USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1129 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 28 MET CE :methyl 178:sc= -0.0359 (180deg=-0.0112) USER MOD Set 1.2: A 110 MET CE :methyl -128:sc= -1.03 (180deg=-1.41) USER MOD Single : A 10 SER OG : rot -20:sc= 0.858 USER MOD Single : A 11 ASN : amide:sc= -0.526 K(o=-0.53,f=-1.6) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.022 X(o=-0.022,f=-0.097) USER MOD Single : A 19 THR OG1 : rot 64:sc= -3.21! USER MOD Single : A 23 LYS NZ :NH3+ 149:sc= 0.357 (180deg=-0.421) USER MOD Single : A 29 SER OG : rot -72:sc= 1.21 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 43 MET CE :methyl 143:sc= -0.581 (180deg=-4.04!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 90:sc= 1.23 USER MOD Single : A 57 THR OG1 : rot -37:sc= -0.611 USER MOD Single : A 61 SER OG : rot -37:sc= 0 USER MOD Single : A 68 SER OG : rot 59:sc= 0.571 USER MOD Single : A 69 THR OG1 : rot -49:sc= 0.147 USER MOD Single : A 70 HIS : no HD1:sc= -0.702 X(o=-0.7,f=-0.94) USER MOD Single : A 75 MET CE :methyl -179:sc= 0 (180deg=-0.000833) USER MOD Single : A 77 GLN : amide:sc= -0.451 X(o=-0.45,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.691 K(o=-0.69,f=-0.074) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 170:sc= -3.78! (180deg=-3.94!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.245 K(o=-0.24,f=-2!) USER MOD Single : A 96 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.14) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 175:sc= -0.995 (180deg=-1.09) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -2.3! C(o=-2.3!,f=-3.4!) USER MOD Single : A 104 GLN : amide:sc= -0.0154 X(o=-0.015,f=0) USER MOD Single : A 106 TYR OH : rot 70:sc= 1.35 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -2.73 X(o=-2.7,f=-2.6) USER MOD Single : A 112 THR OG1 : rot 180:sc=0.000793 USER MOD Single : A 115 HIS : no HD1:sc= -1.72 X(o=-1.7,f=-1.3) USER MOD Single : A 122 LYS NZ :NH3+ 173:sc= 0.687 (180deg=0.583) USER MOD Single : A 123 ASN : amide:sc= -0.73 K(o=-0.73,f=-2.4) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -174:sc= 0 (180deg=-0.0122) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.232 6.476 -9.383 1.00 63.33 N ATOM 98 CA SER A 10 4.956 7.707 -9.677 1.00 24.03 C ATOM 99 C SER A 10 5.563 7.660 -11.076 1.00 12.31 C ATOM 100 O SER A 10 5.607 8.669 -11.779 1.00 31.11 O ATOM 101 CB SER A 10 6.057 7.936 -8.639 1.00 31.11 C ATOM 102 OG SER A 10 6.280 6.769 -7.867 1.00 3.14 O ATOM 0 HA SER A 10 4.248 8.535 -9.635 1.00 24.03 H new ATOM 0 HB2 SER A 10 6.980 8.226 -9.141 1.00 31.11 H new ATOM 0 HB3 SER A 10 5.778 8.761 -7.984 1.00 31.11 H new ATOM 0 HG SER A 10 5.501 6.179 -7.934 1.00 3.14 H new ATOM 108 N ASN A 11 6.029 6.481 -11.473 1.00 23.22 N ATOM 109 CA ASN A 11 6.634 6.301 -12.788 1.00 