A 93 3.468 -26.419 -3.413 1.00 52.23 C ATOM 1485 O GLY A 93 2.376 -26.437 -2.840 1.00 42.24 O ATOM 0 H GLY A 93 5.475 -27.245 -5.806 1.00 53.11 H new ATOM 0 HA2 GLY A 93 2.739 -27.201 -5.279 1.00 34.24 H new ATOM 0 HA3 GLY A 93 3.933 -28.218 -4.497 1.00 34.24 H new ATOM 1489 N ARG A 94 4.519 -25.745 -2.935 1.00 53.03 N ATOM 1490 CA ARG A 94 4.416 -24.897 -1.740 1.00 44.44 C ATOM 1491 C ARG A 94 3.432 -23.744 -1.986 1.00 43.25 C ATOM 1492 O ARG A 94 2.611 -23.415 -1.128 1.00 25.00 O ATOM 1493 CB ARG A 94 5.790 -24.328 -1.354 1.00 35.22 C ATOM 1494 CG ARG A 94 6.882 -25.381 -1.187 1.00 35.32 C ATOM 1495 CD ARG A 94 6.537 -26.412 -0.118 1.00 41.24 C ATOM 1496 NE ARG A 94 7.583 -27.420 0.021 1.00 43.43 N ATOM 1497 CZ ARG A 94 7.444 -28.542 0.675 1.00 42.31 C ATOM 1498 NH1 ARG A 94 6.348 -28.813 1.310 1.00 21.30 N ATOM 1499 NH2 ARG A 94 8.424 -29.381 0.724 1.00 50.31 N ATOM 0 H ARG A 94 5.448 -25.769 -3.355 1.00 53.03 H new ATOM 0 HA ARG A 94 4.049 -25.514 -0.920 1.00 44.44 H new ATOM 0 HB2 ARG A 94 6.102 -23.615 -2.117 1.00 35.22 H new ATOM 0 HB3 ARG A 94 5.691 -23.773 -0.421 1.00 35.22 H new ATOM 0 HG2 ARG A 94 7.043 -25.888 -2.138 1.00 35.32 H new ATOM 0 HG3 ARG A 94 7.819 -24.890 -0.925 1.00 35.32 H new ATOM 0 HD2 ARG A 94 6.388 -25.909 0.837 1.00 41.24 H new ATOM 0 HD3 ARG A 94 5.595 -26.898 -0.373 1.00 41.24 H new ATOM 0 HE ARG A 94 8.483 -27.236 -0.422 1.00 43.43 H new ATOM 0 HH11 ARG A 94 5.577 -28.145 1.304 1.00 21.30 H new ATOM 0 HH12 ARG A 94 6.256 -29.694 1.816 1.00 21.30 H new ATOM 0 HH21 ARG A 94 9.303 -29.167 0.253 1.00 50.31 H new ATOM 0 HH22 ARG A 94 8.319 -30.258 1.234 1.00 50.31 H new ATOM 1513 N ILE A 95 3.518 -23.149 -3.176 1.00 5.22 N ATOM 1514 CA ILE A 95 2.617 -22.064 -3.576 1.00 44.10 C ATOM 1515 C ILE A 95 1.166 -22.564 -3.641 1.00 24.14 C ATOM 1516 O ILE A 95 0.245 -21.914 -3.143 1.00 31.34 O ATOM 1517 CB ILE A 95 3.016 -21.486 -4.959 1.00 72.44 C ATOM 1518 CG1 ILE A 95 4.513 -21.126 -4.988 1.00 62.13 C ATOM 1519 CG2 ILE A 95 2.160 -20.265 -5.304 1.00 15.43 C ATOM 1520 CD1 ILE A 95 4.914 -20.057 -3.994 1.00 53.14 C ATOM 0 H ILE A 95 4.207 -23.401 -3.885 1.00 5.22 H new ATOM 0 HA ILE A 95 2.700 -21.278 -2.826 1.00 44.10 H new ATOM 0 HB ILE A 95 2.835 -22.253 -5.712 1.00 72.44 H new ATOM 0 HG12 ILE A 95 5.095 -22.026 -4.791 1.00 62.13 H new ATOM 0 HG13 ILE A 95 4.775 -20.790 -5.991 1.00 62.13 H new ATOM 0 HG21 ILE A 95 2.457 -19.876 -6.278 1.00 15.43 H new ATOM 0 HG22 ILE A 95 1.109 -20.554 -5.334 1.00 15.43 H new ATOM 0 HG23 ILE A 95 2.303 -19.494 -4.546 1.00 15.43 H new ATOM 0 HD11 ILE A 95 5.983 -19.863 -4.080 1.00 53.14 H new ATOM 0 HD12 ILE A 95 4.361 -19.141 -4.202 1.00 53.14 H new ATOM 0 HD13 ILE A 95 4.687 -20.396 -2.983 1.00 53.14 H new ATOM 1532 N VAL A 96 0.978 -23.737 -4.252 1.00 72.34 N ATOM 1533 CA VAL A 96 -0.344 -24.370 -4.330 1.00 21.23 C ATOM 1534 C VAL A 96 -0.930 -24.592 -2.928 1.00 40.24 C ATOM 1535 O VAL A 96 -2.082 -24.252 -2.664 1.00 22.34 O ATOM 1536 CB VAL A 96 -0.283 -25.734 -5.065 1.00 42.44 C ATOM 1537 CG1 VAL A 96 -1.680 -26.333 -5.231 1.00 14.45 C ATOM 1538 CG2 VAL A 96 0.409 -25.593 -6.417 1.00 72.24 C ATOM 0 H VAL A 96 1.724 -24.269 -4.700 1.00 72.34 H new ATOM 0 HA VAL A 96 -0.984 -23.691 -4.894 1.00 21.23 H new ATOM 0 HB VAL A 96 0.305 -26.417 -4.452 1.00 42.44 H new ATOM 0 HG11 VAL A 96 -1.607 -27.289 -5.750 1.00 14.45 H new ATOM 0 HG12 VAL A 96 -2.129 -26.486 -4.250 1.00 14.45 H new ATOM 0 HG13 VAL A 96 -2.301 -25.652 -5.812 1.00 14.45 H new ATOM 0 HG21 VAL A 96 0.439 -26.563 -6.913 1.00 72.24 H new ATOM 0 HG22 VAL A 96 -0.143 -24.886 -7.036 1.00 72.24 H new ATOM 0 HG23 VAL A 96 1.426 -25.229 -6.269 1.00 72.24 H new ATOM 1548 N THR A 97 -0.120 -25.162 -2.034 1.00 63.05 N ATOM 1549 CA THR A 97 -0.539 -25.411 -0.644 1.00 43.43 C ATOM 1550 C THR A 97 -0.980 -24.116 0.053 1.00 22.22 C ATOM 1551 O THR A 97 -2.018 -24.077 0.712 1.00 52.43 O ATOM 1552 CB THR A 97 0.597 -26.066 0.187 1.00 41.53 C ATOM 1553 OG1 THR A 97 0.993 -27.311 -0.410 1.00 72.33 O ATOM 1554 CG2 THR A 97 0.161 -26.319 1.629 1.00 62.54 C ATOM 0 H THR A 97 0.832 -25.462 -2.243 1.00 63.05 H new ATOM 0 HA THR A 97 -1.385 -26.096 -0.697 1.00 43.43 H new ATOM 0 HB THR A 97 1.438 -25.373 0.195 1.00 41.53 H new ATOM 0 HG1 THR A 97 1.472 -27.135 -1.247 1.00 72.33 H new ATOM 0 HG21 THR A 97 0.981 -26.778 2.182 1.00 62.54 H new ATOM 0 HG22 THR A 97 -0.109 -25.373 2.099 1.00 62.54 H new ATOM 0 HG23 THR A 97 -0.701 -26.986 1.637 1.00 62.54 H new ATOM 1562 N LEU A 98 -0.188 -23.058 -0.111 1.00 73.04 N ATOM 1563 CA LEU A 98 -0.493 -21.754 0.489 1.00 31.33 C ATOM 1564 C LEU A 98 -1.867 -21.225 0.039 1.00 54.45 C ATOM 1565 O LEU A 98 -2.737 -20.919 0.859 1.00 33.33 O ATOM 1566 CB LEU A 98 0.587 -20.737 0.094 1.00 71.41 C ATOM 1567 CG LEU A 98 0.419 -19.338 0.709 1.00 41.23 C ATOM 1568 CD1 LEU A 98 0.803 -19.344 2.184 1.00 63.20 C ATOM 1569 CD2 LEU A 98 1.224 -18.298 -0.064 1.00 45.23 C ATOM 0 H LEU A 98 0.674 -23.076 -0.656 1.00 73.04 H new ATOM 0 HA LEU A 98 -0.514 -21.887 1.571 1.00 31.33 H new ATOM 0 HB2 LEU A 98 1.560 -21.131 0.386 1.00 71.41 H new ATOM 0 HB3 LEU A 98 0.595 -20.641 -0.992 1.00 71.41 H new ATOM 0 HG LEU A 98 -0.633 -19.063 0.637 1.00 41.23 H new ATOM 0 HD11 LEU A 98 0.676 -18.343 2.597 1.00 63.20 H new ATOM 0 HD12 LEU A 98 0.164 -20.043 2.723 1.00 63.20 H new ATOM 0 HD13 LEU A 98 1.844 -19.650 2.288 1.00 63.20 H new ATOM 0 HD21 LEU A 98 1.086 -17.318 0.393 1.00 45.23 H new ATOM 0 HD22 LEU A 98 2.281 -18.564 -0.040 1.00 45.23 H new ATOM 0 HD23 LEU A 98 0.881 -18.267 -1.098 1.00 45.23 H new ATOM 1581 N ILE A 99 -2.054 -21.140 -1.275 1.00 62.43 N ATOM 1582 CA ILE A 99 -3.266 -20.548 -1.851 1.00 4.11 C ATOM 1583 C ILE A 99 -4.501 -21.452 -1.658 1.00 33.05 C ATOM 1584 O ILE A 99 -5.605 -20.962 -1.405 1.00 20.44 O ATOM 1585 CB ILE A 99 -3.063 -20.244 -3.358 1.00 42.52 C ATOM 1586 CG1 ILE A 99 -1.799 -19.389 -3.564 1.00 71.41 C ATOM 1587 CG2 ILE A 99 -4.284 -19.531 -3.936 1.00 24.21 C ATOM 1588 CD1 ILE A 99 -1.490 -19.076 -5.017 1.00 14.03 C ATOM 0 H ILE A 99 -1.382 -21.474 -1.966 1.00 62.43 H new ATOM 0 HA ILE A 99 -3.450 -19.615 -1.318 1.00 4.11 H new ATOM 0 HB ILE A 99 -2.938 -21.190 -3.885 1.00 42.52 H new ATOM 0 HG12 ILE A 99 -1.915 -18.452 -3.019 1.00 71.41 H new ATOM 0 HG13 ILE A 99 -0.947 -19.909 -3.127 1.00 71.41 H new ATOM 0 HG21 ILE A 99 -4.119 -19.328 -4.994 1.00 24.21 H new ATOM 0 HG22 ILE A 99 -5.164 -20.164 -3.821 1.00 24.21 H new ATOM 0 HG23 ILE A 99 -4.441 -18.592 -3.406 1.00 24.21 H new ATOM 0 HD11 ILE A 99 -0.585 -18.471 -5.074 1.00 14.03 H new ATOM 0 HD12 ILE A 99 -1.340 -20.006 -5.566 1.00 14.03 H new ATOM 0 HD13 ILE A 99 -2.323 -18.526 -5.456 1.00 14.03 H new ATOM 1600 N SER A 100 -4.310 -22.768 -1.766 1.00 32.34 N ATOM 1601 CA SER A 100 -5.412 -23.728 -1.583 1.00 34.24 C ATOM 1602 C SER A 100 -5.910 -23.733 -0.133 1.00 42.35 C ATOM 1603 O SER A 100 -7.115 -23.741 0.116 1.00 30.54 O ATOM 1604 CB SER A 100 -4.985 -25.147 -1.984 1.00 25.44 C ATOM 1605 OG SER A 100 -3.935 -25.624 -1.158 1.00 42.30 O ATOM 0 H SER A 100 -3.409 -23.197 -1.978 1.00 32.34 H new ATOM 0 HA SER A 100 -6.226 -23.408 -2.233 1.00 34.24 H new ATOM 0 HB2 SER A 100 -5.840 -25.820 -1.913 1.00 25.44 H new