USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1308 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 116 THR OG1 : rot -48:sc= 0.00128 USER MOD Set 1.2: A 171 ASN : amide:sc= -0.0638 K(o=-0.97,f=-1.5) USER MOD Set 1.3: A 173 HIS : no HD1:sc= -0.908 K(o=-0.97,f=-3.3) USER MOD Set 2.1: A 124 TYR OH : rot -164:sc= 1.06 USER MOD Set 2.2: A 128 TYR OH : rot 15:sc= 0.674 USER MOD Set 2.3: A 168 HIS : no HD1:sc= -1.38! C(o=0.35!,f=-7.9!) USER MOD Set 3.1: A 95 SER OG : rot -30:sc= 0.0402 USER MOD Set 3.2: A 101 HIS : no HD1:sc= -0.969 X(o=-0.93,f=-0.56) USER MOD Set 4.1: A 87 LYS NZ :NH3+ -175:sc= -2.45! (180deg=-2.55!) USER MOD Set 4.2: A 103 THR OG1 : rot 180:sc= 0.259 USER MOD Set 4.3: A 156 HIS : no HD1:sc= -3.19 K(o=-5.4,f=-8!) USER MOD Set 5.1: A 22 SER OG : rot -179:sc= 2.39 USER MOD Set 5.2: A 25 THR OG1 : rot 17:sc= 1.11 USER MOD Set 6.1: A 12 GLN : amide:sc= 0.886 K(o=2.1,f=-1.6) USER MOD Set 6.2: A 91 SER OG : rot 89:sc= 1.19 USER MOD Single : A 8 LYS NZ :NH3+ -163:sc= -0.0823 (180deg=-0.392) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 98:sc= 0.0563 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -0.456 K(o=-0.46,f=-1.2) USER MOD Single : A 36 GLN : amide:sc= 0.949 K(o=0.95,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -105:sc= 0.00741 USER MOD Single : A 43 CYS SG : rot -122:sc= -0.231 USER MOD Single : A 46 MET CE :methyl 141:sc= -1.14 (180deg=-3.31!) USER MOD Single : A 50 ASN : amide:sc= 0.718 K(o=0.72,f=0) USER MOD Single : A 51 THR OG1 : rot 81:sc= 1.21 USER MOD Single : A 52 LYS NZ :NH3+ 175:sc= 0.543 (180deg=0.516) USER MOD Single : A 54 SER OG : rot -143:sc= 0.728 USER MOD Single : A 61 THR OG1 : rot -166:sc= -1.09 USER MOD Single : A 62 TYR OH : rot 50:sc= 0.786 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 158:sc= -3.49 (180deg=-3.91!) USER MOD Single : A 73 ASN : amide:sc= -4.28! C(o=-4.3!,f=-6!) USER MOD Single : A 77 HIS : no HD1:sc= 1.08 K(o=1.1,f=-4.7!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -0.869 K(o=-0.87,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 165:sc= 0.685 (180deg=0.541) USER MOD Single : A 106 LYS NZ :NH3+ -178:sc= 0.578 (180deg=0.572) USER MOD Single : A 113 LYS NZ :NH3+ 134:sc= 1.22 (180deg=0.529) USER MOD Single : A 119 HIS : no HD1:sc= 0.251 K(o=0.25,f=-1.8!) USER MOD Single : A 120 HIS : no HD1:sc= 0.627 K(o=0.63,f=-4.9!) USER MOD Single : A 127 GLN : amide:sc= -0.305 X(o=-0.3,f=-0.0047) USER MOD Single : A 130 LYS NZ :NH3+ 170:sc=-0.00199 (180deg=-0.125) USER MOD Single : A 137 MET CE :methyl 154:sc= -0.362 (180deg=-1.19) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0474 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 158 SER OG : rot 137:sc= -1.49! USER MOD Single : A 161 LYS NZ :NH3+ 151:sc= 0.153 (180deg=0.0177) USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 166 LYS NZ :NH3+ -157:sc= -0.202 (180deg=-0.718) USER MOD Single : A 167 TYR OH : rot -93:sc= 0.871 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= -0.146 X(o=-0.15,f=-0.39) USER MOD Single : A 175 CYS SG : rot 90:sc= -0.348 USER MOD Single : A 179 LYS NZ :NH3+ 159:sc= 2.48 (180deg=0.111) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -15.829 8.084 3.811 1.00 13.02 N ATOM 93 CA LYS A 8 -16.599 7.638 2.659 1.00 52.11 C ATOM 94 C LYS A 8 -15.747 6.647 1.877 1.00 15.22 C ATOM 95 O LYS A 8 -16.188 6.041 0.899 1.00 52.13 O ATOM 96 CB LYS A 8 -16.979 8.832 1.777 1.00 22.11 C ATOM 97 CG LYS A 8 -15.774 9.613 1.269 1.00 13.44 C ATOM 98 CD LYS A 8 -15.841 11.085 1.653 1.00 61.21 C ATOM 99 CE LYS A 8 -16.949 11.820 0.910 1.00 40.02 C ATOM 100 NZ LYS A 8 -16.773 11.756 -0.568 1.00 24.32 N ATOM 0 HA LYS A 8 -17.522 7.160 2.986 1.00 52.11 H new ATOM 0 HB2 LYS A 8 -17.558 8.476 0.925 1.00 22.11 H new ATOM 0 HB3 LYS A 8 -17.625 9.502 2.344 1.00 22.11 H new ATOM 0 HG2 LYS A 8 -14.862 9.175 1.674 1.00 13.44 H new ATOM 0 HG3 LYS A 8 -15.716 9.524 0.184 1.00 13.44 H new ATOM 0 HD2 LYS A 8 -16.005 11.172 2.727 1.00 61.21 H new ATOM 0 HD3 LYS A 8 -14.884 11.560 1.438 1.00 61.21 H new ATOM 0 HE2 LYS A 8 -17.913 11.388 1.179 1.00 40.02 H new ATOM 0 HE3 LYS A 8 -16.967 12.863 1.227 1.00 40.02 H new ATOM 0 HZ1 LYS A 8 -17.359 12.487 -1.019 1.00 24.32 H new ATOM 0 HZ2 LYS A 8 -15.774 11.917 -0.806 1.00 24.32 H new ATOM 0 HZ3 LYS A 8 -17.064 10.819 -0.912 1.00 24.32 H new ATOM 114 N GLU A 9 -14.516 6.514 2.351 1.00 12.24 N ATOM 115 CA GLU A 9 -13.491 5.694 1.738 1.00 35.21 C ATOM 116 C GLU A 9 -13.895 4.220 1.698 1.00 4.34 C ATOM 117 O GLU A 9 -14.347 3.671 2.706 1.00 21.23 O ATOM 118 CB GLU A 9 -12.179 5.854 2.519 1.00 1.15 C ATOM 119 CG GLU A 9 -11.543 7.241 2.411 1.00 14.35 C ATOM 120 CD GLU A 9 -12.134 8.257 3.375 1.00 12.32 C ATOM 121 OE1 GLU A 9 -13.145 8.902 3.031 1.00 62.23 O ATOM 122 OE2 GLU A 9 -11.587 8.416 4.480 1.00 12.25 O ATOM 0 H GLU A 9 -14.198 6.988 3.196 1.00 12.24 H new ATOM 0 HA GLU A 9 -13.358 6.028 0.709 1.00 35.21 H new ATOM 0 HB2 GLU A 9 -12.367 5.635 3.570 1.00 1.15 H new ATOM 0 HB3 GLU A 9 -11.465 5.112 2.162 1.00 1.15 H new ATOM 0 HG2 GLU A 9 -10.472 7.156 2.597 1.00 14.35 H new ATOM 0 HG3 GLU A 9 -11.662 7.608 1.391 1.00 14.35 H new ATOM 129 N PRO A 10 -13.750 3.569 0.519 1.00 2.33 N ATOM 130 CA PRO A 10 -14.056 2.139 0.331 1.00 43.31 C ATOM 131 C PRO A 10 -13.224 1.229 1.228 1.00 72.23 C ATOM 132 O PRO A 10 -12.247 1.668 1.844 1.00 0.01 O ATOM 133 CB PRO A 10 -13.710 1.874 -1.140 1.00 34.41 C ATOM 134 CG PRO A 10 -12.864 3.013 -1.568 1.00 44.33 C ATOM 135 CD PRO A 10 -13.296 4.187 -0.739 1.00 20.53 C ATOM 0 HA PRO A 10 -15.094 1.927 0.589 1.00 43.31 H new ATOM 0 HB2 PRO A 10 -13.179 0.929 -1.253 1.00 34.41 H new ATOM 0 HB3 PRO A 10 -14.612 1.807 -1.748 1.00 34.41 H new ATOM 0 HG2 PRO A 10 -11.808 2.794 -1.413 1.00 44.33 H new ATOM 0 HG3 PRO A 10 -12.994 3.217 -2.631 1.00 44.33 H new ATOM 0 HD2 PRO A 10 -12.475 4.884 -0.571 1.00 20.53 H new ATOM 0 HD3 PRO A 10 -14.096 4.748 -1.223 1.00 20.53 H new ATOM 143 N GLU A 11 -13.617 -0.044 1.281 1.00 4.24 N ATOM 144 CA GLU A 11 -12.964 -1.038 2.131 1.00 34.32 C ATOM 145 C GLU A 11 -11.456 -1.102 1.880 1.00 52.24 C ATOM 146 O GLU A 11 -10.689 -1.295 2.807 1.00 44.22 O ATOM 147 CB GLU A 11 -13.602 -2.433 1.942 1.00 65.52 C ATOM 148 CG GLU A 11 -13.200 -3.176 0.665 1.00 3.31 C ATOM 149 CD GLU A 11 -13.739 -2.550 -0.606 1.00 4.33 C ATOM 150 OE1 GLU A 11 -14.855 -2.913 -1.025 1.00 25.43 O ATOM 151 OE2 GLU A 11 -13.047 -1.699 -1.198 1.00 52.05 O ATOM 0 H GLU A 11 -14.396 -0.414 0.736 1.00 4.24 H new ATOM 0 HA GLU A 11 -13.114 -0.723 3.164 1.00 34.32 H new ATOM 0 HB2 GLU A 11 -13.339 -3.052 2.800 1.00 65.52 H new ATOM 0 HB3 GLU A 11 -14.686 -2.321 1.950 1.00 65.52 H new ATOM 0 HG2 GLU A 11 -12.112 -3.215 0.606 1.00 3.31 H new ATOM 0 HG3 GLU A 11 -13.553 -4.205 0.729 1.00 3.31 H new ATOM 158 N GLN A 12 -11.047 -0.894 0.632 1.00 63.31 N ATOM 159 CA GLN A 12 -9.645 -0.998 0.242 1.00 23.03 C ATOM 160 C GLN A 12 -8.776 0.077 0.913 1.00 10.03 C ATOM 161 O GLN A 12 -7.603 -0.152 1.189 1.00 1.33 O ATOM 162 CB GLN A 12 -9.526 -0.924 -1.288 1.00 11.03 C ATOM 163 CG GLN A 12 -9.684 0.479 -1.864 1.00 71.21 C ATOM 164 CD GLN A 12 -10.496 0.525 -3.140 1.00 12.44 C ATOM 165 OE1 GLN A 12 -10.184 1.282 -4.058 1.00 42.24 O ATOM 166 NE2 GLN A 12 -11.574 -0.232 -3.186 1.00 61.21 N ATOM 0 H GLN A 12 -11.675 -0.650 -0.134 1.00 63.31 H new ATOM 0 HA GLN A 12 -9.271 -1.962 0.586 1.00 23.03 H new ATOM 0 HB2 GLN A 12 -8.554 -1.318 -1.584 1.00 11.03 H new ATOM 0 HB3 GLN A 12 -10.281 -1.573 -1.731 1.00 11.03 H new ATOM 0 HG2 GLN A 12 -10.159 1.117 -1.118 1.00 71.21 H new ATOM 0 HG3 GLN A 12 -8.696 0.896 -2.057 1.00 71.21 H new ATOM 0 HE21 GLN A 12 -11.799 -0.847 -2.404 1.00 61.21 H new ATOM 0 HE22 GLN A 12 -12.183 -0.203 -4.004 1.00 61.21 H new ATOM 175 N LEU A 13 -9.359 1.237 1.209 1.00 61.24 N ATOM 176 CA LEU A 13 -8.586 2.339 1.777 1.00 2.45 C ATOM 177 C LEU A 13 -8.488 2.203 3.287 1.00 10.34 C ATOM 178 O LEU A 13 -7.597 2.766 3.907 1.00 40.14 O ATOM 179 CB LEU A 13 -9.206 3.699 1.437 1.00 24.34 C ATOM 180 CG LEU A 13 -9.617 3.910 -0.021 1.00 54.03 C ATOM 181 CD1 LEU A 13 -9.961 5.362 -0.285 1.00 22.43 C ATOM 182 CD2 LEU A 13 -8.531 3.465 -0.969 1.00 60.22 C ATOM 0 H LEU A 13 -10.349 1.437 1.068 1.00 61.24 H new ATOM 0 HA LEU A 13 -7.590 2.289 1.338 1.00 2.45 H new ATOM 0 HB2 LEU A 13 -10.086 3.841 2.065 1.00 24.34 H new ATOM 0 HB3 LEU A 13 -8.493 4.478 1.708 1.00 24.34 H new ATOM 0 HG LEU A 13 -10.503 3.299 -0.196 1.00 54.03 H new ATOM 0 HD11 LEU A 13 -10.250 5.484 -1.329 1.00 22.43 H new ATOM 0 HD12 LEU A 13 -10.789 5.663 0.358 1.00 22.43 H new ATOM 0 HD13 LEU A 13 -9.093 5.986 -0.074 1.00 22.43 H new ATOM 0 HD21 LEU A 13 -8.856 3.629 -1.997 1.00 60.22 H new ATOM 0 HD22 LEU A 13 -7.624 4.039 -0.779 1.00 60.22 H new ATOM 0 HD23 LEU A 13 -8.327 2.405 -0.817 1.00 60.22 H new ATOM 194 N ARG A 14 -9.403 1.447 3.873 1.00 63.25 N ATOM 195 CA ARG A 14 -9.440 1.301 5.321 1.00 65.35 C ATOM 196 C ARG A 14 -8.990 -0.098 5.743 1.00 75.41 C ATOM 197 O ARG A 14 -8.943 -0.414 6.930 1.00 52.43 O ATOM 198 CB ARG A 14 -10.847 1.603 5.853 1.00 63.43 C ATOM 199 CG ARG A 14 -11.908 0.634 5.362 1.00 34.24 C ATOM 200 CD ARG A 14 -13.306 1.067 5.776 1.00 30.43 C ATOM 201 NE ARG A 14 -14.289 0.004 5.560 1.00 1.51 N ATOM 202 CZ ARG A 14 -15.330 0.087 4.727 1.00 12.44 C ATOM 203 NH1 ARG A 14 -15.547 1.190 4.015 1.00 23.43 N ATOM 204 NH2 ARG A 14 -16.150 -0.948 4.599 1.00 70.14 N ATOM 0 H ARG A 14 -10.125 0.928 3.373 1.00 63.25 H new ATOM 0 HA ARG A 14 -8.745 2.020 5.754 1.00 65.35 H new ATOM 0 HB2 ARG A 14 -10.826 1.583 6.943 1.00 63.43 H new ATOM 0 HB3 ARG A 14 -11.127 2.614 5.559 1.00 63.43 H new ATOM 0 HG2 ARG A 14 -11.858 0.560 4.276 1.00 34.24 H new ATOM 0 HG3 ARG A 14 -11.703 -0.360 5.759 1.00 34.24 H new ATOM 0 HD2 ARG A 14 -13.302 1.351 6.828 1.00 30.43 H new ATOM 0 HD3 ARG A 14 -13.596 1.951 5.209 1.00 30.43 H new ATOM 0 HE ARG A 14 -14.170 -0.863 6.084 1.00 1.51 H new ATOM 0 HH11 ARG A 14 -14.915 1.986 4.102 1.00 23.43 H new ATOM 0 HH12 ARG A 14 -16.346 1.240 3.383 1.00 23.43 H new ATOM 0 HH21 ARG A 14 -15.984 -1.800 5.135 1.00 70.14 H new ATOM 0 HH22 ARG A 14 -16.947 -0.892 3.965 1.00 70.14 H new ATOM 218 N LYS A 15 -8.707 -0.946 4.770 1.00 14.20 N ATOM 219 CA LYS A 15 -8.204 -2.281 5.048 1.00 43.04 C ATOM 220 C LYS A 15 -6.691 -2.372 4.858 1.00 43.44 C ATOM 221 O LYS A 15 -6.088 -1.609 4.100 1.00 34.11 O ATOM 222 CB LYS A 15 -8.923 -3.291 4.145 1.00 72.13 C ATOM 223 CG LYS A 15 -8.669 -4.751 4.483 1.00 74.43 C ATOM 224 CD LYS A 15 -9.558 -5.676 3.666 1.00 61.00 C ATOM 225 CE LYS A 15 -9.273 -5.572 2.178 1.00 20.43 C ATOM 226 NZ LYS A 15 -9.990 -6.615 1.401 1.00 42.32 N ATOM 0 H LYS A 15 -8.817 -0.734 3.778 1.00 14.20 H new ATOM 0 HA LYS A 15 -8.407 -2.513 6.094 1.00 43.04 H new ATOM 0 HB2 LYS A 15 -9.995 -3.103 4.197 1.00 72.13 H new ATOM 0 HB3 LYS A 15 -8.618 -3.114 3.113 1.00 72.13 H new ATOM 0 HG2 LYS A 15 -7.623 -4.992 4.296 1.00 74.43 H new ATOM 0 HG3 LYS A 15 -8.849 -4.916 5.545 1.00 74.43 H new ATOM 0 HD2 LYS A 15 -9.408 -6.705 3.993 1.00 61.00 H new ATOM 0 HD3 LYS A 15 -10.604 -5.432 3.853 1.00 61.00 H new ATOM 0 HE2 LYS A 15 -9.569 -4.586 1.820 1.00 20.43 H new ATOM 0 HE3 LYS A 15 -8.201 -5.665 2.007 1.00 20.43 H new ATOM 0 HZ1 LYS A 15 -9.768 -6.509 0.390 1.00 42.32 H new ATOM 0 HZ2 LYS A 15 -9.690 -7.557 1.724 1.00 42.32 H new ATOM 0 HZ3 LYS A 15 -11.015 -6.511 1.543 1.00 42.32 H new ATOM 240 N LEU A 16 -6.099 -3.322 5.564 1.00 12.33 N ATOM 241 CA LEU A 16 -4.686 -3.619 5.448 1.00 11.21 C ATOM 242 C LEU A 16 -4.492 -5.050 4.977 1.00 63.35 C ATOM 243 O LEU A 16 -5.265 -5.937 5.326 1.00 65.41 O ATOM 244 CB LEU A 16 -3.961 -3.428 6.785 1.00 11.13 C ATOM 245 CG LEU A 16 -3.838 -1.987 7.271 1.00 53.12 C ATOM 246 CD1 LEU A 16 -3.103 -1.932 8.598 1.00 15.42 C ATOM 247 CD2 LEU A 16 -3.132 -1.127 6.239 1.00 31.20 C ATOM 0 H LEU A 16 -6.591 -3.910 6.237 1.00 12.33 H new ATOM 0 HA LEU A 16 -4.262 -2.926 4.721 1.00 11.21 H new ATOM 0 HB2 LEU A 16 -4.484 -4.006 7.547 1.00 11.13 H new ATOM 0 HB3 LEU A 16 -2.960 -3.849 6.698 1.00 11.13 H new ATOM 0 HG LEU A 16 -4.844 -1.592 7.415 1.00 53.12 H new ATOM 0 HD11 LEU A 16 -3.025 -0.896 8.928 1.00 15.42 H new ATOM 0 HD12 LEU A 16 -3.651 -2.510 9.342 1.00 15.42 H new ATOM 0 HD13 LEU A 16 -2.104 -2.351 8.478 1.00 15.42 H new ATOM 0 HD21 LEU A 16 -3.056 -0.104 6.608 1.00 31.20 H new ATOM 0 HD22 LEU A 16 -2.132 -1.522 6.058 1.00 31.20 H new ATOM 0 HD23 LEU A 16 -3.699 -1.136 5.308 1.00 31.20 H new ATOM 259 N PHE A 17 -3.461 -5.257 4.185 1.00 1.51 N ATOM 260 CA PHE A 17 -3.060 -6.580 3.753 1.00 72.44 C ATOM 261 C PHE A 17 -1.941 -7.060 4.657 1.00 60.52 C ATOM 262 O PHE A 17 -0.924 -6.393 4.798 1.00 74.21 O ATOM 263 CB PHE A 17 -2.591 -6.544 2.292 1.00 65.35 C ATOM 264 CG PHE A 17 -1.757 -7.730 1.880 1.00 11.23 C ATOM 265 CD1 PHE A 17 -2.350 -8.943 1.573 1.00 44.31 C ATOM 266 CD2 PHE A 17 -0.375 -7.623 1.795 1.00 51.33 C ATOM 267 CE1 PHE A 17 -1.583 -10.027 1.192 1.00 30.43 C ATOM 268 CE2 PHE A 17 0.395 -8.704 1.416 1.00 63.03 C ATOM 269 CZ PHE A 17 -0.209 -9.908 1.114 1.00 5.13 C ATOM 0 H PHE A 17 -2.873 -4.507 3.820 1.00 1.51 H new ATOM 0 HA PHE A 17 -3.906 -7.265 3.816 1.00 72.44 H new ATOM 0 HB2 PHE A 17 -3.465 -6.486 1.643 1.00 65.35 H new ATOM 0 HB3 PHE A 17 -2.013 -5.634 2.130 1.00 65.35 H new ATOM 0 HD1 PHE A 17 -3.424 -9.043 1.632 1.00 44.31 H new ATOM 0 HD2 PHE A 17 0.103 -6.683 2.028 1.00 51.33 H new ATOM 0 HE1 PHE A 17 -2.058 -10.968 0.955 1.00 30.43 H new ATOM 0 HE2 PHE A 17 1.469 -8.608 1.356 1.00 63.03 H new ATOM 0 HZ PHE A 17 0.392 -10.755 0.817 1.00 5.13 H new ATOM 279 N ILE A 18 -2.130 -8.196 5.280 1.00 52.55 N ATOM 280 CA ILE A 18 -1.136 -8.718 6.191 1.00 45.35 C ATOM 281 C ILE A 18 -0.361 -9.837 5.521 1.00 33.12 C ATOM 282 O ILE A 18 -0.897 -10.914 5.287 1.00 11.13 O ATOM 283 CB ILE A 18 -1.773 -9.245 7.492 1.00 43.32 C ATOM 284 CG1 ILE A 18 -2.821 -8.260 8.025 1.00 23.34 C ATOM 285 CG2 ILE A 18 -0.696 -9.492 8.538 1.00 62.41 C ATOM 286 CD1 ILE A 18 -2.276 -6.878 8.320 1.00 3.44 C ATOM 0 H ILE A 18 -2.961 -8.778 5.175 1.00 52.55 H new ATOM 0 HA ILE A 18 -0.464 -7.900 6.450 1.00 45.35 H new ATOM 0 HB ILE A 18 -2.275 -10.187 7.273 1.00 43.32 H new ATOM 0 HG12 ILE A 18 -3.627 -8.173 7.296 1.00 23.34 H new ATOM 0 HG13 ILE A 18 -3.258 -8.669 8.936 1.00 23.34 H new ATOM 0 HG21 ILE A 18 -1.156 -9.864 9.453 1.00 62.41 H new ATOM 0 HG22 ILE A 18 0.013 -10.230 8.163 1.00 62.41 H new ATOM 0 HG23 ILE A 18 -0.172 -8.559 8.748 1.00 62.41 H new ATOM 0 HD11 ILE A 18 -3.079 -6.242 8.693 1.00 3.44 H new ATOM 0 HD12 ILE A 18 -1.491 -6.950 9.073 1.00 3.44 H new ATOM 0 HD13 ILE A 18 -1.865 -6.446 7.407 1.00 3.44 H new ATOM 298 N GLY A 19 0.897 -9.574 5.223 1.00 41.22 N ATOM 299 CA GLY A 19 1.723 -10.550 4.558 1.00 43.33 C ATOM 300 C GLY A 19 2.669 -11.226 5.514 1.00 13.52 C ATOM 301 O GLY A 19 3.079 -10.632 6.510 1.00 63.12 O ATOM 0 H GLY A 19 1.364 -8.692 5.433 1.00 41.22 H new ATOM 0 HA2 GLY A 19 1.090 -11.299 4.083 1.00 43.33 H new ATOM 0 HA3 GLY A 19 2.292 -10.065 3.765 1.00 43.33 H new ATOM 305 N GLY A 20 3.013 -12.465 5.218 1.00 3.42 N ATOM 306 CA GLY A 20 3.932 -13.200 6.058 1.00 3.10 C ATOM 307 C GLY A 20 3.352 -13.551 7.409 1.00 53.43 C ATOM 308 O GLY A 20 3.988 -13.332 8.439 1.00 45.30 O ATOM 0 H GLY A 20 2.671 -12.979 4.406 1.00 3.42 H new ATOM 0 HA2 GLY A 20 4.228 -14.116 5.547 1.00 3.10 H new ATOM 0 HA3 GLY A 20 4.836 -12.609 6.200 1.00 3.10 H new ATOM 312 N LEU A 21 2.140 -14.081 7.412 1.00 3.31 N ATOM 313 CA LEU A 21 1.548 -14.625 8.619 1.00 73.34 C ATOM 314 C LEU A 21 2.124 -16.005 8.882 1.00 14.11 C ATOM 315 O LEU A 21 2.912 -16.523 8.084 1.00 33.32 O ATOM 316 CB LEU A 21 0.025 -14.737 8.469 1.00 41.43 C ATOM 317 CG LEU A 21 -0.748 -13.424 8.531 1.00 20.15 C ATOM 318 CD1 LEU A 21 -2.211 -13.653 8.197 1.00 32.14 C ATOM 319 CD2 LEU A 21 -0.618 -12.801 9.906 1.00 23.24 C ATOM 0 H LEU A 21 1.545 -14.145 6.586 1.00 3.31 H new ATOM 0 HA LEU A 21 1.773 -13.958 9.451 1.00 73.34 H new ATOM 0 HB2 LEU A 21 -0.192 -15.220 7.516 1.00 41.43 H new ATOM 0 HB3 LEU A 21 -0.351 -15.395 9.253 1.00 41.43 H new ATOM 0 HG LEU A 21 -0.326 -12.740 7.795 1.00 20.15 H new ATOM 0 HD11 LEU A 21 -2.748 -12.706 8.246 1.00 32.14 H new ATOM 0 HD12 LEU A 21 -2.294 -14.066 7.192 1.00 32.14 H new ATOM 0 HD13 LEU A 21 -2.643 -14.352 8.913 1.00 32.14 H new ATOM 0 HD21 LEU A 21 -1.175 -11.864 9.935 1.00 23.24 H new ATOM 0 HD22 LEU A 21 -1.018 -13.485 10.655 1.00 23.24 H new ATOM 0 HD23 LEU A 21 0.433 -12.605 10.119 1.00 23.24 H new ATOM 331 N SER A 22 1.729 -16.605 9.987 1.00 41.35 N ATOM 332 CA SER A 22 2.106 -17.971 10.259 1.00 63.02 C ATOM 333 C SER A 22 1.128 -18.887 9.533 1.00 41.14 C ATOM 334 O SER A 22 0.083 -18.433 9.051 1.00 55.31 O ATOM 335 CB SER A 22 2.099 -18.241 11.769 1.00 14.21 C ATOM 336 OG SER A 22 0.781 -18.410 12.261 1.00 75.45 O ATOM 0 H SER A 22 1.151 -16.169 10.705 1.00 41.35 H new ATOM 0 HA SER A 22 3.119 -18.160 9.903 1.00 63.02 H new ATOM 0 HB2 SER A 22 2.685 -19.135 11.982 1.00 14.21 H new ATOM 0 HB3 SER A 22 2.579 -17.413 12.290 1.00 14.21 H new ATOM 0 HG SER A 22 0.811 -18.572 13.227 1.00 75.45 H new ATOM 342 N PHE A 23 1.447 -20.166 9.450 1.00 24.42 N ATOM 343 CA PHE A 23 0.562 -21.119 8.794 1.00 51.44 C ATOM 344 C PHE A 23 -0.580 -21.520 9.723 1.00 33.55 C ATOM 345 O PHE A 23 -1.448 -22.313 9.354 1.00 71.52 O ATOM 346 CB PHE A 23 1.341 -22.355 8.347 1.00 33.22 C ATOM 347 CG PHE A 23 2.270 -22.093 7.194 1.00 51.31 C ATOM 348 CD1 PHE A 23 1.814 -22.195 5.890 1.00 11.12 C ATOM 349 CD2 PHE A 23 3.595 -21.750 7.413 1.00 21.11 C ATOM 350 CE1 PHE A 23 2.664 -21.960 4.825 1.00 13.25 C ATOM 351 CE2 PHE A 23 4.448 -21.513 6.353 1.00 74.20 C ATOM 352 CZ PHE A 23 3.983 -21.619 5.057 1.00 64.31 C ATOM 0 H PHE A 23 2.306 -20.569 9.825 1.00 24.42 H new ATOM 0 HA PHE A 23 0.138 -20.639 7.912 1.00 51.44 H new ATOM 0 HB2 PHE A 23 1.918 -22.735 9.190 1.00 33.22 H new ATOM 0 HB3 PHE A 23 0.636 -23.137 8.065 1.00 33.22 H new ATOM 0 HD1 PHE A 23 0.784 -22.461 5.703 1.00 11.12 H new ATOM 0 HD2 PHE A 23 3.965 -21.667 8.424 1.00 21.11 H new ATOM 0 HE1 PHE A 23 2.297 -22.043 3.813 1.00 13.25 H new ATOM 0 HE2 PHE A 23 5.478 -21.245 6.537 1.00 74.20 H new ATOM 0 HZ PHE A 23 4.649 -21.436 4.227 1.00 64.31 H new ATOM 362 N GLU A 24 -0.579 -20.948 10.922 1.00 31.20 N ATOM 363 CA GLU A 24 -1.559 -21.281 11.938 1.00 53.31 C ATOM 364 C GLU A 24 -2.286 -20.034 12.449 1.00 22.22 C ATOM 365 O GLU A 24 -2.930 -20.080 13.497 1.00 62.10 O ATOM 366 CB GLU A 24 -0.862 -21.991 13.100 1.00 30.13 C ATOM 367 CG GLU A 24 -0.103 -23.240 12.678 1.00 32.43 C ATOM 368 CD GLU A 24 0.634 -23.898 13.823 1.00 12.32 C ATOM 369 OE1 GLU A 24 -0.027 -24.445 14.726 1.00 74.21 O ATOM 370 OE2 GLU A 24 1.881 -23.900 13.808 1.00 55.55 O ATOM 0 H GLU A 24 0.100 -20.244 11.212 1.00 31.20 H new ATOM 0 HA GLU A 24 -2.304 -21.939 11.492 1.00 53.31 H new ATOM 0 HB2 GLU A 24 -0.169 -21.298 13.576 1.00 30.13 H new ATOM 0 HB3 GLU A 24 -1.606 -22.263 13.849 1.00 30.13 H new ATOM 0 HG2 GLU A 24 -0.803 -23.955 12.245 1.00 32.43 H new ATOM 0 HG3 GLU A 24 0.610 -22.978 11.896 1.00 32.43 H new ATOM 377 N THR A 25 -2.180 -18.924 11.714 1.00 21.13 N ATOM 378 CA THR A 25 -2.854 -17.685 12.095 1.00 0.22 C ATOM 379 C THR A 25 -4.358 -17.772 11.827 1.00 40.52 C ATOM 