1.24 C ATOM 110 C ASN A 11 5.655 6.682 -13.894 1.00 14.24 C ATOM 111 O ASN A 11 6.052 7.203 -14.936 1.00 55.11 O ATOM 112 CB ASN A 11 7.087 4.851 -12.970 1.00 5.33 C ATOM 113 CG ASN A 11 5.955 3.942 -13.406 1.00 61.11 C ATOM 114 OD1 ASN A 11 4.911 3.878 -12.758 1.00 33.45 O ATOM 115 ND2 ASN A 11 6.158 3.233 -14.511 1.00 31.05 N ATOM 0 H ASN A 11 5.999 5.636 -10.903 1.00 23.22 H new ATOM 0 HA ASN A 11 7.502 6.957 -12.854 1.00 1.24 H new ATOM 0 HB2 ASN A 11 7.886 4.813 -13.711 1.00 5.33 H new ATOM 0 HB3 ASN A 11 7.504 4.483 -12.033 1.00 5.33 H new ATOM 0 HD21 ASN A 11 5.432 2.604 -14.854 1.00 31.05 H new ATOM 0 HD22 ASN A 11 7.040 3.318 -15.017 1.00 31.05 H new ATOM 122 N ASP A 12 4.374 6.419 -13.658 1.00 51.33 N ATOM 123 CA ASP A 12 3.337 6.736 -14.633 1.00 73.13 C ATOM 124 C ASP A 12 2.855 8.174 -14.467 1.00 21.32 C ATOM 125 O ASP A 12 2.389 8.798 -15.420 1.00 44.50 O ATOM 126 CB ASP A 12 2.159 5.770 -14.489 1.00 3.52 C ATOM 127 CG ASP A 12 2.173 4.679 -15.541 1.00 23.34 C ATOM 128 OD1 ASP A 12 3.199 3.975 -15.651 1.00 51.22 O ATOM 129 OD2 ASP A 12 1.159 4.528 -16.254 1.00 10.41 O ATOM 0 H ASP A 12 4.029 5.987 -12.801 1.00 51.33 H new ATOM 0 HA ASP A 12 3.765 6.629 -15.630 1.00 73.13 H new ATOM 0 HB2 ASP A 12 2.184 5.316 -13.498 1.00 3.52 H new ATOM 0 HB3 ASP A 12 1.225 6.327 -14.560 1.00 3.52 H new ATOM 134 N LYS A 13 2.969 8.693 -13.249 1.00 42.21 N ATOM 135 CA LYS A 13 2.546 10.057 -12.956 1.00 40.40 C ATOM 136 C LYS A 13 3.299 11.059 -13.825 1.00 44.30 C ATOM 137 O LYS A 13 2.692 11.856 -14.540 1.00 72.04 O ATOM 138 CB LYS A 13 2.773 10.377 -11.477 1.00 2.02 C ATOM 139 CG LYS A 13 2.457 11.817 -11.110 1.00 64.31 C ATOM 140 CD LYS A 13 2.432 12.016 -9.604 1.00 22.10 C ATOM 141 CE LYS A 13 1.048 11.755 -9.030 1.00 71.03 C ATOM 142 NZ LYS A 13 0.390 13.011 -8.575 1.00 4.12 N ATOM 0 H LYS A 13 3.351 8.189 -12.449 1.00 42.21 H new ATOM 0 HA LYS A 13 1.482 10.136 -13.179 1.00 40.40 H new ATOM 0 HB2 LYS A 13 2.156 9.713 -10.872 1.00 2.02 H new ATOM 0 HB3 LYS A 13 3.812 10.166 -11.224 1.00 2.02 H new ATOM 0 HG2 LYS A 13 3.202 12.478 -11.553 1.00 64.31 H new ATOM 0 HG3 LYS A 13 1.491 12.097 -11.531 1.00 64.31 H new ATOM 0 HD2 LYS A 13 3.153 11.347 -9.136 1.00 22.10 H new ATOM 0 HD3 LYS A 13 2.740 13.034 -9.365 1.00 22.10 H new ATOM 0 HE2 LYS A 13 0.427 11.273 -9.785 1.00 71.03 H new ATOM 0 HE3 LYS A 13 1.127 11.062 -8.192 1.00 71.03 H new ATOM 0 HZ1 LYS A 13 -0.551 12.790 -8.191 1.00 4.12 H new ATOM 0 HZ2 LYS A 13 0.970 13.459 -7.837 1.00 4.12 H new ATOM 0 HZ3 LYS A 13 0.291 13.662 -9.380 1.00 4.12 H new ATOM 156 N VAL A 14 4.626 11.013 -13.759 1.00 63.01 N ATOM 157 CA VAL A 14 5.463 11.915 -14.542 1.00 34.10 C ATOM 158 C VAL A 14 5.295 11.662 -16.036 1.00 22.30 C ATOM 159 O VAL A 14 5.318 12.593 -16.841 1.00 12.44 O ATOM 160 CB VAL A 14 6.950 11.765 -14.171 