ATOM 0 HB3 SER A 100 -4.662 -25.151 -3.025 1.00 25.44 H new ATOM 0 HG SER A 100 -3.088 -25.221 -1.440 1.00 42.30 H new ATOM 1611 N PHE A 101 -4.979 -23.731 0.825 1.00 44.45 N ATOM 1612 CA PHE A 101 -5.339 -23.630 2.245 1.00 34.43 C ATOM 1613 C PHE A 101 -6.066 -22.305 2.529 1.00 24.11 C ATOM 1614 O PHE A 101 -7.034 -22.267 3.291 1.00 53.32 O ATOM 1615 CB PHE A 101 -4.094 -23.759 3.136 1.00 4.25 C ATOM 1616 CG PHE A 101 -4.391 -23.685 4.618 1.00 22.00 C ATOM 1617 CD1 PHE A 101 -5.380 -24.479 5.184 1.00 4.32 C ATOM 1618 CD2 PHE A 101 -3.677 -22.827 5.446 1.00 20.13 C ATOM 1619 CE1 PHE A 101 -5.651 -24.418 6.539 1.00 33.35 C ATOM 1620 CE2 PHE A 101 -3.947 -22.763 6.801 1.00 50.24 C ATOM 1621 CZ PHE A 101 -4.935 -23.560 7.347 1.00 44.24 C ATOM 0 H PHE A 101 -3.977 -23.798 0.647 1.00 44.45 H new ATOM 0 HA PHE A 101 -6.015 -24.452 2.480 1.00 34.43 H new ATOM 0 HB2 PHE A 101 -3.602 -24.707 2.921 1.00 4.25 H new ATOM 0 HB3 PHE A 101 -3.390 -22.968 2.876 1.00 4.25 H new ATOM 0 HD1 PHE A 101 -5.945 -25.153 4.558 1.00 4.32 H new ATOM 0 HD2 PHE A 101 -2.902 -22.203 5.026 1.00 20.13 H new ATOM 0 HE1 PHE A 101 -6.423 -25.042 6.964 1.00 33.35 H new ATOM 0 HE2 PHE A 101 -3.386 -22.090 7.432 1.00 50.24 H new ATOM 0 HZ PHE A 101 -5.146 -23.511 8.405 1.00 44.24 H new ATOM 1631 N GLY A 102 -5.596 -21.222 1.907 1.00 43.44 N ATOM 1632 CA GLY A 102 -6.289 -19.942 2.005 1.00 25.35 C ATOM 1633 C GLY A 102 -7.738 -20.028 1.531 1.00 13.41 C ATOM 1634 O GLY A 102 -8.654 -19.560 2.210 1.00 75.05 O ATOM 0 H GLY A 102 -4.750 -21.207 1.338 1.00 43.44 H new ATOM 0 HA2 GLY A 102 -6.267 -19.598 3.039 1.00 25.35 H new ATOM 0 HA3 GLY A 102 -5.758 -19.198 1.411 1.00 25.35 H new ATOM 1638 N ALA A 103 -7.941 -20.644 0.364 1.00 31.21 N ATOM 1639 CA ALA A 103 -9.286 -20.865 -0.180 1.00 62.12 C ATOM 1640 C ALA A 103 -10.106 -21.810 0.712 1.00 54.50 C ATOM 1641 O ALA A 103 -11.324 -21.660 0.850 1.00 62.42 O ATOM 1642 CB ALA A 103 -9.192 -21.421 -1.596 1.00 41.25 C ATOM 0 H ALA A 103 -7.189 -21.000 -0.226 1.00 31.21 H new ATOM 0 HA ALA A 103 -9.801 -19.905 -0.206 1.00 62.12 H new ATOM 0 HB1 ALA A 103 -10.195 -21.582 -1.991 1.00 41.25 H new ATOM 0 HB2 ALA A 103 -8.661 -20.712 -2.231 1.00 41.25 H new ATOM 0 HB3 ALA A 103 -8.652 -22.368 -1.580 1.00 41.25 H new ATOM 1648 N PHE A 104 -9.427 -22.786 1.309 1.00 1.43 N ATOM 1649 CA PHE A 104 -10.057 -23.722 2.244 1.00 11.33 C ATOM 1650 C PHE A 104 -10.615 -22.991 3.476 1.00 62.43 C ATOM 1651 O PHE A 104 -11.742 -23.243 3.905 1.00 52.45 O ATOM 1652 CB PHE A 104 -9.046 -24.793 2.675 1.00 73.40 C ATOM 1653 CG PHE A 104 -9.554 -25.708 3.760 1.00 12.41 C ATOM 1654 CD1 PHE A 104 -10.480 -26.700 3.474 1.00 12.43 C ATOM 1655 CD2 PHE A 104 -9.113 -25.567 5.069 1.00 74.52 C ATOM 1656 CE1 PHE A 104 -10.951 -27.533 4.469 1.00 34.44 C ATOM 1657 CE2 PHE A 104 -9.582 -26.397 6.066 1.00 61.02 C ATOM 1658 CZ PHE A 104 -10.502 -27.380 5.767 1.00 21.23 C ATOM 0 H PHE A 104 -8.431 -22.952 1.162 1.00 1.43 H new ATOM 0 HA PHE A 104 -10.892 -24.201 1.733 1.00 11.33 H new ATOM 0 HB2 PHE A 104 -8.773 -25.392 1.806 1.00 73.40 H new ATOM 0 HB3 PHE A 104 -8.137 -24.302 3.023 1.00 73.40 H new ATOM 0 HD1 PHE A 104 -10.837 -26.822 2.462 1.00 12.43 H new ATOM 0 HD2 PHE A 104 -8.394 -24.798 5.310 1.00 74.52 H new ATOM 0 HE1 PHE A 104 -11.670 -28.304 4.233 1.00 34.44 H new ATOM 0 HE2 PHE A 104 -9.229 -26.277 7.080 1.00 61.02 H new ATOM 0 HZ PHE A 104 -10.871 -28.030 6.547 1.00 21.23 H new ATOM 1668 N VAL A 105 -9.825 -22.088 4.046 1.00 2.12 N ATOM 1669 CA VAL A 105 -10.279 -21.292 5.187 1.00 31.34 C ATOM 1670 C VAL A 105 -11.354 -20.281 4.754 1.00 64.54 C ATOM 1671 O VAL A 105 -12.331 -20.053 5.469 1.00 1.23 O ATOM 1672 CB VAL A 105 -9.103 -20.545 5.869 1.00 24.53 C ATOM 1673 CG1 VAL A 105 -9.588 -19.757 7.088 1.00 75.54 C ATOM 1674 CG2 VAL A 105 -8.003 -21.528 6.265 1.00 0.43 C ATOM 0 H VAL A 105 -8.872 -21.887 3.741 1.00 2.12 H new ATOM 0 HA VAL A 105 -10.709 -21.985 5.911 1.00 31.34 H new ATOM 0 HB VAL A 105 -8.690 -19.835 5.152 1.00 24.53 H new ATOM 0 HG11 VAL A 105 -8.744 -19.243 7.548 1.00 75.54 H new ATOM 0 HG12 VAL A 105 -10.333 -19.025 6.775 1.00 75.54 H new ATOM 0 HG13 VAL A 105 -10.033 -20.441 7.810 1.00 75.54 H new ATOM 0 HG21 VAL A 105 -7.186 -20.987 6.742 1.00 0.43 H new ATOM 0 HG22 VAL A 105 -8.406 -22.264 6.961 1.00 0.43 H new ATOM 0 HG23 VAL A 105 -7.631 -22.036 5.375 1.00 0.43 H new ATOM 1684 N ALA A 106 -11.174 -19.702 3.564 1.00 63.12 N ATOM 1685 CA ALA A 106 -12.114 -18.715 3.015 1.00 24.40 C ATOM 1686 C ALA A 106 -13.560 -19.239 2.987 1.00 52.34 C ATOM 1687 O ALA A 106 -14.485 -18.556 3.433 1.00 2.11 O ATOM 1688 CB ALA A 106 -11.678 -18.300 1.614 1.00 74.03 C ATOM 0 H ALA A 106 -10.379 -19.901 2.956 1.00 63.12 H new ATOM 0 HA ALA A 106 -12.097 -17.848 3.675 1.00 24.40 H new ATOM 0 HB1 ALA A 106 -12.381 -17.568 1.216 1.00 74.03 H new ATOM 0 HB2 ALA A 106 -10.682 -17.859 1.658 1.00 74.03 H new ATOM 0 HB3 ALA A 106 -11.659 -19.175 0.965 1.00 74.03 H new ATOM 1694 N LYS A 107 -13.756 -20.452 2.466 1.00 0.11 N ATOM 1695 CA LYS A 107 -15.096 -21.052 2.421 1.00 42.30 C ATOM 1696 C LYS A 107 -15.657 -21.270 3.838 1.00 25.24 C ATOM 1697 O LYS A 107 -16.853 -21.095 4.078 1.00 53.10 O ATOM 1698 CB LYS A 107 -15.079 -22.374 1.636 1.00 51.01 C ATOM 1699 CG LYS A 107 -14.211 -23.463 2.259 1.00 4.53 C ATOM 1700 CD LYS A 107 -14.250 -24.753 1.445 1.00 23.25 C ATOM 1701 CE LYS A 107 -13.665 -24.564 0.050 1.00 63.14 C ATOM 1702 NZ LYS A 107 -13.867 -25.764 -0.801 1.00 73.34 N ATOM 0 H LYS A 107 -13.016 -21.034 2.073 1.00 0.11 H new ATOM 0 HA LYS A 107 -15.754 -20.354 1.903 1.00 42.30 H new ATOM 0 HB2 LYS A 107 -16.100 -22.745 1.550 1.00 51.01 H new ATOM 0 HB3 LYS A 107 -14.725 -22.178 0.624 1.00 51.01 H new ATOM 0 HG2 LYS A 107 -13.182 -23.110 2.332 1.00 4.53 H new ATOM 0 HG3 LYS A 107 -14.552 -23.663 3.275 1.00 4.53 H new ATOM 0 HD2 LYS A 107 -13.694 -25.530 1.969 1.00 23.25 H new ATOM 0 HD3 LYS A 107 -15.280 -25.099 1.363 1.00 23.25 H new ATOM 0 HE2 LYS A 107 -14.129 -23.700 -0.425 1.00 63.14 H new ATOM 0 HE3 LYS A 107 -12.599 -24.350 0.129 1.00 63.14 H new ATOM 0 HZ1 LYS A 107 -13.455 -25.596 -1.741 1.00 73.34 H new ATOM 0 HZ2 LYS A 107 -13.402 -26.584 -0.361 1.00 73.34 H new ATOM 0 HZ3 LYS A 107 -14.885 -25.954 -0.898 1.00 73.34 H new ATOM 1716 N HIS A 108 -14.783 -21.636 4.778 1.00 44.32 N ATOM 1717 CA HIS A 108 -15.182 -21.789 6.180 1.00 52.34 C ATOM 1718 C HIS A 108 -15.601 -20.432 6.767 1.00 65.12 C ATOM 1719 O HIS A 108 -16.492 -20.357 7.613 1.00 24.12 O ATOM 1720 CB HIS A 108 -14.034 -22.395 7.001 1.00 45.33 C ATOM 1721 CG HIS A 108 -14.396 -22.701 8.428 1.00 64.20 C ATOM 1722 ND1 HIS A 108 -15.072 -23.842 8.803 1.00 44.43 N ATOM 1723 CD2 HIS A 108 -14.167 -22.014 9.578 1.00 34.53 C ATOM 1724 CE1 HIS A 108 -15.244 -23.847 10.109 1.00 63.54 C ATOM 1725 NE2 HIS A 108 -14.706 -22.752 10.603 1.00 24.53 N ATOM 0 H HIS A 108 -13.799 -21.831 4.596 1.00 44.32 H new ATOM 0 HA HIS A 108 -16.035 -22.466 6.226 1.00 52.34 H new ATOM 0 HB2 HIS A 108 -13.700 -23.313 6.517 1.00 45.33 H new ATOM 0 HB3 HIS A 108 -13.190 -21.705 6.991 1.00 45.33 H new ATOM 0 HD2 HIS A 108 -13.657 -21.066 9.669 1.00 34.53 H new ATOM 0 HE1 HIS A 108 -15.742 -24.618 