380 O THR A 25 -4.781 -18.170 10.739 1.00 24.42 O ATOM 381 CB THR A 25 -2.285 -16.467 11.333 1.00 40.04 C ATOM 382 OG1 THR A 25 -0.865 -16.405 11.488 1.00 64.42 O ATOM 383 CG2 THR A 25 -2.897 -15.168 11.841 1.00 65.52 C ATOM 0 H THR A 25 -1.635 -18.860 10.854 1.00 21.13 H new ATOM 0 HA THR A 25 -2.678 -17.551 13.162 1.00 0.22 H new ATOM 0 HB THR A 25 -2.536 -16.589 10.279 1.00 40.04 H new ATOM 0 HG1 THR A 25 -0.533 -17.269 11.811 1.00 64.42 H new ATOM 0 HG21 THR A 25 -2.478 -14.328 11.287 1.00 65.52 H new ATOM 0 HG22 THR A 25 -3.977 -15.195 11.698 1.00 65.52 H new ATOM 0 HG23 THR A 25 -2.674 -15.051 12.901 1.00 65.52 H new ATOM 391 N THR A 26 -5.156 -17.411 12.824 1.00 64.42 N ATOM 392 CA THR A 26 -6.600 -17.367 12.675 1.00 2.35 C ATOM 393 C THR A 26 -7.075 -15.925 12.556 1.00 21.53 C ATOM 394 O THR A 26 -6.339 -14.992 12.893 1.00 15.52 O ATOM 395 CB THR A 26 -7.308 -18.045 13.860 1.00 14.44 C ATOM 396 OG1 THR A 26 -6.841 -17.485 15.090 1.00 74.52 O ATOM 397 CG2 THR A 26 -7.058 -19.545 13.840 1.00 51.53 C ATOM 0 H THR A 26 -4.822 -17.143 13.750 1.00 64.42 H new ATOM 0 HA THR A 26 -6.854 -17.911 11.765 1.00 2.35 H new ATOM 0 HB THR A 26 -8.381 -17.872 13.774 1.00 14.44 H new ATOM 0 HG1 THR A 26 -7.297 -17.919 15.841 1.00 74.52 H new ATOM 0 HG21 THR A 26 -7.566 -20.010 14.685 1.00 51.53 H new ATOM 0 HG22 THR A 26 -7.441 -19.965 12.910 1.00 51.53 H new ATOM 0 HG23 THR A 26 -5.987 -19.736 13.910 1.00 51.53 H new ATOM 405 N ASP A 27 -8.303 -15.745 12.086 1.00 70.55 N ATOM 406 CA ASP A 27 -8.846 -14.413 11.843 1.00 1.33 C ATOM 407 C ASP A 27 -9.134 -13.689 13.151 1.00 55.14 C ATOM 408 O ASP A 27 -9.073 -12.467 13.208 1.00 51.42 O ATOM 409 CB ASP A 27 -10.123 -14.487 10.989 1.00 32.21 C ATOM 410 CG ASP A 27 -11.377 -14.725 11.812 1.00 53.03 C ATOM 411 OD1 ASP A 27 -11.597 -15.870 12.253 1.00 61.43 O ATOM 412 OD2 ASP A 27 -12.142 -13.763 12.026 1.00 21.20 O ATOM 0 H ASP A 27 -8.944 -16.507 11.865 1.00 70.55 H new ATOM 0 HA ASP A 27 -8.092 -13.847 11.295 1.00 1.33 H new ATOM 0 HB2 ASP A 27 -10.233 -13.558 10.430 1.00 32.21 H new ATOM 0 HB3 ASP A 27 -10.018 -15.288 10.258 1.00 32.21 H new ATOM 417 N GLU A 28 -9.428 -14.444 14.203 1.00 63.34 N ATOM 418 CA GLU A 28 -9.768 -13.856 15.490 1.00 12.41 C ATOM 419 C GLU A 28 -8.520 -13.401 16.236 1.00 53.50 C ATOM 420 O GLU A 28 -8.536 -12.375 16.910 1.00 0.23 O ATOM 421 CB GLU A 28 -10.579 -14.840 16.336 1.00 40.15 C ATOM 422 CG GLU A 28 -9.924 -16.201 16.517 1.00 11.35 C ATOM 423 CD GLU A 28 -10.809 -17.163 17.274 1.00 54.10 C ATOM 424 OE1 GLU A 28 -10.820 -17.117 18.518 1.00 72.13 O ATOM 425 OE2 GLU A 28 -11.510 -17.964 16.628 1.00 2.51 O ATOM 0 H GLU A 28 -9.437 -15.464 14.189 1.00 63.34 H new ATOM 0 HA GLU A 28 -10.383 -12.976 15.304 1.00 12.41 H new ATOM 0 HB2 GLU A 28 -10.751 -14.400 17.318 1.00 40.15 H new ATOM 0 HB3 GLU A 28 -11.556 -14.979 15.873 1.00 40.15 H new ATOM 0 HG2 GLU A 28 -9.686 -16.621 15.540 1.00 11.35 H new ATOM 0 HG3 GLU A 28 -8.981 -16.081 17.050 1.00 11.35 H new ATOM 432 N SER A 29 -7.436 -14.152 16.096 1.00 20.55 N ATOM 433 CA SER A 29 -6.178 -13.789 16.725 1.00 72.21 C ATOM 434 C SER A 29 -5.505 -12.649 15.966 1.00 5.45 C ATOM 435 O SER A 29 -4.906 -11.761 16.573 1.00 5.21 O ATOM 436 CB SER A 29 -5.264 -15.009 16.817 1.00 44.52 C ATOM 437 OG SER A 29 -5.831 -15.991 17.673 1.00 60.43 O ATOM 0 H SER A 29 -7.405 -15.015 15.553 1.00 20.55 H new ATOM 0 HA SER A 29 -6.380 -13.438 17.737 1.00 72.21 H new ATOM 0 HB2 SER A 29 -5.108 -15.430 15.824 1.00 44.52 H new ATOM 0 HB3 SER A 29 -4.286 -14.710 17.194 1.00 44.52 H new ATOM 0 HG SER A 29 -6.287 -16.671 17.134 1.00 60.43 H new ATOM 443 N LEU A 30 -5.633 -12.669 14.639 1.00 2.42 N ATOM 444 CA LEU A 30 -5.141 -11.580 13.801 1.00 1.14 C ATOM 445 C LEU A 30 -5.905 -10.298 14.122 1.00 30.04 C ATOM 446 O LEU A 30 -5.309 -9.238 14.325 1.00 73.51 O ATOM 447 CB LEU A 30 -5.295 -11.935 12.314 1.00 60.10 C ATOM 448 CG LEU A 30 -4.752 -10.897 11.324 1.00 74.31 C ATOM 449 CD1 LEU A 30 -3.264 -10.686 11.532 1.00 74.45 C ATOM 450 CD2 LEU A 30 -5.024 -11.325 9.889 1.00 30.52 C ATOM 0 H LEU A 30 -6.074 -13.430 14.122 1.00 2.42 H new ATOM 0 HA LEU A 30 -4.082 -11.425 14.008 1.00 1.14 H new ATOM 0 HB2 LEU A 30 -4.790 -12.884 12.131 1.00 60.10 H new ATOM 0 HB3 LEU A 30 -6.353 -12.092 12.104 1.00 60.10 H new ATOM 0 HG LEU A 30 -5.268 -9.955 11.508 1.00 74.31 H new ATOM 0 HD11 LEU A 30 -2.898 -9.946 10.820 1.00 74.45 H new ATOM 0 HD12 LEU A 30 -3.085 -10.332 12.547 1.00 74.45 H new ATOM 0 HD13 LEU A 30 -2.738 -11.628 11.378 1.00 74.45 H new ATOM 0 HD21 LEU A 30 -4.630 -10.574 9.204 1.00 30.52 H new ATOM 0 HD22 LEU A 30 -4.538 -12.282 9.696 1.00 30.52 H new ATOM 0 HD23 LEU A 30 -6.099 -11.427 9.737 1.00 30.52 H new ATOM 462 N ARG A 31 -7.230 -10.419 14.165 1.00 1.12 N ATOM 463 CA ARG A 31 -8.116 -9.325 14.542 1.00 60.10 C ATOM 464 C ARG A 31 -7.754 -8.742 15.901 1.00 73.02 C ATOM 465 O ARG A 31 -7.426 -7.568 15.994 1.00 70.05 O ATOM 466 CB ARG A 31 -9.554 -9.829 14.574 1.00 35.12 C ATOM 467 CG ARG A 31 -10.584 -8.766 14.884 1.00 1.02 C ATOM 468 CD ARG A 31 -11.954 -9.388 15.071 1.00 33.03 C ATOM 469 NE ARG A 31 -12.247 -10.416 14.067 1.00 52.10 N ATOM 470 CZ ARG A 31 -13.306 -10.398 13.257 1.00 70.13 C ATOM 471 NH1 ARG A 31 -14.183 -9.404 13.315 1.00 2.15 N ATOM 472 NH2 ARG A 31 -13.497 -11.388 12.397 1.00 64.35 N ATOM 0 H ARG A 31 -7.720 -11.284 13.938 1.00 1.12 H new ATOM 0 HA ARG A 31 -8.005 -8.534 13.800 1.00 60.10 H new ATOM 0 HB2 ARG A 31 -9.791 -10.276 13.608 1.00 35.12 H new ATOM 0 HB3 ARG A 31 -9.632 -10.621 15.319 1.00 35.12 H new ATOM 0 HG2 ARG A 31 -10.297 -8.227 15.787 1.00 1.02 H new ATOM 0 HG3 ARG A 31 -10.617 -8.037 14.074 1.00 1.02 H new ATOM 0 HD2 ARG A 31 -12.016 -9.829 16.066 1.00 33.03 H new ATOM 0 HD3 ARG A 31 -12.714 -8.608 15.020 1.00 33.03 H new ATOM 0 HE ARG A 31 -11.597 -11.197 13.983 1.00 52.10 H new ATOM 0 HH11 ARG A 31 -14.050 -8.645 13.983 1.00 2.15 H new ATOM 0 HH12 ARG A 31 -14.990 -9.399 12.691 1.00 2.15 H new ATOM 0 HH21 ARG A 31 -12.834 -12.162 12.355 1.00 64.35 H new ATOM 0 HH22 ARG A 31 -14.307 -11.376 11.777 1.00 64.35 H new ATOM 486 N SER A 32 -7.819 -9.576 16.937 1.00 34.20 N ATOM 487 CA SER A 32 -7.536 -9.159 18.314 1.00 34.52 C ATOM 488 C SER A 32 -6.207 -8.404 18.434 1.00 4.04 C ATOM 489 O SER A 32 -6.072 -7.505 19.268 1.00 20.13 O ATOM 490 CB SER A 32 -7.517 -10.377 19.238 1.00 51.45 C ATOM 491 OG SER A 32 -7.669 -9.991 20.592 1.00 24.40 O ATOM 0 H SER A 32 -8.069 -10.561 16.848 1.00 34.20 H new ATOM 0 HA SER A 32 -8.332 -8.476 18.611 1.00 34.52 H new ATOM 0 HB2 SER A 32 -8.318 -11.061 18.959 1.00 51.45 H new ATOM 0 HB3 SER A 32 -6.579 -10.917 19.114 1.00 51.45 H new ATOM 0 HG SER A 32 -7.655 -10.788 21.163 1.00 24.40 H new ATOM 497 N HIS A 33 -5.242 -8.750 17.593 1.00 5.40 N ATOM 498 CA HIS A 33 -3.950 -8.089 17.618 1.00 30.13 C ATOM 499 C HIS A 33 -4.050 -6.681 17.039 1.00 14.34 C ATOM 500 O HIS A 33 -3.805 -5.709 17.739 1.00 64.41 O ATOM 501 CB HIS A 33 -2.911 -8.897 16.849 1.00 61.14 C ATOM 502 CG HIS A 33 -1.511 -8.622 17.294 1.00 21.44 C ATOM 503 ND1 HIS A 33 -0.630 -7.916 16.517 1.00 4.23 N ATOM 504 CD2 HIS A 33 -0.896 -8.982 18.444 1.00 55.33 C ATOM 505 CE1 HIS A 33 0.494 -7.864 17.205 1.00 41.44 C ATOM 506 NE2 HIS A 33 0.381 -8.494 18.382 1.00 10.35 N ATOM 0 H HIS A 33 -5.331 -9.482 16.888 1.00 5.40 H new ATOM 0 HA HIS A 33 -3.634 -8.017 18.659 1.00 30.13 H new ATOM 0 HB2 HIS A 33 -3.123 -9.959 16.970 1.00 61.14 H new ATOM 0 HB3 HIS A 33 -2.999 -8.673 15.786 1.00 61.14 H new ATOM 0 HD2 HIS A 33 -1.330 -9.547 19.256 1.00 55.33 H new ATOM 0 HE1 HIS A 33 1.394 -7.374 16.862 1.00 41.44 H new ATOM 0 HE2 HIS A 33 1.106 -8.591 19.093 1.00 10.35 H new ATOM 514 N PHE A 34 -4.446 -6.570 15.777 1.00 12.32 N ATOM 515 CA PHE A 34 -4.495 -5.273 15.099 1.00 1.04 C ATOM 516 C PHE A 34 -5.586 -4.364 15.672 1.00 74.33 C ATOM 517 O PHE A 34 -5.517 -3.139 15.541 1.00 65.52 O ATOM 518 CB PHE A 34 -4.683 -5.468 13.594 1.00 34.50 C ATOM 519 CG PHE A 34 -3.404 -5.826 12.883 1.00 0.40 C ATOM 520 CD1 PHE A 34 -2.965 -7.140 12.827 1.00 41.14 C ATOM 521 CD2 PHE A 34 -2.639 -4.844 12.274 1.00 31.03 C ATOM 522 CE1 PHE A 34 -1.789 -7.467 12.176 1.00 61.02 C ATOM 523 CE2 PHE A 34 -1.463 -5.165 11.622 1.00 70.33 C ATOM 524 CZ PHE A 34 -1.038 -6.479 11.574 1.00 42.24 C ATOM 0 H PHE A 34 -4.738 -7.359 15.200 1.00 12.32 H new ATOM 0 HA PHE A 34 -3.542 -4.774 15.274 1.00 1.04 H new ATOM 0 HB2 PHE A 34 -5.419 -6.254 13.424 1.00 34.50 H new ATOM 0 HB3 PHE A 34 -5.088 -4.553 13.162 1.00 34.50 H new ATOM 0 HD1 PHE A 34 -3.548 -7.918 13.297 1.00 41.14 H new ATOM 0 HD2 PHE A 34 -2.966 -3.815 12.309 1.00 31.03 H new ATOM 0 HE1 PHE A 34 -1.459 -8.495 12.139 1.00 61.02 H new ATOM 0 HE2 PHE A 34 -0.877 -4.390 11.151 1.00 70.33 H new ATOM 0 HZ PHE A 34 -0.119 -6.732 11.066 1.00 42.24 H new ATOM 534 N GLU A 35 -6.579 -4.974 16.316 1.00 30.33 N ATOM 535 CA GLU A 35 -7.655 -4.255 17.000 1.00 10.03 C ATOM 536 C GLU A 35 -7.116 -3.276 18.055 1.00 31.22 C ATOM 537 O GLU A 35 -7.769 -2.283 18.380 1.00 21.24 O ATOM 538 CB GLU A 35 -8.600 -5.261 17.666 1.00 60.31 C ATOM 539 CG GLU A 35 -9.836 -4.635 18.278 1.00 15.13 C ATOM 540 CD GLU A 35 -10.601 -5.603 19.158 1.00 45.12 C ATOM 541 OE1 GLU A 35 -10.192 -5.809 20.319 1.00 60.44 O ATOM 542 OE2 GLU A 35 -11.626 -6.148 18.702 1.00 35.54 O ATOM 0 H GLU A 35 -6.661 -5.989 16.379 1.00 30.33 H new ATOM 0 HA GLU A 35 -8.192 -3.671 16.252 1.00 10.03 H new ATOM 0 HB2 GLU A 35 -8.908 -5.999 16.926 1.00 60.31 H new ATOM 0 HB3 GLU A 35 -8.054 -5.797 18.443 1.00 60.31 H new ATOM 0 HG2 GLU A 35 -9.545 -3.765 18.867 1.00 15.13 H new ATOM 0 HG3 GLU A 35 -10.490 -4.277 17.483 1.00 15.13 H new ATOM 549 N GLN A 36 -5.922 -3.558 18.577 1.00 40.14 N ATOM 550 CA GLN A 36 -5.301 -2.722 19.610 1.00 23.25 C ATOM 551 C GLN A 36 -5.088 -1.283 19.139 1.00 12.02 C ATOM 552 O GLN A 36 -5.066 -0.359 19.947 1.00 61.52 O ATOM 553 CB GLN A 36 -3.953 -3.301 20.038 1.00 62.52 C ATOM 554 CG GLN A 36 -4.034 -4.694 20.637 1.00 21.22 C ATOM 555 CD GLN A 36 -2.663 -5.270 20.940 1.00 60.21 C ATOM 556 OE1 GLN A 36 -2.143 -5.121 22.046 1.00 12.15 O ATOM 557 NE2 GLN A 36 -2.061 -5.916 19.954 1.00 30.32 N ATOM 0 H GLN A 36 -5.361 -4.364 18.301 1.00 40.14 H new ATOM 0 HA GLN A 36 -5.990 -2.713 20.454 1.00 23.25 H new ATOM 0 HB2 GLN A 36 -3.291 -3.328 19.172 1.00 62.52 H new ATOM 0 HB3 GLN A 36 -3.498 -2.631 20.767 1.00 62.52 H new ATOM 0 HG2 GLN A 36 -4.622 -4.659 21.554 1.00 21.22 H new ATOM 0 HG3 GLN A 36 -4.559 -5.354 19.947 1.00 21.22 H new ATOM 0 HE21 GLN A 36 -2.526 -6.018 19.052 1.00 30.32 H new ATOM 0 HE22 GLN A 36 -1.132 -6.312 20.096 1.00 30.32 H new ATOM 566 N TRP A 37 -4.940 -1.096 17.838 1.00 5.15 N ATOM 567 CA TRP A 37 -4.641 0.221 17.292 1.00 14.31 C ATOM 568 C TRP A 37 -5.894 0.904 16.758 1.00 42.22 C ATOM 569 O TRP A 37 -5.922 2.123 16.601 1.00 61.32 O ATOM 570 CB TRP A 37 -3.559 0.107 16.217 1.00 14.43 C ATOM 571 CG TRP A 37 -2.234 -0.272 16.804 1.00 72.53 C ATOM 572 CD1 TRP A 37 -1.283 0.576 17.292 1.00 12.11 C ATOM 573 CD2 TRP A 37 -1.726 -1.597 16.994 1.00 43.13 C ATOM 574 NE1 TRP A 37 -0.217 -0.143 17.779 1.00 54.22 N ATOM 575 CE2 TRP A 37 -0.464 -1.479 17.604 1.00 22.33 C ATOM 576 CE3 TRP A 37 -2.216 -2.871 16.707 1.00 11.04 C ATOM 577 CZ2 TRP A 37 0.308 -2.587 17.934 1.00 35.35 C ATOM 578 CZ3 TRP A 37 -1.446 -3.970 17.034 1.00 60.02 C ATOM 579 CH2 TRP A 37 -0.196 -3.823 17.642 1.00 13.20 C ATOM 0 H TRP A 37 -5.021 -1.836 17.141 1.00 5.15 H new ATOM 0 HA TRP A 37 -4.261 0.850 18.097 1.00 14.31 H new ATOM 0 HB2 TRP A 37 -3.856 -0.638 15.479 1.00 14.43 H new ATOM 0 HB3 TRP A 37 -3.466 1.058 15.692 1.00 14.43 H new ATOM 0 HD1 TRP A 37 -1.357 1.653 17.295 1.00 12.11 H new ATOM 0 HE1 TRP A 37 0.622 0.254 18.202 1.00 54.22 H new ATOM 0 HE3 TRP A 37 -3.180 -2.996 16.237 1.00 11.04 H new ATOM 0 HZ2 TRP A 37 1.273 -2.475 18.405 1.00 35.35 H new ATOM 0 HZ3 TRP A 37 -1.816 -4.961 16.816 1.00 60.02 H new ATOM 0 HH2 TRP A 37 0.382 -4.702 17.885 1.00 13.20 H new ATOM 590 N GLY A 38 -6.928 0.123 16.486 1.00 52.11 N ATOM 591 CA GLY A 38 -8.202 0.687 16.102 1.00 53.23 C ATOM 592 C GLY A 38 -9.261 -0.378 15.943 1.00 63.44 C ATOM 593 O GLY A 38 -8.937 -1.553 15.773 1.00 11.43 O ATOM 0 H GLY A 38 -6.906 -0.896 16.525 1.00 52.11 H new ATOM 0 HA2 GLY A 38 -8.522 1.408 16.854 1.00 53.23 H new ATOM 0 HA3 GLY A 38 -8.091 1.232 15.165 1.00 53.23 H new ATOM 597 N THR A 39 -10.523 0.029 16.000 1.00 41.34 N ATOM 598 CA THR A 39 -11.636 -0.894 15.858 1.00 21.04 C ATOM 599 C THR A 39 -11.654 -1.531 14.476 1.00 33.15 C ATOM 600 O THR A 39 -11.731 -0.841 13.461 1.00 51.15 O ATOM 601 CB THR A 39 -12.983 -0.189 16.102 1.00 33.42 C ATOM 602 OG1 THR A 39 -13.010 0.360 17.424 1.00 13.35 O ATOM 603 CG2 THR A 39 -14.141 -1.162 15.919 1.00 24.31 C ATOM 0 H THR A 39 -10.800 1.000 16.145 1.00 41.34 H new ATOM 0 HA THR A 39 -11.497 -1.671 16.609 1.00 21.04 H new ATOM 0 HB THR A 39 -13.091 0.615 15.375 1.00 33.42 H new ATOM 0 HG1 THR A 39 -13.868 0.809 17.574 1.00 13.35 H new ATOM 0 HG21 THR A 39 -15.083 -0.644 16.096 1.00 24.31 H new ATOM 0 HG22 THR A 39 -14.129 -1.555 14.903 1.00 24.31 H new ATOM 0 HG23 THR A 39 -14.041 -1.984 16.627 1.00 24.31 H new ATOM 611 N LEU A 40 -11.544 -2.843 14.453 1.00 45.32 N ATOM 612 CA LEU A 40 -11.673 -3.589 13.220 1.00 52.51 C ATOM 613 C LEU A 40 -13.136 -3.872 12.920 1.00 32.03 C ATOM 614 O LEU A 40 -13.911 -4.231 13.803 1.00 70.30 O ATOM 615 CB LEU A 40 -10.875 -4.892 13.286 1.00 34.13 C ATOM 616 CG LEU A 40 -9.360 -4.721 13.433 1.00 31.32 C ATOM 617 CD1 LEU A 40 -8.677 -6.072 13.429 1.00 70.32 C ATOM 618 CD2 LEU A 40 -8.800 -3.856 12.318 1.00 2.14 C ATOM 0 H LEU A 40 -11.365 -3.416 15.278 1.00 45.32 H new ATOM 0 HA LEU A 40 -11.265 -2.983 12.411 1.00 52.51 H new ATOM 0 HB2 LEU A 40 -11.241 -5.482 14.126 1.00 34.13 H new ATOM 0 HB3 LEU A 40 -11.074 -5.468 12.382 1.00 34.13 H new ATOM 0 HG LEU A 40 -9.167 -4.225 14.384 1.00 31.32 H new ATOM 0 HD11 LEU A 40 -7.601 -5.936 13.534 1.00 70.32 H new ATOM 0 HD12 LEU A 40 -9.050 -6.671 14.260 1.00 70.32 H new ATOM 0 HD13 LEU A 40 -8.888 -6.584 12.490 1.00 70.32 H new ATOM 0 HD21 LEU A 40 -7.723 -3.750 12.446 1.00 2.14 H new ATOM 0 HD22 LEU A 40 -9.007 -4.324 11.356 1.00 2.14 H new ATOM 0 HD23 LEU A 40 -9.268 -2.872 12.351 1.00 2.14 H new ATOM 630 N THR A 41 -13.502 -3.686 11.672 1.00 63.25 N ATOM 631 CA THR A 41 -14.858 -3.932 11.226 1.00 74.23 C ATOM 632 C THR A 41 -14.927 -5.241 10.450 1.00 45.11 C ATOM 633 O THR A 41 -15.992 -5.846 10.314 1.00 45.44 O ATOM 634 CB THR A 41 -15.365 -2.770 10.354 1.00 5.42 C ATOM 635 OG1 THR A 41 -14.348 -2.381 9.417 1.00 73.12 O ATOM 636 CG2 THR A 41 -15.742 -1.575 11.213 1.00 70.23 C ATOM 0 H THR A 41 -12.872 -3.361 10.939 1.00 63.25 H new ATOM 0 HA THR A 41 -15.500 -4.007 12.104 1.00 74.23 H new ATOM 0 HB THR A 41 -16.250 -3.109 9.816 1.00 5.42 H new ATOM 0 HG1 THR A 41 -13.946 -1.534 9.703 1.00 73.12 H new ATOM 0 HG21 THR A 41 -16.098 -0.766 10.575 1.00 70.23 H new ATOM 0 HG22 THR A 41 -16.530 -1.861 11.909 1.00 70.23 H new ATOM 0 HG23 THR A 41 -14.869 -1.239 11.772 1.00 70.23 H new ATOM 644 N ASP A 42 -13.776 -5.664 9.937 1.00 21.01 N ATOM 645 CA ASP A 42 -13.655 -6.927 9.218 1.00 73.11 C ATOM 646 C ASP A 42 -12.249 -7.478 9.385 1.00 75.34 C ATOM 647 O ASP A 42 -11.304 -6.715 9.564 1.00 2.15 O ATOM 648 CB ASP A 42 -13.939 -6.720 7.729 1.00 32.52 C ATOM 649 CG ASP A 42 -14.185 -8.014 6.983 1.00 24.14 C ATOM 650 OD1 ASP A 42 -15.320 -8.526 7.035 1.00 14.43 O ATOM 651 OD2 ASP A 42 -13.247 -8.517 6.333 1.00 24.22 O ATOM 0 H ASP A 42 -12.903 -5.142 10.008 1.00 21.01 H new ATOM 0 HA ASP A 42 -14.380 -7.632 9.626 1.00 73.11 H new ATOM 0 HB2 ASP A 42 -14.809 -6.073 7.618 1.00 32.52 H new ATOM 0 HB3 ASP A 42 -13.096 -6.200 7.274 1.00 32.52 H new ATOM 656 N CYS A 43 -12.113 -8.790 9.357 1.00 42.12 N ATOM 657 CA CYS A 43 -10.807 -9.430 9.390 1.00 1.11 C ATOM 658 C CYS A 43 -10.918 -10.849 8.858 1.00 75.43 C ATOM 659 O CYS A 43 -11.799 -11.601 9.275 1.00 72.44 O ATOM 660 CB CYS A 43 -10.251 -9.452 10.817 1.00 22.23 C ATOM 661 SG CYS A 43 -8.698 -10.357 10.992 1.00 72.44 S ATOM 0 H CYS A 43 -12.897 -9.441 9.311 1.00 42.12 H new ATOM 0 HA CYS A 43 -10.124 -8.859 8.762 1.00 1.11 H new ATOM 0 HB2 CYS A 43 -10.100 -8.426 11.152 1.00 22.23 H new ATOM 0 HB3 CYS A 43 -10.995 -9.897 11.478 1.00 22.23 H new ATOM 0 HG CYS A 43 -8.847 -11.311 11.863 1.00 72.44 H new ATOM 667 N VAL A 44 -10.043 -11.209 7.927 1.00 63.03 N ATOM 668 CA VAL A 44 -10.032 -12.556 7.395 1.00 54.11 C ATOM 669 C VAL A 44 -8.620 -12.976 6.992 1.00 62.32 C ATOM 670 O VAL A 44 -7.903 -12.243 6.311 1.00 2.43 O ATOM 671 CB VAL A 44 -11.006 -12.696 6.194 1.00 23.43 C ATOM 672 CG1 VAL A 44 -10.674 -11.712 5.087 1.00 54.33 C ATOM 673 CG2 VAL A 44 -11.010 -14.117 5.654 1.00 72.20 C ATOM 0 H VAL A 44 -9.338 -10.588 7.530 1.00 63.03 H new ATOM 0 HA VAL A 44 -10.374 -13.223 8.186 1.00 54.11 H new ATOM 0 HB VAL A 44 -12.005 -12.463 6.562 1.00 23.43 H new ATOM 0 HG11 VAL A 44 -11.377 -11.840 4.264 1.00 54.33 H new ATOM 0 HG12 VAL A 44 -10.746 -10.694 5.471 1.00 54.33 H new ATOM 0 HG13 VAL A 44 -9.660 -11.894 4.730 1.00 54.33 H new ATOM 0 HG21 VAL A 44 -11.701 -14.185 4.814 1.00 72.20 H new ATOM 0 HG22 VAL A 44 -10.007 -14.383 5.321 1.00 72.20 H new ATOM 0 HG23 VAL A 44 -11.325 -14.804 6.439 1.00 72.20 H new ATOM 683 N VAL A 45 -8.211 -14.144 7.458 1.00 2.32 N ATOM 684 CA VAL A 45 -6.963 -14.744 7.024 1.00 34.00 C ATOM 685 C VAL A 45 -7.225 -15.570 5.778 1.00 23.03 C ATOM 686 O VAL A 45 -8.150 -16.384 5.757 1.00 4.55 O ATOM 687 CB VAL A 45 -6.347 -15.639 8.127 1.00 22.01 C ATOM 688 CG1 VAL A 45 -5.071 -16.321 7.647 1.00 54.45 C ATOM 689 CG2 VAL A 45 -6.063 -14.819 9.370 1.00 14.32 C ATOM 0 H VAL A 45 -8.729 -14.697 8.141 1.00 2.32 H new ATOM 0 HA VAL A 45 -6.250 -13.948 6.810 1.00 34.00 H new ATOM 0 HB VAL A 45 -7.072 -16.416 8.367 1.00 22.01 H new ATOM 0 HG11 VAL A 45 -4.667 -16.941 8.447 1.00 54.45 H new ATOM 0 HG12 VAL A 45 -5.295 -16.946 6.782 1.00 54.45 H new ATOM 0 HG13 VAL A 45 -4.337 -15.565 7.368 1.00 54.45 H new ATOM 0 HG21 VAL A 45 -5.630 -15.460 10.138 1.00 14.32 H new ATOM 0 HG22 VAL A 45 -5.362 -14.020 9.127 1.00 14.32 H new ATOM 0 HG23 VAL A 45 -6.992 -14.386 9.740 1.00 14.32 H new ATOM 699 N MET A 46 -6.439 -15.343 4.735 1.00 63.13 N ATOM 700 CA MET A 46 -6.587 -16.098 3.507 1.00 12.43 C ATOM 701 C MET A 46 -6.077 -17.506 3.694 1.00 60.13 C ATOM 702 O MET A 46 -4.877 -17.763 3.686 1.00 5.13 O ATOM 703 CB MET A 46 -5.860 -15.442 2.347 1.00 63.32 C ATOM 704 CG MET A 46 -6.493 -14.147 1.870 1.00 2.51 C ATOM 705 SD MET A 46 -7.804 -14.401 0.651 1.00 61.55 S ATOM 706 CE MET A 46 -9.185 -14.873 1.692 1.00 33.31 C ATOM 0 H MET A 46 -5.696 -14.644 4.718 1.00 63.13 H new ATOM 0 HA MET A 46 -7.650 -16.121 3.267 1.00 12.43 H new ATOM 0 HB2 MET A 46 -4.830 -15.243 2.644 1.00 63.32 H new ATOM 0 HB3 MET A 46 -5.821 -16.143 1.513 1.00 63.32 H new ATOM 0 HG2 MET A 46 -6.902 -13.613 2.728 1.00 2.51 H new ATOM 0 HG3 MET A 46 -5.721 -13.511 1.437 1.00 2.51 H new ATOM 0 HE1 MET A 46 -10.100 -14.418 1.311 1.00 33.31 H new ATOM 0 HE2 MET A 46 -9.290 -15.958 1.687 1.00 33.31 H new ATOM 0 HE3 MET A 46 -9.006 -14.530 2.711 1.00 33.31 H new ATOM 716 N ARG A 47 -7.007 -18.388 3.935 1.00 41.11 N ATOM 717 CA