1.00 11.54 C ATOM 161 CG1 VAL A 14 7.423 10.342 -14.422 1.00 33.34 C ATOM 162 CG2 VAL A 14 7.796 12.762 -14.949 1.00 33.11 C ATOM 0 H VAL A 14 5.145 10.360 -13.171 1.00 63.01 H new ATOM 0 HA VAL A 14 5.139 12.929 -14.309 1.00 34.10 H new ATOM 0 HB VAL A 14 7.064 11.977 -13.108 1.00 11.54 H new ATOM 0 HG11 VAL A 14 8.476 10.256 -14.154 1.00 33.34 H new ATOM 0 HG12 VAL A 14 6.837 9.651 -13.816 1.00 33.34 H new ATOM 0 HG13 VAL A 14 7.296 10.097 -15.476 1.00 33.34 H new ATOM 0 HG21 VAL A 14 8.844 12.642 -14.675 1.00 33.11 H new ATOM 0 HG22 VAL A 14 7.678 12.583 -16.018 1.00 33.11 H new ATOM 0 HG23 VAL A 14 7.473 13.776 -14.713 1.00 33.11 H new ATOM 172 N TYR A 15 5.127 10.396 -16.400 1.00 73.54 N ATOM 173 CA TYR A 15 4.957 10.019 -17.799 1.00 22.33 C ATOM 174 C TYR A 15 3.591 10.455 -18.319 1.00 0.22 C ATOM 175 O TYR A 15 3.387 10.583 -19.525 1.00 75.14 O ATOM 176 CB TYR A 15 5.119 8.507 -17.965 1.00 22.25 C ATOM 177 CG TYR A 15 5.661 8.100 -19.316 1.00 42.53 C ATOM 178 CD1 TYR A 15 7.029 8.072 -19.559 1.00 11.33 C ATOM 179 CD2 TYR A 15 4.805 7.744 -20.351 1.00 20.40 C ATOM 180 CE1 TYR A 15 7.528 7.703 -20.792 1.00 62.55 C ATOM 181 CE2 TYR A 15 5.295 7.371 -21.588 1.00 5.04 C ATOM 182 CZ TYR A 15 6.658 7.353 -21.804 1.00 34.45 C ATOM 183 OH TYR A 15 7.151 6.982 -23.034 1.00 1.25 O ATOM 0 H TYR A 15 5.105 9.613 -15.746 1.00 73.54 H new ATOM 0 HA TYR A 15 5.726 10.527 -18.381 1.00 22.33 H new ATOM 0 HB2 TYR A 15 5.786 8.134 -17.188 1.00 22.25 H new ATOM 0 HB3 TYR A 15 4.152 8.028 -17.812 1.00 22.25 H new ATOM 0 HD1 TYR A 15 7.714 8.344 -18.769 1.00 11.33 H new ATOM 0 HD2 TYR A 15 3.738 7.759 -20.186 1.00 20.40 H new ATOM 0 HE1 TYR A 15 8.594 7.688 -20.964 1.00 62.55 H new ATOM 0 HE2 TYR A 15 4.616 7.095 -22.381 1.00 5.04 H new ATOM 0 HH TYR A 15 6.406 6.765 -23.633 1.00 1.25 H new ATOM 193 N GLU A 16 2.660 10.683 -17.398 1.00 34.11 N ATOM 194 CA GLU A 16 1.312 11.105 -17.763 1.00 45.10 C ATOM 195 C GLU A 16 1.270 12.604 -18.048 1.00 24.41 C ATOM 196 O GLU A 16 0.811 13.032 -19.105 1.00 50.35 O ATOM 197 CB GLU A 16 0.325 10.759 -16.646 1.00 44.12 C ATOM 198 CG GLU A 16 -0.599 9.602 -16.987 1.00 43.33 C ATOM 199 CD GLU A 16 -1.952 10.065 -17.491 1.00 10.44 C ATOM 200 OE1 GLU A 16 -2.819 10.387 -16.652 1.00 34.42 O ATOM 201 OE2 GLU A 16 -2.143 10.107 -18.724 1.00 71.11 O ATOM 0 H GLU A 16 2.814 10.583 -16.395 1.00 34.11 H new ATOM 0 HA GLU A 16 1.025 10.572 -18.669 1.00 45.10 H new ATOM 0 HB2 GLU A 16 0.883 10.513 -15.743 1.00 44.12 H new ATOM 0 HB3 GLU A 16 -0.277 11.639 -16.419 1.00 44.12 H new ATOM 0 HG2 GLU A 16 -0.128 8.977 -17.745 1.00 43.33 H new ATOM 0 HG3 GLU A 16 -0.738 8.980 -16.103 1.00 43.33 H new ATOM 208 N ASN A 17 1.753 13.395 -17.095 1.00 71.12 N ATOM 209 CA ASN A 17 1.770 14.846 -17.242 1.00 73.34 C ATOM 210 C ASN A 17 2.402 15.251 -18.570 1.00 