10.678 1.00 63.54 H new ATOM 0 HE2 HIS A 108 -14.692 -22.493 11.589 1.00 24.53 H new ATOM 1734 N LEU A 109 -14.946 -19.363 6.307 1.00 74.44 N ATOM 1735 CA LEU A 109 -15.283 -18.003 6.739 1.00 4.13 C ATOM 1736 C LEU A 109 -16.668 -17.591 6.232 1.00 23.25 C ATOM 1737 O LEU A 109 -17.509 -17.147 7.007 1.00 65.21 O ATOM 1738 CB LEU A 109 -14.232 -17.000 6.241 1.00 74.13 C ATOM 1739 CG LEU A 109 -12.808 -17.230 6.763 1.00 40.01 C ATOM 1740 CD1 LEU A 109 -11.852 -16.181 6.207 1.00 64.35 C ATOM 1741 CD2 LEU A 109 -12.785 -17.230 8.287 1.00 3.02 C ATOM 0 H LEU A 109 -14.180 -19.412 5.636 1.00 74.44 H new ATOM 0 HA LEU A 109 -15.294 -17.997 7.829 1.00 4.13 H new ATOM 0 HB2 LEU A 109 -14.211 -17.031 5.152 1.00 74.13 H new ATOM 0 HB3 LEU A 109 -14.548 -15.996 6.525 1.00 74.13 H new ATOM 0 HG LEU A 109 -12.474 -18.209 6.419 1.00 40.01 H new ATOM 0 HD11 LEU A 109 -10.848 -16.364 6.591 1.00 64.35 H new ATOM 0 HD12 LEU A 109 -11.841 -16.239 5.119 1.00 64.35 H new ATOM 0 HD13 LEU A 109 -12.182 -15.189 6.514 1.00 64.35 H new ATOM 0 HD21 LEU A 109 -11.765 -17.395 8.635 1.00 3.02 H new ATOM 0 HD22 LEU A 109 -13.144 -16.269 8.656 1.00 3.02 H new ATOM 0 HD23 LEU A 109 -13.429 -18.026 8.661 1.00 3.02 H new ATOM 1753 N LYS A 110 -16.910 -17.764 4.934 1.00 63.43 N ATOM 1754 CA LYS A 110 -18.222 -17.456 4.351 1.00 30.55 C ATOM 1755 C LYS A 110 -19.327 -18.255 5.061 1.00 20.33 C ATOM 1756 O LYS A 110 -20.410 -17.733 5.348 1.00 51.12 O ATOM 1757 CB LYS A 110 -18.225 -17.763 2.848 1.00 2.34 C ATOM 1758 CG LYS A 110 -19.525 -17.380 2.146 1.00 63.14 C ATOM 1759 CD LYS A 110 -19.481 -17.699 0.656 1.00 61.31 C ATOM 1760 CE LYS A 110 -20.741 -17.234 -0.063 1.00 62.30 C ATOM 1761 NZ LYS A 110 -21.967 -17.895 0.459 1.00 1.40 N ATOM 0 H LYS A 110 -16.222 -18.113 4.267 1.00 63.43 H new ATOM 0 HA LYS A 110 -18.420 -16.393 4.489 1.00 30.55 H new ATOM 0 HB2 LYS A 110 -17.398 -17.233 2.376 1.00 2.34 H new ATOM 0 HB3 LYS A 110 -18.045 -18.828 2.703 1.00 2.34 H new ATOM 0 HG2 LYS A 110 -20.357 -17.912 2.607 1.00 63.14 H new ATOM 0 HG3 LYS A 110 -19.712 -16.315 2.284 1.00 63.14 H new ATOM 0 HD2 LYS A 110 -18.610 -17.220 0.208 1.00 61.31 H new ATOM 0 HD3 LYS A 110 -19.360 -18.774 0.518 1.00 61.31 H new ATOM 0 HE2 LYS A 110 -20.840 -16.154 0.044 1.00 62.30 H new ATOM 0 HE3 LYS A 110 -20.645 -17.441 -1.129 1.00 62.30 H new ATOM 0 HZ1 LYS A 110 -22.780 -17.638 -0.136 1.00 1.40 H new ATOM 0 HZ2 LYS A 110 -21.839 -18.927 0.443 1.00 1.40 H new ATOM 0 HZ3 LYS A 110 -22.141 -17.583 1.436 1.00 1.40 H new ATOM 1775 N THR A 111 -19.024 -19.518 5.358 1.00 43.22 N ATOM 1776 CA THR A 111 -19.924 -20.391 6.123 1.00 24.41 C ATOM 1777 C THR A 111 -20.295 -19.774 7.483 1.00 11.15 C ATOM 1778 O THR A 111 -21.471 -19.707 7.842 1.00 1.25 O ATOM 1779 CB THR A 111 -19.282 -21.785 6.345 1.00 15.31 C ATOM 1780 OG1 THR A 111 -19.169 -22.481 5.091 1.00 11.34 O ATOM 1781 CG2 THR A 111 -20.085 -22.632 7.327 1.00 24.21 C ATOM 0 H THR A 111 -18.152 -19.967 5.078 1.00 43.22 H new ATOM 0 HA THR A 111 -20.835 -20.503 5.536 1.00 24.41 H new ATOM 0 HB THR A 111 -18.292 -21.624 6.771 1.00 15.31 H new ATOM 0 HG1 THR A 111 -18.396 -22.139 4.596 1.00 11.34 H new ATOM 0 HG21 THR A 111 -19.600 -23.600 7.454 1.00 24.21 H new ATOM 0 HG22 THR A 111 -20.136 -22.123 8.290 1.00 24.21 H new ATOM 0 HG23 THR A 111 -21.094 -22.779 6.941 1.00 24.21 H new ATOM 1789 N ILE A 112 -19.294 -19.307 8.232 1.00 33.54 N ATOM 1790 CA ILE A 112 -19.538 -18.696 9.550 1.00 52.23 C ATOM 1791 C ILE A 112 -19.801 -17.178 9.448 1.00 25.23 C ATOM 1792 O ILE A 112 -19.627 -16.444 10.423 1.00 14.14 O ATOM 1793 CB ILE A 112 -18.359 -18.949 10.527 1.00 22.20 C ATOM 1794 CG1 ILE A 112 -17.060 -18.324 9.992 1.00 14.34 C ATOM 1795 CG2 ILE A 112 -18.178 -20.449 10.768 1.00 45.21 C ATOM 1796 CD1 ILE A 112 -15.872 -18.472 10.922 1.00 50.14 C ATOM 0 H ILE A 112 -18.313 -19.337 7.956 1.00 33.54 H new ATOM 0 HA ILE A 112 -20.434 -19.177 9.943 1.00 52.23 H new ATOM 0 HB ILE A 112 -18.595 -18.472 11.478 1.00 22.20 H new ATOM 0 HG12 ILE A 112 -16.817 -18.783 9.034 1.00 14.34 H new ATOM 0 HG13 ILE A 112 -17.230 -17.264 9.804 1.00 14.34 H new ATOM 0 HG21 ILE A 112 -17.347 -20.609 11.455 1.00 45.21 H new ATOM 0 HG22 ILE A 112 -19.090 -20.861 11.199 1.00 45.21 H new ATOM 0 HG23 ILE A 112 -17.967 -20.947 9.821 1.00 45.21 H new ATOM 0 HD11 ILE A 112 -14.996 -18.005 10.471 1.00 50.14 H new ATOM 0 HD12 ILE A 112 -16.092 -17.988 11.873 1.00 50.14 H new ATOM 0 HD13 ILE A 112 -15.672 -19.530 11.091 1.00 50.14 H new ATOM 1808 N ASN A 113 -20.225 -16.721 8.262 1.00 44.13 N ATOM 1809 CA ASN A 113 -20.631 -15.317 8.042 1.00 64.11 C ATOM 1810 C ASN A 113 -19.448 -14.328 8.130 1.00 71.22 C ATOM 1811 O ASN A 113 -19.641 -13.111 8.164 1.00 44.11 O ATOM 1812 CB ASN A 113 -21.725 -14.931 9.045 1.00 51.22 C ATOM 1813 CG ASN A 113 -22.902 -15.890 9.002 1.00 71.54 C ATOM 1814 OD1 ASN A 113 -23.310 -16.359 7.943 1.00 74.40 O ATOM 1815 ND2 ASN A 113 -23.433 -16.222 10.157 1.00 11.21 N ATOM 0 H ASN A 113 -20.298 -17.306 7.430 1.00 44.13 H new ATOM 0 HA ASN A 113 -21.018 -15.249 7.025 1.00 64.11 H new ATOM 0 HB2 ASN A 113 -21.306 -14.917 10.051 1.00 51.22 H new ATOM 0 HB3 ASN A 113 -22.073 -13.921 8.831 1.00 51.22 H new ATOM 0 HD21 ASN A 113 -24.206 -16.887 10.191 1.00 11.21 H new ATOM 0 HD22 ASN A 113 -23.072 -15.815 11.020 1.00 11.21 H new ATOM 1822 N GLN A 114 -18.231 -14.859 8.135 1.00 50.03 N ATOM 1823 CA GLN A 114 -17.009 -14.048 8.233 1.00 62.43 C ATOM 1824 C GLN A 114 -16.409 -13.726 6.851 1.00 42.51 C ATOM 1825 O GLN A 114 -15.186 -13.691 6.696 1.00 71.31 O ATOM 1826 CB GLN A 114 -15.967 -14.794 9.077 1.00 64.41 C ATOM 1827 CG GLN A 114 -16.303 -14.877 10.560 1.00 31.23 C ATOM 1828 CD GLN A 114 -16.219 -13.531 11.250 1.00 5.51 C ATOM 1829 OE1 GLN A 114 -17.203 -12.804 11.363 1.00 70.14 O ATOM 1830 NE2 GLN A 114 -15.035 -13.180 11.701 1.00 0.22 N ATOM 0 H GLN A 114 -18.057 -15.862 8.072 1.00 50.03 H new ATOM 0 HA GLN A 114 -17.279 -13.103 8.705 1.00 62.43 H new ATOM 0 HB2 GLN A 114 -15.856 -15.805 8.685 1.00 64.41 H new ATOM 0 HB3 GLN A 114 -15.002 -14.299 8.962 1.00 64.41 H new ATOM 0 HG2 GLN A 114 -17.308 -15.281 10.679 1.00 31.23 H new ATOM 0 HG3 GLN A 114 -15.620 -15.574 11.046 1.00 31.23 H new ATOM 0 HE21 GLN A 114 -14.240 -13.809 11.590 1.00 0.22 H new ATOM 0 HE22 GLN A 114 -14.912 -12.279 12.162 1.00 0.22 H new ATOM 1839 N GLU A 115 -17.256 -13.463 5.851 1.00 14.41 N ATOM 1840 CA GLU A 115 -16.763 -13.111 4.507 1.00 11.43 C ATOM 1841 C GLU A 115 -15.817 -11.896 4.570 1.00 61.31 C ATOM 1842 O GLU A 115 -14.868 -11.790 3.791 1.00 65.40 O ATOM 1843 CB GLU A 115 -17.924 -12.812 3.544 1.00 43.14 C ATOM 1844 CG GLU A 115 -17.478 -12.656 2.087 1.00 75.03 C ATOM 1845 CD GLU A 115 -18.586 -12.174 1.161 1.00 30.20 C ATOM 1846 OE1 GLU A 115 -19.597 -12.889 1.008 1.00 10.41 O ATOM 1847 OE2 GLU A 115 -18.448 -11.074 0.581 1.00 63.14 O ATOM 0 H GLU A 115 -18.272 -13.485 5.939 1.00 14.41 H new ATOM 0 HA GLU A 115 -16.212 -13.972 4.129 1.00 11.43 H new ATOM 0 HB2 GLU A 115 -18.657 -13.617 3.608 1.00 43.14 H new ATOM 0 HB3 GLU A 115 -18.425 -11.898 3.863 1.00 43.14 H new ATOM 0 HG2 GLU A 115 -16.647 -11.952 2.043 1.00 75.03 H new ATOM 0 HG3 GLU A 115 -17.104 -13.614 