ARG A 47 -6.702 -19.781 4.133 1.00 50.44 C ATOM 718 C ARG A 47 -7.045 -20.588 2.899 1.00 12.34 C ATOM 719 O ARG A 47 -7.797 -20.143 2.033 1.00 33.42 O ATOM 720 CB ARG A 47 -7.455 -20.323 5.345 1.00 34.22 C ATOM 721 CG ARG A 47 -7.079 -19.632 6.643 1.00 34.11 C ATOM 722 CD ARG A 47 -8.063 -19.955 7.748 1.00 54.43 C ATOM 723 NE ARG A 47 -9.390 -19.392 7.489 1.00 24.10 N ATOM 724 CZ ARG A 47 -10.461 -19.611 8.254 1.00 4.40 C ATOM 725 NH1 ARG A 47 -10.367 -20.382 9.332 1.00 5.35 N ATOM 726 NH2 ARG A 47 -11.624 -19.057 7.939 1.00 50.03 N ATOM 0 H ARG A 47 -8.000 -18.163 4.000 1.00 41.11 H new ATOM 0 HA ARG A 47 -5.631 -19.872 4.315 1.00 50.44 H new ATOM 0 HB2 ARG A 47 -8.526 -20.211 5.179 1.00 34.22 H new ATOM 0 HB3 ARG A 47 -7.257 -21.391 5.439 1.00 34.22 H new ATOM 0 HG2 ARG A 47 -6.078 -19.940 6.944 1.00 34.11 H new ATOM 0 HG3 ARG A 47 -7.047 -18.554 6.487 1.00 34.11 H new ATOM 0 HD2 ARG A 47 -8.144 -21.037 7.856 1.00 54.43 H new ATOM 0 HD3 ARG A 47 -7.684 -19.568 8.694 1.00 54.43 H new ATOM 0 HE ARG A 47 -9.503 -18.794 6.671 1.00 24.10 H new ATOM 0 HH11 ARG A 47 -9.474 -20.809 9.577 1.00 5.35 H new ATOM 0 HH12 ARG A 47 -11.188 -20.547 9.914 1.00 5.35 H new ATOM 0 HH21 ARG A 47 -11.699 -18.464 7.112 1.00 50.03 H new ATOM 0 HH22 ARG A 47 -12.443 -19.224 8.523 1.00 50.03 H new ATOM 740 N ASP A 48 -6.462 -21.764 2.831 1.00 33.03 N ATOM 741 CA ASP A 48 -6.706 -22.694 1.753 1.00 11.14 C ATOM 742 C ASP A 48 -8.099 -23.299 1.898 1.00 24.14 C ATOM 743 O ASP A 48 -8.420 -23.842 2.946 1.00 14.41 O ATOM 744 CB ASP A 48 -5.647 -23.801 1.802 1.00 15.42 C ATOM 745 CG ASP A 48 -5.846 -24.876 0.753 1.00 1.20 C ATOM 746 OD1 ASP A 48 -6.233 -24.551 -0.384 1.00 3.30 O ATOM 747 OD2 ASP A 48 -5.612 -26.053 1.067 1.00 61.12 O ATOM 0 H ASP A 48 -5.800 -22.104 3.528 1.00 33.03 H new ATOM 0 HA ASP A 48 -6.648 -22.174 0.797 1.00 11.14 H new ATOM 0 HB2 ASP A 48 -4.661 -23.355 1.671 1.00 15.42 H new ATOM 0 HB3 ASP A 48 -5.660 -24.262 2.790 1.00 15.42 H new ATOM 752 N PRO A 49 -8.951 -23.209 0.866 1.00 5.04 N ATOM 753 CA PRO A 49 -10.289 -23.810 0.902 1.00 22.30 C ATOM 754 C PRO A 49 -10.245 -25.337 0.971 1.00 74.52 C ATOM 755 O PRO A 49 -11.208 -25.978 1.393 1.00 13.33 O ATOM 756 CB PRO A 49 -10.929 -23.357 -0.416 1.00 54.40 C ATOM 757 CG PRO A 49 -9.797 -22.964 -1.299 1.00 23.23 C ATOM 758 CD PRO A 49 -8.697 -22.491 -0.393 1.00 45.32 C ATOM 0 HA PRO A 49 -10.842 -23.500 1.789 1.00 22.30 H new ATOM 0 HB2 PRO A 49 -11.514 -24.160 -0.864 1.00 54.40 H new ATOM 0 HB3 PRO A 49 -11.608 -22.520 -0.254 1.00 54.40 H new ATOM 0 HG2 PRO A 49 -9.466 -23.808 -1.904 1.00 23.23 H new ATOM 0 HG3 PRO A 49 -10.098 -22.176 -1.989 1.00 23.23 H new ATOM 0 HD2 PRO A 49 -7.714 -22.729 -0.799 1.00 45.32 H new ATOM 0 HD3 PRO A 49 -8.731 -21.411 -0.252 1.00 45.32 H new ATOM 766 N ASN A 50 -9.117 -25.912 0.568 1.00 34.02 N ATOM 767 CA ASN A 50 -8.982 -27.360 0.492 1.00 61.24 C ATOM 768 C ASN A 50 -8.611 -27.962 1.844 1.00 61.01 C ATOM 769 O ASN A 50 -9.306 -28.838 2.356 1.00 61.50 O ATOM 770 CB ASN A 50 -7.933 -27.748 -0.548 1.00 32.35 C ATOM 771 CG ASN A 50 -8.309 -27.282 -1.935 1.00 43.40 C ATOM 772 OD1 ASN A 50 -8.942 -28.004 -2.703 1.00 74.24 O ATOM 773 ND2 ASN A 50 -7.931 -26.062 -2.258 1.00 5.32 N ATOM 0 H ASN A 50 -8.283 -25.396 0.289 1.00 34.02 H new ATOM 0 HA ASN A 50 -9.951 -27.760 0.194 1.00 61.24 H new ATOM 0 HB2 ASN A 50 -6.971 -27.318 -0.270 1.00 32.35 H new ATOM 0 HB3 ASN A 50 -7.809 -28.831 -0.551 1.00 32.35 H new ATOM 0 HD21 ASN A 50 -8.162 -25.683 -3.176 1.00 5.32 H new ATOM 0 HD22 ASN A 50 -7.407 -25.497 -1.590 1.00 5.32 H new ATOM 780 N THR A 51 -7.520 -27.475 2.420 1.00 14.10 N ATOM 781 CA THR A 51 -6.968 -28.048 3.644 1.00 21.42 C ATOM 782 C THR A 51 -7.249 -27.167 4.862 1.00 64.42 C ATOM 783 O THR A 51 -6.998 -27.569 5.997 1.00 62.44 O ATOM 784 CB THR A 51 -5.446 -28.246 3.490 1.00 33.21 C ATOM 785 OG1 THR A 51 -5.138 -28.522 2.116 1.00 52.13 O ATOM 786 CG2 THR A 51 -4.941 -29.389 4.360 1.00 35.51 C ATOM 0 H THR A 51 -6.995 -26.679 2.057 1.00 14.10 H new ATOM 0 HA THR A 51 -7.454 -29.010 3.806 1.00 21.42 H new ATOM 0 HB THR A 51 -4.951 -27.330 3.812 1.00 33.21 H new ATOM 0 HG1 THR A 51 -5.108 -27.682 1.612 1.00 52.13 H new ATOM 0 HG21 THR A 51 -3.865 -29.500 4.226 1.00 35.51 H new ATOM 0 HG22 THR A 51 -5.156 -29.172 5.406 1.00 35.51 H new ATOM 0 HG23 THR A 51 -5.440 -30.314 4.071 1.00 35.51 H new ATOM 794 N LYS A 52 -7.770 -25.971 4.605 1.00 13.12 N ATOM 795 CA LYS A 52 -8.138 -25.011 5.652 1.00 12.32 C ATOM 796 C LYS A 52 -6.921 -24.581 6.468 1.00 73.14 C ATOM 797 O LYS A 52 -7.002 -24.391 7.684 1.00 33.03 O ATOM 798 CB LYS A 52 -9.232 -25.578 6.568 1.00 53.24 C ATOM 799 CG LYS A 52 -10.456 -26.110 5.830 1.00 64.51 C ATOM 800 CD LYS A 52 -10.955 -25.139 4.769 1.00 54.33 C ATOM 801 CE LYS A 52 -12.415 -25.389 4.420 1.00 30.21 C ATOM 802 NZ LYS A 52 -12.632 -26.741 3.841 1.00 44.25 N ATOM 0 H LYS A 52 -7.952 -25.634 3.660 1.00 13.12 H new ATOM 0 HA LYS A 52 -8.537 -24.127 5.155 1.00 12.32 H new ATOM 0 HB2 LYS A 52 -8.806 -26.382 7.168 1.00 53.24 H new ATOM 0 HB3 LYS A 52 -9.550 -24.798 7.260 1.00 53.24 H new ATOM 0 HG2 LYS A 52 -10.210 -27.063 5.361 1.00 64.51 H new ATOM 0 HG3 LYS A 52 -11.254 -26.304 6.546 1.00 64.51 H new ATOM 0 HD2 LYS A 52 -10.836 -24.116 5.127 1.00 54.33 H new ATOM 0 HD3 LYS A 52 -10.344 -25.235 3.871 1.00 54.33 H new ATOM 0 HE2 LYS A 52 -13.025 -25.278 5.316 1.00 30.21 H new ATOM 0 HE3 LYS A 52 -12.751 -24.634 3.710 1.00 30.21 H new ATOM 0 HZ1 LYS A 52 -13.650 -26.898 3.698 1.00 44.25 H new ATOM 0 HZ2 LYS A 52 -12.139 -26.811 2.928 1.00 44.25 H new ATOM 0 HZ3 LYS A 52 -12.259 -27.461 4.492 1.00 44.25 H new ATOM 816 N ARG A 53 -5.794 -24.415 5.788 1.00 33.31 N ATOM 817 CA ARG A 53 -4.574 -23.953 6.434 1.00 3.11 C ATOM 818 C ARG A 53 -4.278 -22.546 5.955 1.00 33.33 C ATOM 819 O ARG A 53 -4.732 -22.163 4.884 1.00 11.21 O ATOM 820 CB ARG A 53 -3.391 -24.873 6.110 1.00 42.32 C ATOM 821 CG ARG A 53 -3.629 -26.345 6.428 1.00 50.24 C ATOM 822 CD ARG A 53 -4.023 -26.566 7.881 1.00 50.23 C ATOM 823 NE ARG A 53 -3.055 -25.990 8.813 1.00 35.10 N ATOM 824 CZ ARG A 53 -3.372 -25.528 10.024 1.00 30.04 C ATOM 825 NH1 ARG A 53 -4.628 -25.569 10.453 1.00 41.15 N ATOM 826 NH2 ARG A 53 -2.432 -25.019 10.804 1.00 3.15 N ATOM 0 H ARG A 53 -5.700 -24.594 4.788 1.00 33.31 H new ATOM 0 HA ARG A 53 -4.717 -23.965 7.514 1.00 3.11 H new ATOM 0 HB2 ARG A 53 -3.152 -24.777 5.051 1.00 42.32 H new ATOM 0 HB3 ARG A 53 -2.518 -24.531 6.666 1.00 42.32 H new ATOM 0 HG2 ARG A 53 -4.414 -26.732 5.778 1.00 50.24 H new ATOM 0 HG3 ARG A 53 -2.725 -26.913 6.209 1.00 50.24 H new ATOM 0 HD2 ARG A 53 -5.003 -26.125 8.060 1.00 50.23 H new ATOM 0 HD3 ARG A 53 -4.115 -27.635 8.071 1.00 50.23 H new ATOM 0 HE ARG A 53 -2.079 -25.938 8.520 1.00 35.10 H new ATOM 0 HH11 ARG A 53 -5.359 -25.956 9.855 1.00 41.15 H new ATOM 0 HH12 ARG A 53 -4.862 -25.214 11.380 1.00 41.15 H new ATOM 0 HH21 ARG A 53 -1.466 -24.980 10.479 1.00 3.15 H new ATOM 0 HH22 ARG A 53 -2.674 -24.666 11.730 1.00 3.15 H new ATOM 840 N SER A 54 -3.515 -21.779 6.717 1.00 62.44 N ATOM 841 CA SER A 54 -3.247 -20.398 6.351 1.00 2.44 C ATOM 842 C SER A 54 -2.280 -20.342 5.177 1.00 73.00 C ATOM 843 O SER A 54 -1.308 -21.097 5.124 1.00 74.01 O ATOM 844 CB SER A 54 -2.678 -19.633 7.551 1.00 14.54 C ATOM 845 OG SER A 54 -2.239 -18.332 7.190 1.00 32.13 O ATOM 0 H SER A 54 -3.074 -22.085 7.584 1.00 62.44 H new ATOM 0 HA SER A 54 -4.183 -19.927 6.051 1.00 2.44 H new ATOM 0 HB2 SER A 54 -3.440 -19.557 8.327 1.00 14.54 H new ATOM 0 HB3 SER A 54 -1.845 -20.192 7.976 1.00 14.54 H new ATOM 0 HG SER A 54 -1.432 -18.106 7.698 1.00 32.13 H new ATOM 851 N ARG A 55 -2.559 -19.451 4.231 1.00 11.34 N ATOM 852 CA ARG A 55 -1.684 -19.247 3.083 1.00 42.02 C ATOM 853 C ARG A 55 -0.550 -18.298 3.448 1.00 42.21 C ATOM 854 O ARG A 55 0.298 -17.974 2.616 1.00 34.35 O ATOM 855 CB ARG A 55 -2.462 -18.663 1.906 1.00 41.11 C ATOM 856 CG ARG A 55 -3.505 -19.586 1.300 1.00 65.51 C ATOM 857 CD ARG A 55 -4.525 -18.770 0.525 1.00 4.33 C ATOM 858 NE ARG A 55 -5.383 -19.572 -0.342 1.00 62.13 N ATOM 859 CZ ARG A 55 -6.389 -19.055 -1.052 1.00 73.42 C ATOM 860 NH1 ARG A 55 -6.650 -17.753 -0.986 1.00 12.44 N ATOM 861 NH2 ARG A 55 -7.121 -19.834 -1.839 1.00 62.34 N ATOM 0 H ARG A 55 -3.388 -18.857 4.238 1.00 11.34 H new ATOM 0 HA ARG A 55 -1.275 -20.216 2.796 1.00 42.02 H new ATOM 0 HB2 ARG A 55 -2.956 -17.749 2.235 1.00 41.11 H new ATOM 0 HB3 ARG A 55 -1.754 -18.380 1.127 1.00 41.11 H new ATOM 0 HG2 ARG A 55 -3.025 -20.308 0.639 1.00 65.51 H new ATOM 0 HG3 ARG A 55 -4.002 -20.154 2.086 1.00 65.51 H new ATOM 0 HD2 ARG A 55 -5.148 -18.220 1.230 1.00 4.33 H new ATOM 0 HD3 ARG A 55 -4.001 -18.031 -0.081 1.00 4.33 H new ATOM 0 HE ARG A 55 -5.206 -20.574 -0.409 1.00 62.13 H new ATOM 0 HH11 ARG A 55 -6.082 -17.148 -0.393 1.00 12.44 H new ATOM 0 HH12 ARG A 55 -7.419 -17.359 -1.529 1.00 12.44 H new ATOM 0 HH21 ARG A 55 -6.916 -20.831 -1.903 1.00 62.34 H new ATOM 0 HH22 ARG A 55 -7.889 -19.435 -2.380 1.00 62.34 H new ATOM 875 N GLY A 56 -0.537 -17.860 4.700 1.00 62.05 N ATOM 876 CA GLY A 56 0.493 -16.958 5.162 1.00 74.41 C ATOM 877 C GLY A 56 0.187 -15.495 4.907 1.00 24.44 C ATOM 878 O GLY A 56 1.094 -14.673 4.928 1.00 65.13 O ATOM 0 H GLY A 56 -1.227 -18.117 5.406 1.00 62.05 H new ATOM 0 HA2 GLY A 56 0.640 -17.107 6.232 1.00 74.41 H new ATOM 0 HA3 GLY A 56 1.433 -17.213 4.672 1.00 74.41 H new ATOM 882 N PHE A 57 -1.070 -15.155 4.658 1.00 62.24 N ATOM 883 CA PHE A 57 -1.452 -13.758 4.479 1.00 55.12 C ATOM 884 C PHE A 57 -2.950 -13.577 4.708 1.00 42.32 C ATOM 885 O PHE A 57 -3.717 -14.535 4.627 1.00 51.30 O ATOM 886 CB PHE A 57 -1.036 -13.228 3.092 1.00 60.03 C ATOM 887 CG PHE A 57 -1.647 -13.933 1.906 1.00 4.42 C ATOM 888 CD1 PHE A 57 -1.083 -15.095 1.404 1.00 53.31 C ATOM 889 CD2 PHE A 57 -2.766 -13.411 1.275 1.00 4.50 C ATOM 890 CE1 PHE A 57 -1.626 -15.725 0.301 1.00 5.41 C ATOM 891 CE2 PHE A 57 -3.310 -14.035 0.168 1.00 25.45 C ATOM 892 CZ PHE A 57 -2.739 -15.193 -0.317 1.00 74.43 C ATOM 0 H PHE A 57 -1.839 -15.820 4.575 1.00 62.24 H new ATOM 0 HA PHE A 57 -0.917 -13.169 5.224 1.00 55.12 H new ATOM 0 HB2 PHE A 57 -1.296 -12.171 3.035 1.00 60.03 H new ATOM 0 HB3 PHE A 57 0.049 -13.294 3.010 1.00 60.03 H new ATOM 0 HD1 PHE A 57 -0.209 -15.513 1.881 1.00 53.31 H new ATOM 0 HD2 PHE A 57 -3.218 -12.506 1.653 1.00 4.50 H new ATOM 0 HE1 PHE A 57 -1.180 -16.633 -0.077 1.00 5.41 H new ATOM 0 HE2 PHE A 57 -4.180 -13.617 -0.316 1.00 25.45 H new ATOM 0 HZ PHE A 57 -3.163 -15.683 -1.181 1.00 74.43 H new ATOM 902 N GLY A 58 -3.351 -12.348 5.014 1.00 41.12 N ATOM 903 CA GLY A 58 -4.745 -12.044 5.269 1.00 44.54 C ATOM 904 C GLY A 58 -5.008 -10.555 5.188 1.00 71.12 C ATOM 905 O GLY A 58 -4.199 -9.822 4.629 1.00 3.32 O ATOM 0 H GLY A 58 -2.724 -11.547 5.090 1.00 41.12 H new ATOM 0 HA2 GLY A 58 -5.371 -12.566 4.545 1.00 44.54 H new ATOM 0 HA3 GLY A 58 -5.025 -12.412 6.256 1.00 44.54 H new ATOM 909 N PHE A 59 -6.137 -10.106 5.729 1.00 31.30 N ATOM 910 CA PHE A 59 -6.485 -8.688 5.717 1.00 12.42 C ATOM 911 C PHE A 59 -7.187 -8.295 7.010 1.00 42.42 C ATOM 912 O PHE A 59 -7.884 -9.108 7.621 1.00 52.43 O ATOM 913 CB PHE A 59 -7.425 -8.328 4.554 1.00 33.54 C ATOM 914 CG PHE A 59 -7.224 -9.109 3.291 1.00 61.23 C ATOM 915 CD1 PHE A 59 -6.312 -8.700 2.331 1.00 41.51 C ATOM 916 CD2 PHE A 59 -7.961 -10.253 3.067 1.00 61.20 C ATOM 917 CE1 PHE A 59 -6.143 -9.429 1.168 1.00 71.51 C ATOM 918 CE2 PHE A 59 -7.800 -10.983 1.916 1.00 71.24 C ATOM 919 CZ PHE A 59 -6.888 -10.576 0.962 1.00 64.52 C ATOM 0 H PHE A 59 -6.828 -10.705 6.182 1.00 31.30 H new ATOM 0 HA PHE A 59 -5.545 -8.148 5.603 1.00 12.42 H new ATOM 0 HB2 PHE A 59 -8.454 -8.468 4.886 1.00 33.54 H new ATOM 0 HB3 PHE A 59 -7.304 -7.269 4.328 1.00 33.54 H new ATOM 0 HD1 PHE A 59 -5.729 -7.805 2.492 1.00 41.51 H new ATOM 0 HD2 PHE A 59 -8.675 -10.579 3.808 1.00 61.20 H new ATOM 0 HE1 PHE A 59 -5.432 -9.104 0.423 1.00 71.51 H new ATOM 0 HE2 PHE A 59 -8.386 -11.876 1.756 1.00 71.24 H new ATOM 0 HZ PHE A 59 -6.757 -11.152 0.058 1.00 64.52 H new ATOM 929 N VAL A 60 -7.007 -7.043 7.409 1.00 54.34 N ATOM 930 CA VAL A 60 -7.731 -6.471 8.537 1.00 31.12 C ATOM 931 C VAL A 60 -8.355 -5.136 8.130 1.00 34.22 C ATOM 932 O VAL A 60 -7.663 -4.230 7.674 1.00 5.12 O ATOM 933 CB VAL A 60 -6.832 -6.269 9.787 1.00 44.03 C ATOM 934 CG1 VAL A 60 -6.547 -7.596 10.469 1.00 75.31 C ATOM 935 CG2 VAL A 60 -5.528 -5.579 9.422 1.00 72.21 C ATOM 0 H VAL A 60 -6.357 -6.397 6.962 1.00 54.34 H new ATOM 0 HA VAL A 60 -8.509 -7.183 8.811 1.00 31.12 H new ATOM 0 HB VAL A 60 -7.376 -5.629 10.481 1.00 44.03 H new ATOM 0 HG11 VAL A 60 -5.916 -7.428 11.342 1.00 75.31 H new ATOM 0 HG12 VAL A 60 -7.486 -8.053 10.783 1.00 75.31 H new ATOM 0 HG13 VAL A 60 -6.035 -8.260 9.773 1.00 75.31 H new ATOM 0 HG21 VAL A 60 -4.920 -5.452 10.318 1.00 72.21 H new ATOM 0 HG22 VAL A 60 -4.985 -6.187 8.699 1.00 72.21 H new ATOM 0 HG23 VAL A 60 -5.742 -4.603 8.987 1.00 72.21 H new ATOM 945 N THR A 61 -9.664 -5.031 8.260 1.00 2.11 N ATOM 946 CA THR A 61 -10.369 -3.814 7.893 1.00 12.43 C ATOM 947 C THR A 61 -10.647 -2.972 9.125 1.00 2.05 C ATOM 948 O THR A 61 -11.292 -3.432 10.062 1.00 23.45 O ATOM 949 CB THR A 61 -11.705 -4.119 7.194 1.00 61.13 C ATOM 950 OG1 THR A 61 -11.523 -5.146 6.213 1.00 74.41 O ATOM 951 CG2 THR A 61 -12.262 -2.872 6.523 1.00 44.51 C ATOM 0 H THR A 61 -10.263 -5.775 8.618 1.00 2.11 H new ATOM 0 HA THR A 61 -9.727 -3.269 7.202 1.00 12.43 H new ATOM 0 HB THR A 61 -12.414 -4.457 7.950 1.00 61.13 H new ATOM 0 HG1 THR A 61 -12.307 -5.181 5.626 1.00 74.41 H new ATOM 0 HG21 THR A 61 -13.207 -3.112 6.035 1.00 44.51 H new ATOM 0 HG22 THR A 61 -12.427 -2.098 7.273 1.00 44.51 H new ATOM 0 HG23 THR A 61 -11.552 -2.511 5.779 1.00 44.51 H new ATOM 959 N TYR A 62 -10.158 -1.746 9.120 1.00 64.12 N ATOM 960 CA TYR A 62 -10.386 -0.833 10.220 1.00 4.33 C ATOM 961 C TYR A 62 -11.687 -0.076 10.028 1.00 2.30 C ATOM 962 O TYR A 62 -12.255 -0.060 8.935 1.00 3.55 O ATOM 963 CB TYR A 62 -9.224 0.152 10.346 1.00 11.22 C ATOM 964 CG TYR A 62 -8.036 -0.403 11.098 1.00 40.40 C ATOM 965 CD1 TYR A 62 -7.960 -0.286 12.477 1.00 23.44 C ATOM 966 CD2 TYR A 62 -6.994 -1.044 10.433 1.00 71.03 C ATOM 967 CE1 TYR A 62 -6.881 -0.791 13.176 1.00 32.30 C ATOM 968 CE2 TYR A 62 -5.914 -1.550 11.129 1.00 45.44 C ATOM 969 CZ TYR A 62 -5.864 -1.420 12.497 1.00 13.01 C ATOM 970 OH TYR A 62 -4.790 -1.924 13.190 1.00 44.13 O ATOM 0 H TYR A 62 -9.597 -1.359 8.361 1.00 64.12 H new ATOM 0 HA TYR A 62 -10.455 -1.418 11.137 1.00 4.33 H new ATOM 0 HB2 TYR A 62 -8.903 0.452 9.348 1.00 11.22 H new ATOM 0 HB3 TYR A 62 -9.575 1.052 10.852 1.00 11.22 H new ATOM 0 HD1 TYR A 62 -8.757 0.208 13.013 1.00 23.44 H new ATOM 0 HD2 TYR A 62 -7.031 -1.147 9.359 1.00 71.03 H new ATOM 0 HE1 TYR A 62 -6.836 -0.692 14.251 1.00 32.30 H new ATOM 0 HE2 TYR A 62 -5.112 -2.045 10.601 1.00 45.44 H new ATOM 0 HH TYR A 62 -5.110 -2.479 13.931 1.00 44.13 H new ATOM 980 N ALA A 63 -12.167 0.520 11.107 1.00 23.24 N ATOM 981 CA ALA A 63 -13.353 1.356 11.066 1.00 22.24 C ATOM 982 C ALA A 63 -13.059 2.646 10.315 1.00 4.43 C ATOM 983 O ALA A 63 -13.836 3.086 9.469 1.00 22.33 O ATOM 984 CB ALA A 63 -13.823 1.659 12.481 1.00 52.34 C ATOM 0 H ALA A 63 -11.746 0.438 12.033 1.00 23.24 H new ATOM 0 HA ALA A 63 -14.146 0.823 10.541 1.00 22.24 H new ATOM 0 HB1 ALA A 63 -14.713 2.287 12.442 1.00 52.34 H new ATOM 0 HB2 ALA A 63 -14.059 0.726 12.994 1.00 52.34 H new ATOM 0 HB3 ALA A 63 -13.034 2.181 13.022 1.00 52.34 H new ATOM 990 N THR A 64 -11.911 3.231 10.618 1.00 14.41 N ATOM 991 CA THR A 64 -11.508 4.485 10.016 1.00 64.11 C ATOM 992 C THR A 64 -10.144 4.340 9.349 1.00 74.41 C ATOM 993 O THR A 64 -9.274 3.616 9.843 1.00 3.31 O ATOM 994 CB THR A 64 -11.448 5.597 11.079 1.00 2.32 C ATOM 995 OG1 THR A 64 -12.568 5.477 11.965 1.00 11.24 O ATOM 996 CG2 THR A 64 -11.458 6.971 10.437 1.00 0.13 C ATOM 0 H THR A 64 -11.239 2.850 11.284 1.00 14.41 H new ATOM 0 HA THR A 64 -12.247 4.754 9.261 1.00 64.11 H new ATOM 0 HB THR A 64 -10.518 5.485 11.636 1.00 2.32 H new ATOM 0 HG1 THR A 64 -12.527 6.185 12.642 1.00 11.24 H new ATOM 0 HG21 THR A 64 -11.415 7.735 11.213 1.00 0.13 H new ATOM 0 HG22 THR A 64 -10.594 7.072 9.780 1.00 0.13 H new ATOM 0 HG23 THR A 64 -12.372 7.095 9.856 1.00 0.13 H new ATOM 1004 N VAL A 65 -9.963 5.026 8.227 1.00 3.03 N ATOM 1005 CA VAL A 65 -8.693 5.017 7.511 1.00 10.21 C ATOM 1006 C VAL A 65 -7.576 5.628 8.372 1.00 12.40 C ATOM 1007 O VAL A 65 -6.438 5.174 8.332 1.00 51.14 O ATOM 1008 CB VAL A 65 -8.820 5.757 6.157 1.00 64.31 C ATOM 1009 CG1 VAL A 65 -9.297 7.185 6.350 1.00 70.03 C ATOM 1010 CG2 VAL A 65 -7.510 5.732 5.391 1.00 24.12 C ATOM 0 H VAL A 65 -10.685 5.599 7.791 1.00 3.03 H new ATOM 0 HA VAL A 65 -8.427 3.981 7.303 1.00 10.21 H new ATOM 0 HB VAL A 65 -9.568 5.228 5.567 1.00 64.31 H new ATOM 0 HG11 VAL A 65 -9.376 7.677 5.380 1.00 70.03 H new ATOM 0 HG12 VAL A 65 -10.273 7.180 6.835 1.00 70.03 H new ATOM 0 HG13 VAL A 65 -8.585 7.725 6.974 1.00 70.03 H new ATOM 0 HG21 VAL A 65 -7.632 6.260 4.445 1.00 24.12 H new ATOM 0 HG22 VAL A 65 -6.734 6.219 5.981 1.00 24.12 H new ATOM 0 HG23 VAL A 65 -7.222 4.699 5.196 1.00 24.12 H new ATOM 1020 N GLU A 66 -7.910 6.663 9.138 1.00 70.10 N ATOM 1021 CA GLU A 66 -6.988 7.254 10.108 1.00 4.14 C ATOM 1022 C GLU A 66 -6.456 6.224 11.120 1.00 73.13 C ATOM 1023 O GLU A 66 -5.286 6.275 11.500 1.00 40.21 O ATOM 1024 CB GLU A 66 -7.696 8.402 10.833 1.00 65.44 C ATOM 1025 CG GLU A 66 -8.530 9.272 9.898 1.00 42.33 C ATOM 1026 CD GLU A 66 -9.081 10.519 10.556 1.00 31.21 C ATOM 1027 OE1 GLU A 66 -10.136 10.432 11.213 1.00 25.11 O ATOM 1028 OE2 GLU A 66 -8.468 11.596 10.391 1.00 61.02 O ATOM 0 H GLU A 66 -8.824 7.115 9.105 1.00 70.10 H new ATOM 0 HA GLU A 66 -6.121 7.630 9.565 1.00 4.14 H new ATOM 0 HB2 GLU A 66 -8.341 7.991 11.610 1.00 65.44 H new ATOM 0 HB3 GLU A 66 -6.952 9.023 11.332 1.00 65.44 H new ATOM 0 HG2 GLU A 66 -7.918 9.563 9.044 1.00 42.33 H new ATOM 0 HG3 GLU A 66 -9.359 8.681 9.509 1.00 42.33 H new ATOM 1035 N GLU A 67 -7.306 5.280 11.532 1.00 74.21 N ATOM 1036 CA GLU A 67 -6.887 4.216 12.454 1.00 34.45 C ATOM 1037 C GLU A 67 -5.906 3.268 11.773 1.00 30.43 C ATOM 1038 O GLU A 67 -5.067 2.644 12.425 1.00 3.23 O ATOM 1039 CB GLU A 67 -8.100 3.431 12.962 1.00 25.54 C ATOM 1040 CG GLU A 67 -9.057 4.253 13.813 1.00 41.41 C ATOM 1041 CD GLU A 67 -8.418 4.798 15.075 1.00 2.32 C ATOM 1042 OE1 GLU A 67 -7.618 5.748 14.987 1.00 33.35 O ATOM 1043 OE2 GLU A 67 -8.729 4.285 16.164 1.00 50.12 O ATOM 0 H GLU A 67 -8.283 5.229 11.245 1.00 74.21 H new ATOM 0 HA GLU A 67 -6.391 4.685 13.304 1.00 34.45 H new ATOM 0 HB2 GLU A 67 -8.644 3.029 12.107 1.00 25.54 H new ATOM 0 HB3 GLU A 67 -7.750 2.580 13.546 1.00 25.54 H new ATOM 0 HG2 GLU A 67 -9.439 5.084 13.219 1.00 41.41 H new ATOM 0 HG3 GLU A 67 -9.913 3.635 14.085 1.00 41.41 H new ATOM 1050 N VAL A 68 -6.016 3.182 10.454 1.00 54.54 N ATOM 1051 CA VAL A 68 -5.086 2.408 9.640 1.00 12.43 C ATOM 1052 C VAL A 68 -3.686 3.006 9.716 1.00 65.02 C ATOM 1053 O VAL A 68 -2.704 2.287 9.883 1.00 74.10 O ATOM 1054 CB VAL A 68 -5.541 2.375 8.166 1.00 2.54 C ATOM 1055 CG1 VAL A 68 -4.433 1.887 7.259 1.00 72.43 C ATOM 1056 CG2 VAL A 68 -6.766 1.508 8.007 1.00 15.13 C ATOM 0 H VAL A 68 -6.750 3.645 9.919 1.00 54.54 H new ATOM 0 HA VAL A 68 -5.070 1.391 10.032 1.00 12.43 H new ATOM 0 HB VAL A 68 -5.792 3.395 7.874 1.00 2.54 H new ATOM 0 HG11 VAL A 68 -4.786 1.875 6.228 1.00 72.43 H new ATOM 0 HG12 VAL A 68 -3.575 2.554 7.342 1.00 72.43 H new ATOM 0 HG13 VAL A 68 -4.139 0.879 7.553 1.00 72.43 H new ATOM 0 HG21 VAL A 68 -7.071 1.498 6.961 1.00 15.13 H new ATOM 0 HG22 VAL A 68 -6.537 0.492 8.328 1.00 15.13 H new ATOM 0 HG23 VAL A 68 -7.576 1.907 8.617 1.00 15.13 H new ATOM 1066 N ASP A 69 -3.616 4.325 9.589 1.00 64.34 N ATOM 1067 CA ASP A 69 -2.352 5.057 9.644 1.00 3.43 C ATOM 1068 C ASP A 69 -1.553 4.724 10.901 1.00 21.25 C ATOM 1069 O ASP A 69 -0.354 4.461 10.829 1.00 65.40 O ATOM 1070 CB ASP A 69 -2.609 6.560 9.588 1.00 13.33 C ATOM 1071 CG ASP A 69 -2.892 7.061 8.186 1.00 51.34 C ATOM 1072 OD1 ASP A 69 -1.958 7.102 7.358 1.00 25.15 O ATOM 1073 OD2 ASP A 69 -4.049 7.430 7.908 1.00 41.02 O ATOM 0 H ASP A 69 -4.432 4.920 9.445 1.00 64.34 H new ATOM 0 HA ASP A 69 -1.764 4.750 8.779 1.00 3.43 H new ATOM 0 HB2 ASP A 69 -3.454 6.803 10.232 1.00 13.33 H new ATOM 0 HB3 ASP A 69 -1.742 7.086 9.988 1.00 13.33 H new ATOM 1078 N ALA A 70 -2.219 4.760 12.052 1.00 2.34 N ATOM 1079 CA ALA A 70 -1.605 4.363 13.320 1.00 44.12 C ATOM 1080 C ALA A 70 -1.085 2.921 13.297 1.00 1.41 C ATOM 1081 O ALA A 70 -0.023 2.629 13.844 1.00 21.43 O ATOM 1082 CB ALA A 70 -2.599 4.550 14.448 1.00 73.40 C ATOM 0 H ALA A 70 -3.190 5.062 12.135 1.00 2.34 H new ATOM 0 HA ALA A 70 -0.739 5.005 13.481 1.00 44.12 H new ATOM 0 HB1 ALA A 70 -2.139 4.254 15.391 1.00 73.40 H new ATOM 0 HB2 ALA A 70 -2.895 5.598 14.502 1.00 73.40 H new ATOM 0 HB3 ALA A 70 -3.479 3.933 14.264 1.00 73.40 H new ATOM 1088 N ALA A 71 -1.812 2.031 12.636 1.00 32.31 N ATOM 1089 CA ALA A 71 -1.373 0.646 12.501 1.00 63.41 C ATOM 1090 C ALA A 71 -0.118 0.574 11.637 1.00 32.00 C ATOM 1091 O ALA A 71 0.773 -0.244 11.867 1.00 20.15 O ATOM 1092 CB ALA A 71 -2.472 -0.208 11.901 1.00 72.12 C ATOM 0 H ALA A 71 -2.704 2.240 12.187 1.00 32.31 H new ATOM 0 HA ALA A 71 -1.141 0.260 13.494 1.00 63.41 H new ATOM 0 HB1 ALA A 71 -2.124 -1.237 11.809 1.00 72.12 H new ATOM 0 HB2 ALA A 71 -3.350 -0.178 12.547 1.00 72.12 H new ATOM 0 HB3 ALA A 71 -2.734 0.176 10.915 1.00 72.12 H new ATOM 1098 N MET A 72 -0.051 1.453 10.647 1.00 44.02 N ATOM 1099 CA MET A 72 1.103 1.531 9.766 1.00 51.45 C ATOM 1100 C MET A 72 2.320 2.068 10.511 1.00 40.42 C ATOM 1101 O MET A 72 3.429 1.583 10.322 1.00 2.12 O ATOM 1102 CB MET A 72 0.796 2.404 8.542 1.00 2.43 C ATOM 1103 CG MET A 72 -0.412 1.933 7.735 1.00 71.00 C ATOM 1104 SD MET A 72 0.010 0.867 6.338 1.00 31.34 S ATOM 1105 CE MET A 72 0.863 -0.491 7.122 1.00 74.43 C ATOM 0 H MET A 72 -0.788 2.125 10.434 1.00 44.02 H new ATOM 0 HA MET A 72 1.330 0.522 9.421 1.00 51.45 H new ATOM 0 HB2 MET A 72 0.623 3.428 8.872 1.00 2.43 H new ATOM 0 HB3 MET A 72 1.671 2.422 7.892 1.00 2.43 H new ATOM 0 HG2 MET A 72 -1.091 1.396 8.397 1.00 71.00 H new ATOM 0 HG3 MET A 72 -0.951 2.805 7.364 1.00 71.00 H new ATOM 0 HE1 MET A 72 0.828 -1.366 6.473 1.00 74.43 H new ATOM 0 HE2 MET A 72 1.902 -0.214 7.301 1.00 74.43 H new ATOM 0 HE3 MET A 72 0.381 -0.724 8.072 1.00 74.43 H new ATOM 1115 N ASN A 73 2.111 3.033 11.395 1.00 43.51 N ATOM 1116 CA ASN A 73 3.223 3.624 12.135 1.00 11.24 C ATOM 1117 C ASN A 73 3.692 2.703 13.266 1.00 70.22 C ATOM 1118 O ASN A 73 4.744 2.924 13.866 1.00 75.21 O ATOM 1119 CB ASN A 73 2.849 5.034 12.646 1.00 23.44 C ATOM 1120 CG ASN A 73 1.968 5.093 13.895 1.00 2.24 C ATOM 1121 OD1 ASN A 73 2.129 4.348 14.860 1.00 11.03 O ATOM 1122 ND2 ASN A 73 1.020 6.012 13.883 1.00 72.01 N ATOM 0 H ASN A 73 1.194 3.421 11.618 1.00 43.51 H new ATOM 0 HA ASN A 73 4.067 3.737 11.455 1.00 11.24 H new ATOM 0 HB2 ASN A 73 3.771 5.578 12.852 1.00 23.44 H new ATOM 0 HB3 ASN A 73 2.338 5.564 11.842 1.00 23.44 H new ATOM 0 HD21 ASN A 73 0.401 6.116 14.687 1.00 72.01 H new ATOM 0 HD22 ASN A 73 0.907 6.618 13.070 1.00 72.01 H new ATOM 1129 N ALA A 74 2.908 1.661 13.530 1.00 75.11 N ATOM 1130 CA ALA A 74 3.196 0.724 14.612 1.00 35.24 C ATOM 1131 C ALA A 74 4.089 -0.436 14.159 1.00 21.12 C ATOM 1132 O ALA A 74 4.567 -1.209 14.990 1.00 34.42 O ATOM 1133 CB ALA A 74 1.899 0.191 15.190 1.00 72.04 C ATOM 0 H ALA A 74 2.061 1.443 13.004 1.00 75.11 H new ATOM 0 HA ALA A 74 3.745 1.270 15.379 1.00 35.24 H new ATOM 0 HB1 ALA A 74 2.120 -0.508 15.997 1.00 72.04 H new ATOM 0 HB2 ALA A 74 1.307 1.019 15.579 1.00 72.04 H new ATOM 0 HB3 ALA A 74 1.337 -0.322 14.410 1.00 72.04 H new ATOM 1139 N ARG A 75 4.275 -0.570 12.843 1.00 31.22 N ATOM 1140 CA ARG A 75 5.132 -1.621 12.264 1.00 62.10 C ATOM 1141 C ARG A 75 6.530 -1.672 12.885 1.00 51.32 C ATOM 1142 O ARG A 75 7.072 -0.653 13.306 1.00 43.32 O ATOM 1143 CB ARG A 75 5.270 -1.422 10.759 1.00 63.33 C ATOM 1144 CG ARG A 75 4.165 -2.070 9.946 1.00 23.32 C ATOM 1145 CD ARG A 75 4.220 -1.616 8.500 1.00 4.03 C ATOM 1146 NE ARG A 75 4.126 -0.162 8.417 1.00 13.33 N ATOM 1147 CZ ARG A 75 4.507 0.578 7.383 1.00 3.14 C ATOM 1148 NH1 ARG A 75 5.016 0.021 6.299 1.00 30.40 N ATOM 1149 NH2 ARG A 75 4.382 1.893 7.446 1.00 32.42 N ATOM 0 H ARG A 75 3.842 0.039 12.149 1.00 31.22 H new ATOM 0 HA ARG A 75 4.638 -2.567 12.485 1.00 62.10 H new ATOM 0 HB2 ARG A 75 5.286 -0.353 10.544 1.00 63.33 H new ATOM 0 HB3 ARG A 75 6.229 -1.826 10.436 1.00 63.33 H new ATOM 0 HG2 ARG A 75 4.260 -3.155 9.995 1.00 23.32 H new ATOM 0 HG3 ARG A 75 3.196 -1.816 10.375 1.00 23.32 H new ATOM 0 HD2 ARG A 75 5.150 -1.953 8.042 1.00 4.03 H new ATOM 0 HD3 ARG A 75 3.405 -2.072 7.938 1.00 4.03 H new ATOM 0 HE ARG A 75 3.734 0.327 9.222 1.00 13.33 H new ATOM 0 HH11 ARG A 75 5.121 -0.992 6.248 1.00 30.40 H new ATOM 0 HH12 ARG A 75 5.304 0.604 5.513 1.00 30.40 H new ATOM 0 HH21 ARG A 75 3.996 2.329 8.283 1.00 32.42 H new ATOM 0 HH22 ARG A 75 4.672 2.471 6.657 1.00 32.42 H new ATOM 1163 N PRO A 76 7.139 -2.872 12.948 1.00 75.53 N ATOM 1164 CA PRO A 76 6.520 -4.120 12.504 1.00 22.44 C ATOM 1165 C PRO A 76 5.588 -4.716 13.558 1.00 41.41 C ATOM 1166 O PRO A 76 5.672 -4.391 14.743 1.00 43.42 O ATOM 1167 CB PRO A 76 7.713 -5.057 12.261 1.00 60.40 C ATOM 1168 CG PRO A 76 8.944 -4.274 12.591 1.00 63.22 C ATOM 1169 CD PRO A 76 8.499 -3.108 13.424 1.00 4.42 C ATOM 0 HA PRO A 76 5.898 -3.966 11.623 1.00 22.44 H new ATOM 0 HB2 PRO A 76 7.641 -5.947 12.886 1.00 60.40 H new ATOM 0 HB3 PRO A 76 7.735 -5.396 11.225 1.00 60.40 H new ATOM 0 HG2 PRO A 76 9.660 -4.889 13.136 1.00 63.22 H new ATOM 0 HG3 PRO A 76 9.442 -3.934 11.683 1.00 63.22 H new ATOM 0 HD2 PRO A 76 8.520 -3.340 14.489 1.00 4.42 H new ATOM 0 HD3 PRO A 76 9.137 -2.237 13.274 1.00 4.42 H new ATOM 1177 N HIS A 77 4.710 -5.595 13.108 1.00 3.41 N ATOM 1178 CA HIS A 77 3.751 -6.242 13.996 1.00 63.20 C ATOM 1179 C HIS A 77 4.093 -7.711 14.153 1.00 23.23 C ATOM 1180 O HIS A 77 4.681 -8.314 13.256 1.00 22.21 O ATOM 1181 CB HIS A 77 2.321 -6.102 13.470 1.00 11.24 C ATOM 1182 CG HIS A 77 1.787 -4.705 13.509 1.00 20.12 C ATOM 1183 ND1 HIS A 77 0.851 -4.324 14.432 1.00 21.14 N ATOM 1184 CD2 HIS A 77 2.063 -3.658 12.703 1.00 22.45 C ATOM 1185 CE1 HIS A 77 0.575 -3.062 14.168 1.00 21.31 C ATOM 1186 NE2 HIS A 77 1.288 -2.616 13.128 1.00 62.12 N ATOM 0 H HIS A 77 4.639 -5.880 12.131 1.00 3.41 H new ATOM 0 HA HIS A 77 3.810 -5.747 14.965 1.00 63.20 H new ATOM 0 HB2 HIS A 77 2.287 -6.463 12.442 1.00 11.24 H new ATOM 0 HB3 HIS A 77 1.666 -6.746 14.056 1.00 11.24 H new ATOM 0 HD2 HIS A 77 2.762 -3.646 11.880 1.00 22.45 H new ATOM 0 HE1 HIS A 77 -0.136 -2.465 14.721 1.00 21.31 H new ATOM 0 HE2 HIS A 77 1.259 -1.678 12.729 1.00 62.12 H new ATOM 1194 N LYS A 78 3.740 -8.282 15.289 1.00 35.51 N ATOM 1195 CA LYS A 78 3.981 -9.693 15.521 1.00 13.43 C ATOM 1196 C LYS A 78 2.775 -10.356 16.171 1.00 11.03 C ATOM 1197 O LYS A 78 2.529 -10.194 17.366 1.00 54.11 O ATOM 1198 CB LYS A 78 5.237 -9.898 16.379 1.00 14.20 C ATOM 1199 CG LYS A 78 5.415 -11.334 16.842 1.00 50.22 C ATOM 1200 CD LYS A 78 6.871 -11.683 17.095 1.00 24.54 C ATOM 1201 CE LYS A 78 7.616 -11.961 15.801 1.00 74.54 C ATOM 1202 NZ LYS A 78 9.030 -12.340 16.051 1.00 3.23 N ATOM 0 H LYS A 78 3.288 -7.793 16.062 1.00 35.51 H new ATOM 0 HA LYS A 78 4.145 -10.166 14.553 1.00 13.43 H new ATOM 0 HB2 LYS A 78 6.114 -9.596 15.807 1.00 14.20 H new ATOM 0 HB3 LYS A 78 5.185 -9.245 17.251 1.00 14.20 H new ATOM 0 HG2 LYS A 78 4.842 -11.492 17.756 1.00 50.22 H new ATOM 0 HG3 LYS A 78 5.008 -12.009 16.089 1.00 50.22 H new ATOM 0 HD2 LYS A 78 7.355 -10.862 17.624 1.00 24.54 H new ATOM 0 HD3 LYS A 78 6.928 -12.558 17.743 1.00 24.54 H new ATOM 0 HE2 LYS A 78 7.115 -12.762 15.258 1.00 74.54 H new ATOM 0 HE3 LYS A 78 7.583 -11.076 15.165 1.00 74.54 H new ATOM 0 HZ1 LYS A 78 9.506 -12.522 15.144 1.00 3.23 H new ATOM 0 HZ2 LYS A 78 9.515 -11.565 16.547 1.00 3.23 H new ATOM 0 HZ3 LYS A 78 9.061 -13.199 16.637 1.00 3.23 H new ATOM 1216 N VAL A 79 2.034 -11.111 15.372 1.00 24.24 N ATOM 1217 CA VAL A 79 0.876 -11.848 15.855 1.00 22.11 C ATOM 1218 C VAL A 79 1.082 -13.343 15.618 1.00 14.42 C ATOM 1219 O VAL A 79 1.657 -13.738 14.600 1.00 32.51 O ATOM 1220 CB VAL A 79 -0.435 -11.360 15.182 1.00 21.54 C ATOM 1221 CG1 VAL A 79 -0.345 -11.444 13.666 1.00 1.00 C ATOM 1222 CG2 VAL A 79 -1.636 -12.141 15.695 1.00 1.42 C ATOM 0 H VAL A 79 2.218 -11.229 14.376 1.00 24.24 H new ATOM 0 HA VAL A 79 0.776 -11.665 16.925 1.00 22.11 H new ATOM 0 HB VAL A 79 -0.571 -10.312 15.450 1.00 21.54 H new ATOM 0 HG11 VAL A 79 -1.279 -11.095 13.226 1.00 1.00 H new ATOM 0 HG12 VAL A 79 0.477 -10.820 13.315 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -0.168 -12.478 13.369 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -2.541 -11.779 15.207 1.00 1.42 H new ATOM 0 HG22 VAL A 79 -1.503 -13.200 15.473 1.00 1.42 H new ATOM 0 HG23 VAL A 79 -1.725 -12.005 16.773 1.00 1.42 H new ATOM 1232 N ASP A 80 0.663 -14.153 16.596 1.00 42.24 N ATOM 1233 CA ASP A 80 0.805 -15.615 16.557 1.00 61.13 C ATOM 1234 C ASP A 80 2.282 -16.006 16.609 1.00 74.42 C ATOM 1235 O ASP A 80 2.666 -17.109 16.226 1.00 74.31 O ATOM 1236 CB ASP A 80 0.120 -16.225 15.316 1.00 53.54 C ATOM 1237 CG ASP A 80 -0.288 -17.667 15.534 1.00 11.52 C ATOM 1238 OD1 ASP A 80 -1.210 -17.910 16.333 1.00 72.30 O ATOM 1239 OD2 ASP A 80 0.295 -18.561 14.893 1.00 24.33 O ATOM 0 H ASP A 80 0.212 -13.811 17.444 1.00 42.24 H new ATOM 0 HA ASP A 80 0.303 -16.021 17.435 1.00 61.13 H new ATOM 0 HB2 ASP A 80 -0.761 -15.635 15.063 1.00 53.54 H new ATOM 0 HB3 ASP A 80 0.798 -16.166 14.464 1.00 53.54 H new ATOM 1244 N GLY A 81 3.104 -15.092 17.116 1.00 31.21 N ATOM 1245 CA GLY A 81 4.534 -15.319 17.196 1.00 73.42 C ATOM 1246 C GLY A 81 5.209 -15.192 15.850 1.00 75.53 C ATOM 1247 O GLY A 81 6.268 -15.771 15.621 1.00 2.41 O ATOM 0 H GLY A 81 2.799 -14.188 17.477 1.00 31.21 H new ATOM 0 HA2 GLY A 81 4.975 -14.604 17.891 1.00 73.42 H new ATOM 0 HA3 GLY A 81 4.720 -16.314 17.601 1.00 73.42 H new ATOM 1251 N ARG A 82 4.599 -14.428 14.957 1.00 2.42 N ATOM 1252 CA ARG A 82 5.115 -14.272 13.612 1.00 72.52 C ATOM 1253 C ARG A 82 5.215 -12.791 13.249 1.00 13.33 C ATOM 1254 O ARG A 82 4.306 -12.016 13.543 1.00 41.24 O ATOM 1255 CB ARG A 82 4.208 -15.007 12.623 1.00 71.20 C ATOM 1256 CG ARG A 82 4.846 -15.227 11.268 1.00 41.22 C ATOM 1257 CD ARG A 82 5.744 -16.453 11.271 1.00 4.51 C ATOM 1258 NE ARG A 82 6.205 -16.809 9.930 1.00 41.31 N ATOM 1259 CZ ARG A 82 6.726 -17.995 9.611 1.00 31.13 C ATOM 1260 NH1 ARG A 82 6.857 -18.941 10.533 1.00 51.31 N ATOM 1261 NH2 ARG A 82 7.108 -18.239 8.363 1.00 14.35 N ATOM 0 H ARG A 82 3.743 -13.906 15.144 1.00 2.42 H new ATOM 0 HA ARG A 82 6.115 -14.703 13.562 1.00 72.52 H new ATOM 0 HB2 ARG A 82 3.930 -15.972 13.046 1.00 71.20 H new ATOM 0 HB3 ARG A 82 3.287 -14.438 12.494 1.00 71.20 H new ATOM 0 HG2 ARG A 82 4.069 -15.345 10.513 1.00 41.22 H new ATOM 0 HG3 ARG A 82 5.428 -14.348 10.991 1.00 41.22 H new ATOM 0 HD2 ARG A 82 6.606 -16.267 11.911 1.00 4.51 H new ATOM 0 HD3 ARG A 82 5.203 -17.295 11.702 1.00 4.51 H new ATOM 0 HE ARG A 82 6.123 -16.108 9.194 1.00 41.31 H new ATOM 0 HH11 ARG A 82 6.558 -18.763 11.492 1.00 51.31 H new ATOM 0 HH12 ARG A 82 7.256 -19.846 10.282 1.00 51.31 H new ATOM 0 HH21 ARG A 82 7.003 -17.519 7.648 1.00 14.35 H new ATOM 0 HH22 ARG A 82 7.506 -19.146 8.120 1.00 14.35 H new ATOM 1275 N VAL A 83 6.325 -12.405 12.621 1.00 60.31 N ATOM 1276 CA VAL A 83 6.544 -11.010 12.239 1.00 72.20 C ATOM 1277 C VAL A 83 5.856 -10.719 10.901 1.00 63.54 C ATOM 1278 O VAL A 83 6.245 -11.229 9.850 1.00 24.15 O ATOM 1279 CB VAL A 83 8.055 -10.634 12.200 1.00 52.44 C ATOM 1280 CG1 VAL A 83 8.856 -11.549 11.280 1.00 53.41 C ATOM 1281 CG2 VAL A 83 8.230 -9.174 11.799 1.00 13.01 C ATOM 0 H VAL A 83 7.085 -13.036 12.366 1.00 60.31 H new ATOM 0 HA VAL A 83 6.096 -10.380 13.007 1.00 72.20 H new ATOM 0 HB VAL A 83 8.450 -10.773 13.206 1.00 52.44 H new ATOM 0 HG11 VAL A 83 9.903 -11.246 11.287 1.00 53.41 H new ATOM 0 HG12 VAL A 83 8.774 -12.578 11.629 1.00 53.41 H new ATOM 0 HG13 VAL A 83 8.465 -11.478 10.265 1.00 53.41 H new ATOM 0 HG21 VAL A 83 9.292 -8.928 11.777 1.00 13.01 H new ATOM 0 HG22 VAL A 83 7.799 -9.014 10.811 1.00 13.01 H new ATOM 0 HG23 VAL A 83 7.724 -8.535 12.523 1.00 13.01 H new ATOM 1291 N VAL A 84 4.811 -9.913 10.956 1.00 61.10 N ATOM 1292 CA VAL A 84 3.943 -9.717 9.807 1.00 22.44 C ATOM 1293 C VAL A 84 4.210 -8.393 9.104 1.00 43.42 C ATOM 1294 O VAL A 84 4.740 -7.443 9.692 1.00 32.24 O ATOM 1295 CB VAL A 84 2.455 -9.800 10.210 1.00 4.31 C ATOM 1296 CG1 VAL A 84 2.206 -11.054 11.026 1.00 63.41 C ATOM 1297 CG2 VAL A 84 2.018 -8.564 10.980 1.00 2.22 C ATOM 0 H VAL A 84 4.542 -9.383 11.785 1.00 61.10 H new ATOM 0 HA VAL A 84 4.169 -10.523 9.109 1.00 22.44 H new ATOM 0 HB VAL A 84 1.859 -9.846 9.299 1.00 4.31 H new ATOM 0 HG11 VAL A 84 1.154 -11.103 11.305 1.00 63.41 H new ATOM 0 HG12 VAL A 84 2.466 -11.931 10.433 1.00 63.41 H new ATOM 0 HG13 VAL A 84 2.820 -11.030 11.927 1.00 63.41 H new ATOM 0 HG21 VAL A 84 0.965 -8.656 11.248 1.00 2.22 H new ATOM 0 HG22 VAL A 84 2.616 -8.469 11.886 1.00 2.22 H new ATOM 0 HG23 VAL A 84 2.158 -7.680 10.359 1.00 2.22 H new ATOM 1307 N GLU A 85 3.862 -8.370 7.831 1.00 42.30 N ATOM 1308 CA GLU A 85 3.989 -7.186 7.003 1.00 65.41 C ATOM 1309 C GLU A 85 2.622 -6.635 6.626 1.00 13.41 C ATOM 1310 O GLU A 85 1.990 -7.106 5.684 1.00 35.13 O ATOM 1311 CB GLU A 85 4.772 -7.520 5.736 1.00 33.43 C ATOM 1312 CG GLU A 85 5.162 -6.309 4.912 1.00 21.52 C ATOM 1313 CD GLU A 85 5.907 -5.239 5.684 1.00 24.23 C ATOM 1314 OE1 GLU A 85 6.826 -5.578 6.454 1.00 53.44 O ATOM 1315 OE2 GLU A 85 5.588 -4.045 5.479 1.00 31.12 O ATOM 0 H GLU A 85 3.481 -9.178 7.339 1.00 42.30 H new ATOM 0 HA GLU A 85 4.523 -6.427 7.575 1.00 65.41 H new ATOM 0 HB2 GLU A 85 5.675 -8.064 6.013 1.00 33.43 H new ATOM 0 HB3 GLU A 85 4.174 -8.189 5.118 1.00 33.43 H new ATOM 0 HG2 GLU A 85 5.783 -6.637 4.078 1.00 21.52 H new ATOM 0 HG3 GLU A 85 4.260 -5.870 4.485 1.00 21.52 H new ATOM 1322 N PRO A 86 2.142 -5.643 7.367 1.00 23.21 N ATOM 1323 CA PRO A 86 0.907 -4.962 7.043 1.00 75.32 C ATOM 1324 C PRO A 86 1.127 -3.915 5.957 1.00 63.41 C ATOM 1325 O PRO A 86 2.059 -3.111 6.027 1.00 3.12 O ATOM 1326 CB PRO A 86 0.484 -4.312 8.365 1.00 42.03 C ATOM 1327 CG PRO A 86 1.598 -4.551 9.337 1.00 1.31 C ATOM 1328 CD PRO A 86 2.762 -5.103 8.568 1.00 51.33 C ATOM 0 HA PRO A 86 0.147 -5.636 6.649 1.00 75.32 H new ATOM 0 HB2 PRO A 86 0.308 -3.244 8.233 1.00 42.03 H new ATOM 0 HB3 PRO A 86 -0.447 -4.746 8.729 1.00 42.03 H new ATOM 0 HG2 PRO A 86 1.875 -3.623 9.837 1.00 1.31 H new ATOM 0 HG3 PRO A 86 1.286 -5.250 10.113 1.00 1.31 H new ATOM 0 HD2 PRO A 86 3.492 -4.329 8.331 1.00 51.33 H new ATOM 0 HD3 PRO A 86 3.287 -5.874 9.131 1.00 51.33 H new ATOM 1336 N LYS A 87 0.289 -3.966 4.942 1.00 63.12 N ATOM 1337 CA LYS A 87 0.360 -3.051 3.815 1.00 51.20 C ATOM 1338 C LYS A 87 -1.027 -2.540 3.514 1.00 60.43 C ATOM 1339 O LYS A 87 -1.993 -3.043 4.065 1.00 23.24 O ATOM 1340 CB LYS A 87 0.931 -3.751 2.571 1.00 23.32 C ATOM 1341 CG LYS A 87 2.274 -4.423 2.798 1.00 53.14 C ATOM 1342 CD LYS A 87 3.104 -4.461 1.528 1.00 34.30 C ATOM 1343 CE LYS A 87 4.362 -5.278 1.716 1.00 41.22 C ATOM 1344 NZ LYS A 87 5.398 -4.517 2.455 1.00 13.43 N ATOM 0 H LYS A 87 -0.467 -4.647 4.873 1.00 63.12 H new ATOM 0 HA LYS A 87 1.022 -2.224 4.074 1.00 51.20 H new ATOM 0 HB2 LYS A 87 0.216 -4.499 2.228 1.00 23.32 H new ATOM 0 HB3 LYS A 87 1.034 -3.018 1.771 1.00 23.32 H new ATOM 0 HG2 LYS A 87 2.821 -3.889 3.575 1.00 53.14 H new ATOM 0 HG3 LYS A 87 2.116 -5.439 3.160 1.00 53.14 H new ATOM 0 HD2 LYS A 87 2.511 -4.884 0.717 1.00 34.30 H new ATOM 0 HD3 LYS A 87 3.368 -3.445 1.234 1.00 34.30 H new ATOM 0 HE2 LYS A 87 4.125 -6.193 2.258 1.00 41.22 H new ATOM 0 HE3 LYS A 87 4.753 -5.576 0.743 1.00 41.22 H new ATOM 0 HZ1 LYS A 87 6.276 -5.073 2.493 1.00 13.43 H new ATOM 0 HZ2 LYS A 87 5.580 -3.616 1.969 1.00 13.43 H new ATOM 0 HZ3 LYS A 87 5.066 -4.328 3.422 1.00 13.43 H new ATOM 1358 N ARG A 88 -1.132 -1.552 2.653 1.00 44.51 N ATOM 1359 CA ARG A 88 -2.431 -1.052 2.249 1.00 35.12 C ATOM 1360 C ARG A 88 -3.127 -2.090 1.376 1.00 23.23 C ATOM 1361 O ARG A 88 -2.481 -2.758 0.566 1.00 72.30 O ATOM 1362 CB ARG A 88 -2.271 0.265 1.491 1.00 70.22 C ATOM 1363 CG ARG A 88 -3.579 0.995 1.223 1.00 54.45 C ATOM 1364 CD ARG A 88 -4.259 1.417 2.517 1.00 5.40 C ATOM 1365 NE ARG A 88 -3.361 2.202 3.371 1.00 15.32 N ATOM 1366 CZ ARG A 88 -3.737 3.205 4.166 1.00 3.14 C ATOM 1367 NH1 ARG A 88 -5.004 3.582 4.245 1.00 72.14 N ATOM 1368 NH2 ARG A 88 -2.825 3.826 4.899 1.00 15.01 N ATOM 0 H ARG A 88 -0.339 -1.080 2.220 1.00 44.51 H new ATOM 0 HA ARG A 88 -3.041 -0.868 3.134 1.00 35.12 H new ATOM 0 HB2 ARG A 88 -1.612 0.921 2.060 1.00 70.22 H new ATOM 0 HB3 ARG A 88 -1.778 0.066 0.540 1.00 70.22 H new ATOM 0 HG2 ARG A 88 -3.386 1.875 0.609 1.00 54.45 H new ATOM 0 HG3 ARG A 88 -4.247 0.349 0.654 1.00 54.45 H new ATOM 0 HD2 ARG A 88 -5.148 2.005 2.286 1.00 5.40 H new ATOM 0 HD3 ARG A 88 -4.594 0.532 3.058 1.00 5.40 H new ATOM 0 HE ARG A 88 -2.370 1.962 3.356 1.00 15.32 H new ATOM 0 HH11 ARG A 88 -5.714 3.103 3.691 1.00 72.14 H new ATOM 0 HH12 ARG A 88 -5.270 4.352 4.859 1.00 72.14 H new ATOM 0 HH21 ARG A 88 -1.848 3.536 4.851 1.00 15.01 H new ATOM 0 HH22 ARG A 88 -3.099 4.594 5.511 1.00 15.01 H new ATOM 1382 N ALA A 89 -4.420 -2.289 1.603 1.00 5.20 N ATOM 1383 CA ALA A 89 -5.214 -3.138 0.734 1.00 3.24 C ATOM 1384 C ALA A 89 -5.340 -2.512 -0.645 1.00 31.40 C ATOM 1385 O ALA A 89 -6.169 -1.630 -0.874 1.00 51.40 O ATOM 1386 CB ALA A 89 -6.582 -3.393 1.331 1.00 52.32 C ATOM 0 H ALA A 89 -4.936 -1.874 2.379 1.00 5.20 H new ATOM 0 HA ALA A 89 -4.706 -4.097 0.635 1.00 3.24 H new ATOM 0 HB1 ALA A 89 -7.158 -4.032 0.661 1.00 52.32 H new ATOM 0 HB2 ALA A 89 -6.471 -3.886 2.297 1.00 52.32 H new ATOM 0 HB3 ALA A 89 -7.103 -2.445 1.465 1.00 52.32 H new ATOM 1392 N VAL A 90 -4.480 -2.971 -1.533 1.00 54.03 N ATOM 1393 CA VAL A 90 -4.433 -2.501 -2.910 1.00 64.12 C ATOM 1394 C VAL A 90 -5.785 -2.640 -3.602 1.00 23.21 C ATOM 1395 O VAL A 90 -6.469 -3.658 -3.463 1.00 31.11 O ATOM 1396 CB VAL A 90 -3.393 -3.298 -3.732 1.00 54.22 C ATOM 1397 CG1 VAL A 90 -3.106 -2.604 -5.048 1.00 43.45 C ATOM 1398 CG2 VAL A 90 -2.107 -3.509 -2.953 1.00 24.21 C ATOM 0 H VAL A 90 -3.786 -3.688 -1.320 1.00 54.03 H new ATOM 0 HA VAL A 90 -4.154 -1.448 -2.866 1.00 64.12 H new ATOM 0 HB VAL A 90 -3.821 -4.279 -3.939 1.00 54.22 H new ATOM 0 HG11 VAL A 90 -2.372 -3.181 -5.611 1.00 43.45 H new ATOM 0 HG12 VAL A 90 -4.027 -2.525 -5.626 1.00 43.45 H new ATOM 0 HG13 VAL A 90 -2.712 -1.606 -4.855 1.00 43.45 H new ATOM 0 HG21 VAL A 90 -1.401 -4.072 -3.563 1.00 24.21 H new ATOM 0 HG22 VAL A 90 -1.674 -2.542 -2.696 1.00 24.21 H new ATOM 0 HG23 VAL A 90 -2.322 -4.064 -2.040 1.00 24.21 H new ATOM 1408 N SER A 91 -6.161 -1.596 -4.337 1.00 32.21 N ATOM 1409 CA SER A 91 -7.392 -1.589 -5.115 1.00 64.55 C ATOM 1410 C SER A 91 -7.387 -2.751 -6.107 1.00 14.44 C ATOM 1411 O SER A 91 -6.335 -3.124 -6.615 1.00 61.54 O ATOM 1412 CB SER A 91 -7.529 -0.257 -5.858 1.00 61.22 C ATOM 1413 OG SER A 91 -8.880 0.036 -6.155 1.00 74.13 O ATOM 0 H SER A 91 -5.620 -0.734 -4.408 1.00 32.21 H new ATOM 0 HA SER A 91 -8.242 -1.706 -4.443 1.00 64.55 H new ATOM 0 HB2 SER A 91 -7.107 0.544 -5.251 1.00 61.22 H new ATOM 0 HB3 SER A 91 -6.952 -0.294 -6.782 1.00 61.22 H new ATOM 0 HG SER A 91 -9.279 0.530 -5.409 1.00 74.13 H new ATOM 1419 N ARG A 92 -8.571 -3.295 -6.382 1.00 41.12 N ATOM 1420 CA ARG A 92 -8.732 -4.528 -7.160 1.00 12.20 C ATOM 1421 C ARG A 92 -7.999 -4.475 -8.507 1.00 2.10 C ATOM 1422 O ARG A 92 -7.386 -5.460 -8.914 1.00 52.14 O ATOM 1423 CB ARG A 92 -10.232 -4.801 -7.363 1.00 4.04 C ATOM 1424 CG ARG A 92 -10.568 -6.186 -7.907 1.00 73.41 C ATOM 1425 CD ARG A 92 -10.588 -6.202 -9.425 1.00 71.44 C ATOM 1426 NE ARG A 92 -11.107 -7.457 -9.962 1.00 4.13 N ATOM 1427 CZ ARG A 92 -11.381 -7.659 -11.251 1.00 5.33 C ATOM 1428 NH1 ARG A 92 -11.181 -6.693 -12.142 1.00 4.21 N ATOM 1429 NH2 ARG A 92 -11.868 -8.829 -11.648 1.00 21.41 N ATOM 0 H ARG A 92 -9.454 -2.891 -6.070 1.00 41.12 H new ATOM 0 HA ARG A 92 -8.278 -5.345 -6.599 1.00 12.20 H new ATOM 0 HB2 ARG A 92 -10.742 -4.668 -6.409 1.00 4.04 H new ATOM 0 HB3 ARG A 92 -10.633 -4.052 -8.046 1.00 4.04 H new ATOM 0 HG2 ARG A 92 -9.835 -6.907 -7.545 1.00 73.41 H new ATOM 0 HG3 ARG A 92 -11.540 -6.501 -7.527 1.00 73.41 H new ATOM 0 HD2 ARG A 92 -11.199 -5.375 -9.786 1.00 71.44 H new ATOM 0 HD3 ARG A 92 -9.578 -6.039 -9.801 1.00 71.44 H new ATOM 0 HE ARG A 92 -11.270 -8.226 -9.311 1.00 4.13 H new ATOM 0 HH11 ARG A 92 -10.815 -5.789 -11.841 1.00 4.21 H new ATOM 0 HH12 ARG A 92 -11.393 -6.855 -13.126 1.00 4.21 H new ATOM 0 HH21 ARG A 92 -12.032 -9.571 -10.967 1.00 21.41 H new ATOM 0 HH22 ARG A 92 -12.078 -8.986 -12.634 1.00 21.41 H new ATOM 1443 N GLU A 93 -8.051 -3.332 -9.184 1.00 51.40 N ATOM 1444 CA GLU A 93 -7.433 -3.199 -10.503 1.00 2.43 C ATOM 1445 C GLU A 93 -5.907 -3.241 -10.431 1.00 20.22 C ATOM 1446 O GLU A 93 -5.265 -3.852 -11.285 1.00 43.21 O ATOM 1447 CB GLU A 93 -7.895 -1.915 -11.192 1.00 34.44 C ATOM 1448 CG GLU A 93 -9.376 -1.917 -11.544 1.00 71.35 C ATOM 1449 CD GLU A 93 -9.790 -3.131 -12.353 1.00 42.23 C ATOM 1450 OE1 GLU A 93 -9.638 -3.103 -13.589 1.00 35.34 O ATOM 1451 OE2 GLU A 93 -10.273 -4.113 -11.760 1.00 1.11 O ATOM 0 H GLU A 93 -8.512 -2.487 -8.845 1.00 51.40 H new ATOM 0 HA GLU A 93 -7.758 -4.055 -11.094 1.00 2.43 H new ATOM 0 HB2 GLU A 93 -7.685 -1.066 -10.541 1.00 34.44 H new ATOM 0 HB3 GLU A 93 -7.313 -1.770 -12.102 1.00 34.44 H new ATOM 0 HG2 GLU A 93 -9.962 -1.882 -10.626 1.00 71.35 H new ATOM 0 HG3 GLU A 93 -9.611 -1.014 -12.107 1.00 71.35 H new ATOM 1458 N ASP A 94 -5.324 -2.616 -9.414 1.00 1.03 N ATOM 1459 CA ASP A 94 -3.868 -2.628 -9.261 1.00 51.24 C ATOM 1460 C ASP A 94 -3.420 -3.942 -8.632 1.00 32.23 C ATOM 1461 O ASP A 94 -2.359 -4.463 -8.956 1.00 33.31 O ATOM 1462 CB ASP A 94 -3.380 -1.442 -8.421 1.00 74.04 C ATOM 1463 CG ASP A 94 -1.867 -1.284 -8.461 1.00 21.34 C ATOM 1464 OD1 ASP A 94 -1.361 -0.665 -9.421 1.00 73.52 O ATOM 1465 OD2 ASP A 94 -1.182 -1.765 -7.531 1.00 14.21 O ATOM 0 H ASP A 94 -5.826 -2.101 -8.691 1.00 1.03 H new ATOM 0 HA ASP A 94 -3.425 -2.535 -10.253 1.00 51.24 H new ATOM 0 HB2 ASP A 94 -3.848 -0.527 -8.784 1.00 74.04 H new ATOM 0 HB3 ASP A 94 -3.701 -1.576 -7.388 1.00 74.04 H new ATOM 1470 N SER A 95 -4.271 -4.495 -7.769 1.00 32.13 N ATOM 1471 CA SER A 95 -4.020 -5.787 -7.128 1.00 4.32 C ATOM 1472 C SER A 95 -4.115 -6.921 -8.148 1.00 63.11 C ATOM 1473 O SER A 95 -3.725 -8.057 -7.878 1.00 72.21 O ATOM 1474 CB SER A 95 -5.032 -6.014 -5.999 1.00 53.15 C ATOM 1475 OG SER A 95 -4.679 -7.124 -5.190 1.00 40.31 O ATOM 0 H SER A 95 -5.153 -4.062 -7.494 1.00 32.13 H new ATOM 0 HA SER A 95 -3.012 -5.778 -6.712 1.00 4.32 H new ATOM 0 HB2 SER A 95 -5.093 -5.119 -5.381 1.00 53.15 H new ATOM 0 HB3 SER A 95 -6.022 -6.175 -6.425 1.00 53.15 H new ATOM 0 HG SER A 95 -4.199 -7.784 -5.732 1.00 40.31 H new ATOM 1481 N GLN A 96 -4.641 -6.592 -9.319 1.00 30.00 N ATOM 1482 CA GLN A 96 -4.754 -7.528 -10.424 1.00 20.21 C ATOM 1483 C GLN A 96 -3.417 -7.629 -11.166 1.00 10.41 C ATOM 1484 O GLN A 96 -3.237 -8.470 -12.045 1.00 74.44 O ATOM 1485 CB GLN A 96 -5.861 -7.045 -11.363 1.00 33.52 C ATOM 1486 CG GLN A 96 -6.301 -8.054 -12.407 1.00 10.32 C ATOM 1487 CD GLN A 96 -7.315 -7.475 -13.379 1.00 1.03 C ATOM 1488 OE1 GLN A 96 -7.371 -7.871 -14.542 1.00 11.01 O ATOM 1489 NE2 GLN A 96 -8.116 -6.526 -12.914 1.00 53.02 N ATOM 0 H GLN A 96 -5.003 -5.662 -9.529 1.00 30.00 H new ATOM 0 HA GLN A 96 -5.006 -8.520 -10.050 1.00 20.21 H new ATOM 0 HB2 GLN A 96 -6.727 -6.763 -10.764 1.00 33.52 H new ATOM 0 HB3 GLN A 96 -5.518 -6.144 -11.872 1.00 33.52 H new ATOM 0 HG2 GLN A 96 -5.430 -8.404 -12.960 1.00 10.32 H new ATOM 0 HG3 GLN A 96 -6.733 -8.923 -11.910 1.00 10.32 H new ATOM 0 HE21 GLN A 96 -8.039 -6.224 -11.943 1.00 53.02 H new ATOM 0 HE22 GLN A 96 -8.809 -6.098 -13.528 1.00 53.02 H new ATOM 1498 N ARG A 97 -2.481 -6.762 -10.796 1.00 73.33 N ATOM 1499 CA ARG A 97 -1.157 -6.751 -11.400 1.00 51.34 C ATOM 1500 C ARG A 97 -0.185 -7.578 -10.561 1.00 33.14 C ATOM 1501 O ARG A 97 -0.357 -7.707 -9.347 1.00 10.44 O ATOM 1502 CB ARG A 97 -0.629 -5.315 -11.521 1.00 74.04 C ATOM 1503 CG ARG A 97 -1.537 -4.377 -12.305 1.00 12.35 C ATOM 1504 CD ARG A 97 -1.682 -4.815 -13.754 1.00 63.00 C ATOM 1505 NE ARG A 97 -0.385 -4.974 -14.410 1.00 63.53 N ATOM 1506 CZ ARG A 97 -0.188 -5.661 -15.536 1.00 61.31 C ATOM 1507 NH1 ARG A 97 -1.205 -6.255 -16.149 1.00 31.34 N ATOM 1508 NH2 ARG A 97 1.036 -5.767 -16.036 1.00 74.42 N ATOM 0 H ARG A 97 -2.618 -6.053 -10.075 1.00 73.33 H new ATOM 0 HA ARG A 97 -1.237 -7.186 -12.396 1.00 51.34 H new ATOM 0 HB2 ARG A 97 -0.483 -4.908 -10.520 1.00 74.04 H new ATOM 0 HB3 ARG A 97 0.350 -5.339 -12.001 1.00 74.04 H new ATOM 0 HG2 ARG A 97 -2.520 -4.344 -11.835 1.00 12.35 H new ATOM 0 HG3 ARG A 97 -1.133 -3.365 -12.269 1.00 12.35 H new ATOM 0 HD2 ARG A 97 -2.227 -5.758 -13.795 1.00 63.00 H new ATOM 0 HD3 ARG A 97 -2.276 -4.080 -14.297 1.00 63.00 H new ATOM 0 HE ARG A 97 0.424 -4.529 -13.977 1.00 63.53 H new ATOM 0 HH11 ARG A 97 -2.145 -6.188 -15.759 1.00 31.34 H new ATOM 0 HH12 ARG A 97 -1.046 -6.779 -17.010 1.00 31.34 H new ATOM 0 HH21 ARG A 97 1.822 -5.324 -15.560 1.00 74.42 H new ATOM 0 HH22 ARG A 97 1.192 -6.291 -16.897 1.00 74.42 H new ATOM 1522 N PRO A 98 0.838 -8.163 -11.202 1.00 20.10 N ATOM 1523 CA PRO A 98 1.884 -8.911 -10.500 1.00 74.22 C ATOM 1524 C PRO A 98 2.833 -7.987 -9.735 1.00 31.43 C ATOM 1525 O PRO A 98 3.448 -7.089 -10.315 1.00 40.33 O ATOM 1526 CB PRO A 98 2.625 -9.628 -11.630 1.00 21.12 C ATOM 1527 CG PRO A 98 2.397 -8.789 -12.840 1.00 34.03 C ATOM 1528 CD PRO A 98 1.049 -8.147 -12.662 1.00 34.43 C ATOM 0 HA PRO A 98 1.475 -9.587 -9.749 1.00 74.22 H new ATOM 0 HB2 PRO A 98 3.688 -9.719 -11.408 1.00 21.12 H new ATOM 0 HB3 PRO A 98 2.242 -10.638 -11.773 1.00 21.12 H new ATOM 0 HG2 PRO A 98 3.177 -8.034 -12.942 1.00 34.03 H new ATOM 0 HG3 PRO A 98 2.422 -9.397 -13.745 1.00 34.03 H new ATOM 0 HD2 PRO A 98 1.035 -7.131 -13.056 1.00 34.43 H new ATOM 0 HD3 PRO A 98 0.270 -8.702 -13.184 1.00 34.43 H new ATOM 1536 N GLY A 99 2.940 -8.203 -8.432 1.00 51.33 N ATOM 1537 CA GLY A 99 3.831 -7.396 -7.621 1.00 5.50 C ATOM 1538 C GLY A 99 3.115 -6.253 -6.932 1.00 73.51 C ATOM 1539 O GLY A 99 3.743 -5.288 -6.496 1.00 53.53 O ATOM 0 H GLY A 99 2.427 -8.922 -7.921 1.00 51.33 H new ATOM 0 HA2 GLY A 99 4.306 -8.028 -6.870 1.00 5.50 H new ATOM 0 HA3 GLY A 99 4.626 -6.996 -8.250 1.00 5.50 H new ATOM 1543 N ALA A 100 1.798 -6.371 -6.821 1.00 44.40 N ATOM 1544 CA ALA A 100 0.982 -5.324 -6.224 1.00 60.02 C ATOM 1545 C ALA A 100 1.078 -5.334 -4.703 1.00 10.42 C ATOM 1546 O ALA A 100 1.062 -4.284 -4.070 1.00 74.21 O ATOM 1547 CB ALA A 100 -0.462 -5.478 -6.657 1.00 64.34 C ATOM 0 H ALA A 100 1.271 -7.185 -7.138 1.00 44.40 H new ATOM 0 HA ALA A 100 1.364 -4.365 -6.574 1.00 60.02 H new ATOM 0 HB1 ALA A 100 -1.064 -4.690 -6.205 1.00 64.34 H new ATOM 0 HB2 ALA A 100 -0.526 -5.406 -7.743 1.00 64.34 H new ATOM 0 HB3 ALA A 100 -0.837 -6.450 -6.336 1.00 64.34 H new ATOM 1553 N HIS A 101 1.188 -6.519 -4.123 1.00 3.34 N ATOM 1554 CA HIS A 101 1.262 -6.648 -2.673 1.00 33.43 C ATOM 1555 C HIS A 101 2.703 -6.818 -2.202 1.00 0.32 C ATOM 1556 O HIS A 101 2.952 -7.185 -1.052 1.00 24.11 O ATOM 1557 CB HIS A 101 0.402 -7.816 -2.188 1.00 40.32 C ATOM 1558 CG HIS A 101 -1.038 -7.453 -1.970 1.00 55.14 C ATOM 1559 ND1 HIS A 101 -2.058 -8.224 -2.471 1.00 1.42 N ATOM 1560 CD2 HIS A 101 -1.569 -6.415 -1.280 1.00 71.24 C ATOM 1561 CE1 HIS A 101 -3.177 -7.644 -2.074 1.00 41.43 C ATOM 1562 NE2 HIS A 101 -2.931 -6.546 -1.352 1.00 32.44 N ATOM 0 H HIS A 101 1.228 -7.403 -4.630 1.00 3.34 H new ATOM 0 HA HIS A 101 0.873 -5.726 -2.241 1.00 33.43 H new ATOM 0 HB2 HIS A 101 0.458 -8.624 -2.917 1.00 40.32 H new ATOM 0 HB3 HIS A 101 0.817 -8.199 -1.255 1.00 40.32 H new ATOM 0 HD2 HIS A 101 -1.023 -5.634 -0.771 1.00 71.24 H new ATOM 0 HE1 HIS A 101 -4.166 -8.011 -2.304 1.00 41.43 H new ATOM 0 HE2 HIS A 101 -3.624 -5.925 -0.935 1.00 32.44 H new ATOM 1570 N LEU A 102 3.649 -6.542 -3.090 1.00 73.30 N ATOM 1571 CA LEU A 102 5.060 -6.565 -2.730 1.00 51.30 C ATOM 1572 C LEU A 102 5.453 -5.238 -2.092 1.00 44.53 C ATOM 1573 O LEU A 102 4.673 -4.284 -2.092 1.00 50.13 O ATOM 1574 CB LEU A 102 5.940 -6.839 -3.957 1.00 11.51 C ATOM 1575 CG LEU A 102 5.792 -8.230 -4.583 1.00 53.11 C ATOM 1576 CD1 LEU A 102 6.724 -8.374 -5.777 1.00 73.12 C ATOM 1577 CD2 LEU A 102 6.073 -9.322 -3.562 1.00 73.03 C ATOM 0 H LEU A 102 3.465 -6.300 -4.064 1.00 73.30 H new ATOM 0 HA LEU A 102 5.217 -7.372 -2.014 1.00 51.30 H new ATOM 0 HB2 LEU A 102 5.713 -6.092 -4.718 1.00 11.51 H new ATOM 0 HB3 LEU A 102 6.983 -6.698 -3.672 1.00 11.51 H new ATOM 0 HG LEU A 102 4.762 -8.340 -4.923 1.00 53.11 H new ATOM 0 HD11 LEU A 102 6.608 -9.367 -6.211 1.00 73.12 H new ATOM 0 HD12 LEU A 102 6.477 -7.620 -6.524 1.00 73.12 H new ATOM 0 HD13 LEU A 102 7.756 -8.239 -5.452 1.00 73.12 H new ATOM 0 HD21 LEU A 102 5.961 -10.298 -4.033 1.00 73.03 H new ATOM 0 HD22 LEU A 102 7.091 -9.215 -3.186 1.00 73.03 H new ATOM 0 HD23 LEU A 102 5.369 -9.236 -2.734 1.00 73.03 H new ATOM 1589 N THR A 103 6.656 -5.172 -1.548 1.00 11.42 N ATOM 1590 CA THR A 103 7.112 -3.965 -0.886 1.00 34.44 C ATOM 1591 C THR A 103 7.791 -3.030 -1.876 1.00 41.14 C ATOM 1592 O THR A 103 9.018 -2.964 -1.959 1.00 63.51 O ATOM 1593 CB THR A 103 8.068 -4.280 0.274 1.00 32.34 C ATOM 1594 OG1 THR A 103 7.631 -5.468 0.946 1.00 34.10 O ATOM 1595 CG2 THR A 103 8.110 -3.130 1.267 1.00 0.44 C ATOM 0 H THR A 103 7.331 -5.937 -1.552 1.00 11.42 H new ATOM 0 HA THR A 103 6.231 -3.471 -0.475 1.00 34.44 H new ATOM 0 HB THR A 103 9.068 -4.428 -0.134 1.00 32.34 H new ATOM 0 HG1 THR A 103 8.242 -5.669 1.685 1.00 34.10 H new ATOM 0 HG21 THR A 103 8.793 -3.376 2.080 1.00 0.44 H new ATOM 0 HG22 THR A 103 8.455 -2.227 0.763 1.00 0.44 H new ATOM 0 HG23 THR A 103 7.112 -2.961 1.671 1.00 0.44 H new ATOM 1603 N VAL A 104 6.970 -2.339 -2.640 1.00 64.51 N ATOM 1604 CA VAL A 104 7.438 -1.361 -3.598 1.00 53.00 C ATOM 1605 C VAL A 104 7.109 0.037 -3.093 1.00 10.02 C ATOM 1606 O VAL A 104 5.948 0.348 -2.815 1.00 70.10 O ATOM 1607 CB VAL A 104 6.810 -1.595 -4.999 1.00 24.05 C ATOM 1608 CG1 VAL A 104 5.333 -1.926 -4.891 1.00 12.40 C ATOM 1609 CG2 VAL A 104 7.020 -0.396 -5.908 1.00 74.33 C ATOM 0 H VAL A 104 5.955 -2.441 -2.613 1.00 64.51 H new ATOM 0 HA VAL A 104 8.518 -1.466 -3.703 1.00 53.00 H new ATOM 0 HB VAL A 104 7.320 -2.450 -5.443 1.00 24.05 H new ATOM 0 HG11 VAL A 104 4.922 -2.084 -5.888 1.00 12.40 H new ATOM 0 HG12 VAL A 104 5.205 -2.832 -4.298 1.00 12.40 H new ATOM 0 HG13 VAL A 104 4.809 -1.100 -4.409 1.00 12.40 H new ATOM 0 HG21 VAL A 104 6.568 -0.593 -6.880 1.00 74.33 H new ATOM 0 HG22 VAL A 104 6.555 0.484 -5.463 1.00 74.33 H new ATOM 0 HG23 VAL A 104 8.088 -0.217 -6.034 1.00 74.33 H new ATOM 1619 N LYS A 105 8.127 0.863 -2.922 1.00 11.22 N ATOM 1620 CA LYS A 105 7.924 2.229 -2.479 1.00 53.25 C ATOM 1621 C LYS A 105 8.160 3.201 -3.630 1.00 73.00 C ATOM 1622 O LYS A 105 8.435 4.376 -3.421 1.00 10.51 O ATOM 1623 CB LYS A 105 8.871 2.553 -1.320 1.00 41.02 C ATOM 1624 CG LYS A 105 8.826 1.545 -0.182 1.00 71.43 C ATOM 1625 CD LYS A 105 9.691 1.992 0.983 1.00 23.44 C ATOM 1626 CE LYS A 105 9.636 1.016 2.148 1.00 3.53 C ATOM 1627 NZ LYS A 105 10.491 1.463 3.282 1.00 72.31 N ATOM 0 H LYS A 105 9.102 0.610 -3.084 1.00 11.22 H new ATOM 0 HA LYS A 105 6.894 2.334 -2.137 1.00 53.25 H new ATOM 0 HB2 LYS A 105 9.890 2.608 -1.702 1.00 41.02 H new ATOM 0 HB3 LYS A 105 8.624 3.539 -0.928 1.00 41.02 H new ATOM 0 HG2 LYS A 105 7.797 1.418 0.154 1.00 71.43 H new ATOM 0 HG3 LYS A 105 9.167 0.574 -0.540 1.00 71.43 H new ATOM 0 HD2 LYS A 105 10.723 2.097 0.648 1.00 23.44 H new ATOM 0 HD3 LYS A 105 9.364 2.976 1.320 1.00 23.44 H new ATOM 0 HE2 LYS A 105 8.606 0.913 2.488 1.00 3.53 H new ATOM 0 HE3 LYS A 105 9.961 0.031 1.813 1.00 3.53 H new ATOM 0 HZ1 LYS A 105 10.241 0.928 4.138 1.00 72.31 H new ATOM 0 HZ2 LYS A 105 11.491 1.296 3.050 1.00 72.31 H new ATOM 0 HZ3 LYS A 105 10.340 2.478 3.452 1.00 72.31 H new ATOM 1641 N LYS A 106 8.054 2.700 -4.845 1.00 22.52 N ATOM 1642 CA LYS A 106 8.246 3.525 -6.027 1.00 32.25 C ATOM 1643 C LYS A 106 7.016 3.511 -6.921 1.00 72.21 C ATOM 1644 O LYS A 106 6.350 2.485 -7.057 1.00 0.33 O ATOM 1645 CB LYS A 106 9.463 3.035 -6.802 1.00 74.31 C ATOM 1646 CG LYS A 106 10.713 3.844 -6.522 1.00 72.41 C ATOM 1647 CD LYS A 106 10.838 5.014 -7.481 1.00 42.40 C ATOM 1648 CE LYS A 106 11.289 4.557 -8.856 1.00 50.53 C ATOM 1649 NZ LYS A 106 12.690 4.060 -8.841 1.00 31.22 N ATOM 0 H LYS A 106 7.835 1.723 -5.042 1.00 22.52 H new ATOM 0 HA LYS A 106 8.409 4.553 -5.702 1.00 32.25 H new ATOM 0 HB2 LYS A 106 9.650 1.991 -6.551 1.00 74.31 H new ATOM 0 HB3 LYS A 106 9.245 3.072 -7.869 1.00 74.31 H new ATOM 0 HG2 LYS A 106 10.688 4.212 -5.496 1.00 72.41 H new ATOM 0 HG3 LYS A 106 11.591 3.204 -6.610 1.00 72.41 H new ATOM 0 HD2 LYS A 106 9.878 5.524 -7.562 1.00 42.40 H new ATOM 0 HD3 LYS A 106 11.551 5.737 -7.084 1.00 42.40 H new ATOM 0 HE2 LYS A 106 10.627 3.767 -9.212 1.00 50.53 H new ATOM 0 HE3 LYS A 106 11.205 5.385 -9.560 1.00 50.53 H new ATOM 0 HZ1 LYS A 106 12.973 3.789 -9.804 1.00 31.22 H new ATOM 0 HZ2 LYS A 106 13.321 4.810 -8.493 1.00 31.22 H new ATOM 0 HZ3 LYS A 106 12.758 3.233 -8.215 1.00 31.22 H new ATOM 1663 N ILE A 107 6.708 4.653 -7.529 1.00 3.55 N ATOM 1664 CA ILE A 107 5.573 4.746 -8.439 1.00 3.13 C ATOM 1665 C ILE A 107 5.951 5.454 -9.736 1.00 54.10 C ATOM 1666 O ILE A 107 6.852 6.301 -9.767 1.00 73.32 O ATOM 1667 CB ILE A 107 4.371 5.472 -7.801 1.00 15.42 C ATOM 1668 CG1 ILE A 107 4.829 6.718 -7.049 1.00 35.35 C ATOM 1669 CG2 ILE A 107 3.620 4.531 -6.879 1.00 13.15 C ATOM 1670 CD1 ILE A 107 3.695 7.514 -6.450 1.00 32.31 C ATOM 0 H ILE A 107 7.227 5.523 -7.408 1.00 3.55 H new ATOM 0 HA ILE A 107 5.282 3.719 -8.660 1.00 3.13 H new ATOM 0 HB ILE A 107 3.696 5.789 -8.595 1.00 15.42 H new ATOM 0 HG12 ILE A 107 5.513 6.421 -6.254 1.00 35.35 H new ATOM 0 HG13 ILE A 107 5.390 7.357 -7.730 1.00 35.35 H new ATOM 0 HG21 ILE A 107 2.774 5.055 -6.435 1.00 13.15 H new ATOM 0 HG22 ILE A 107 3.258 3.675 -7.449 1.00 13.15 H new ATOM 0 HG23 ILE A 107 4.288 4.185 -6.090 1.00 13.15 H new ATOM 0 HD11 ILE A 107 4.096 8.385 -5.931 1.00 32.31 H new ATOM 0 HD12 ILE A 107 3.022 7.842 -7.242 1.00 32.31 H new ATOM 0 HD13 ILE A 107 3.147 6.891 -5.743 1.00 32.31 H new ATOM 1682 N PHE A 108 5.259 5.075 -10.798 1.00 73.42 N ATOM 1683 CA PHE A 108 5.473 5.622 -12.126 1.00 12.25 C ATOM 1684 C PHE A 108 4.478 6.740 -12.397 1.00 71.31 C ATOM 1685 O PHE A 108 3.308 6.634 -12.042 1.00 32.23 O ATOM 1686 CB PHE A 108 5.328 4.493 -13.164 1.00 2.24 C ATOM 1687 CG PHE A 108 4.917 4.930 -14.549 1.00 0.42 C ATOM 1688 CD1 PHE A 108 5.864 5.292 -15.494 1.00 20.15 C ATOM 1689 CD2 PHE A 108 3.575 4.968 -14.904 1.00 62.51 C ATOM 1690 CE1 PHE A 108 5.480 5.682 -16.764 1.00 10.14 C ATOM 1691 CE2 PHE A 108 3.187 5.355 -16.167 1.00 63.43 C ATOM 1692 CZ PHE A 108 4.139 5.714 -17.102 1.00 65.12 C ATOM 0 H PHE A 108 4.523 4.369 -10.760 1.00 73.42 H new ATOM 0 HA PHE A 108 6.477 6.042 -12.196 1.00 12.25 H new ATOM 0 HB2 PHE A 108 6.279 3.966 -13.236 1.00 2.24 H new ATOM 0 HB3 PHE A 108 4.594 3.777 -12.795 1.00 2.24 H new ATOM 0 HD1 PHE A 108 6.912 5.269 -15.236 1.00 20.15 H new ATOM 0 HD2 PHE A 108 2.825 4.690 -14.179 1.00 62.51 H new ATOM 0 HE1 PHE A 108 6.227 5.962 -17.492 1.00 10.14 H new ATOM 0 HE2 PHE A 108 2.139 5.378 -16.427 1.00 63.43 H new ATOM 0 HZ PHE A 108 3.837 6.019 -18.093 1.00 65.12 H new ATOM 1702 N VAL A 109 4.959 7.807 -13.011 1.00 41.30 N ATOM 1703 CA VAL A 109 4.111 8.920 -13.408 1.00 10.41 C ATOM 1704 C VAL A 109 4.284 9.182 -14.899 1.00 73.24 C ATOM 1705 O VAL A 109 5.337 9.625 -15.329 1.00 35.43 O ATOM 1706 CB VAL A 109 4.470 10.205 -12.624 1.00 35.41 C ATOM 1707 CG1 VAL A 109 3.501 11.332 -12.944 1.00 22.24 C ATOM 1708 CG2 VAL A 109 4.501 9.936 -11.129 1.00 54.24 C ATOM 0 H VAL A 109 5.944 7.927 -13.248 1.00 41.30 H new ATOM 0 HA VAL A 109 3.077 8.656 -13.186 1.00 10.41 H new ATOM 0 HB VAL A 109 5.466 10.517 -12.937 1.00 35.41 H new ATOM 0 HG11 VAL A 109 3.778 12.222 -12.379 1.00 22.24 H new ATOM 0 HG12 VAL A 109 3.540 11.553 -14.011 1.00 22.24 H new ATOM 0 HG13 VAL A 109 2.489 11.030 -12.672 1.00 22.24 H new ATOM 0 HG21 VAL A 109 4.756 10.854 -10.599 1.00 54.24 H new ATOM 0 HG22 VAL A 109 3.521 9.588 -10.802 1.00 54.24 H new ATOM 0 HG23 VAL A 109 5.248 9.173 -10.912 1.00 54.24 H new ATOM 1718 N GLY A 110 3.265 8.901 -15.693 1.00 43.52 N ATOM 1719 CA GLY A 110 3.386 9.102 -17.124 1.00 64.44 C ATOM 1720 C GLY A 110 2.155 9.736 -17.721 1.00 1.44 C ATOM 1721 O GLY A 110 1.039 9.415 -17.329 1.00 71.45 O ATOM 0 H GLY A 110 2.364 8.541 -15.379 1.00 43.52 H new ATOM 0 HA2 GLY A 110 4.251 9.733 -17.328 1.00 64.44 H new ATOM 0 HA3 GLY A 110 3.569 8.143 -17.609 1.00 64.44 H new ATOM 1725 N GLY A 111 2.351 10.627 -18.680 1.00 21.21 N ATOM 1726 CA GLY A 111 1.227 11.327 -19.269 1.00 21.41 C ATOM 1727 C GLY A 111 1.291 12.819 -19.026 1.00 24.35 C ATOM 1728 O GLY A 111 0.354 13.548 -19.349 1.00 71.41 O ATOM 0 H GLY A 111 3.263 10.878 -19.060 1.00 21.21 H new ATOM 0 HA2 GLY A 111 1.204 11.136 -20.342 1.00 21.41 H new ATOM 0 HA3 GLY A 111 0.299 10.933 -18.855 1.00 21.41 H new ATOM 1732 N ILE A 112 2.397 13.272 -18.446 1.00 44.14 N ATOM 1733 CA ILE A 112 2.623 14.696 -18.250 1.00 15.10 C ATOM 1734 C ILE A 112 2.969 15.354 -19.586 1.00 2.55 C ATOM 1735 O ILE A 112 4.092 15.254 -20.081 1.00 35.34 O ATOM 1736 CB ILE A 112 3.724 14.973 -17.191 1.00 65.41 C ATOM 1737 CG1 ILE A 112 4.949 14.075 -17.408 1.00 74.22 C ATOM 1738 CG2 ILE A 112 3.166 14.760 -15.790 1.00 3.10 C ATOM 1739 CD1 ILE A 112 6.115 14.395 -16.497 1.00 33.15 C ATOM 0 H ILE A 112 3.149 12.673 -18.104 1.00 44.14 H new ATOM 0 HA ILE A 112 1.702 15.133 -17.865 1.00 15.10 H new ATOM 0 HB ILE A 112 4.042 16.010 -17.302 1.00 65.41 H new ATOM 0 HG12 ILE A 112 4.657 13.036 -17.256 1.00 74.22 H new ATOM 0 HG13 ILE A 112 5.275 14.166 -18.444 1.00 74.22 H new ATOM 0 HG21 ILE A 112 3.946 14.957 -15.054 1.00 3.10 H new ATOM 0 HG22 ILE A 112 2.330 15.440 -15.624 1.00 3.10 H new ATOM 0 HG23 ILE A 112 2.822 13.731 -15.688 1.00 3.10 H new ATOM 0 HD11 ILE A 112 6.941 13.717 -16.712 1.00 33.15 H new ATOM 0 HD12 ILE A 112 6.436 15.423 -16.664 1.00 33.15 H new ATOM 0 HD13 ILE A 112 5.808 14.275 -15.458 1.00 33.15 H new ATOM 1751 N LYS A 113 1.978 16.012 -20.172 1.00 32.43 N ATOM 1752 CA LYS A 113 2.082 16.525 -21.537 1.00 1.42 C ATOM 1753 C LYS A 113 2.733 17.908 -21.598 1.00 12.12 C ATOM 1754 O LYS A 113 2.545 18.644 -22.565 1.00 44.12 O ATOM 1755 CB LYS A 113 0.691 16.544 -22.210 1.00 12.24 C ATOM 1756 CG LYS A 113 -0.477 16.917 -21.289 1.00 72.02 C ATOM 1757 CD LYS A 113 -0.469 18.386 -20.883 1.00 11.02 C ATOM 1758 CE LYS A 113 -0.752 19.306 -22.061 1.00 30.20 C ATOM 1759 NZ LYS A 113 -0.897 20.723 -21.635 1.00 52.31 N ATOM 0 H LYS A 113 1.084 16.206 -19.721 1.00 32.43 H new ATOM 0 HA LYS A 113 2.736 15.847 -22.086 1.00 1.42 H new ATOM 0 HB2 LYS A 113 0.717 17.249 -23.041 1.00 12.24 H new ATOM 0 HB3 LYS A 113 0.497 15.559 -22.634 1.00 12.24 H new ATOM 0 HG2 LYS A 113 -1.417 16.690 -21.793 1.00 72.02 H new ATOM 0 HG3 LYS A 113 -0.438 16.298 -20.393 1.00 72.02 H new ATOM 0 HD2 LYS A 113 -1.216 18.551 -20.107 1.00 11.02 H new ATOM 0 HD3 LYS A 113 0.500 18.637 -20.452 1.00 11.02 H new ATOM 0 HE2 LYS A 113 0.057 19.226 -22.787 1.00 30.20 H new ATOM 0 HE3 LYS A 113 -1.664 18.983 -22.563 1.00 30.20 H new ATOM 0 HZ1 LYS A 113 -0.348 21.335 -22.272 1.00 52.31 H new ATOM 0 HZ2 LYS A 113 -1.900 20.996 -21.672 1.00 52.31 H new ATOM 0 HZ3 LYS A 113 -0.544 20.831 -20.663 1.00 52.31 H new ATOM 1773 N GLU A 114 3.507 18.251 -20.581 1.00 12.54 N ATOM 1774 CA GLU A 114 4.224 19.517 -20.554 1.00 34.34 C ATOM 1775 C GLU A 114 5.345 19.458 -19.528 1.00 33.24 C ATOM 1776 O GLU A 114 5.482 18.460 -18.812 1.00 33.03 O ATOM 1777 CB GLU A 114 3.274 20.675 -20.244 1.00 11.31 C ATOM 1778 CG GLU A 114 2.496 20.499 -18.957 1.00 14.34 C ATOM 1779 CD GLU A 114 1.475 21.589 -18.751 1.00 73.12 C ATOM 1780 OE1 GLU A 114 0.363 21.468 -19.296 1.00 11.51 O ATOM 1781 OE2 GLU A 114 1.779 22.572 -18.050 1.00 54.20 O ATOM 0 H GLU A 114 3.656 17.667 -19.758 1.00 12.54 H new ATOM 0 HA GLU A 114 4.656 19.691 -21.539 1.00 34.34 H new ATOM 0 HB2 GLU A 114 3.849 21.599 -20.187 1.00 11.31 H new ATOM 0 HB3 GLU A 114 2.572 20.788 -21.070 1.00 11.31 H new ATOM 0 HG2 GLU A 114 1.994 19.532 -18.968 1.00 14.34 H new ATOM 0 HG3 GLU A 114 3.188 20.489 -18.115 1.00 14.34 H new ATOM 1788 N ASP A 115 6.137 20.522 -19.468 1.00 41.05 N ATOM 1789 CA ASP A 115 7.280 20.598 -18.564 1.00 44.31 C ATOM 1790 C ASP A 115 6.820 20.527 -17.112 1.00 65.41 C ATOM 1791 O ASP A 115 6.022 21.350 -16.657 1.00 11.32 O ATOM 1792 CB ASP A 115 8.060 21.893 -18.800 1.00 43.21 C ATOM 1793 CG ASP A 115 9.466 21.841 -18.240 1.00 54.13 C ATOM 1794 OD1 ASP A 115 9.631 21.962 -17.013 1.00 3.14 O ATOM 1795 OD2 ASP A 115 10.419 21.705 -19.034 1.00 3.40 O ATOM 0 H ASP A 115 6.006 21.355 -20.043 1.00 41.05 H new ATOM 0 HA ASP A 115 7.933 19.749 -18.767 1.00 44.31 H new ATOM 0 HB2 ASP A 115 8.107 22.093 -19.870 1.00 43.21 H new ATOM 0 HB3 ASP A 115 7.522 22.724 -18.343 1.00 43.21 H new ATOM 1800 N THR A 116 7.309 19.532 -16.396 1.00 62.40 N ATOM 1801 CA THR A 116 6.941 19.334 -15.008 1.00 60.51 C ATOM 1802 C THR A 116 8.182 19.340 -14.132 1.00 33.03 C ATOM 1803 O THR A 116 9.255 18.899 -14.544 1.00 75.10 O ATOM 1804 CB THR A 116 6.170 18.011 -14.819 1.00 31.11 C ATOM 1805 OG1 THR A 116 5.279 17.816 -15.926 1.00 12.44 O ATOM 1806 CG2 THR A 116 5.374 18.018 -13.514 1.00 34.41 C ATOM 0 H THR A 116 7.968 18.843 -16.758 1.00 62.40 H new ATOM 0 HA THR A 116 6.287 20.155 -14.712 1.00 60.51 H new ATOM 0 HB THR A 116 6.891 17.195 -14.773 1.00 31.11 H new ATOM 0 HG1 THR A 116 4.773 18.640 -16.088 1.00 12.44 H new ATOM 0 HG21 THR A 116 4.841 17.073 -13.408 1.00 34.41 H new ATOM 0 HG22 THR A 116 6.055 18.147 -12.673 1.00 34.41 H new ATOM 0 HG23 THR A 116 4.657 18.839 -13.529 1.00 34.41 H new ATOM 1814 N GLU A 117 8.021 19.843 -12.928 1.00 20.04 N ATOM 1815 CA GLU A 117 9.125 19.984 -12.009 1.00 31.41 C ATOM 1816 C GLU A 117 9.001 19.024 -10.853 1.00 11.43 C ATOM 1817 O GLU A 117 7.936 18.439 -10.608 1.00 1.22 O ATOM 1818 CB GLU A 117 9.206 21.412 -11.491 1.00 5.45 C ATOM 1819 CG GLU A 117 9.910 22.345 -12.449 1.00 51.12 C ATOM 1820 CD GLU A 117 11.418 22.278 -12.326 1.00 61.05 C ATOM 1821 OE1 GLU A 117 11.941 22.467 -11.210 1.00 5.24 O ATOM 1822 OE2 GLU A 117 12.092 22.032 -13.342 1.00 64.44 O ATOM 0 H GLU A 117 7.125 20.164 -12.561 1.00 20.04 H new ATOM 0 HA GLU A 117 10.041 19.748 -12.552 1.00 31.41 H new ATOM 0 HB2 GLU A 117 8.198 21.783 -11.304 1.00 5.45 H new ATOM 0 HB3 GLU A 117 9.730 21.417 -10.535 1.00 5.45 H new ATOM 0 HG2 GLU A 117 9.621 22.097 -13.470 1.00 51.12 H new ATOM 0 HG3 GLU A 117 9.579 23.367 -12.264 1.00 51.12 H new ATOM 1829 N GLU A 118 10.106 18.881 -10.149 1.00 3.14 N ATOM 1830 CA GLU A 118 10.168 18.062 -8.953 1.00 33.34 C ATOM 1831 C GLU A 118 9.197 18.598 -7.918 1.00 62.14 C ATOM 1832 O GLU A 118 8.406 17.850 -7.359 1.00 22.31 O ATOM 1833 CB GLU A 118 11.594 18.058 -8.404 1.00 11.33 C ATOM 1834 CG GLU A 118 11.734 17.445 -7.025 1.00 2.14 C ATOM 1835 CD GLU A 118 13.156 17.516 -6.520 1.00 54.53 C ATOM 1836 OE1 GLU A 118 13.525 18.541 -5.915 1.00 53.25 O ATOM 1837 OE2 GLU A 118 13.917 16.559 -6.745 1.00 25.50 O ATOM 0 H GLU A 118 10.989 19.330 -10.390 1.00 3.14 H new ATOM 0 HA GLU A 118 9.888 17.037 -9.196 1.00 33.34 H new ATOM 0 HB2 GLU A 118 12.235 17.513 -9.097 1.00 11.33 H new ATOM 0 HB3 GLU A 118 11.960 19.084 -8.371 1.00 11.33 H new ATOM 0 HG2 GLU A 118 11.075 17.963 -6.328 1.00 2.14 H new ATOM 0 HG3 GLU A 118 11.411 16.404 -7.055 1.00 2.14 H new ATOM 1844 N HIS A 119 9.240 19.913 -7.720 1.00 74.25 N ATOM 1845 CA HIS A 119 8.385 20.606 -6.760 1.00 31.44 C ATOM 1846 C HIS A 119 6.907 20.332 -7.020 1.00 24.14 C ATOM 1847 O HIS A 119 6.124 20.246 -6.081 1.00 30.22 O ATOM 1848 CB HIS A 119 8.644 22.117 -6.825 1.00 20.42 C ATOM 1849 CG HIS A 119 10.063 22.506 -6.526 1.00 64.51 C ATOM 1850 ND1 HIS A 119 11.076 22.272 -7.425 1.00 63.42 N ATOM 1851 CD2 HIS A 119 10.581 23.084 -5.418 1.00 54.42 C ATOM 1852 CE1 HIS A 119 12.181 22.706 -6.845 1.00 52.14 C ATOM 1853 NE2 HIS A 119 11.931 23.207 -5.628 1.00 1.33 N ATOM 0 H HIS A 119 9.874 20.532 -8.225 1.00 74.25 H new ATOM 0 HA HIS A 119 8.630 20.229 -5.767 1.00 31.44 H new ATOM 0 HB2 HIS A 119 8.381 22.478 -7.819 1.00 20.42 H new ATOM 0 HB3 HIS A 119 7.984 22.619 -6.118 1.00 20.42 H new ATOM 0 HD2 HIS A 119 10.036 23.390 -4.537 1.00 54.42 H new ATOM 0 HE1 HIS A 119 13.162 22.662 -7.295 1.00 52.14 H new ATOM 0 HE2 HIS A 119 12.613 23.604 -4.982 1.00 1.33 H new ATOM 1861 N HIS A 120 6.541 20.173 -8.291 1.00 21.25 N ATOM 1862 CA HIS A 120 5.150 19.923 -8.665 1.00 63.30 C ATOM 1863 C HIS A 120 4.664 18.589 -8.116 1.00 14.43 C ATOM 1864 O HIS A 120 3.712 18.544 -7.329 1.00 42.12 O ATOM 1865 CB HIS A 120 4.963 19.952 -10.185 1.00 13.15 C ATOM 1866 CG HIS A 120 5.171 21.307 -10.792 1.00 53.53 C ATOM 1867 ND1 HIS A 120 5.740 21.458 -12.031 1.00 40.32 N ATOM 1868 CD2 HIS A 120 4.887 22.530 -10.286 1.00 71.35 C ATOM 1869 CE1 HIS A 120 5.795 22.761 -12.247 1.00 21.32 C ATOM 1870 NE2 HIS A 120 5.288 23.450 -11.219 1.00 62.35 N ATOM 0 H HIS A 120 7.188 20.213 -9.079 1.00 21.25 H new ATOM 0 HA HIS A 120 4.555 20.724 -8.226 1.00 63.30 H new ATOM 0 HB2 HIS A 120 5.659 19.248 -10.641 1.00 13.15 H new ATOM 0 HB3 HIS A 120 3.957 19.606 -10.425 1.00 13.15 H new ATOM 0 HD2 HIS A 120 4.431 22.740 -9.330 1.00 71.35 H new ATOM 0 HE1 HIS A 120 6.199 23.212 -13.141 1.00 21.32 H new ATOM 0 HE2 HIS A 120 5.214 24.465 -11.144 1.00 62.35 H new ATOM 1878 N LEU A 121 5.340 17.505 -8.477 1.00 60.51 N ATOM 1879 CA LEU A 121 4.855 16.196 -8.088 1.00 22.04 C ATOM 1880 C LEU A 121 5.235 15.881 -6.642 1.00 61.23 C ATOM 1881 O LEU A 121 4.533 15.142 -5.965 1.00 74.11 O ATOM 1882 CB LEU A 121 5.336 15.106 -9.056 1.00 52.41 C ATOM 1883 CG LEU A 121 6.848 14.960 -9.244 1.00 35.02 C ATOM 1884 CD1 LEU A 121 7.445 14.045 -8.186 1.00 64.43 C ATOM 1885 CD2 LEU A 121 7.136 14.418 -10.630 1.00 4.21 C ATOM 0 H LEU A 121 6.201 17.508 -9.023 1.00 60.51 H new ATOM 0 HA LEU A 121 3.767 16.212 -8.145 1.00 22.04 H new ATOM 0 HB2 LEU A 121 4.944 14.149 -8.711 1.00 52.41 H new ATOM 0 HB3 LEU A 121 4.891 15.299 -10.032 1.00 52.41 H new ATOM 0 HG LEU A 121 7.309 15.942 -9.135 1.00 35.02 H new ATOM 0 HD11 LEU A 121 8.520 13.959 -8.344 1.00 64.43 H new ATOM 0 HD12 LEU A 121 7.255 14.461 -7.196 1.00 64.43 H new ATOM 0 HD13 LEU A 121 6.988 13.058 -8.259 1.00 64.43 H new ATOM 0 HD21 LEU A 121 8.213 14.314 -10.764 1.00 4.21 H new ATOM 0 HD22 LEU A 121 6.660 13.444 -10.746 1.00 4.21 H new ATOM 0 HD23 LEU A 121 6.742 15.105 -11.379 1.00 4.21 H new ATOM 1897 N ARG A 122 6.332 16.467 -6.165 1.00 42.04 N ATOM 1898 CA ARG A 122 6.773 16.260 -4.791 1.00 42.34 C ATOM 1899 C ARG A 122 5.771 16.873 -3.826 1.00 11.42 C ATOM 1900 O ARG A 122 5.396 16.245 -2.849 1.00 62.21 O ATOM 1901 CB ARG A 122 8.178 16.853 -4.580 1.00 4.14 C ATOM 1902 CG ARG A 122 8.739 16.690 -3.171 1.00 42.53 C ATOM 1903 CD ARG A 122 8.423 17.885 -2.291 1.00 2.05 C ATOM 1904 NE ARG A 122 9.069 19.107 -2.760 1.00 34.51 N ATOM 1905 CZ ARG A 122 8.611 20.333 -2.509 1.00 72.13 C ATOM 1906 NH1 ARG A 122 7.506 20.503 -1.792 1.00 22.11 N ATOM 1907 NH2 ARG A 122 9.259 21.388 -2.976 1.00 73.53 N ATOM 0 H ARG A 122 6.930 17.088 -6.711 1.00 42.04 H new ATOM 0 HA ARG A 122 6.829 15.189 -4.595 1.00 42.34 H new ATOM 0 HB2 ARG A 122 8.864 16.384 -5.285 1.00 4.14 H new ATOM 0 HB3 ARG A 122 8.148 17.915 -4.823 1.00 4.14 H new ATOM 0 HG2 ARG A 122 8.327 15.788 -2.719 1.00 42.53 H new ATOM 0 HG3 ARG A 122 9.819 16.555 -3.224 1.00 42.53 H new ATOM 0 HD2 ARG A 122 7.344 18.036 -2.261 1.00 2.05 H new ATOM 0 HD3 ARG A 122 8.744 17.676 -1.270 1.00 2.05 H new ATOM 0 HE ARG A 122 9.922 19.017 -3.313 1.00 34.51 H new ATOM 0 HH11 ARG A 122 7.003 19.693 -1.430 1.00 22.11 H new ATOM 0 HH12 ARG A 122 7.160 21.444 -1.603 1.00 22.11 H new ATOM 0 HH21 ARG A 122 10.108 21.262 -3.527 1.00 73.53 H new ATOM 0 HH22 ARG A 122 8.910 22.327 -2.785 1.00 73.53 H new ATOM 1921 N ASP A 123 5.325 18.093 -4.121 1.00 1.02 N ATOM 1922 CA ASP A 123 4.332 18.774 -3.288 1.00 50.20 C ATOM 1923 C ASP A 123 3.034 17.978 -3.249 1.00 24.33 C ATOM 1924 O ASP A 123 2.331 17.954 -2.239 1.00 75.20 O ATOM 1925 CB ASP A 123 4.064 20.181 -3.829 1.00 64.43 C ATOM 1926 CG ASP A 123 3.034 20.943 -3.022 1.00 1.34 C ATOM 1927 OD1 ASP A 123 3.415 21.579 -2.022 1.00 52.23 O ATOM 1928 OD2 ASP A 123 1.843 20.920 -3.389 1.00 4.42 O ATOM 0 H ASP A 123 5.635 18.631 -4.930 1.00 1.02 H new ATOM 0 HA ASP A 123 4.726 18.852 -2.275 1.00 50.20 H new ATOM 0 HB2 ASP A 123 4.998 20.744 -3.839 1.00 64.43 H new ATOM 0 HB3 ASP A 123 3.725 20.108 -4.862 1.00 64.43 H new ATOM 1933 N TYR A 124 2.749 17.299 -4.348 1.00 54.01 N ATOM 1934 CA TYR A 124 1.534 16.533 -4.480 1.00 71.24 C ATOM 1935 C TYR A 124 1.620 15.176 -3.772 1.00 64.44 C ATOM 1936 O TYR A 124 0.779 14.854 -2.935 1.00 60.12 O ATOM 1937 CB TYR A 124 1.234 16.342 -5.958 1.00 41.32 C ATOM 1938 CG TYR A 124 0.033 15.489 -6.202 1.00 31.45 C ATOM 1939 CD1 TYR A 124 -1.231 15.964 -5.912 1.00 24.21 C ATOM 1940 CD2 TYR A 124 0.169 14.201 -6.684 1.00 32.22 C ATOM 1941 CE1 TYR A 124 -2.342 15.180 -6.103 1.00 23.32 C ATOM 1942 CE2 TYR A 124 -0.935 13.402 -6.872 1.00 32.20 C ATOM 1943 CZ TYR A 124 -2.191 13.901 -6.580 1.00 71.04 C ATOM 1944 OH TYR A 124 -3.296 13.116 -6.748 1.00 32.22 O ATOM 0 H TYR A 124 3.355 17.267 -5.168 1.00 54.01 H new ATOM 0 HA TYR A 124 0.727 17.085 -3.998 1.00 71.24 H new ATOM 0 HB2 TYR A 124 1.081 17.317 -6.421 1.00 41.32 H new ATOM 0 HB3 TYR A 124 2.099 15.890 -6.444 1.00 41.32 H new ATOM 0 HD1 TYR A 124 -1.347 16.967 -5.529 1.00 24.21 H new ATOM 0 HD2 TYR A 124 1.152 13.818 -6.915 1.00 32.22 H new ATOM 0 HE1 TYR A 124 -3.326 15.566 -5.880 1.00 23.32 H new ATOM 0 HE2 TYR A 124 -0.822 12.394 -7.244 1.00 32.20 H new ATOM 0 HH TYR A 124 -3.021 12.180 -6.845 1.00 32.22 H new ATOM 1954 N PHE A 125 2.621 14.381 -4.126 1.00 74.13 N ATOM 1955 CA PHE A 125 2.780 13.030 -3.586 1.00 53.20 C ATOM 1956 C PHE A 125 3.127 13.043 -2.088 1.00 2.51 C ATOM 1957 O PHE A 125 2.830 12.086 -1.375 1.00 72.12 O ATOM 1958 CB PHE A 125 3.858 12.273 -4.375 1.00 12.42 C ATOM 1959 CG PHE A 125 3.435 11.825 -5.754 1.00 43.01 C ATOM 1960 CD1 PHE A 125 2.383 10.936 -5.926 1.00 30.31 C ATOM 1961 CD2 PHE A 125 4.099 12.287 -6.876 1.00 22.11 C ATOM 1962 CE1 PHE A 125 2.006 10.520 -7.194 1.00 51.05 C ATOM 1963 CE2 PHE A 125 3.725 11.876 -8.142 1.00 73.51 C ATOM 1964 CZ PHE A 125 2.679 10.992 -8.299 1.00 12.13 C ATOM 0 H PHE A 125 3.345 14.649 -4.793 1.00 74.13 H new ATOM 0 HA PHE A 125 1.824 12.518 -3.693 1.00 53.20 H new ATOM 0 HB2 PHE A 125 4.736 12.912 -4.469 1.00 12.42 H new ATOM 0 HB3 PHE A 125 4.161 11.398 -3.801 1.00 12.42 H new ATOM 0 HD1 PHE A 125 1.852 10.564 -5.062 1.00 30.31 H new ATOM 0 HD2 PHE A 125 4.921 12.978 -6.762 1.00 22.11 H new ATOM 0 HE1 PHE A 125 1.186 9.827 -7.315 1.00 51.05 H new ATOM 0 HE2 PHE A 125 4.252 12.248 -9.008 1.00 73.51 H new ATOM 0 HZ PHE A 125 2.387 10.670 -9.288 1.00 12.13 H new ATOM 1974 N GLU A 126 3.707 14.146 -1.613 1.00 72.14 N ATOM 1975 CA GLU A 126 4.107 14.272 -0.203 1.00 61.20 C ATOM 1976 C GLU A 126 2.882 14.290 0.712 1.00 35.32 C ATOM 1977 O GLU A 126 2.966 13.943 1.890 1.00 42.14 O ATOM 1978 CB GLU A 126 4.932 15.544 0.015 1.00 23.41 C ATOM 1979 CG GLU A 126 6.430 15.313 0.163 1.00 34.14 C ATOM 1980 CD GLU A 126 6.828 14.887 1.561 1.00 4.20 C ATOM 1981 OE1 GLU A 126 6.361 15.511 2.532 1.00 74.00 O ATOM 1982 OE2 GLU A 126 7.634 13.947 1.697 1.00 61.34 O ATOM 0 H GLU A 126 3.912 14.968 -2.181 1.00 72.14 H new ATOM 0 HA GLU A 126 4.719 13.405 0.046 1.00 61.20 H new ATOM 0 HB2 GLU A 126 4.763 16.219 -0.824 1.00 23.41 H new ATOM 0 HB3 GLU A 126 4.566 16.050 0.909 1.00 23.41 H new ATOM 0 HG2 GLU A 126 6.746 14.549 -0.547 1.00 34.14 H new ATOM 0 HG3 GLU A 126 6.961 16.229 -0.097 1.00 34.14 H new ATOM 1989 N GLN A 127 1.750 14.722 0.161 1.00 41.51 N ATOM 1990 CA GLN A 127 0.477 14.716 0.886 1.00 12.44 C ATOM 1991 C GLN A 127 0.070 13.301 1.296 1.00 4.14 C ATOM 1992 O GLN A 127 -0.560 13.108 2.333 1.00 21.12 O ATOM 1993 CB GLN A 127 -0.630 15.335 0.028 1.00 71.33 C ATOM 1994 CG GLN A 127 -0.275 16.696 -0.551 1.00 33.21 C ATOM 1995 CD GLN A 127 -1.392 17.286 -1.379 1.00 22.10 C ATOM 1996 OE1 GLN A 127 -2.220 18.043 -0.882 1.00 52.44 O ATOM 1997 NE2 GLN A 127 -1.428 16.929 -2.649 1.00 44.32 N ATOM 0 H GLN A 127 1.686 15.083 -0.791 1.00 41.51 H new ATOM 0 HA GLN A 127 0.615 15.310 1.789 1.00 12.44 H new ATOM 0 HB2 GLN A 127 -0.866 14.654 -0.790 1.00 71.33 H new ATOM 0 HB3 GLN A 127 -1.532 15.432 0.632 1.00 71.33 H new ATOM 0 HG2 GLN A 127 -0.031 17.380 0.262 1.00 33.21 H new ATOM 0 HG3 GLN A 127 0.619 16.602 -1.168 1.00 33.21 H new ATOM 0 HE21 GLN A 127 -0.719 16.297 -3.021 1.00 44.32 H new ATOM 0 HE22 GLN A 127 -2.165 17.285 -3.258 1.00 44.32 H new ATOM 2006 N TYR A 128 0.432 12.316 0.482 1.00 73.54 N ATOM 2007 CA TYR A 128 0.087 10.922 0.755 1.00 63.13 C ATOM 2008 C TYR A 128 1.061 10.300 1.752 1.00 71.21 C ATOM 2009 O TYR A 128 0.713 9.366 2.478 1.00 21.44 O ATOM 2010 CB TYR A 128 0.092 10.107 -0.539 1.00 52.54 C ATOM 2011 CG TYR A 128 -0.957 10.529 -1.546 1.00 63.50 C ATOM 2012 CD1 TYR A 128 -0.728 11.585 -2.423 1.00 1.31 C ATOM 2013 CD2 TYR A 128 -2.170 9.858 -1.632 1.00 11.35 C ATOM 2014 CE1 TYR A 128 -1.680 11.960 -3.351 1.00 62.35 C ATOM 2015 CE2 TYR A 128 -3.124 10.226 -2.559 1.00 44.55 C ATOM 2016 CZ TYR A 128 -2.873 11.277 -3.416 1.00 3.32 C ATOM 2017 OH TYR A 128 -3.824 11.647 -4.338 1.00 11.33 O ATOM 0 H TYR A 128 0.966 12.456 -0.376 1.00 73.54 H new ATOM 0 HA TYR A 128 -0.913 10.907 1.188 1.00 63.13 H new ATOM 0 HB2 TYR A 128 1.076 10.188 -1.001 1.00 52.54 H new ATOM 0 HB3 TYR A 128 -0.059 9.056 -0.293 1.00 52.54 H new ATOM 0 HD1 TYR A 128 0.209 12.120 -2.377 1.00 1.31 H new ATOM 0 HD2 TYR A 128 -2.370 9.035 -0.962 1.00 11.35 H new ATOM 0 HE1 TYR A 128 -1.489 12.785 -4.022 1.00 62.35 H new ATOM 0 HE2 TYR A 128 -4.062 9.694 -2.613 1.00 44.55 H new ATOM 0 HH TYR A 128 -3.417 12.233 -5.010 1.00 11.33 H new ATOM 2027 N GLY A 129 2.281 10.813 1.761 1.00 32.02 N ATOM 2028 CA GLY A 129 3.290 10.319 2.675 1.00 74.11 C ATOM 2029 C GLY A 129 4.660 10.884 2.389 1.00 30.04 C ATOM 2030 O GLY A 129 4.821 11.699 1.484 1.00 74.02 O ATOM 0 H GLY A 129 2.592 11.567 1.148 1.00 32.02 H new ATOM 0 HA2 GLY A 129 3.004 10.570 3.696 1.00 74.11 H new ATOM 0 HA3 GLY A 129 3.330 9.231 2.613 1.00 74.11 H new ATOM 2034 N LYS A 130 5.650 10.443 3.153 1.00 34.11 N ATOM 2035 CA LYS A 130 7.002 10.966 3.041 1.00 15.23 C ATOM 2036 C LYS A 130 7.706 10.443 1.790 1.00 3.33 C ATOM 2037 O LYS A 130 7.660 9.252 1.483 1.00 41.23 O ATOM 2038 CB LYS A 130 7.811 10.601 4.291 1.00 22.14 C ATOM 2039 CG LYS A 130 9.270 11.013 4.207 1.00 54.52 C ATOM 2040 CD LYS A 130 10.058 10.583 5.430 1.00 45.43 C ATOM 2041 CE LYS A 130 11.521 10.968 5.293 1.00 70.21 C ATOM 2042 NZ LYS A 130 11.710 12.443 5.287 1.00 10.14 N ATOM 0 H LYS A 130 5.539 9.718 3.862 1.00 34.11 H new ATOM 0 HA LYS A 130 6.934 12.051 2.956 1.00 15.23 H new ATOM 0 HB2 LYS A 130 7.357 11.076 5.160 1.00 22.14 H new ATOM 0 HB3 LYS A 130 7.754 9.524 4.450 1.00 22.14 H new ATOM 0 HG2 LYS A 130 9.719 10.575 3.315 1.00 54.52 H new ATOM 0 HG3 LYS A 130 9.334 12.096 4.097 1.00 54.52 H new ATOM 0 HD2 LYS A 130 9.637 11.048 6.321 1.00 45.43 H new ATOM 0 HD3 LYS A 130 9.972 9.505 5.563 1.00 45.43 H new ATOM 0 HE2 LYS A 130 12.089 10.533 6.115 1.00 70.21 H new ATOM 0 HE3 LYS A 130 11.922 10.547 4.371 1.00 70.21 H new ATOM 0 HZ1 LYS A 130 12.724 12.663 5.363 1.00 10.14 H new ATOM 0 HZ2 LYS A 130 11.335 12.837 4.401 1.00 10.14 H new ATOM 0 HZ3 LYS A 130 11.204 12.861 6.093 1.00 10.14 H new ATOM 2056 N ILE A 131 8.353 11.352 1.084 1.00 32.33 N ATOM 2057 CA ILE A 131 9.141 11.021 -0.091 1.00 1.30 C ATOM 2058 C ILE A 131 10.632 11.035 0.261 1.00 75.52 C ATOM 2059 O ILE A 131 11.070 11.839 1.085 1.00 62.41 O ATOM 2060 CB ILE A 131 8.858 12.027 -1.232 1.00 1.45 C ATOM 2061 CG1 ILE A 131 7.382 11.975 -1.637 1.00 51.41 C ATOM 2062 CG2 ILE A 131 9.750 11.761 -2.435 1.00 12.21 C ATOM 2063 CD1 ILE A 131 7.006 12.995 -2.690 1.00 31.03 C ATOM 0 H ILE A 131 8.347 12.347 1.310 1.00 32.33 H new ATOM 0 HA ILE A 131 8.862 10.023 -0.430 1.00 1.30 H new ATOM 0 HB ILE A 131 9.084 13.027 -0.862 1.00 1.45 H new ATOM 0 HG12 ILE A 131 7.151 10.977 -2.011 1.00 51.41 H new ATOM 0 HG13 ILE A 131 6.765 12.134 -0.752 1.00 51.41 H new ATOM 0 HG21 ILE A 131 9.528 12.484 -3.220 1.00 12.21 H new ATOM 0 HG22 ILE A 131 10.795 11.855 -2.141 1.00 12.21 H new ATOM 0 HG23 