1.725 1.00 75.03 H new ATOM 1854 N SER A 116 -16.079 -10.993 5.518 1.00 63.20 N ATOM 1855 CA SER A 116 -15.234 -9.807 5.741 1.00 14.43 C ATOM 1856 C SER A 116 -13.772 -10.190 6.021 1.00 74.33 C ATOM 1857 O SER A 116 -12.853 -9.433 5.710 1.00 73.03 O ATOM 1858 CB SER A 116 -15.782 -8.980 6.916 1.00 54.21 C ATOM 1859 OG SER A 116 -17.138 -8.613 6.701 1.00 22.10 O ATOM 0 H SER A 116 -16.876 -11.058 6.151 1.00 63.20 H new ATOM 0 HA SER A 116 -15.258 -9.213 4.827 1.00 14.43 H new ATOM 0 HB2 SER A 116 -15.701 -9.556 7.838 1.00 54.21 H new ATOM 0 HB3 SER A 116 -15.176 -8.083 7.046 1.00 54.21 H new ATOM 0 HG SER A 116 -17.460 -8.090 7.464 1.00 22.10 H new ATOM 1865 N SER A 117 -13.568 -11.372 6.604 1.00 2.40 N ATOM 1866 CA SER A 117 -12.221 -11.870 6.923 1.00 5.12 C ATOM 1867 C SER A 117 -11.499 -12.399 5.672 1.00 13.04 C ATOM 1868 O SER A 117 -10.268 -12.396 5.608 1.00 32.41 O ATOM 1869 CB SER A 117 -12.294 -12.975 7.988 1.00 55.50 C ATOM 1870 OG SER A 117 -12.933 -12.515 9.172 1.00 24.12 O ATOM 0 H SER A 117 -14.320 -12.008 6.868 1.00 2.40 H new ATOM 0 HA SER A 117 -11.648 -11.029 7.314 1.00 5.12 H new ATOM 0 HB2 SER A 117 -12.838 -13.831 7.589 1.00 55.50 H new ATOM 0 HB3 SER A 117 -11.288 -13.319 8.226 1.00 55.50 H new ATOM 0 HG SER A 117 -12.966 -13.241 9.829 1.00 24.12 H new ATOM 1876 N ILE A 118 -12.270 -12.859 4.682 1.00 31.44 N ATOM 1877 CA ILE A 118 -11.706 -13.400 3.433 1.00 21.23 C ATOM 1878 C ILE A 118 -10.846 -12.360 2.692 1.00 33.21 C ATOM 1879 O ILE A 118 -9.799 -12.691 2.132 1.00 55.25 O ATOM 1880 CB ILE A 118 -12.825 -13.903 2.476 1.00 73.02 C ATOM 1881 CG1 ILE A 118 -13.671 -14.994 3.159 1.00 42.25 C ATOM 1882 CG2 ILE A 118 -12.225 -14.425 1.166 1.00 64.13 C ATOM 1883 CD1 ILE A 118 -14.812 -15.511 2.305 1.00 44.33 C ATOM 0 H ILE A 118 -13.289 -12.869 4.718 1.00 31.44 H new ATOM 0 HA ILE A 118 -11.073 -14.238 3.723 1.00 21.23 H new ATOM 0 HB ILE A 118 -13.476 -13.061 2.240 1.00 73.02 H new ATOM 0 HG12 ILE A 118 -13.023 -15.829 3.426 1.00 42.25 H new ATOM 0 HG13 ILE A 118 -14.077 -14.596 4.089 1.00 42.25 H new ATOM 0 HG21 ILE A 118 -13.025 -14.772 0.512 1.00 64.13 H new ATOM 0 HG22 ILE A 118 -11.675 -13.624 0.673 1.00 64.13 H new ATOM 0 HG23 ILE A 118 -11.548 -15.252 1.380 1.00 64.13 H new ATOM 0 HD11 ILE A 118 -15.360 -16.276 2.855 1.00 44.33 H new ATOM 0 HD12 ILE A 118 -15.484 -14.689 2.059 1.00 44.33 H new ATOM 0 HD13 ILE A 118 -14.413 -15.941 1.386 1.00 44.33 H new ATOM 1895 N GLU A 119 -11.287 -11.102 2.706 1.00 41.45 N ATOM 1896 CA GLU A 119 -10.595 -10.027 1.979 1.00 51.23 C ATOM 1897 C GLU A 119 -9.142 -9.829 2.478 1.00 64.44 C ATOM 1898 O GLU A 119 -8.202 -9.937 1.687 1.00 21.24 O ATOM 1899 CB GLU A 119 -11.403 -8.720 2.064 1.00 32.25 C ATOM 1900 CG GLU A 119 -12.831 -8.859 1.545 1.00 64.25 C ATOM 1901 CD GLU A 119 -13.661 -7.600 1.738 1.00 32.41 C ATOM 1902 OE1 GLU A 119 -14.287 -7.454 2.809 1.00 72.13 O ATOM 1903 OE2 GLU A 119 -13.704 -6.760 0.814 1.00 1.42 O ATOM 0 H GLU A 119 -12.119 -10.798 3.211 1.00 41.45 H new ATOM 0 HA GLU A 119 -10.526 -10.323 0.932 1.00 51.23 H new ATOM 0 HB2 GLU A 119 -11.432 -8.385 3.101 1.00 32.25 H new ATOM 0 HB3 GLU A 119 -10.890 -7.946 1.493 1.00 32.25 H new ATOM 0 HG2 GLU A 119 -12.803 -9.109 0.485 1.00 64.25 H new ATOM 0 HG3 GLU A 119 -13.318 -9.690 2.056 1.00 64.25 H new ATOM 1910 N PRO A 120 -8.917 -9.556 3.791 1.00 62.34 N ATOM 1911 CA PRO A 120 -7.551 -9.451 4.337 1.00 34.33 C ATOM 1912 C PRO A 120 -6.788 -10.786 4.267 1.00 73.02 C ATOM 1913 O PRO A 120 -5.559 -10.803 4.196 1.00 20.22 O ATOM 1914 CB PRO A 120 -7.769 -9.019 5.796 1.00 24.04 C ATOM 1915 CG PRO A 120 -9.159 -9.447 6.118 1.00 64.11 C ATOM 1916 CD PRO A 120 -9.936 -9.315 4.835 1.00 23.31 C ATOM 0 HA PRO A 120 -6.941 -8.750 3.768 1.00 34.33 H new ATOM 0 HB2 PRO A 120 -7.046 -9.492 6.460 1.00 24.04 H new ATOM 0 HB3 PRO A 120 -7.651 -7.942 5.911 1.00 24.04 H new ATOM 0 HG2 PRO A 120 -9.177 -10.474 6.482 1.00 64.11 H new ATOM 0 HG3 PRO A 120 -9.589 -8.823 6.902 1.00 64.11 H new ATOM 0 HD2 PRO A 120 -10.747 -10.041 4.780 1.00 23.31 H new ATOM 0 HD3 PRO A 120 -10.386 -8.327 4.737 1.00 23.31 H new ATOM 1924 N LEU A 121 -7.522 -11.905 4.283 1.00 23.02 N ATOM 1925 CA LEU A 121 -6.910 -13.234 4.144 1.00 23.04 C ATOM 1926 C LEU A 121 -6.250 -13.374 2.761 1.00 33.05 C ATOM 1927 O LEU A 121 -5.095 -13.792 2.654 1.00 34.54 O ATOM 1928 CB LEU A 121 -7.969 -14.334 4.374 1.00 72.21 C ATOM 1929 CG LEU A 121 -7.432 -15.754 4.679 1.00 11.15 C ATOM 1930 CD1 LEU A 121 -8.545 -16.639 5.233 1.00 75.22 C ATOM 1931 CD2 LEU A 121 -6.819 -16.409 3.442 1.00 64.54 C ATOM 0 H LEU A 121 -8.536 -11.918 4.390 1.00 23.02 H new ATOM 0 HA LEU A 121 -6.133 -13.350 4.900 1.00 23.04 H new ATOM 0 HB2 LEU A 121 -8.608 -14.025 5.201 1.00 72.21 H new ATOM 0 HB3 LEU A 121 -8.601 -14.391 3.488 1.00 72.21 H new ATOM 0 HG LEU A 121 -6.647 -15.648 5.428 1.00 11.15 H new ATOM 0 HD11 LEU A 121 -8.150 -17.633 5.442 1.00 75.22 H new ATOM 0 HD12 LEU A 121 -8.933 -16.202 6.153 1.00 75.22 H new ATOM 0 HD13 LEU A 121 -9.348 -16.715 4.500 1.00 75.22 H new ATOM 0 HD21 LEU A 121 -6.455 -17.403 3.700 1.00 64.54 H new ATOM 0 HD22 LEU A 121 -7.575 -16.491 2.661 1.00 64.54 H new ATOM 0 HD23 LEU A 121 -5.989 -15.801 3.082 1.00 64.54 H new ATOM 1943 N ALA A 122 -6.985 -13.009 1.708 1.00 12.30 N ATOM 1944 CA ALA A 122 -6.439 -13.001 0.344 1.00 70.42 C ATOM 1945 C ALA A 122 -5.170 -12.139 0.264 1.00 65.43 C ATOM 1946 O ALA A 122 -4.187 -12.504 -0.393 1.00 22.12 O ATOM 1947 CB ALA A 122 -7.489 -12.497 -0.643 1.00 30.35 C ATOM 0 H ALA A 122 -7.960 -12.715 1.771 1.00 12.30 H new ATOM 0 HA ALA A 122 -6.170 -14.023 0.079 1.00 70.42 H new ATOM 0 HB1 ALA A 122 -7.071 -12.496 -1.650 1.00 30.35 H new ATOM 0 HB2 ALA A 122 -8.361 -13.151 -0.612 1.00 30.35 H new ATOM 0 HB3 ALA A 122 -7.786 -11.484 -0.373 1.00 30.35 H new ATOM 1953 N GLU A 123 -5.198 -10.995 0.949 1.00 60.34 N ATOM 1954 CA GLU A 123 -4.026 -10.122 1.045 1.00 63.23 C ATOM 1955 C GLU A 123 -2.906 -10.778 1.864 1.00 54.15 C ATOM 1956 O GLU A 123 -1.735 -10.611 1.553 1.00 1.02 O ATOM 1957 CB GLU A 123 -4.401 -8.767 1.662 1.00 64.41 C ATOM 1958 CG GLU A 123 -5.410 -7.973 0.840 1.00 25.13 C ATOM 1959 CD GLU A 123 -5.586 -6.551 1.348 1.00 62.32 C ATOM 1960 OE1 GLU A 123 -6.430 -6.326 2.243 1.00 54.34 O ATOM 1961 OE2 GLU A 123 -4.873 -5.646 0.860 1.00 22.42 O ATOM 0 H GLU A 123 -6.020 -10.651 1.446 1.00 60.34 H new ATOM 0 HA GLU A 123 -3.659 -9.958 0.032 1.00 63.23 H new ATOM 0 HB2 GLU A 123 -4.809 -8.933 2.659 1.00 64.41 H new ATOM 0 HB3 GLU A 123 -3.496 -8.171 1.783 1.00 64.41 H new ATOM 0 HG2 GLU A 123 -5.085 -7.946 -0.200 1.00 25.13 H new ATOM 0 HG3 GLU A 123 -6.373 -8.484 0.860 1.00 25.13 H new ATOM 1968 N SER A 124 -3.273 -11.532 2.902 1.00 53.13 N ATOM 1969 CA SER A 124 -2.287 -12.236 3.742 1.00 23.32 C ATOM 1970 C SER A 124 -1.520 -13.290 2.936 1.00 62.00 C ATOM 1971 O SER A 124 -0.299 -13.394 3.039 1.00 10.51 O ATOM 1972 CB SER A 124 -2.963 -12.911 4.944 1.00 30.30 C ATOM 1973 OG SER A 124 -3.569 -11.958 5.804 1.00 35.20 O ATOM 0 H SER A 124 -4.243 -11.674 3.185 1.00 53.13 H new ATOM 0 HA SER A 124 -1.584 -11.485 4.103 1.00 23.32 H new ATOM 0 HB2 SER A 124 -3.717 -13.615 4.591 1.00 30.30 H new ATOM 