ILE A 131 9.567 10.753 -2.808 1.00 12.21 H new ATOM 0 HD11 ILE A 131 5.946 12.899 -2.927 1.00 31.03 H new ATOM 0 HD12 ILE A 131 7.204 13.998 -2.312 1.00 31.03 H new ATOM 0 HD13 ILE A 131 7.596 12.823 -3.590 1.00 31.03 H new ATOM 2075 N GLU A 132 11.402 10.138 -0.345 1.00 24.31 N ATOM 2076 CA GLU A 132 12.843 10.102 -0.124 1.00 1.11 C ATOM 2077 C GLU A 132 13.574 10.918 -1.183 1.00 55.43 C ATOM 2078 O GLU A 132 14.425 11.748 -0.863 1.00 61.35 O ATOM 2079 CB GLU A 132 13.368 8.668 -0.132 1.00 21.44 C ATOM 2080 CG GLU A 132 12.758 7.792 0.941 1.00 73.12 C ATOM 2081 CD GLU A 132 13.628 6.606 1.287 1.00 64.43 C ATOM 2082 OE1 GLU A 132 13.606 5.607 0.547 1.00 22.15 O ATOM 2083 OE2 GLU A 132 14.354 6.674 2.298 1.00 3.41 O ATOM 0 H GLU A 132 11.054 9.429 -0.990 1.00 24.31 H new ATOM 0 HA GLU A 132 13.033 10.538 0.857 1.00 1.11 H new ATOM 0 HB2 GLU A 132 13.171 8.223 -1.107 1.00 21.44 H new ATOM 0 HB3 GLU A 132 14.450 8.686 -0.003 1.00 21.44 H new ATOM 0 HG2 GLU A 132 12.588 8.388 1.838 1.00 73.12 H new ATOM 0 HG3 GLU A 132 11.784 7.437 0.605 1.00 73.12 H new ATOM 2090 N VAL A 133 13.235 10.680 -2.442 1.00 12.32 N ATOM 2091 CA VAL A 133 13.886 11.359 -3.550 1.00 41.13 C ATOM 2092 C VAL A 133 12.973 11.343 -4.781 1.00 74.24 C ATOM 2093 O VAL A 133 12.099 10.481 -4.906 1.00 1.24 O ATOM 2094 CB VAL A 133 15.263 10.707 -3.868 1.00 3.55 C ATOM 2095 CG1 VAL A 133 15.105 9.405 -4.636 1.00 42.32 C ATOM 2096 CG2 VAL A 133 16.170 11.670 -4.618 1.00 32.10 C ATOM 0 H VAL A 133 12.510 10.019 -2.721 1.00 12.32 H new ATOM 0 HA VAL A 133 14.070 12.395 -3.267 1.00 41.13 H new ATOM 0 HB VAL A 133 15.734 10.472 -2.914 1.00 3.55 H new ATOM 0 HG11 VAL A 133 16.088 8.981 -4.839 1.00 42.32 H new ATOM 0 HG12 VAL A 133 14.521 8.701 -4.043 1.00 42.32 H new ATOM 0 HG13 VAL A 133 14.592 9.598 -5.578 1.00 42.32 H new ATOM 0 HG21 VAL A 133 17.124 11.185 -4.825 1.00 32.10 H new ATOM 0 HG22 VAL A 133 15.698 11.958 -5.557 1.00 32.10 H new ATOM 0 HG23 VAL A 133 16.340 12.559 -4.010 1.00 32.10 H new ATOM 2106 N ILE A 134 13.160 12.301 -5.674 1.00 51.32 N ATOM 2107 CA ILE A 134 12.332 12.406 -6.866 1.00 33.13 C ATOM 2108 C ILE A 134 13.173 12.164 -8.108 1.00 23.45 C ATOM 2109 O ILE A 134 14.239 12.760 -8.270 1.00 51.25 O ATOM 2110 CB ILE A 134 11.635 13.789 -6.973 1.00 1.42 C ATOM 2111 CG1 ILE A 134 10.534 13.939 -5.919 1.00 64.43 C ATOM 2112 CG2 ILE A 134 11.049 14.002 -8.363 1.00 64.53 C ATOM 2113 CD1 ILE A 134 11.026 14.415 -4.570 1.00 43.04 C ATOM 0 H ILE A 134 13.880 13.019 -5.596 1.00 51.32 H new ATOM 0 HA ILE A 134 11.555 11.645 -6.788 1.00 33.13 H new ATOM 0 HB ILE A 134 12.396 14.548 -6.792 1.00 1.42 H new ATOM 0 HG12 ILE A 134 9.786 14.641 -6.289 1.00 64.43 H new ATOM 0 HG13 ILE A 134 10.035 12.978 -5.793 1.00 64.43 H new ATOM 0 HG21 ILE A 134 10.567 14.979 -8.409 1.00 64.53 H new ATOM 0 HG22 ILE A 134 11.846 13.955 -9.105 1.00 64.53 H new ATOM 0 HG23 ILE A 134 10.314 13.225 -8.571 1.00 64.53 H new ATOM 0 HD11 ILE A 134 10.184 14.494 -3.883 1.00 43.04 H new ATOM 0 HD12 ILE A 134 11.751 13.703 -4.175 1.00 43.04 H new ATOM 0 HD13 ILE A 134 11.499 15.391 -4.679 1.00 43.04 H new ATOM 2125 N GLU A 135 12.704 11.271 -8.962 1.00 51.02 N ATOM 2126 CA GLU A 135 13.386 10.974 -10.207 1.00 61.11 C ATOM 2127 C GLU A 135 12.720 11.684 -11.384 1.00 60.11 C ATOM 2128 O GLU A 135 11.674 11.267 -11.872 1.00 52.51 O ATOM 2129 CB GLU A 135 13.378 9.460 -10.426 1.00 14.23 C ATOM 2130 CG GLU A 135 14.385 8.720 -9.567 1.00 10.34 C ATOM 2131 CD GLU A 135 14.184 7.222 -9.586 1.00 22.10 C ATOM 2132 OE1 GLU A 135 14.547 6.579 -10.589 1.00 61.42 O ATOM 2133 OE2 GLU A 135 13.668 6.677 -8.595 1.00 25.54 O ATOM 0 H GLU A 135 11.848 10.737 -8.813 1.00 51.02 H new ATOM 0 HA GLU A 135 14.413 11.335 -10.145 1.00 61.11 H new ATOM 0 HB2 GLU A 135 12.380 9.075 -10.215 1.00 14.23 H new ATOM 0 HB3 GLU A 135 13.585 9.251 -11.476 1.00 14.23 H new ATOM 0 HG2 GLU A 135 15.392 8.951 -9.915 1.00 10.34 H new ATOM 0 HG3 GLU A 135 14.313 9.079 -8.540 1.00 10.34 H new ATOM 2140 N ILE A 136 13.340 12.757 -11.844 1.00 24.21 N ATOM 2141 CA ILE A 136 12.871 13.457 -13.027 1.00 51.52 C ATOM 2142 C ILE A 136 13.682 13.018 -14.232 1.00 43.54 C ATOM 2143 O ILE A 136 14.888 13.255 -14.299 1.00 33.23 O ATOM 2144 CB ILE A 136 12.982 14.995 -12.885 1.00 52.31 C ATOM 2145 CG1 ILE A 136 12.220 15.499 -11.650 1.00 14.33 C ATOM 2146 CG2 ILE A 136 12.465 15.684 -14.145 1.00 42.22 C ATOM 2147 CD1 ILE A 136 10.714 15.345 -11.739 1.00 12.14 C ATOM 0 H ILE A 136 14.171 13.163 -11.415 1.00 24.21 H new ATOM 0 HA ILE A 136 11.818 13.205 -13.154 1.00 51.52 H new ATOM 0 HB ILE A 136 14.035 15.243 -12.753 1.00 52.31 H new ATOM 0 HG12 ILE A 136 12.577 14.960 -10.772 1.00 14.33 H new ATOM 0 HG13 ILE A 136 12.457 16.552 -11.496 1.00 14.33 H new ATOM 0 HG21 ILE A 136 12.550 16.765 -14.030 1.00 42.22 H new ATOM 0 HG22 ILE A 136 13.055 15.363 -15.003 1.00 42.22 H new ATOM 0 HG23 ILE A 136 11.420 15.417 -14.303 1.00 42.22 H new ATOM 0 HD11 ILE A 136 10.255 15.725 -10.826 1.00 12.14 H new ATOM 0 HD12 ILE A 136 10.341 15.908 -12.595 1.00 12.14 H new ATOM 0 HD13 ILE A 136 10.463 14.291 -11.860 1.00 12.14 H new ATOM 2159 N MET A 137 13.026 12.382 -15.178 1.00 13.14 N ATOM 2160 CA MET A 137 13.686 11.952 -16.393 1.00 54.54 C ATOM 2161 C MET A 137 13.165 12.763 -17.561 1.00 31.33 C ATOM 2162 O MET A 137 12.039 13.262 -17.528 1.00 20.21 O ATOM 2163 CB MET A 137 13.496 10.451 -16.636 1.00 23.00 C ATOM 2164 CG MET A 137 12.253 9.859 -15.987 1.00 11.11 C ATOM 2165 SD MET A 137 12.120 8.078 -16.234 1.00 33.30 S ATOM 2166 CE MET A 137 13.744 7.521 -15.745 1.00 2.53 C ATOM 0 H MET A 137 12.034 12.150 -15.130 1.00 13.14 H new ATOM 0 HA MET A 137 14.757 12.123 -16.288 1.00 54.54 H new ATOM 0 HB2 MET A 137 13.449 10.273 -17.710 1.00 23.00 H new ATOM 0 HB3 MET A 137 14.373 9.922 -16.263 1.00 23.00 H new ATOM 0 HG2 MET A 137 12.269 10.073 -14.918 1.00 11.11 H new ATOM 0 HG3 MET A 137 11.368 10.346 -16.396 1.00 11.11 H new ATOM 0 HE1 MET A 137 13.687 6.488 -15.403 1.00 2.53 H new ATOM 0 HE2 MET A 137 14.422 7.585 -16.596 1.00 2.53 H new ATOM 0 HE3 MET A 137 14.116 8.150 -14.937 1.00 2.53 H new ATOM 2176 N THR A 138 13.986 12.910 -18.580 1.00 1.42 N ATOM 2177 CA THR A 138 13.658 13.781 -19.685 1.00 71.22 C ATOM 2178 C THR A 138 12.920 13.035 -20.790 1.00 52.31 C ATOM 2179 O THR A 138 13.107 11.831 -20.978 1.00 23.23 O ATOM 2180 CB THR A 138 14.926 14.448 -20.247 1.00 64.22 C ATOM 2181 OG1 THR A 138 16.042 13.557 -20.122 1.00 72.44 O ATOM 2182 CG2 THR A 138 15.225 15.741 -19.505 1.00 44.14 C ATOM 0 H THR A 138 14.885 12.436 -18.664 1.00 1.42 H new ATOM 0 HA THR A 138 12.992 14.555 -19.303 1.00 71.22 H new ATOM 0 HB THR A 138 14.757 14.677 -21.299 1.00 64.22 H new ATOM 0 HG1 THR A 138 16.846 13.986 -20.483 1.00 72.44 H new ATOM 0 HG21 THR A 138 16.125 16.197 -19.917 1.00 44.14 H new ATOM 0 HG22 THR A 138 14.386 16.428 -19.618 1.00 44.14 H new ATOM 0 HG23 THR A 138 15.379 15.526 -18.447 1.00 44.14 H new ATOM 2319 N GLY A 147 6.789 14.049 -20.344 1.00 72.32 N ATOM 2320 CA GLY A 147 6.438 12.737 -20.833 1.00 23.21 C ATOM 2321 C GLY A 147 6.250 11.718 -19.735 1.00 60.30 C ATOM 2322 O GLY A 147 5.244 11.002 -19.735 1.00 75.34 O ATOM 0 HA2 GLY A 147 5.518 12.808 -21.414 1.00 23.21 H new ATOM 0 HA3 GLY A 147 7.217 12.390 -21.511 1.00 23.21 H new ATOM 2326 N PHE A 148 7.162 11.673 -18.762 1.00 15.22 N ATOM 2327 CA PHE A 148 7.063 10.728 -17.658 1.00 60.21 C ATOM 2328 C PHE A 148 8.105 11.063 -16.588 1.00 31.30 C ATOM 2329 O PHE A 148 9.140 11.664 -16.881 1.00 11.50 O ATOM 2330 CB PHE A 148 7.240 9.272 -18.146 1.00 55.04 C ATOM 2331 CG PHE A 148 8.465 9.024 -18.998 1.00 44.33 C ATOM 2332 CD1 PHE A 148 8.419 9.194 -20.375 1.00 21.52 C ATOM 2333 CD2 PHE A 148 9.655 8.611 -18.425 1.00 61.02 C ATOM 2334 CE1 PHE A 148 9.534 8.961 -21.158 1.00 12.35 C ATOM 2335 CE2 PHE A 148 10.774 8.375 -19.203 1.00 34.20 C ATOM 2336 CZ PHE A 148 10.714 8.550 -20.570 1.00 33.44 C ATOM 0 H PHE A 148 7.978 12.283 -18.720 1.00 15.22 H new ATOM 0 HA PHE A 148 6.066 10.814 -17.225 1.00 60.21 H new ATOM 0 HB2 PHE A 148 7.283 8.617 -17.276 1.00 55.04 H new ATOM 0 HB3 PHE A 148 6.356 8.987 -18.717 1.00 55.04 H new ATOM 0 HD1 PHE A 148 7.499 9.513 -20.841 1.00 21.52 H new ATOM 0 HD2 PHE A 148 9.711 8.471 -17.356 1.00 61.02 H new ATOM 0 HE1 PHE A 148 9.482 9.100 -22.228 1.00 12.35 H new ATOM 0 HE2 PHE A 148 11.695 8.054 -18.740 1.00 34.20 H new ATOM 0 HZ PHE A 148 11.587 8.366 -21.178 1.00 33.44 H new ATOM 2346 N ALA A 149 7.807 10.683 -15.353 1.00 41.23 N ATOM 2347 CA ALA A 149 8.685 10.912 -14.217 1.00 61.14 C ATOM 2348 C ALA A 149 8.514 9.782 -13.206 1.00 21.44 C ATOM 2349 O ALA A 149 7.654 8.914 -13.371 1.00 22.45 O ATOM 2350 CB ALA A 149 8.377 12.261 -13.569 1.00 32.45 C ATOM 0 H ALA A 149 6.940 10.203 -15.111 1.00 41.23 H new ATOM 0 HA ALA A 149 9.719 10.929 -14.561 1.00 61.14 H new ATOM 0 HB1 ALA A 149 9.043 12.417 -12.720 1.00 32.45 H new ATOM 0 HB2 ALA A 149 8.526 13.057 -14.298 1.00 32.45 H new ATOM 0 HB3 ALA A 149 7.343 12.272 -13.226 1.00 32.45 H new ATOM 2356 N PHE A 150 9.331 9.803 -12.169 1.00 41.44 N ATOM 2357 CA PHE A 150 9.281 8.799 -11.119 1.00 34.12 C ATOM 2358 C PHE A 150 9.483 9.456 -9.761 1.00 40.22 C ATOM 2359 O PHE A 150 10.062 10.533 -9.660 1.00 35.34 O ATOM 2360 CB PHE A 150 10.344 7.713 -11.336 1.00 45.44 C ATOM 2361 CG PHE A 150 9.984 6.687 -12.377 1.00 63.23 C ATOM 2362 CD1 PHE A 150 9.305 5.535 -12.028 1.00 74.44 C ATOM 2363 CD2 PHE A 150 10.336 6.873 -13.702 1.00 54.14 C ATOM 2364 CE1 PHE A 150 8.981 4.589 -12.981 1.00 55.25 C ATOM 2365 CE2 PHE A 150 10.017 5.929 -14.659 1.00 52.12 C ATOM 2366 CZ PHE A 150 9.338 4.785 -14.298 1.00 12.45 C ATOM 0 H PHE A 150 10.048 10.515 -12.030 1.00 41.44 H new ATOM 0 HA PHE A 150 8.300 8.325 -11.152 1.00 34.12 H new ATOM 0 HB2 PHE A 150 11.280 8.191 -11.624 1.00 45.44 H new ATOM 0 HB3 PHE A 150 10.524 7.204 -10.389 1.00 45.44 H new ATOM 0 HD1 PHE A 150 9.024 5.372 -10.998 1.00 74.44 H new ATOM 0 HD2 PHE A 150 10.867 7.768 -13.992 1.00 54.14 H new ATOM 0 HE1 PHE A 150 8.447 3.695 -12.694 1.00 55.25 H new ATOM 0 HE2 PHE A 150 10.299 6.087 -15.689 1.00 52.12 H new ATOM 0 HZ PHE A 150 9.087 4.045 -15.044 1.00 12.45 H new ATOM 2376 N VAL A 151 8.982 8.821 -8.723 1.00 62.21 N ATOM 2377 CA VAL A 151 9.159 9.333 -7.374 1.00 53.44 C ATOM 2378 C VAL A 151 9.337 8.192 -6.371 1.00 0.11 C ATOM 2379 O VAL A 151 8.601 7.203 -6.382 1.00 20.21 O ATOM 2380 CB VAL A 151 7.990 10.272 -6.964 1.00 64.32 C ATOM 2381 CG1 VAL A 151 6.643 9.614 -7.182 1.00 62.05 C ATOM 2382 CG2 VAL A 151 8.127 10.728 -5.520 1.00 11.41 C ATOM 0 H VAL A 151 8.450 7.953 -8.783 1.00 62.21 H new ATOM 0 HA VAL A 151 10.072 9.929 -7.364 1.00 53.44 H new ATOM 0 HB VAL A 151 8.046 11.150 -7.608 1.00 64.32 H new ATOM 0 HG11 VAL A 151 5.850 10.300 -6.884 1.00 62.05 H new ATOM 0 HG12 VAL A 151 6.528 9.362 -8.236 1.00 62.05 H new ATOM 0 HG13 VAL A 151 6.581 8.706 -6.583 1.00 62.05 H new ATOM 0 HG21 VAL A 151 7.294 11.383 -5.265 1.00 11.41 H new ATOM 0 HG22 VAL A 151 8.120 9.859 -4.862 1.00 11.41 H new ATOM 0 HG23 VAL A 151 9.065 11.269 -5.397 1.00 11.41 H new ATOM 2392 N THR A 152 10.352 8.336 -5.530 1.00 24.14 N ATOM 2393 CA THR A 152 10.694 7.341 -4.533 1.00 75.24 C ATOM 2394 C THR A 152 10.103 7.718 -3.179 1.00 64.13 C ATOM 2395 O THR A 152 10.378 8.794 -2.658 1.00 31.24 O ATOM 2396 CB THR A 152 12.223 7.227 -4.397 1.00 43.02 C ATOM 2397 OG1 THR A 152 12.796 6.762 -5.621 1.00 63.44 O ATOM 2398 CG2 THR A 152 12.613 6.301 -3.258 1.00 4.23 C ATOM 0 H THR A 152 10.963 9.153 -5.523 1.00 24.14 H new ATOM 0 HA THR A 152 10.282 6.384 -4.854 1.00 75.24 H new ATOM 0 HB THR A 152 12.610 8.221 -4.172 1.00 43.02 H new ATOM 0 HG1 THR A 152 13.769 6.695 -5.522 1.00 63.44 H new ATOM 0 HG21 THR A 152 13.699 6.244 -3.191 1.00 4.23 H new ATOM 0 HG22 THR A 152 12.211 6.687 -2.321 1.00 4.23 H new ATOM 0 HG23 THR A 152 12.208 5.306 -3.443 1.00 4.23 H new ATOM 2406 N PHE A 153 9.324 6.823 -2.606 1.00 31.13 N ATOM 2407 CA PHE A 153 8.682 7.079 -1.333 1.00 64.00 C ATOM 2408 C PHE A 153 9.445 6.436 -0.193 1.00 22.11 C ATOM 2409 O PHE A 153 10.206 5.491 -0.390 1.00 21.33 O ATOM 2410 CB PHE A 153 7.255 6.555 -1.343 1.00 43.05 C ATOM 2411 CG PHE A 153 6.239 7.608 -1.643 1.00 42.33 C ATOM 2412 CD1 PHE A 153 5.982 7.996 -2.946 1.00 61.33 C ATOM 2413 CD2 PHE A 153 5.535 8.205 -0.616 1.00 53.21 C ATOM 2414 CE1 PHE A 153 5.037 8.963 -3.215 1.00 70.11 C ATOM 2415 CE2 PHE A 153 4.593 9.172 -0.879 1.00 64.32 C ATOM 2416 CZ PHE A 153 4.342 9.550 -2.178 1.00 62.22 C ATOM 0 H PHE A 153 9.120 5.907 -3.005 1.00 31.13 H new ATOM 0 HA PHE A 153 8.673 8.158 -1.181 1.00 64.00 H new ATOM 0 HB2 PHE A 153 7.173 5.760 -2.084 1.00 43.05 H new ATOM 0 HB3 PHE A 153 7.032 6.111 -0.373 1.00 43.05 H new ATOM 0 HD1 PHE A 153 6.526 7.538 -3.759 1.00 61.33 H new ATOM 0 HD2 PHE A 153 5.726 7.909 0.405 1.00 53.21 H new ATOM 0 HE1 PHE A 153 4.841 9.260 -4.235 1.00 70.11 H new ATOM 0 HE2 PHE A 153 4.051 9.634 -0.067 1.00 64.32 H new ATOM 0 HZ PHE A 153 3.600 10.307 -2.386 1.00 62.22 H new ATOM 2426 N ASP A 154 9.229 6.966 0.995 1.00 22.22 N ATOM 2427 CA ASP A 154 9.835 6.444 2.211 1.00 34.13 C ATOM 2428 C ASP A 154 9.092 5.201 2.687 1.00 21.12 C ATOM 2429 O ASP A 154 9.677 4.302 3.296 1.00 52.22 O ATOM 2430 CB ASP A 154 9.814 7.537 3.284 1.00 4.04 C ATOM 2431 CG ASP A 154 10.192 7.045 4.659 1.00 43.22 C ATOM 2432 OD1 ASP A 154 11.396 7.019 4.977 1.00 12.11 O ATOM 2433 OD2 ASP A 154 9.283 6.708 5.436 1.00 11.45 O ATOM 0 H ASP A 154 8.626 7.774 1.148 1.00 22.22 H new ATOM 0 HA ASP A 154 10.867 6.155 2.012 1.00 34.13 H new ATOM 0 HB2 ASP A 154 10.498 8.333 2.992 1.00 4.04 H new ATOM 0 HB3 ASP A 154 8.816 7.974 3.326 1.00 4.04 H new ATOM 2438 N ASP A 155 7.806 5.140 2.381 1.00 50.33 N ATOM 2439 CA ASP A 155 6.985 4.016 2.796 1.00 40.53 C ATOM 2440 C ASP A 155 6.224 3.437 1.615 1.00 35.25 C ATOM 2441 O ASP A 155 5.917 4.146 0.656 1.00 72.01 O ATOM 2442 CB ASP A 155 6.004 4.440 3.887 1.00 5.31 C ATOM 2443 CG ASP A 155 5.793 3.350 4.915 1.00 1.14 C ATOM 2444 OD1 ASP A 155 5.346 2.244 4.540 1.00 20.23 O ATOM 2445 OD2 ASP A 155 6.086 3.593 6.103 1.00 1.34 O ATOM 0 H ASP A 155 7.310 5.854 1.848 1.00 50.33 H new ATOM 0 HA ASP A 155 7.647 3.248 3.195 1.00 40.53 H new ATOM 0 HB2 ASP A 155 6.377 5.337 4.381 1.00 5.31 H new ATOM 0 HB3 ASP A 155 5.048 4.700 3.433 1.00 5.31 H new ATOM 2450 N HIS A 156 5.918 2.148 1.695 1.00 43.34 N ATOM 2451 CA HIS A 156 5.183 1.465 0.635 1.00 54.30 C ATOM 2452 C HIS A 156 3.700 1.808 0.728 1.00 1.02 C ATOM 2453 O HIS A 156 2.985 1.820 -0.275 1.00 44.02 O ATOM 2454 CB HIS A 156 5.390 -0.066 0.709 1.00 24.45 C ATOM 2455 CG HIS A 156 4.961 -0.709 2.007 1.00 3.13 C ATOM 2456 ND1 HIS A 156 3.646 -0.788 2.382 1.00 64.03 N ATOM 2457 CD2 HIS A 156 5.718 -1.280 2.966 1.00 0.30 C ATOM 2458 CE1 HIS A 156 3.638 -1.393 3.552 1.00 45.34 C ATOM 2459 NE2 HIS A 156 4.872 -1.718 3.946 1.00 71.35 N ATOM 0 H HIS A 156 6.168 1.552 2.485 1.00 43.34 H new ATOM 0 HA HIS A 156 5.568 1.807 -0.326 1.00 54.30 H new ATOM 0 HB2 HIS A 156 4.839 -0.531 -0.108 1.00 24.45 H new ATOM 0 HB3 HIS A 156 6.446 -0.283 0.546 1.00 24.45 H new ATOM 0 HD2 HIS A 156 6.794 -1.374 2.961 1.00 0.30 H new ATOM 0 HE1 HIS A 156 2.744 -1.600 4.122 1.00 45.34 H new ATOM 0 HE2 HIS A 156 5.132 -2.198 4.808 1.00 71.35 H new ATOM 2467 N ASP A 157 3.274 2.102 1.955 1.00 61.11 N ATOM 2468 CA ASP A 157 1.881 2.411 2.266 1.00 13.23 C ATOM 2469 C ASP A 157 1.368 3.603 1.463 1.00 11.30 C ATOM 2470 O ASP A 157 0.303 3.538 0.846 1.00 75.40 O ATOM 2471 CB ASP A 157 1.746 2.687 3.763 1.00 71.34 C ATOM 2472 CG ASP A 157 0.409 3.291 4.117 1.00 3.43 C ATOM 2473 OD1 ASP A 157 -0.623 2.681 3.785 1.00 23.53 O ATOM 2474 OD2 ASP A 157 0.385 4.385 4.717 1.00 42.14 O ATOM 0 H ASP A 157 3.891 2.133 2.767 1.00 61.11 H new ATOM 0 HA ASP A 157 1.273 1.549 1.990 1.00 13.23 H new ATOM 0 HB2 ASP A 157 1.879 1.757 4.315 1.00 71.34 H new ATOM 0 HB3 ASP A 157 2.542 3.362 4.079 1.00 71.34 H new ATOM 2479 N SER A 158 2.145 4.679 1.450 1.00 65.31 N ATOM 2480 CA SER A 158 1.750 5.895 0.760 1.00 12.00 C ATOM 2481 C SER A 158 1.723 5.686 -0.752 1.00 2.12 C ATOM 2482 O SER A 158 0.905 6.280 -1.454 1.00 5.23 O ATOM 2483 CB SER A 158 2.710 7.017 1.125 1.00 2.52 C ATOM 2484 OG SER A 158 2.798 7.156 2.532 1.00 14.12 O ATOM 0 H SER A 158 3.053 4.732 1.911 1.00 65.31 H new ATOM 0 HA SER A 158 0.741 6.164 1.074 1.00 12.00 H new ATOM 0 HB2 SER A 158 3.697 6.808 0.712 1.00 2.52 H new ATOM 0 HB3 SER A 158 2.370 7.953 0.682 1.00 2.52 H new ATOM 0 HG SER A 158 3.735 7.282 2.790 1.00 14.12 H new ATOM 2490 N VAL A 159 2.587 4.796 -1.228 1.00 13.02 N ATOM 2491 CA VAL A 159 2.665 4.474 -2.644 1.00 3.32 C ATOM 2492 C VAL A 159 1.399 3.753 -3.078 1.00 63.15 C ATOM 2493 O VAL A 159 0.839 4.029 -4.142 1.00 42.02 O ATOM 2494 CB VAL A 159 3.928 3.616 -2.937 1.00 71.02 C ATOM 2495 CG1 VAL A 159 3.684 2.524 -3.980 1.00 24.05 C ATOM 2496 CG2 VAL A 159 5.058 4.520 -3.381 1.00 60.35 C ATOM 0 H VAL A 159 3.248 4.282 -0.646 1.00 13.02 H new ATOM 0 HA VAL A 159 2.750 5.397 -3.217 1.00 3.32 H new ATOM 0 HB VAL A 159 4.193 3.104 -2.012 1.00 71.02 H new ATOM 0 HG11 VAL A 159 4.604 1.961 -4.139 1.00 24.05 H new ATOM 0 HG12 VAL A 159 2.903 1.851 -3.626 1.00 24.05 H new ATOM 0 HG13 VAL A 159 3.371 2.981 -4.919 1.00 24.05 H new ATOM 0 HG21 VAL A 159 5.944 3.920 -3.587 1.00 60.35 H new ATOM 0 HG22 VAL A 159 4.763 5.054 -4.284 1.00 60.35 H new ATOM 0 HG23 VAL A 159 5.281 5.238 -2.592 1.00 60.35 H new ATOM 2506 N ASP A 160 0.944 2.854 -2.221 1.00 55.50 N ATOM 2507 CA ASP A 160 -0.247 2.085 -2.506 1.00 33.44 C ATOM 2508 C ASP A 160 -1.491 2.965 -2.500 1.00 3.42 C ATOM 2509 O ASP A 160 -2.368 2.791 -3.344 1.00 22.33 O ATOM 2510 CB ASP A 160 -0.424 0.930 -1.545 1.00 53.21 C ATOM 2511 CG ASP A 160 -1.321 -0.118 -2.155 1.00 43.23 C ATOM 2512 OD1 ASP A 160 -0.936 -0.668 -3.208 1.00 21.00 O ATOM 2513 OD2 ASP A 160 -2.404 -0.377 -1.608 1.00 42.53 O ATOM 0 H ASP A 160 1.383 2.642 -1.325 1.00 55.50 H new ATOM 0 HA ASP A 160 -0.116 1.671 -3.506 1.00 33.44 H new ATOM 0 HB2 ASP A 160 0.546 0.495 -1.305 1.00 53.21 H new ATOM 0 HB3 ASP A 160 -0.854 1.288 -0.609 1.00 53.21 H new ATOM 2518 N LYS A 161 -1.544 3.935 -1.575 1.00 64.31 N ATOM 2519 CA LYS A 161 -2.643 4.915 -1.535 1.00 70.21 C ATOM 2520 C LYS A 161 -2.817 5.585 -2.893 1.00 2.04 C ATOM 2521 O LYS A 161 -3.933 5.863 -3.336 1.00 32.31 O ATOM 2522 CB LYS A 161 -2.374 6.015 -0.503 1.00 5.41 C ATOM 2523 CG LYS A 161 -2.213 5.531 0.925 1.00 12.41 C ATOM 2524 CD LYS A 161 -2.002 6.703 1.872 1.00 54.53 C ATOM 2525 CE LYS A 161 -1.546 6.237 3.240 1.00 64.50 C ATOM 2526 NZ LYS A 161 -1.525 7.338 4.237 1.00 11.53 N ATOM 0 H LYS A 161 -0.842 4.063 -0.846 1.00 64.31 H new ATOM 0 HA LYS A 161 -3.544 4.366 -1.262 1.00 70.21 H new ATOM 0 HB2 LYS A 161 -1.470 6.551 -0.793 1.00 5.41 H new ATOM 0 HB3 LYS A 161 -3.194 6.732 -0.537 1.00 5.41 H new ATOM 0 HG2 LYS A 161 -3.098 4.970 1.225 1.00 12.41 H new ATOM 0 HG3 LYS A 161 -1.365 4.849 0.989 1.00 12.41 H new ATOM 0 HD2 LYS A 161 -1.260 7.382 1.452 1.00 54.53 H new ATOM 0 HD3 LYS A 161 -2.931 7.265 1.969 1.00 54.53 H new ATOM 0 HE2 LYS A 161 -2.209 5.446 3.591 1.00 64.50 H new ATOM 0 HE3 LYS A 161 -0.549 5.805 3.159 1.00 64.50 H new ATOM 0 HZ1 LYS A 161 -1.696 6.950 5.187 1.00 11.53 H new ATOM 0 HZ2 LYS A 161 -0.597 7.807 4.217 1.00 11.53 H new ATOM 0 HZ3 LYS A 161 -2.267 8.029 4.007 1.00 11.53 H new ATOM 2540 N ILE A 162 -1.690 5.828 -3.542 1.00 64.54 N ATOM 2541 CA ILE A 162 -1.657 6.515 -4.815 1.00 1.04 C ATOM 2542 C ILE A 162 -2.050 5.604 -5.985 1.00 41.13 C ATOM 2543 O ILE A 162 -2.860 5.992 -6.816 1.00 71.01 O ATOM 2544 CB ILE A 162 -0.261 7.116 -5.047 1.00 51.52 C ATOM 2545 CG1 ILE A 162 -0.043 8.291 -4.106 1.00 34.32 C ATOM 2546 CG2 ILE A 162 -0.092 7.562 -6.481 1.00 54.33 C ATOM 2547 CD1 ILE A 162 1.389 8.442 -3.659 1.00 52.40 C ATOM 0 H ILE A 162 -0.771 5.552 -3.196 1.00 64.54 H new ATOM 0 HA ILE A 162 -2.398 7.313 -4.775 1.00 1.04 H new ATOM 0 HB ILE A 162 0.482 6.345 -4.843 1.00 51.52 H new ATOM 0 HG12 ILE A 162 -0.360 9.208 -4.603 1.00 34.32 H new ATOM 0 HG13 ILE A 162 -0.679 8.168 -3.229 1.00 34.32 H new ATOM 0 HG21 ILE A 162 0.904 7.983 -6.616 1.00 54.33 H new ATOM 0 HG22 ILE A 162 -0.218 6.707 -7.145 1.00 54.33 H new ATOM 0 HG23 ILE A 162 -0.840 8.318 -6.717 1.00 54.33 H new ATOM 0 HD11 ILE A 162 1.473 9.299 -2.990 1.00 52.40 H new ATOM 0 HD12 ILE A 162 1.703 7.540 -3.134 1.00 52.40 H new ATOM 0 HD13 ILE A 162 2.027 8.597 -4.529 1.00 52.40 H new ATOM 2559 N VAL A 163 -1.537 4.377 -6.018 1.00 45.44 N ATOM 2560 CA VAL A 163 -1.760 3.495 -7.174 1.00 32.05 C ATOM 2561 C VAL A 163 -3.186 2.959 -7.176 1.00 63.52 C ATOM 2562 O VAL A 163 -3.666 2.422 -8.178 1.00 43.34 O ATOM 2563 CB VAL A 163 -0.773 2.312 -7.208 1.00 75.32 C ATOM 2564 CG1 VAL A 163 0.651 2.814 -7.155 1.00 52.44 C ATOM 2565 CG2 VAL A 163 -1.048 1.340 -6.073 1.00 33.02 C ATOM 0 H VAL A 163 -0.972 3.970 -5.273 1.00 45.44 H new ATOM 0 HA VAL A 163 -1.592 4.102 -8.064 1.00 32.05 H new ATOM 0 HB VAL A 163 -0.914 1.775 -8.146 1.00 75.32 H new ATOM 0 HG11 VAL A 163 1.337 1.967 -7.180 1.00 52.44 H new ATOM 0 HG12 VAL A 163 0.841 3.460 -8.012 1.00 52.44 H new ATOM 0 HG13 VAL A 163 0.804 3.378 -6.235 1.00 52.44 H new ATOM 0 HG21 VAL A 163 -0.337 0.515 -6.120 1.00 33.02 H new ATOM 0 HG22 VAL A 163 -0.942 1.856 -5.119 1.00 33.02 H new ATOM 0 HG23 VAL A 163 -2.062 0.951 -6.165 1.00 33.02 H new ATOM 2575 N ILE A 164 -3.842 3.105 -6.027 1.00 63.33 N ATOM 2576 CA ILE A 164 -5.255 2.811 -5.877 1.00 44.43 C ATOM 2577 C ILE A 164 -6.076 3.648 -6.863 1.00 15.33 C ATOM 2578 O ILE A 164 -7.100 3.200 -7.385 1.00 34.54 O ATOM 2579 CB ILE A 164 -5.691 3.071 -4.412 1.00 54.34 C ATOM 2580 CG1 ILE A 164 -5.319 1.861 -3.542 1.00 14.21 C ATOM 2581 CG2 ILE A 164 -7.179 3.387 -4.312 1.00 11.11 C ATOM 2582 CD1 ILE A 164 -5.468 2.095 -2.057 1.00 30.11 C ATOM 0 H ILE A 164 -3.399 3.434 -5.169 1.00 63.33 H new ATOM 0 HA ILE A 164 -5.435 1.760 -6.104 1.00 44.43 H new ATOM 0 HB ILE A 164 -5.160 3.949 -4.045 1.00 54.34 H new ATOM 0 HG12 ILE A 164 -5.944 1.016 -3.829 1.00 14.21 H new ATOM 0 HG13 ILE A 164 -4.287 1.580 -3.752 1.00 14.21 H new ATOM 0 HG21 ILE A 164 -7.444 3.563 -3.270 1.00 11.11 H new ATOM 0 HG22 ILE A 164 -7.402 4.278 -4.898 1.00 11.11 H new ATOM 0 HG23 ILE A 164 -7.756 2.546 -4.696 1.00 11.11 H new ATOM 0 HD11 ILE A 164 -5.185 1.192 -1.516 1.00 30.11 H new ATOM 0 HD12 ILE A 164 -4.822 2.918 -1.752 1.00 30.11 H new ATOM 0 HD13 ILE A 164 -6.505 2.344 -1.830 1.00 30.11 H new ATOM 2594 N GLN A 165 -5.584 4.846 -7.151 1.00 50.23 N ATOM 2595 CA GLN A 165 -6.202 5.715 -8.130 1.00 1.12 C ATOM 2596 C GLN A 165 -5.268 5.821 -9.329 1.00 32.31 C ATOM 2597 O GLN A 165 -4.265 6.525 -9.282 1.00 43.05 O ATOM 2598 CB GLN A 165 -6.484 7.098 -7.537 1.00 40.23 C ATOM 2599 CG GLN A 165 -7.191 7.054 -6.187 1.00 34.01 C ATOM 2600 CD GLN A 165 -7.548 8.431 -5.664 1.00 75.33 C ATOM 2601 OE1 GLN A 165 -7.828 9.350 -6.433 1.00 32.42 O ATOM 2602 NE2 GLN A 165 -7.533 8.588 -4.348 1.00 60.42 N ATOM 0 H GLN A 165 -4.750 5.236 -6.712 1.00 50.23 H new ATOM 0 HA GLN A 165 -7.160 5.298 -8.440 1.00 1.12 H new ATOM 0 HB2 GLN A 165 -5.542 7.635 -7.426 1.00 40.23 H new ATOM 0 HB3 GLN A 165 -7.095 7.667 -8.238 1.00 40.23 H new ATOM 0 HG2 GLN A 165 -8.099 6.458 -6.277 1.00 34.01 H new ATOM 0 HG3 GLN A 165 -6.550 6.551 -5.463 1.00 34.01 H new ATOM 0 HE21 GLN A 165 -7.296 7.802 -3.743 1.00 60.42 H new ATOM 0 HE22 GLN A 165 -7.759 9.495 -3.940 1.00 60.42 H new ATOM 2611 N LYS A 166 -5.594 5.080 -10.380 1.00 11.14 N ATOM 2612 CA LYS A 166 -4.712 4.919 -11.536 1.00 64.23 C ATOM 2613 C LYS A 166 -4.324 6.249 -12.190 1.00 62.12 C ATOM 2614 O LYS A 166 -3.225 6.387 -12.713 1.00 51.43 O ATOM 2615 CB LYS A 166 -5.370 4.009 -12.566 1.00 54.44 C ATOM 2616 CG LYS A 166 -4.446 3.628 -13.707 1.00 34.43 C ATOM 2617 CD LYS A 166 -5.056 2.548 -14.570 1.00 2.40 C ATOM 2618 CE LYS A 166 -5.041 1.204 -13.859 1.00 15.44 C ATOM 2619 NZ LYS A 166 -3.666 0.789 -13.471 1.00 54.10 N ATOM 0 H LYS A 166 -6.476 4.573 -10.458 1.00 11.14 H new ATOM 0 HA LYS A 166 -3.790 4.470 -11.167 1.00 64.23 H new ATOM 0 HB2 LYS A 166 -5.717 3.102 -12.071 1.00 54.44 H new ATOM 0 HB3 LYS A 166 -6.250 4.508 -12.972 1.00 54.44 H new ATOM 0 HG2 LYS A 166 -4.235 4.507 -14.316 1.00 34.43 H new ATOM 0 HG3 LYS A 166 -3.493 3.282 -13.306 1.00 34.43 H new ATOM 0 HD2 LYS A 166 -6.081 2.817 -14.824 1.00 2.40 H new ATOM 0 HD3 LYS A 166 -4.505 2.473 -15.507 1.00 2.40 H new ATOM 0 HE2 LYS A 166 -5.667 1.259 -12.968 1.00 15.44 H new ATOM 0 HE3 LYS A 166 -5.478 0.446 -14.509 1.00 15.44 H new ATOM 0 HZ1 LYS A 166 -3.634 -0.244 -13.358 1.00 54.10 H new ATOM 0 HZ2 LYS A 166 -2.995 1.077 -14.211 1.00 54.10 H new ATOM 0 HZ3 LYS A 166 -3.407 1.244 -12.572 1.00 54.10 H new ATOM 2633 N TYR A 167 -5.223 7.212 -12.180 1.00 41.45 N ATOM 2634 CA TYR A 167 -4.917 8.517 -12.750 1.00 62.44 C ATOM 2635 C TYR A 167 -5.086 9.616 -11.715 1.00 5.03 C ATOM 2636 O TYR A 167 -6.072 9.647 -10.976 1.00 54.30 O ATOM 2637 CB TYR A 167 -5.798 8.809 -13.967 1.00 64.05 C ATOM 2638 CG TYR A 167 -5.467 7.958 -15.173 1.00 41.15 C ATOM 2639 CD1 TYR A 167 -5.983 6.675 -15.307 1.00 22.13 C ATOM 2640 CD2 TYR A 167 -4.626 8.433 -16.171 1.00 11.23 C ATOM 2641 CE1 TYR A 167 -5.668 5.891 -16.397 1.00 3.14 C ATOM 2642 CE2 TYR A 167 -4.312 7.654 -17.269 1.00 21.34 C ATOM 2643 CZ TYR A 167 -4.835 6.384 -17.375 1.00 65.32 C ATOM 2644 OH TYR A 167 -4.512 5.596 -18.457 1.00 31.35 O ATOM 0 H TYR A 167 -6.161 7.123 -11.790 1.00 41.45 H new ATOM 0 HA TYR A 167 -3.876 8.496 -13.072 1.00 62.44 H new ATOM 0 HB2 TYR A 167 -6.842 8.650 -13.696 1.00 64.05 H new ATOM 0 HB3 TYR A 167 -5.695 9.860 -14.236 1.00 64.05 H new ATOM 0 HD1 TYR A 167 -6.642 6.285 -14.545 1.00 22.13 H new ATOM 0 HD2 TYR A 167 -4.211 9.427 -16.088 1.00 11.23 H new ATOM 0 HE1 TYR A 167 -6.074 4.894 -16.483 1.00 3.14 H new ATOM 0 HE2 TYR A 167 -3.660 8.039 -18.039 1.00 21.34 H new ATOM 0 HH TYR A 167 -3.673 5.122 -18.278 1.00 31.35 H new ATOM 2654 N HIS A 168 -4.120 10.520 -11.673 1.00 30.53 N ATOM 2655 CA HIS A 168 -4.151 11.642 -10.747 1.00 44.31 C ATOM 2656 C HIS A 168 -3.953 12.948 -11.499 1.00 74.21 C ATOM 2657 O HIS A 168 -3.394 12.960 -12.595 1.00 53.15 O ATOM 2658 CB HIS A 168 -3.062 11.512 -9.678 1.00 62.42 C ATOM 2659 CG HIS A 168 -3.289 10.417 -8.679 1.00 1.51 C ATOM 2660 ND1 HIS A 168 -4.153 10.568 -7.620 1.00 63.10 N ATOM 2661 CD2 HIS A 168 -2.712 9.202 -8.604 1.00 2.24 C ATOM 2662 CE1 HIS A 168 -4.072 9.444 -6.930 1.00 40.31 C ATOM 2663 NE2 HIS A 168 -3.212 8.592 -7.491 1.00 21.21 N ATOM 0 H HIS A 168 -3.297 10.498 -12.275 1.00 30.53 H new ATOM 0 HA HIS A 168 -5.125 11.638 -10.258 1.00 44.31 H new ATOM 0 HB2 HIS A 168 -2.106 11.341 -10.172 1.00 62.42 H new ATOM 0 HB3 HIS A 168 -2.980 12.459 -9.145 1.00 62.42 H new ATOM 0 HD2 HIS A 168 -1.991 8.789 -9.294 1.00 2.24 H new ATOM 0 HE1 HIS A 168 -4.630 9.241 -6.028 1.00 40.31 H new ATOM 0 HE2 HIS A 168 -2.973 7.660 -7.152 1.00 21.21 H new ATOM 2671 N THR A 169 -4.411 14.044 -10.916 1.00 12.34 N ATOM 2672 CA THR A 169 -4.230 15.353 -11.516 1.00 65.45 C ATOM 2673 C THR A 169 -3.510 16.296 -10.555 1.00 74.13 C ATOM 2674 O THR A 169 -4.022 16.624 -9.481 1.00 51.43 O ATOM 2675 CB THR A 169 -5.577 15.967 -11.936 1.00 11.35 C ATOM 2676 OG1 THR A 169 -6.353 14.989 -12.643 1.00 63.50 O ATOM 2677 CG2 THR A 169 -5.372 17.186 -12.824 1.00 54.03 C ATOM 0 H THR A 169 -4.911 14.052 -10.027 1.00 12.34 H new ATOM 0 HA THR A 169 -3.618 15.220 -12.408 1.00 65.45 H new ATOM 0 HB THR A 169 -6.103 16.281 -11.035 1.00 11.35 H new ATOM 0 HG1 THR A 169 -7.211 15.381 -12.908 1.00 63.50 H new ATOM 0 HG21 THR A 169 -6.341 17.599 -13.105 1.00 54.03 H new ATOM 0 HG22 THR A 169 -4.800 17.939 -12.282 1.00 54.03 H new ATOM 0 HG23 THR A 169 -4.828 16.894 -13.722 1.00 54.03 H new ATOM 2685 N VAL A 170 -2.314 16.707 -10.949 1.00 20.21 N ATOM 2686 CA VAL A 170 -1.515 17.640 -10.170 1.00 42.14 C ATOM 2687 C VAL A 170 -1.099 18.824 -11.040 1.00 23.12 C ATOM 2688 O VAL A 170 -0.416 18.642 -12.044 1.00 13.55 O ATOM 2689 CB VAL A 170 -0.260 16.946 -9.560 1.00 2.35 C ATOM 2690 CG1 VAL A 170 0.397 16.001 -10.563 1.00 31.23 C ATOM 2691 CG2 VAL A 170 0.746 17.975 -9.058 1.00 24.11 C ATOM 0 H VAL A 170 -1.871 16.404 -11.816 1.00 20.21 H new ATOM 0 HA VAL A 170 -2.127 18.001 -9.343 1.00 42.14 H new ATOM 0 HB VAL A 170 -0.597 16.353 -8.710 1.00 2.35 H new ATOM 0 HG11 VAL A 170 1.269 15.534 -10.105 1.00 31.23 H new ATOM 0 HG12 VAL A 170 -0.315 15.230 -10.857 1.00 31.23 H new ATOM 0 HG13 VAL A 170 0.707 16.563 -11.444 1.00 31.23 H new ATOM 0 HG21 VAL A 170 1.611 17.463 -8.638 1.00 24.11 H new ATOM 0 HG22 VAL A 170 1.065 18.606 -9.887 1.00 24.11 H new ATOM 0 HG23 VAL A 170 0.282 18.593 -8.290 1.00 24.11 H new ATOM 2701 N ASN A 171 -1.584 20.021 -10.688 1.00 71.02 N ATOM 2702 CA ASN A 171 -1.213 21.271 -11.376 1.00 61.13 C ATOM 2703 C ASN A 171 -1.854 21.306 -12.768 1.00 34.40 C ATOM 2704 O ASN A 171 -1.403 22.004 -13.674 1.00 42.44 O ATOM 2705 CB ASN A 171 0.323 21.419 -11.455 1.00 75.15 C ATOM 2706 CG ASN A 171 0.788 22.834 -11.775 1.00 14.45 C ATOM 2707 OD1 ASN A 171 1.041 23.181 -12.930 1.00 33.14 O ATOM 2708 ND2 ASN A 171 0.911 23.660 -10.751 1.00 53.33 N ATOM 0 H ASN A 171 -2.243 20.154 -9.921 1.00 71.02 H new ATOM 0 HA ASN A 171 -1.590 22.119 -10.804 1.00 61.13 H new ATOM 0 HB2 ASN A 171 0.758 21.110 -10.505 1.00 75.15 H new ATOM 0 HB3 ASN A 171 0.706 20.740 -12.217 1.00 75.15 H new ATOM 0 HD21 ASN A 171 1.224 24.619 -10.904 1.00 53.33 H new ATOM 0 HD22 ASN A 171 0.693 23.339 -9.808 1.00 53.33 H new ATOM 2715 N GLY A 172 -2.943 20.558 -12.917 1.00 51.34 N ATOM 2716 CA GLY A 172 -3.609 20.456 -14.198 1.00 62.44 C ATOM 2717 C GLY A 172 -3.163 19.240 -14.981 1.00 23.13 C ATOM 2718 O GLY A 172 -3.806 18.854 -15.958 1.00 23.53 O ATOM 0 H GLY A 172 -3.376 20.019 -12.167 1.00 51.34 H new ATOM 0 HA2 GLY A 172 -4.687 20.410 -14.042 1.00 62.44 H new ATOM 0 HA3 GLY A 172 -3.409 21.355 -14.782 1.00 62.44 H new ATOM 2722 N HIS A 173 -2.076 18.622 -14.537 1.00 44.32 N ATOM 2723 CA HIS A 173 -1.494 17.481 -15.232 1.00 13.41 C ATOM 2724 C HIS A 173 -2.236 16.209 -14.862 1.00 42.54 C ATOM 2725 O HIS A 173 -2.137 15.741 -13.729 1.00 72.32 O ATOM 2726 CB HIS A 173 -0.012 17.296 -14.862 1.00 74.11 C ATOM 2727 CG HIS A 173 0.890 18.452 -15.187 1.00 73.24 C ATOM 2728 ND1 HIS A 173 0.562 19.745 -14.860 1.00 31.32 N ATOM 2729 CD2 HIS A 173 2.114 18.444 -15.765 1.00 33.02 C ATOM 2730 CE1 HIS A 173 1.583 20.486 -15.236 1.00 42.23 C ATOM 2731 NE2 HIS A 173 2.550 19.743 -15.790 1.00 11.55 N ATOM 0 H HIS A 173 -1.576 18.895 -13.691 1.00 44.32 H new ATOM 0 HA HIS A 173 -1.578 17.676 -16.301 1.00 13.41 H new ATOM 0 HB2 HIS A 173 0.054 17.097 -13.792 1.00 74.11 H new ATOM 0 HB3 HIS A 173 0.364 16.411 -15.375 1.00 74.11 H new ATOM 0 HD2 HIS A 173 2.645 17.580 -16.135 1.00 33.02 H new ATOM 0 HE1 HIS A 173 1.634 21.558 -15.113 1.00 42.23 H new ATOM 0 HE2 HIS A 173 3.439 20.079 -16.159 1.00 11.55 H new ATOM 2739 N ASN A 174 -2.983 15.653 -15.803 1.00 23.12 N ATOM 2740 CA ASN A 174 -3.595 14.357 -15.579 1.00 44.14 C ATOM 2741 C ASN A 174 -2.661 13.270 -16.088 1.00 54.03 C ATOM 2742 O ASN A 174 -2.443 13.110 -17.289 1.00 42.23 O ATOM 2743 CB ASN A 174 -4.992 14.267 -16.226 1.00 4.05 C ATOM 2744 CG ASN A 174 -5.032 14.677 -17.689 1.00 62.31 C ATOM 2745 OD1 ASN A 174 -5.123 15.863 -18.011 1.00 25.24 O ATOM 2746 ND2 ASN A 174 -4.990 13.704 -18.583 1.00 3.21 N ATOM 0 H ASN A 174 -3.177 16.071 -16.713 1.00 23.12 H new ATOM 0 HA ASN A 174 -3.748 14.215 -14.509 1.00 44.14 H new ATOM 0 HB2 ASN A 174 -5.355 13.243 -16.138 1.00 4.05 H new ATOM 0 HB3 ASN A 174 -5.681 14.899 -15.665 1.00 4.05 H new ATOM 0 HD21 ASN A 174 -5.033 13.924 -19.578 1.00 3.21 H new ATOM 0 HD22 ASN A 174 -4.914 12.734 -18.278 1.00 3.21 H new ATOM 2753 N CYS A 175 -2.066 12.561 -15.151 1.00 70.02 N ATOM 2754 CA CYS A 175 -1.094 11.540 -15.474 1.00 35.40 C ATOM 2755 C CYS A 175 -1.484 10.195 -14.885 1.00 4.31 C ATOM 2756 O CYS A 175 -2.231 10.126 -13.907 1.00 52.22 O ATOM 2757 CB CYS A 175 0.272 11.967 -14.939 1.00 51.25 C ATOM 2758 SG CYS A 175 0.231 12.553 -13.228 1.00 72.31 S ATOM 0 H CYS A 175 -2.241 12.675 -14.153 1.00 70.02 H new ATOM 0 HA CYS A 175 -1.055 11.427 -16.557 1.00 35.40 H new ATOM 0 HB2 CYS A 175 0.960 11.124 -15.009 1.00 51.25 H new ATOM 0 HB3 CYS A 175 0.671 12.757 -15.575 1.00 51.25 H new ATOM 0 HG CYS A 175 0.421 11.551 -12.422 1.00 72.31 H new ATOM 2764 N GLU A 176 -0.966 9.136 -15.486 1.00 14.11 N ATOM 2765 CA GLU A 176 -1.171 7.796 -14.989 1.00 63.12 C ATOM 2766 C GLU A 176 -0.121 7.489 -13.937 1.00 54.54 C ATOM 2767 O GLU A 176 1.072 7.720 -14.146 1.00 1.11 O ATOM 2768 CB GLU A 176 -1.081 6.774 -16.126 1.00 42.20 C ATOM 2769 CG GLU A 176 -1.634 5.410 -15.753 1.00 21.20 C ATOM 2770 CD GLU A 176 -1.337 4.346 -16.792 1.00 10.51 C ATOM 2771 OE1 GLU A 176 -2.034 4.307 -17.828 1.00 30.43 O ATOM 2772 OE2 GLU A 176 -0.410 3.538 -16.578 1.00 34.10 O ATOM 0 H GLU A 176 -0.394 9.186 -16.329 1.00 14.11 H new ATOM 0 HA GLU A 176 -2.167 7.731 -14.550 1.00 63.12 H new ATOM 0 HB2 GLU A 176 -1.624 7.154 -16.991 1.00 42.20 H new ATOM 0 HB3 GLU A 176 -0.039 6.666 -16.426 1.00 42.20 H new ATOM 0 HG2 GLU A 176 -1.213 5.103 -14.796 1.00 21.20 H new ATOM 0 HG3 GLU A 176 -2.713 5.486 -15.617 1.00 21.20 H new ATOM 2779 N VAL A 177 -0.582 6.993 -12.810 1.00 61.54 N ATOM 2780 CA VAL A 177 0.290 6.668 -11.704 1.00 25.01 C ATOM 2781 C VAL A 177 0.055 5.231 -11.272 1.00 23.32 C ATOM 2782 O VAL A 177 -1.084 4.801 -11.082 1.00 2.20 O ATOM 2783 CB VAL A 177 0.089 7.615 -10.505 1.00 3.42 C ATOM 2784 CG1 VAL A 177 1.207 7.432 -9.500 1.00 10.30 C ATOM 2785 CG2 VAL A 177 0.015 9.070 -10.949 1.00 44.42 C ATOM 0 H VAL A 177 -1.569 6.804 -12.635 1.00 61.54 H new ATOM 0 HA VAL A 177 1.317 6.791 -12.048 1.00 25.01 H new ATOM 0 HB VAL A 177 -0.861 7.360 -10.035 1.00 3.42 H new ATOM 0 HG11 VAL A 177 1.053 8.107 -8.658 1.00 10.30 H new ATOM 0 HG12 VAL A 177 1.211 6.402 -9.144 1.00 10.30 H new ATOM 0 HG13 VAL A 177 2.163 7.655 -9.974 1.00 10.30 H new ATOM 0 HG21 VAL A 177 -0.127 9.709 -10.078 1.00 44.42 H new ATOM 0 HG22 VAL A 177 0.942 9.344 -11.453 1.00 44.42 H new ATOM 0 HG23 VAL A 177 -0.823 9.199 -11.634 1.00 44.42 H new ATOM 2795 N ARG A 178 1.140 4.495 -11.128 1.00 51.24 N ATOM 2796 CA ARG A 178 1.056 3.060 -10.878 1.00 63.21 C ATOM 2797 C ARG A 178 2.321 2.551 -10.191 1.00 44.51 C ATOM 2798 O ARG A 178 3.280 3.300 -10.032 1.00 1.35 O ATOM 2799 CB ARG A 178 0.820 2.320 -12.206 1.00 72.05 C ATOM 2800 CG ARG A 178 2.074 2.127 -13.042 1.00 23.44 C ATOM 2801 CD ARG A 178 1.740 1.762 -14.479 1.00 21.25 C ATOM 2802 NE ARG A 178 2.946 1.514 -15.263 1.00 34.41 N ATOM 2803 CZ ARG A 178 3.099 1.861 -16.541 1.00 53.33 C ATOM 2804 NH1 ARG A 178 2.121 2.477 -17.200 1.00 72.25 N ATOM 2805 NH2 ARG A 178 4.245 1.604 -17.162 1.00 52.42 N ATOM 0 H ARG A 178 2.091 4.861 -11.179 1.00 51.24 H new ATOM 0 HA ARG A 178 0.218 2.866 -10.209 1.00 63.21 H new ATOM 0 HB2 ARG A 178 0.385 1.344 -11.993 1.00 72.05 H new ATOM 0 HB3 ARG A 178 0.087 2.874 -12.793 1.00 72.05 H new ATOM 0 HG2 ARG A 178 2.666 3.042 -13.027 1.00 23.44 H new ATOM 0 HG3 ARG A 178 2.689 1.343 -12.601 1.00 23.44 H new ATOM 0 HD2 ARG A 178 1.107 0.874 -14.492 1.00 21.25 H new ATOM 0 HD3 ARG A 178 1.167 2.569 -14.936 1.00 21.25 H new ATOM 0 HE ARG A 178 3.724 1.043 -14.802 1.00 34.41 H new ATOM 0 HH11 ARG A 178 1.242 2.689 -16.728 1.00 72.25 H new ATOM 0 HH12 ARG A 178 2.250 2.738 -18.178 1.00 72.25 H new ATOM 0 HH21 ARG A 178 5.004 1.143 -16.661 1.00 52.42 H new ATOM 0 HH22 ARG A 178 4.366 1.868 -18.140 1.00 52.42 H new ATOM 2819 N LYS A 179 2.307 1.283 -9.778 1.00 50.21 N ATOM 2820 CA LYS A 179 3.457 0.666 -9.112 1.00 64.11 C ATOM 2821 C LYS A 179 4.661 0.630 -10.041 1.00 31.12 C ATOM 2822 O LYS A 179 4.578 0.109 -11.152 1.00 14.20 O ATOM 2823 CB LYS A 179 3.119 -0.764 -8.680 1.00 12.45 C ATOM 2824 CG LYS A 179 1.938 -0.866 -7.730 1.00 51.00 C ATOM 2825 CD LYS A 179 2.303 -0.411 -6.326 1.00 12.53 C ATOM 2826 CE LYS A 179 1.937 -1.463 -5.294 1.00 64.50 C ATOM 2827 NZ LYS A 179 0.470 -1.727 -5.237 1.00 0.15 N ATOM 0 H LYS A 179 1.508 0.660 -9.893 1.00 50.21 H new ATOM 0 HA LYS A 179 3.697 1.267 -8.235 1.00 64.11 H new ATOM 0 HB2 LYS A 179 2.909 -1.360 -9.568 1.00 12.45 H new ATOM 0 HB3 LYS A 179 3.994 -1.203 -8.202 1.00 12.45 H new ATOM 0 HG2 LYS A 179 1.115 -0.259 -8.107 1.00 51.00 H new ATOM 0 HG3 LYS A 179 1.585 -1.897 -7.698 1.00 51.00 H new ATOM 0 HD2 LYS A 179 3.372 -0.204 -6.275 1.00 12.53 H new ATOM 0 HD3 LYS A 179 1.787 0.521 -6.097 1.00 12.53 H new ATOM 0 HE2 LYS A 179 2.460 -2.391 -5.525 1.00 64.50 H new ATOM 0 HE3 LYS A 179 2.282 -1.139 -4.312 1.00 64.50 H new ATOM 0 HZ1 LYS A 179 0.301 -2.659 -4.807 1.00 0.15 H new ATOM 0 HZ2 LYS A 179 0.007 -0.993 -4.664 1.00 0.15 H new ATOM 0 HZ3 LYS A 179 0.077 -1.714 -6.200 1.00 0.15 H new ATOM 2841 N ALA A 180 5.769 1.188 -9.593 1.00 63.33 N ATOM 2842 CA ALA A 180 6.991 1.153 -10.371 1.00 3.33 C ATOM 2843 C ALA A 180 7.998 0.235 -9.720 1.00 31.31 C ATOM 2844 O ALA A 180 8.509 0.524 -8.640 1.00 15.32 O ATOM 2845 CB ALA A 180 7.582 2.542 -10.511 1.00 3.53 C ATOM 0 H ALA A 180 5.848 1.669 -8.697 1.00 63.33 H new ATOM 0 HA ALA A 180 6.749 0.776 -11.365 1.00 3.33 H new ATOM 0 HB1 ALA A 180 8.498 2.490 -11.099 1.00 3.53 H new ATOM 0 HB2 ALA A 180 6.866 3.193 -11.012 1.00 3.53 H new ATOM 0 HB3 ALA A 180 7.807 2.943 -9.523 1.00 3.53 H new ATOM 2851 N LEU A 181 8.295 -0.862 -10.379 1.00 4.20 N ATOM 2852 CA LEU A 181 9.282 -1.784 -9.871 1.00 13.05 C ATOM 2853 C LEU A 181 10.602 -1.533 -10.557 1.00 45.44 C ATOM 2854 O LEU A 181 10.749 -1.770 -11.753 1.00 50.21 O ATOM 2855 CB LEU A 181 8.867 -3.235 -10.099 1.00 54.12 C ATOM 2856 CG LEU A 181 7.466 -3.626 -9.612 1.00 42.34 C ATOM 2857 CD1 LEU A 181 7.213 -5.098 -9.879 1.00 23.45 C ATOM 2858 CD2 LEU A 181 7.293 -3.326 -8.131 1.00 43.34 C ATOM 0 H LEU A 181 7.869 -1.136 -11.264 1.00 4.20 H new ATOM 0 HA LEU A 181 9.373 -1.621 -8.797 1.00 13.05 H new ATOM 0 HB2 LEU A 181 8.929 -3.445 -11.167 1.00 54.12 H new ATOM 0 HB3 LEU A 181 9.593 -3.880 -9.605 1.00 54.12 H new ATOM 0 HG LEU A 181 6.739 -3.031 -10.164 1.00 42.34 H new ATOM 0 HD11 LEU A 181 6.216 -5.365 -9.529 1.00 23.45 H new ATOM 0 HD12 LEU A 181 7.286 -5.292 -10.949 1.00 23.45 H new ATOM 0 HD13 LEU A 181 7.955 -5.696 -9.350 1.00 23.45 H new ATOM 0 HD21 LEU A 181 6.290 -3.614 -7.816 1.00 43.34 H new ATOM 0 HD22 LEU A 181 8.029 -3.889 -7.557 1.00 43.34 H new ATOM 0 HD23 LEU A 181 7.436 -2.260 -7.957 1.00 43.34 H new