0 HB3 SER A 124 -2.225 -13.488 5.501 1.00 30.30 H new ATOM 0 HG SER A 124 -4.287 -11.494 5.324 1.00 35.20 H new ATOM 1979 N ILE A 125 -2.246 -14.076 2.140 1.00 21.15 N ATOM 1980 CA ILE A 125 -1.621 -15.061 1.247 1.00 23.01 C ATOM 1981 C ILE A 125 -0.584 -14.385 0.336 1.00 43.55 C ATOM 1982 O ILE A 125 0.564 -14.820 0.239 1.00 73.12 O ATOM 1983 CB ILE A 125 -2.683 -15.773 0.365 1.00 3.01 C ATOM 1984 CG1 ILE A 125 -3.757 -16.440 1.239 1.00 34.14 C ATOM 1985 CG2 ILE A 125 -2.029 -16.803 -0.556 1.00 32.35 C ATOM 1986 CD1 ILE A 125 -3.225 -17.522 2.155 1.00 62.34 C ATOM 0 H ILE A 125 -3.265 -14.052 2.093 1.00 21.15 H new ATOM 0 HA ILE A 125 -1.127 -15.802 1.875 1.00 23.01 H new ATOM 0 HB ILE A 125 -3.163 -15.017 -0.256 1.00 3.01 H new ATOM 0 HG12 ILE A 125 -4.245 -15.675 1.843 1.00 34.14 H new ATOM 0 HG13 ILE A 125 -4.521 -16.870 0.592 1.00 34.14 H new ATOM 0 HG21 ILE A 125 -2.795 -17.287 -1.162 1.00 32.35 H new ATOM 0 HG22 ILE A 125 -1.311 -16.305 -1.208 1.00 32.35 H new ATOM 0 HG23 ILE A 125 -1.514 -17.553 0.044 1.00 32.35 H new ATOM 0 HD11 ILE A 125 -4.045 -17.942 2.737 1.00 62.34 H new ATOM 0 HD12 ILE A 125 -2.763 -18.309 1.559 1.00 62.34 H new ATOM 0 HD13 ILE A 125 -2.483 -17.095 2.830 1.00 62.34 H new ATOM 1998 N THR A 126 -1.009 -13.304 -0.314 1.00 23.15 N ATOM 1999 CA THR A 126 -0.135 -12.526 -1.201 1.00 24.34 C ATOM 2000 C THR A 126 0.970 -11.805 -0.413 1.00 61.15 C ATOM 2001 O THR A 126 2.089 -11.640 -0.899 1.00 41.01 O ATOM 2002 CB THR A 126 -0.950 -11.477 -1.997 1.00 41.34 C ATOM 2003 OG1 THR A 126 -2.064 -12.109 -2.648 1.00 21.31 O ATOM 2004 CG2 THR A 126 -0.086 -10.781 -3.044 1.00 44.53 C ATOM 0 H THR A 126 -1.960 -12.942 -0.245 1.00 23.15 H new ATOM 0 HA THR A 126 0.326 -13.232 -1.891 1.00 24.34 H new ATOM 0 HB THR A 126 -1.309 -10.729 -1.290 1.00 41.34 H new ATOM 0 HG1 THR A 126 -2.765 -12.297 -1.989 1.00 21.31 H new ATOM 0 HG21 THR A 126 -0.688 -10.051 -3.585 1.00 44.53 H new ATOM 0 HG22 THR A 126 0.744 -10.274 -2.552 1.00 44.53 H new ATOM 0 HG23 THR A 126 0.304 -11.520 -3.744 1.00 44.53 H new ATOM 2012 N ASP A 127 0.647 -11.384 0.809 1.00 24.44 N ATOM 2013 CA ASP A 127 1.593 -10.659 1.661 1.00 23.45 C ATOM 2014 C ASP A 127 2.791 -11.548 2.019 1.00 11.13 C ATOM 2015 O ASP A 127 3.937 -11.172 1.790 1.00 41.11 O ATOM 2016 CB ASP A 127 0.883 -10.182 2.937 1.00 51.30 C ATOM 2017 CG ASP A 127 1.714 -9.206 3.749 1.00 41.13 C ATOM 2018 OD1 ASP A 127 2.515 -9.651 4.593 1.00 32.41 O ATOM 2019 OD2 ASP A 127 1.564 -7.982 3.552 1.00 10.42 O ATOM 0 H ASP A 127 -0.268 -11.533 1.235 1.00 24.44 H new ATOM 0 HA ASP A 127 1.964 -9.792 1.114 1.00 23.45 H new ATOM 0 HB2 ASP A 127 -0.061 -9.709 2.666 1.00 51.30 H new ATOM 0 HB3 ASP A 127 0.640 -11.046 3.556 1.00 51.30 H new ATOM 2024 N VAL A 128 2.514 -12.743 2.545 1.00 41.34 N ATOM 2025 CA VAL A 128 3.571 -13.710 2.871 1.00 42.40 C ATOM 2026 C VAL A 128 4.332 -14.136 1.604 1.00 10.31 C ATOM 2027 O VAL A 128 5.562 -14.245 1.604 1.00 23.11 O ATOM 2028 CB VAL A 128 2.993 -14.967 3.574 1.00 62.02 C ATOM 2029 CG1 VAL A 128 4.093 -15.986 3.875 1.00 13.13 C ATOM 2030 CG2 VAL A 128 2.253 -14.577 4.854 1.00 70.23 C ATOM 0 H VAL A 128 1.570 -13.066 2.755 1.00 41.34 H new ATOM 0 HA VAL A 128 4.260 -13.215 3.555 1.00 42.40 H new ATOM 0 HB VAL A 128 2.281 -15.434 2.894 1.00 62.02 H new ATOM 0 HG11 VAL A 128 3.658 -16.856 4.367 1.00 13.13 H new ATOM 0 HG12 VAL A 128 4.567 -16.295 2.944 1.00 13.13 H new ATOM 0 HG13 VAL A 128 4.839 -15.534 4.529 1.00 13.13 H new ATOM 0 HG21 VAL A 128 1.855 -15.472 5.332 1.00 70.23 H new ATOM 0 HG22 VAL A 128 2.942 -14.078 5.535 1.00 70.23 H new ATOM 0 HG23 VAL A 128 1.433 -13.902 4.609 1.00 70.23 H new ATOM 2040 N LEU A 129 3.583 -14.361 0.524 1.00 20.11 N ATOM 2041 CA LEU A 129 4.162 -14.710 -0.777 1.00 2.41 C ATOM 2042 C LEU A 129 5.210 -13.671 -1.218 1.00 75.23 C ATOM 2043 O LEU A 129 6.353 -14.010 -1.522 1.00 44.03 O ATOM 2044 CB LEU A 129 3.038 -14.798 -1.822 1.00 55.44 C ATOM 2045 CG LEU A 129 3.464 -15.251 -3.226 1.00 4.42 C ATOM 2046 CD1 LEU A 129 3.984 -16.682 -3.192 1.00 3.44 C ATOM 2047 CD2 LEU A 129 2.303 -15.118 -4.210 1.00 64.22 C ATOM 0 H LEU A 129 2.564 -14.307 0.524 1.00 20.11 H new ATOM 0 HA LEU A 129 4.664 -15.673 -0.688 1.00 2.41 H new ATOM 0 HB2 LEU A 129 2.278 -15.487 -1.453 1.00 55.44 H new ATOM 0 HB3 LEU A 129 2.567 -13.819 -1.904 1.00 55.44 H new ATOM 0 HG LEU A 129 4.272 -14.603 -3.566 1.00 4.42 H new ATOM 0 HD11 LEU A 129 4.281 -16.985 -4.196 1.00 3.44 H new ATOM 0 HD12 LEU A 129 4.845 -16.741 -2.526 1.00 3.44 H new ATOM 0 HD13 LEU A 129 3.199 -17.346 -2.830 1.00 3.44 H new ATOM 0 HD21 LEU A 129 2.625 -15.444 -5.199 1.00 64.22 H new ATOM 0 HD22 LEU A 129 1.471 -15.738 -3.877 1.00 64.22 H new ATOM 0 HD23 LEU A 129 1.984 -14.077 -4.257 1.00 64.22 H new ATOM 2059 N VAL A 130 4.814 -12.402 -1.216 1.00 65.32 N ATOM 2060 CA VAL A 130 5.693 -11.303 -1.633 1.00 11.23 C ATOM 2061 C VAL A 130 6.739 -10.961 -0.552 1.00 73.32 C ATOM 2062 O VAL A 130 7.833 -10.492 -0.859 1.00 50.51 O ATOM 2063 CB VAL A 130 4.856 -10.043 -1.984 1.00 24.45 C ATOM 2064 CG1 VAL A 130 5.744 -8.840 -2.299 1.00 43.53 C ATOM 2065 CG2 VAL A 130 3.920 -10.342 -3.157 1.00 35.43 C ATOM 0 H VAL A 130 3.882 -12.103 -0.928 1.00 65.32 H new ATOM 0 HA VAL A 130 6.231 -11.636 -2.521 1.00 11.23 H new ATOM 0 HB VAL A 130 4.260 -9.786 -1.109 1.00 24.45 H new ATOM 0 HG11 VAL A 130 5.119 -7.980 -2.539 1.00 43.53 H new ATOM 0 HG12 VAL A 130 6.363 -8.608 -1.433 1.00 43.53 H new ATOM 0 HG13 VAL A 130 6.384 -9.073 -3.150 1.00 43.53 H new ATOM 0 HG21 VAL A 130 3.338 -9.451 -3.394 1.00 35.43 H new ATOM 0 HG22 VAL A 130 4.509 -10.633 -4.027 1.00 35.43 H new ATOM 0 HG23 VAL A 130 3.246 -11.155 -2.886 1.00 35.43 H new ATOM 2075 N ARG A 131 6.403 -11.227 0.707 1.00 15.44 N ATOM 2076 CA ARG A 131 7.299 -10.943 1.838 1.00 62.24 C ATOM 2077 C ARG A 131 8.675 -11.597 1.666 1.00 51.43 C ATOM 2078 O ARG A 131 9.701 -11.018 2.032 1.00 61.32 O ATOM 2079 CB ARG A 131 6.654 -11.430 3.150 1.00 62.01 C ATOM 2080 CG ARG A 131 6.327 -10.313 4.133 1.00 42.43 C ATOM 2081 CD ARG A 131 5.584 -9.166 3.453 1.00 0.40 C ATOM 2082 NE ARG A 131 5.155 -8.136 4.395 1.00 75.05 N ATOM 2083 CZ ARG A 131 5.856 -7.076 4.701 1.00 43.43 C ATOM 2084 NH1 ARG A 131 7.065 -6.930 4.256 1.00 74.35 N ATOM 2085 NH2 ARG A 131 5.347 -6.172 5.472 1.00 24.22 N ATOM 0 H ARG A 131 5.511 -11.642 0.977 1.00 15.44 H new ATOM 0 HA ARG A 131 7.449 -9.864 1.872 1.00 62.24 H new ATOM 0 HB2 ARG A 131 5.738 -11.971 2.913 1.00 62.01 H new ATOM 0 HB3 ARG A 131 7.327 -12.139 3.632 1.00 62.01 H new ATOM 0 HG2 ARG A 131 5.719 -10.710 4.946 1.00 42.43 H new ATOM 0 HG3 ARG A 131 7.249 -9.937 4.578 1.00 42.43 H new ATOM 0 HD2 ARG A 131 6.230 -8.717 2.699 1.00 0.40 H new ATOM 0 HD3 ARG A 131 4.712 -9.562 2.932 1.00 0.40 H new ATOM 0 HE ARG A 131 4.247 -8.251 4.845 1.00 75.05 H new ATOM 0 HH11 ARG A 131 7.479 -7.647 3.660 1.00 74.35 H new ATOM 0 HH12 ARG A 131 7.602 -6.098 4.502 1.00 74.35 H new ATOM 0 HH21 ARG A 131 4.402 -6.288 5.839 1.00 24.22 H new ATOM 0 HH22 ARG A 131 5.890 -5.343 5.714 1.00 24.22 H new ATOM 2099 N THR A 132 8.688 -12.809 1.123 1.00 33.41 N ATOM 2100 CA THR A 132 9.931 -13.580 0.988 1.00 24.23 C ATOM 2101 C THR A 132 10.140 -14.149 -0.428 1.00 21.51 C ATOM 2102 O THR A 132 11.265 -14.175 -0.926 1.00 62.24 O ATOM 2103 CB THR A 132 9.990 -14.725 2.030 1.00 64.34 C ATOM 2104 OG1 THR A 132 10.972 -15.704 1.655 1.00 33.44 O ATOM 2105 CG2 THR A 132 8.625 -15.386 2.209 1.00 43.40 C ATOM 0 H THR A 132 7.857 -13.283 0.768 1.00 33.41 H new ATOM 0 HA THR A 132 10.742 -12.876 1.175 1.00 24.23 H new ATOM 0 HB THR A 132 10.280 -14.286 2.985 1.00 64.34 H new ATOM 0 HG1 THR A 132 11.499 -15.957 2.442 1.00 33.44 H new ATOM 0 HG21 THR A 132 8.702 -16.185 2.947 1.00 43.40 H new ATOM 0 HG22 THR A 132 7.904 -14.644 2.551 1.00 43.40 H new ATOM 0 HG23 THR A 132 8.294 -15.802 1.257 1.00 43.40 H new ATOM 2113 N LYS A 133 9.063 -14.588 -1.084 1.00 33.21 N ATOM 2114 CA LYS A 133 9.164 -15.199 -2.423 1.00 23.03 C ATOM 2115 C LYS A 133 8.985 -14.176 -3.568 1.00 2.24 C ATOM 2116 O LYS A 133 8.952 -14.560 -4.737 1.00 3.04 O ATOM 2117 CB LYS A 133 8.128 -16.335 -2.568 1.00 4.40 C ATOM 2118 CG LYS A 133 8.627 -17.733 -2.181 1.00 40.53 C ATOM 2119 CD LYS A 133 9.094 -17.838 -0.721 1.00 24.22 C ATOM 2120 CE LYS A 133 10.617 -17.917 -0.610 1.00 31.42 C ATOM 2121 NZ LYS A 133 11.065 -18.181 0.783 1.00 33.13 N ATOM 0 H LYS A 133 8.113 -14.535 -0.717 1.00 33.21 H new ATOM 0 HA LYS A 133 10.174 -15.601 -2.509 1.00 23.03 H new ATOM 0 HB2 LYS A 133 7.261 -16.094 -1.953 1.00 4.40 H new ATOM 0 HB3 LYS A 133 7.787 -16.363 -3.603 1.00 4.40 H new ATOM 0 HG2 LYS A 133 7.828 -18.455 -2.351 1.00 40.53 H new ATOM 0 HG3 LYS A 133 9.451 -18.010 -2.838 1.00 40.53 H new ATOM 0 HD2 LYS A 133 8.734 -16.974 -0.162 1.00 24.22 H new ATOM 0 HD3 LYS A 133 8.651 -18.721 -0.261 1.00 24.22 H new ATOM 0 HE2 LYS A 133 10.987 -18.706 -1.265 1.00 31.42 H new ATOM 0 HE3 LYS A 133 11.054 -16.982 -0.960 1.00 31.42 H new ATOM 0 HZ1 LYS A 133 12.028 -18.573 0.769 1.00 33.13 H new ATOM 0 HZ2 LYS A 133 11.061 -17.292 1.323 1.00 33.13 H new ATOM 0 HZ3 LYS A 133 10.420 -18.862 1.232 1.00 33.13 H new ATOM 2135 N ARG A 134 8.893 -12.883 -3.237 1.00 31.00 N ATOM 2136 CA ARG A 134 8.698 -11.822 -4.248 1.00 65.41 C ATOM 2137 C ARG A 134 9.691 -11.925 -5.415 1.00 22.11 C ATOM 2138 O ARG A 134 9.303 -12.148 -6.562 1.00 4.40 O ATOM 2139 CB ARG A 134 8.831 -10.436 -3.603 1.00 11.12 C ATOM 2140 CG ARG A 134 8.867 -9.289 -4.610 1.00 2.45 C ATOM 2141 CD ARG A 134 8.909 -7.927 -3.928 1.00 74.31 C ATOM 2142 NE ARG A 134 10.031 -7.812 -2.998 1.00 64.00 N ATOM 2143 CZ ARG A 134 10.967 -6.908 -3.078 1.00 4.32 C ATOM 2144 NH1 ARG A 134 10.988 -6.057 -4.054 1.00 2.31 N ATOM 2145 NH2 ARG A 134 11.889 -6.869 -2.181 1.00 23.34 N ATOM 0 H ARG A 134 8.950 -12.540 -2.278 1.00 31.00 H new ATOM 0 HA ARG A 134 7.693 -11.960 -4.648 1.00 65.41 H new ATOM 0 HB2 ARG A 134 7.996 -10.282 -2.920 1.00 11.12 H new ATOM 0 HB3 ARG A 134 9.741 -10.410 -3.004 1.00 11.12 H new ATOM 0 HG2 ARG A 134 9.741 -9.399 -5.253 1.00 2.45 H new ATOM 0 HG3 ARG A 134 7.989 -9.345 -5.253 1.00 2.45 H new ATOM 0 HD2 ARG A 134 8.984 -7.146 -4.684 1.00 74.31 H new ATOM 0 HD3 ARG A 134 7.975 -7.762 -3.391 1.00 74.31 H new ATOM 0 HE ARG A 134 10.085 -8.485 -2.234 1.00 64.00 H new ATOM 0 HH11 ARG A 134 10.266 -6.088 -4.774 1.00 2.31 H new ATOM 0 HH12 ARG A 134 11.727 -5.355 -4.103 1.00 2.31 H new ATOM 0 HH21 ARG A 134 11.884 -7.542 -1.415 1.00 23.34 H new ATOM 0 HH22 ARG A 134 12.625 -6.165 -2.236 1.00 23.34 H new ATOM 2159 N ASP A 135 10.971 -11.747 -5.114 1.00 34.32 N ATOM 2160 CA ASP A 135 12.014 -11.778 -6.136 1.00 75.42 C ATOM 2161 C ASP A 135 12.029 -13.109 -6.899 1.00 31.01 C ATOM 2162 O ASP A 135 12.305 -13.139 -8.093 1.00 74.54 O ATOM 2163 CB ASP A 135 13.369 -11.502 -5.495 1.00 71.43 C ATOM 2164 CG ASP A 135 13.435 -10.102 -4.913 1.00 54.51 C ATOM 2165 OD1 ASP A 135 13.831 -9.168 -5.644 1.00 32.15 O ATOM 2166 OD2 ASP A 135 13.078 -9.925 -3.730 1.00 62.35 O ATOM 0 H ASP A 135 11.314 -11.579 -4.168 1.00 34.32 H new ATOM 0 HA ASP A 135 11.798 -10.998 -6.866 1.00 75.42 H new ATOM 0 HB2 ASP A 135 13.556 -12.233 -4.709 1.00 71.43 H new ATOM 0 HB3 ASP A 135 14.156 -11.625 -6.239 1.00 71.43 H new ATOM 2171 N TRP A 136 11.711 -14.202 -6.217 1.00 24.10 N ATOM 2172 CA TRP A 136 11.628 -15.512 -6.871 1.00 4.25 C ATOM 2173 C TRP A 136 10.476 -15.554 -7.889 1.00 64.03 C ATOM 2174 O TRP A 136 10.599 -16.170 -8.948 1.00 51.45 O ATOM 2175 CB TRP A 136 11.472 -16.626 -5.829 1.00 60.04 C ATOM 2176 CG TRP A 136 12.619 -16.690 -4.858 1.00 32.10 C ATOM 2177 CD1 TRP A 136 12.552 -16.597 -3.499 1.00 21.13 C ATOM 2178 CD2 TRP A 136 14.009 -16.841 -5.180 1.00 32.05 C ATOM 2179 NE1 TRP A 136 13.808 -16.690 -2.954 1.00 33.43 N ATOM 2180 CE2 TRP A 136 14.720 -16.838 -3.966 1.00 52.44 C ATOM 2181 CE3 TRP A 136 14.721 -16.983 -6.376 1.00 50.50 C ATOM 2182 CZ2 TRP A 136 16.106 -16.970 -3.914 1.00 43.14 C ATOM 2183 CZ3 TRP A 136 16.095 -17.112 -6.323 1.00 74.11 C ATOM 2184 CH2 TRP A 136 16.775 -17.105 -5.099 1.00 64.31 C ATOM 0 H TRP A 136 11.507 -14.213 -5.218 1.00 24.10 H new ATOM 0 HA TRP A 136 12.559 -15.675 -7.414 1.00 4.25 H new ATOM 0 HB2 TRP A 136 10.545 -16.472 -5.277 1.00 60.04 H new ATOM 0 HB3 TRP A 136 11.383 -17.584 -6.341 1.00 60.04 H new ATOM 0 HD1 TRP A 136 11.641 -16.469 -2.933 1.00 21.13 H new ATOM 0 HE1 TRP A 136 14.027 -16.655 -1.958 1.00 33.43 H new ATOM 0 HE3 TRP A 136 14.205 -16.992 -7.325 1.00 50.50 H new ATOM 0 HZ2 TRP A 136 16.633 -16.966 -2.971 1.00 43.14 H new ATOM 0 HZ3 TRP A 136 16.654 -17.220 -7.241 1.00 74.11 H new ATOM 0 HH2 TRP A 136 17.850 -17.208 -5.091 1.00 64.31 H new ATOM 2195 N LEU A 137 9.365 -14.889 -7.568 1.00 63.15 N ATOM 2196 CA LEU A 137 8.226 -14.776 -8.492 1.00 1.22 C ATOM 2197 C LEU A 137 8.643 -14.131 -9.829 1.00 44.43 C ATOM 2198 O LEU A 137 8.329 -14.644 -10.900 1.00 72.00 O ATOM 2199 CB LEU A 137 7.097 -13.949 -7.853 1.00 71.32 C ATOM 2200 CG LEU A 137 6.332 -14.620 -6.698 1.00 13.33 C ATOM 2201 CD1 LEU A 137 5.452 -13.599 -5.978 1.00 24.11 C ATOM 2202 CD2 LEU A 137 5.483 -15.780 -7.215 1.00 64.32 C ATOM 0 H LEU A 137 9.226 -14.418 -6.674 1.00 63.15 H new ATOM 0 HA LEU A 137 7.869 -15.786 -8.695 1.00 1.22 H new ATOM 0 HB2 LEU A 137 7.523 -13.015 -7.485 1.00 71.32 H new ATOM 0 HB3 LEU A 137 6.381 -13.688 -8.632 1.00 71.32 H new ATOM 0 HG LEU A 137 7.060 -15.015 -5.990 1.00 13.33 H new ATOM 0 HD11 LEU A 137 4.918 -14.089 -5.164 1.00 24.11 H new ATOM 0 HD12 LEU A 137 6.076 -12.801 -5.574 1.00 24.11 H new ATOM 0 HD13 LEU A 137 4.734 -13.177 -6.681 1.00 24.11 H new ATOM 0 HD21 LEU A 137 4.951 -16.240 -6.383 1.00 64.32 H new ATOM 0 HD22 LEU A 137 4.764 -15.408 -7.944 1.00 64.32 H new ATOM 0 HD23 LEU A 137 6.128 -16.521 -7.687 1.00 64.32 H new ATOM 2214 N VAL A 138 9.349 -13.003 -9.763 1.00 5.45 N ATOM 2215 CA VAL A 138 9.787 -12.296 -10.978 1.00 73.51 C ATOM 2216 C VAL A 138 11.012 -12.968 -11.638 1.00 60.24 C ATOM 2217 O VAL A 138 11.104 -13.041 -12.865 1.00 3.34 O ATOM 2218 CB VAL A 138 10.092 -10.799 -10.688 1.00 64.35 C ATOM 2219 CG1 VAL A 138 11.214 -10.645 -9.662 1.00 42.31 C ATOM 2220 CG2 VAL A 138 10.428 -10.051 -11.979 1.00 3.45 C ATOM 0 H VAL A 138 9.631 -12.557 -8.890 1.00 5.45 H new ATOM 0 HA VAL A 138 8.956 -12.353 -11.681 1.00 73.51 H new ATOM 0 HB VAL A 138 9.192 -10.356 -10.261 1.00 64.35 H new ATOM 0 HG11 VAL A 138 11.401 -9.586 -9.483 1.00 42.31 H new ATOM 0 HG12 VAL A 138 10.921 -11.124 -8.728 1.00 42.31 H new ATOM 0 HG13 VAL A 138 12.121 -11.114 -10.042 1.00 42.31 H new ATOM 0 HG21 VAL A 138 10.637 -9.006 -11.750 1.00 3.45 H new ATOM 0 HG22 VAL A 138 11.304 -10.503 -12.444 1.00 3.45 H new ATOM 0 HG23 VAL A 138 9.582 -10.110 -12.664 1.00 3.45 H new ATOM 2230 N LYS A 139 11.943 -13.468 -10.826 1.00 12.11 N ATOM 2231 CA LYS A 139 13.164 -14.107 -11.346 1.00 34.03 C ATOM 2232 C LYS A 139 12.868 -15.450 -12.024 1.00 15.11 C ATOM 2233 O LYS A 139 13.307 -15.699 -13.148 1.00 20.44 O ATOM 2234 CB LYS A 139 14.194 -14.311 -10.224 1.00 34.33 C ATOM 2235 CG LYS A 139 14.827 -13.017 -9.724 1.00 43.31 C ATOM 2236 CD LYS A 139 15.520 -12.259 -10.853 1.00 31.22 C ATOM 2237 CE LYS A 139 16.255 -11.027 -10.344 1.00 61.34 C ATOM 2238 NZ LYS A 139 16.971 -10.317 -11.433 1.00 73.45 N ATOM 0 H LYS A 139 11.881 -13.446 -9.808 1.00 12.11 H new ATOM 0 HA LYS A 139 13.576 -13.433 -12.097 1.00 34.03 H new ATOM 0 HB2 LYS A 139 13.710 -14.814 -9.387 1.00 34.33 H new ATOM 0 HB3 LYS A 139 14.981 -14.974 -10.583 1.00 34.33 H new ATOM 0 HG2 LYS A 139 14.060 -12.385 -9.277 1.00 43.31 H new ATOM 0 HG3 LYS A 139 15.549 -13.244 -8.940 1.00 43.31 H new ATOM 0 HD2 LYS A 139 16.226 -12.921 -11.355 1.00 31.22 H new ATOM 0 HD3 LYS A 139 14.781 -11.959 -11.596 1.00 31.22 H new ATOM 0 HE2 LYS A 139 15.543 -10.348 -9.875 1.00 61.34 H new ATOM 0 HE3 LYS A 139 16.968 -11.322 -9.574 1.00 61.34 H new ATOM 0 HZ1 LYS A 139 17.458 -9.485 -11.043 1.00 73.45 H new ATOM 0 HZ2 LYS A 139 17.669 -10.956 -11.864 1.00 73.45 H new ATOM 0 HZ3 LYS A 139 16.288 -10.012 -12.156 1.00 73.45 H new ATOM 2252 N GLN A 140 12.130 -16.319 -11.338 1.00 72.14 N ATOM 2253 CA GLN A 140 11.786 -17.636 -11.886 1.00 2.51 C ATOM 2254 C GLN A 140 10.529 -17.564 -12.768 1.00 40.11 C ATOM 2255 O GLN A 140 10.073 -18.579 -13.297 1.00 2.14 O ATOM 2256 CB GLN A 140 11.563 -18.653 -10.754 1.00 34.21 C ATOM 2257 CG GLN A 140 12.705 -18.743 -9.742 1.00 34.44 C ATOM 2258 CD GLN A 140 14.059 -18.988 -10.387 1.00 45.14 C ATOM 2259 OE1 GLN A 140 14.454 -20.126 -10.620 1.00 22.10 O ATOM 2260 NE2 GLN A 140 14.788 -17.927 -10.666 1.00 33.15 N ATOM 0 H GLN A 140 11.758 -16.140 -10.405 1.00 72.14 H new ATOM 0 HA GLN A 140 12.624 -17.962 -12.502 1.00 2.51 H new ATOM 0 HB2 GLN A 140 10.647 -18.392 -10.225 1.00 34.21 H new ATOM 0 HB3 GLN A 140 11.407 -19.638 -11.194 1.00 34.21 H new ATOM 0 HG2 GLN A 140 12.746 -17.818 -9.167 1.00 34.44 H new ATOM 0 HG3 GLN A 140 12.495 -19.547 -9.037 1.00 34.44 H new ATOM 0 HE21 GLN A 140 14.431 -16.994 -10.460 1.00 33.15 H new ATOM 0 HE22 GLN A 140 15.710 -18.038 -11.088 1.00 33.15 H new ATOM 2269 N ARG A 141 9.989 -16.352 -12.923 1.00 32.32 N ATOM 2270 CA ARG A 141 8.740 -16.128 -13.659 1.00 74.30 C ATOM 2271 C ARG A 141 7.629 -17.057 -13.149 1.00 75.31 C ATOM 2272 O ARG A 141 6.979 -17.752 -13.927 1.00 42.31 O ATOM 2273 CB ARG A 141 8.954 -16.304 -15.171 1.00 60.15 C ATOM 2274 CG ARG A 141 10.032 -15.388 -15.748 1.00 24.24 C ATOM 2275 CD ARG A 141 9.787 -15.082 -17.222 1.00 1.03 C ATOM 2276 NE ARG A 141 8.483 -14.449 -17.424 1.00 64.31 N ATOM 2277 CZ ARG A 141 8.309 -13.185 -17.697 1.00 51.22 C ATOM 2278 NH1 ARG A 141 9.321 -12.395 -17.865 1.00 41.12 N ATOM 2279 NH2 ARG A 141 7.111 -12.716 -17.808 1.00 11.23 N ATOM 0 H ARG A 141 10.403 -15.501 -12.544 1.00 32.32 H new ATOM 0 HA ARG A 141 8.425 -15.100 -13.482 1.00 74.30 H new ATOM 0 HB2 ARG A 141 9.224 -17.341 -15.373 1.00 60.15 H new ATOM 0 HB3 ARG A 141 8.013 -16.113 -15.687 1.00 60.15 H new ATOM 0 HG2 ARG A 141 10.058 -14.456 -15.183 1.00 24.24 H new ATOM 0 HG3 ARG A 141 11.009 -15.858 -15.632 1.00 24.24 H new ATOM 0 HD2 ARG A 141 10.574 -14.426 -17.595 1.00 1.03 H new ATOM 0 HD3 ARG A 141 9.840 -16.004 -17.801 1.00 1.03 H new ATOM 0 HE ARG A 141 7.653 -15.037 -17.346 1.00 64.31 H new ATOM 0 HH11 ARG A 141 10.271 -12.758 -17.784 1.00 41.12 H new ATOM 0 HH12 ARG A 141 9.169 -11.409 -18.078 1.00 41.12 H new ATOM 0 HH21 ARG A 141 6.308 -13.333 -17.682 1.00 11.23 H new ATOM 0 HH22 ARG A 141 6.967 -11.729 -18.021 1.00 11.23 H new ATOM 2293 N GLY A 142 7.416 -17.030 -11.832 1.00 34.11 N ATOM 2294 CA GLY A 142 6.485 -17.939 -11.166 1.00 50.22 C ATOM 2295 C GLY A 142 5.166 -18.165 -11.902 1.00 3.32 C ATOM 2296 O GLY A 142 4.840 -19.294 -12.248 1.00 44.12 O ATOM 0 H GLY A 142 7.883 -16.379 -11.200 1.00 34.11 H new ATOM 0 HA2 GLY A 142 6.977 -18.902 -11.029 1.00 50.22 H new ATOM 0 HA3 GLY A 142 6.267 -17.548 -10.172 1.00 50.22 H new ATOM 2300 N TRP A 143 4.418 -17.098 -12.163 1.00 61.20 N ATOM 2301 CA TRP A 143 3.088 -17.227 -12.781 1.00 24.35 C ATOM 2302 C TRP A 143 3.151 -17.806 -14.211 1.00 53.14 C ATOM 2303 O TRP A 143 2.150 -18.299 -14.735 1.00 64.53 O ATOM 2304 CB TRP A 143 2.364 -15.872 -12.765 1.00 70.44 C ATOM 2305 CG TRP A 143 2.184 -15.323 -11.373 1.00 10.43 C ATOM 2306 CD1 TRP A 143 2.577 -14.097 -10.907 1.00 24.33 C ATOM 2307 CD2 TRP A 143 1.584 -15.999 -10.254 1.00 51.34 C ATOM 2308 NE1 TRP A 143 2.244 -13.968 -9.579 1.00 72.01 N ATOM 2309 CE2 TRP A 143 1.638 -15.120 -9.157 1.00 40.45 C ATOM 2310 CE3 TRP A 143 1.001 -17.261 -10.075 1.00 14.44 C ATOM 2311 CZ2 TRP A 143 1.135 -15.459 -7.904 1.00 50.52 C ATOM 2312 CZ3 TRP A 143 0.503 -17.595 -8.828 1.00 33.25 C ATOM 2313 CH2 TRP A 143 0.572 -16.695 -7.757 1.00 11.15 C ATOM 0 H TRP A 143 4.700 -16.139 -11.961 1.00 61.20 H new ATOM 0 HA TRP A 143 2.520 -17.941 -12.185 1.00 24.35 H new ATOM 0 HB2 TRP A 143 2.929 -15.156 -13.363 1.00 70.44 H new ATOM 0 HB3 TRP A 143 1.387 -15.981 -13.237 1.00 70.44 H new ATOM 0 HD1 TRP A 143 3.076 -13.342 -11.496 1.00 24.33 H new ATOM 0 HE1 TRP A 143 2.420 -13.146 -9.002 1.00 72.01 H new ATOM 0 HE3 TRP A 143 0.942 -17.960 -10.896 1.00 14.44 H new ATOM 0 HZ2 TRP A 143 1.188 -14.768 -7.076 1.00 50.52 H new ATOM 0 HZ3 TRP A 143 0.054 -18.566 -8.678 1.00 33.25 H new ATOM 0 HH2 TRP A 143 0.172 -16.984 -6.796 1.00 11.15 H new ATOM 2324 N ASP A 144 4.318 -17.723 -14.851 1.00 2.03 N ATOM 2325 CA ASP A 144 4.543 -18.390 -16.141 1.00 42.34 C ATOM 2326 C ASP A 144 5.008 -19.850 -15.950 1.00 73.01 C ATOM 2327 O ASP A 144 4.370 -20.789 -16.438 1.00 35.22 O ATOM 2328 CB ASP A 144 5.565 -17.613 -16.981 1.00 61.15 C ATOM 2329 CG ASP A 144 5.051 -16.246 -17.400 1.00 54.41 C ATOM 2330 OD1 ASP A 144 4.027 -16.186 -18.115 1.00 74.20 O ATOM 2331 OD2 ASP A 144 5.675 -15.225 -17.037 1.00 33.55 O ATOM 0 H ASP A 144 5.122 -17.203 -14.501 1.00 2.03 H new ATOM 0 HA ASP A 144 3.591 -18.407 -16.672 1.00 42.34 H new ATOM 0 HB2 ASP A 144 6.485 -17.493 -16.409 1.00 61.15 H new ATOM 0 HB3 ASP A 144 5.816 -18.192 -17.870 1.00 61.15 H new ATOM 2336 N GLY A 145 6.122 -20.029 -15.235 1.00 54.25 N ATOM 2337 CA GLY A 145 6.704 -21.358 -15.026 1.00 55.24 C ATOM 2338 C GLY A 145 5.786 -22.329 -14.287 1.00 21.31 C ATOM 2339 O GLY A 145 5.794 -23.529 -14.560 1.00 63.24 O ATOM 0 H GLY A 145 6.639 -19.270 -14.791 1.00 54.25 H new ATOM 0 HA2 GLY A 145 6.964 -21.786 -15.994 1.00 55.24 H new ATOM 0 HA3 GLY A 145 7.632 -21.253 -14.464 1.00 55.24 H new ATOM 2343 N PHE A 146 5.001 -21.810 -13.351 1.00 10.32 N ATOM 2344 CA PHE A 146 4.032 -22.613 -12.592 1.00 61.11 C ATOM 2345 C PHE A 146 3.020 -23.310 -13.519 1.00 44.21 C ATOM 2346 O PHE A 146 2.631 -24.457 -13.289 1.00 63.20 O ATOM 2347 CB PHE A 146 3.307 -21.703 -11.587 1.00 65.54 C ATOM 2348 CG PHE A 146 2.113 -22.326 -10.912 1.00 13.24 C ATOM 2349 CD1 PHE A 146 2.274 -23.284 -9.922 1.00 62.42 C ATOM 2350 CD2 PHE A 146 0.825 -21.947 -11.269 1.00 24.41 C ATOM 2351 CE1 PHE A 146 1.176 -23.850 -9.303 1.00 35.15 C ATOM 2352 CE2 PHE A 146 -0.274 -22.510 -10.653 1.00 45.23 C ATOM 2353 CZ PHE A 146 -0.100 -23.464 -9.668 1.00 14.43 C ATOM 0 H PHE A 146 5.013 -20.823 -13.092 1.00 10.32 H new ATOM 0 HA PHE A 146 4.570 -23.398 -12.060 1.00 61.11 H new ATOM 0 HB2 PHE A 146 4.018 -21.393 -10.821 1.00 65.54 H new ATOM 0 HB3 PHE A 146 2.983 -20.800 -12.105 1.00 65.54 H new ATOM 0 HD1 PHE A 146 3.268 -23.591 -9.632 1.00 62.42 H new ATOM 0 HD2 PHE A 146 0.682 -21.202 -12.038 1.00 24.41 H new ATOM 0 HE1 PHE A 146 1.315 -24.595 -8.533 1.00 35.15 H new ATOM 0 HE2 PHE A 146 -1.270 -22.205 -10.940 1.00 45.23 H new ATOM 0 HZ PHE A 146 -0.959 -23.907 -9.185 1.00 14.43 H new ATOM 2363 N VAL A 147 2.616 -22.613 -14.577 1.00 42.11 N ATOM 2364 CA VAL A 147 1.615 -23.127 -15.517 1.00 63.02 C ATOM 2365 C VAL A 147 2.180 -24.251 -16.399 1.00 53.30 C ATOM 2366 O VAL A 147 1.558 -25.301 -16.552 1.00 34.33 O ATOM 2367 CB VAL A 147 1.076 -21.985 -16.407 1.00 15.15 C ATOM 2368 CG1 VAL A 147 0.020 -22.496 -17.390 1.00 73.41 C ATOM 2369 CG2 VAL A 147 0.521 -20.865 -15.531 1.00 31.31 C ATOM 0 H VAL A 147 2.967 -21.684 -14.809 1.00 42.11 H new ATOM 0 HA VAL A 147 0.800 -23.543 -14.925 1.00 63.02 H new ATOM 0 HB VAL A 147 1.900 -21.588 -17.001 1.00 15.15 H new ATOM 0 HG11 VAL A 147 -0.339 -21.668 -18.001 1.00 73.41 H new ATOM 0 HG12 VAL A 147 0.460 -23.258 -18.033 1.00 73.41 H new ATOM 0 HG13 VAL A 147 -0.814 -22.927 -16.836 1.00 73.41 H new ATOM 0 HG21 VAL A 147 0.142 -20.062 -16.163 1.00 31.31 H new ATOM 0 HG22 VAL A 147 -0.289 -21.253 -14.914 1.00 31.31 H new ATOM 0 HG23 VAL A 147 1.313 -20.478 -14.889 1.00 31.31 H new ATOM 2379 N GLU A 148 3.362 -24.026 -16.973 1.00 43.20 N ATOM 2380 CA GLU A 148 4.030 -25.044 -17.799 1.00 30.30 C ATOM 2381 C GLU A 148 4.499 -26.234 -16.943 1.00 63.34 C ATOM 2382 O GLU A 148 4.603 -27.360 -17.426 1.00 14.34 O ATOM 2383 CB GLU A 148 5.235 -24.439 -18.535 1.00 21.22 C ATOM 2384 CG GLU A 148 6.292 -23.866 -17.598 1.00 73.40 C ATOM 2385 CD GLU A 148 7.558 -23.436 -18.315 1.00 11.22 C ATOM 2386 OE1 GLU A 148 7.574 -22.331 -18.896 1.00 34.02 O ATOM 2387 OE2 GLU A 148 8.546 -24.207 -18.299 1.00 62.35 O ATOM 0 H GLU A 148 3.879 -23.151 -16.884 1.00 43.20 H new ATOM 0 HA GLU A 148 3.304 -25.401 -18.529 1.00 30.30 H new ATOM 0 HB2 GLU A 148 5.692 -25.206 -19.160 1.00 21.22 H new ATOM 0 HB3 GLU A 148 4.886 -23.651 -19.202 1.00 21.22 H new ATOM 0 HG2 GLU A 148 5.873 -23.010 -17.069 1.00 73.40 H new ATOM 0 HG3 GLU A 148 6.544 -24.613 -16.846 1.00 73.40 H new ATOM 2394 N PHE A 149 4.783 -25.962 -15.668 1.00 64.41 N ATOM 2395 CA PHE A 149 5.238 -26.990 -14.723 1.00 21.05 C ATOM 2396 C PHE A 149 4.238 -28.162 -14.663 1.00 14.13 C ATOM 2397 O PHE A 149 4.618 -29.330 -14.777 1.00 62.10 O ATOM 2398 CB PHE A 149 5.396 -26.342 -13.336 1.00 35.32 C ATOM 2399 CG PHE A 149 6.071 -27.198 -12.293 1.00 12.44 C ATOM 2400 CD1 PHE A 149 7.455 -27.266 -12.228 1.00 64.11 C ATOM 2401 CD2 PHE A 149 5.326 -27.907 -11.361 1.00 62.12 C ATOM 2402 CE1 PHE A 149 8.081 -28.023 -11.258 1.00 12.31 C ATOM 2403 CE2 PHE A 149 5.949 -28.670 -10.391 1.00 14.15 C ATOM 2404 CZ PHE A 149 7.328 -28.726 -10.339 1.00 10.24 C ATOM 0 H PHE A 149 4.706 -25.030 -15.261 1.00 64.41 H new ATOM 0 HA PHE A 149 6.195 -27.393 -15.055 1.00 21.05 H new ATOM 0 HB2 PHE A 149 5.965 -25.419 -13.448 1.00 35.32 H new ATOM 0 HB3 PHE A 149 4.408 -26.064 -12.969 1.00 35.32 H new ATOM 0 HD1 PHE A 149 8.050 -26.720 -12.945 1.00 64.11 H new ATOM 0 HD2 PHE A 149 4.247 -27.862 -11.394 1.00 62.12 H new ATOM 0 HE1 PHE A 149 9.159 -28.065 -11.218 1.00 12.31 H new ATOM 0 HE2 PHE A 149 5.358 -29.222 -9.675 1.00 14.15 H new ATOM 0 HZ PHE A 149 7.817 -29.319 -9.580 1.00 10.24 H new ATOM 2414 N PHE A 150 2.963 -27.835 -14.465 1.00 15.21 N ATOM 2415 CA PHE A 150 1.876 -28.821 -14.539 1.00 1.34 C ATOM 2416 C PHE A 150 1.358 -29.001 -15.983 1.00 40.40 C ATOM 2417 O PHE A 150 0.827 -30.059 -16.333 1.00 61.51 O ATOM 2418 CB PHE A 150 0.733 -28.410 -13.605 1.00 3.33 C ATOM 2419 CG PHE A 150 1.150 -28.344 -12.155 1.00 12.14 C ATOM 2420 CD1 PHE A 150 1.211 -29.497 -11.384 1.00 50.34 C ATOM 2421 CD2 PHE A 150 1.484 -27.132 -11.564 1.00 42.02 C ATOM 2422 CE1 PHE A 150 1.595 -29.443 -10.057 1.00 2.45 C ATOM 2423 CE2 PHE A 150 1.869 -27.075 -10.237 1.00 2.11 C ATOM 2424 CZ PHE A 150 1.923 -28.232 -9.483 1.00 2.00 C ATOM 0 H PHE A 150 2.651 -26.888 -14.250 1.00 15.21 H new ATOM 0 HA PHE A 150 2.275 -29.783 -14.218 1.00 1.34 H new ATOM 0 HB2 PHE A 150 0.352 -27.436 -13.912 1.00 3.33 H new ATOM 0 HB3 PHE A 150 -0.087 -29.120 -13.709 1.00 3.33 H new ATOM 0 HD1 PHE A 150 0.955 -30.448 -11.827 1.00 50.34 H new ATOM 0 HD2 PHE A 150 1.443 -26.224 -12.147 1.00 42.02 H new ATOM 0 HE1 PHE A 150 1.638 -30.348 -9.470 1.00 2.45 H new ATOM 0 HE2 PHE A 150 2.127 -26.126 -9.790 1.00 2.11 H new ATOM 0 HZ PHE A 150 2.222 -28.188 -8.446 1.00 2.00 H new ATOM 2434 N HIS A 151 1.525 -27.954 -16.801 1.00 22.54 N ATOM 2435 CA HIS A 151 1.017 -27.904 -18.186 1.00 33.50 C ATOM 2436 C HIS A 151 -0.515 -27.772 -18.240 1.00 40.44 C ATOM 2437 O HIS A 151 -1.249 -28.724 -17.970 1.00 32.31 O ATOM 2438 CB HIS A 151 1.482 -29.117 -19.008 1.00 1.53 C ATOM 2439 CG HIS A 151 0.903 -29.164 -20.393 1.00 61.21 C ATOM 2440 ND1 HIS A 151 1.165 -28.211 -21.351 1.00 41.10 N ATOM 2441 CD2 HIS A 151 0.055 -30.048 -20.972 1.00 60.52 C ATOM 2442 CE1 HIS A 151 0.509 -28.503 -22.453 1.00 35.33 C ATOM 2443 NE2 HIS A 151 -0.172 -29.612 -22.253 1.00 31.04 N ATOM 0 H HIS A 151 2.021 -27.108 -16.521 1.00 22.54 H new ATOM 0 HA HIS A 151 1.442 -27.006 -18.635 1.00 33.50 H new ATOM 0 HB2 HIS A 151 2.570 -29.102 -19.079 1.00 1.53 H new ATOM 0 HB3 HIS A 151 1.210 -30.030 -18.478 1.00 1.53 H new ATOM 0 HD2 HIS A 151 -0.364 -30.931 -20.511 1.00 60.52 H new ATOM 0 HE1 HIS A 151 0.526 -27.930 -23.368 1.00 35.33 H new ATOM 0 HE2 HIS A 151 -0.771 -30.072 -22.939 1.00 31.04 H new ATOM 2452 N VAL A 152 -0.987 -26.574 -18.597 1.00 1.42 N ATOM 2453 CA VAL A 152 -2.426 -26.301 -18.741 1.00 12.00 C ATOM 2454 C VAL A 152 -2.692 -25.363 -19.937 1.00 2.23 C ATOM 2455 O VAL A 152 -3.166 -25.795 -20.991 1.00 1.32 O ATOM 2456 CB VAL A 152 -3.033 -25.665 -17.455 1.00 73.44 C ATOM 2457 CG1 VAL A 152 -4.538 -25.446 -17.615 1.00 21.10 C ATOM 2458 CG2 VAL A 152 -2.746 -26.523 -16.221 1.00 3.03 C ATOM 0 H VAL A 152 -0.391 -25.770 -18.794 1.00 1.42 H new ATOM 0 HA VAL A 152 -2.908 -27.264 -18.913 1.00 12.00 H new ATOM 0 HB VAL A 152 -2.555 -24.696 -17.310 1.00 73.44 H new ATOM 0 HG11 VAL A 152 -4.940 -25.001 -16.705 1.00 21.10 H new ATOM 0 HG12 VAL A 152 -4.721 -24.778 -18.457 1.00 21.10 H new ATOM 0 HG13 VAL A 152 -5.027 -26.403 -17.798 1.00 21.10 H new ATOM 0 HG21 VAL A 152 -3.183 -26.052 -15.341 1.00 3.03 H new ATOM 0 HG22 VAL A 152 -3.182 -27.513 -16.357 1.00 3.03 H new ATOM 0 HG23 VAL A 152 -1.669 -26.617 -16.086 1.00 3.03 H new