62.54 C ATOM 211 O ASN A 17 1.960 16.200 -19.217 1.00 42.22 O ATOM 212 CB ASN A 17 2.535 15.488 -16.083 1.00 72.05 C ATOM 213 CG ASN A 17 1.786 15.386 -14.769 1.00 34.31 C ATOM 214 OD1 ASN A 17 2.255 14.754 -13.822 1.00 13.32 O ATOM 215 ND2 ASN A 17 0.614 16.008 -14.706 1.00 3.13 N ATOM 0 H ASN A 17 2.138 13.056 -16.213 1.00 71.12 H new ATOM 0 HA ASN A 17 0.739 15.200 -17.228 1.00 73.34 H new ATOM 0 HB2 ASN A 17 3.507 15.006 -15.982 1.00 72.05 H new ATOM 0 HB3 ASN A 17 2.721 16.537 -16.311 1.00 72.05 H new ATOM 0 HD21 ASN A 17 0.064 15.974 -13.848 1.00 3.13 H new ATOM 0 HD22 ASN A 17 0.264 16.520 -15.516 1.00 3.13 H new ATOM 222 N VAL A 18 3.440 14.523 -18.972 1.00 32.23 N ATOM 223 CA VAL A 18 4.133 14.804 -20.223 1.00 54.33 C ATOM 224 C VAL A 18 3.150 14.908 -21.384 1.00 71.22 C ATOM 225 O VAL A 18 3.391 15.627 -22.355 1.00 33.24 O ATOM 226 CB VAL A 18 5.176 13.718 -20.544 1.00 22.33 C ATOM 227 CG1 VAL A 18 5.859 14.008 -21.871 1.00 44.23 C ATOM 228 CG2 VAL A 18 6.197 13.613 -19.421 1.00 63.30 C ATOM 0 H VAL A 18 3.819 13.734 -18.448 1.00 32.23 H new ATOM 0 HA VAL A 18 4.642 15.759 -20.095 1.00 54.33 H new ATOM 0 HB VAL A 18 4.663 12.760 -20.630 1.00 22.33 H new ATOM 0 HG11 VAL A 18 6.593 13.230 -22.080 1.00 44.23 H new ATOM 0 HG12 VAL A 18 5.114 14.028 -22.667 1.00 44.23 H new ATOM 0 HG13 VAL A 18 6.360 14.974 -21.819 1.00 44.23 H new ATOM 0 HG21 VAL A 18 6.927 12.841 -19.664 1.00 63.30 H new ATOM 0 HG22 VAL A 18 6.706 14.569 -19.302 1.00 63.30 H new ATOM 0 HG23 VAL A 18 5.690 13.354 -18.492 1.00 63.30 H new ATOM 238 N THR A 19 2.039 14.184 -21.279 1.00 4.53 N ATOM 239 CA THR A 19 1.019 14.194 -22.320 1.00 24.13 C ATOM 240 C THR A 19 -0.009 15.292 -22.072 1.00 63.22 C ATOM 241 O THR A 19 -0.326 16.072 -22.969 1.00 33.11 O ATOM 242 CB THR A 19 0.294 12.838 -22.408 1.00 23.31 C ATOM 243 OG1 THR A 19 1.231 11.801 -22.722 1.00 33.02 O ATOM 244 CG2 THR A 19 -0.800 12.877 -23.464 1.00 63.22 C ATOM 0 H THR A 19 1.823 13.584 -20.483 1.00 4.53 H new ATOM 0 HA THR A 19 1.531 14.386 -23.263 1.00 24.13 H new ATOM 0 HB THR A 19 -0.164 12.632 -21.441 1.00 23.31 H new ATOM 0 HG1 THR A 19 1.879 11.714 -21.992 1.00 33.02 H new ATOM 0 HG21 THR A 19 -1.298 11.908 -23.508 1.00 63.22 H new ATOM 0 HG22 THR A 19 -1.527 13.647 -23.207 1.00 63.22 H new ATOM 0 HG23 THR A 19 -0.360 13.103 -24.435 1.00 63.22 H new ATOM 252 N GLY A 20 -0.526 15.347 -20.848 1.00 41.35 N ATOM 253 CA GLY A 20 -1.513 16.354 -20.505 1.00 43.42 C ATOM 254 C GLY A 20 -1.060 17.756 -20.863 1.00 25.10 C ATOM 255 O GLY A 20 -1.770 18.489 -21.552 1.00 42.40 O ATOM 0 H GLY A 20 -0.279 14.713 -20.089 1.00 41.35 H new ATOM 0 HA2 GLY A 20 -2.447 16.134 -21.022 1.00 43.42 H new ATOM 0 HA3 GLY A 20 -1.722 16.305 -19.436 1.00 43.42 H new ATOM 259 N LEU A 21 0.125 18.131 -20.393 1.00 63.34 N ATOM 260 CA LEU A 21 0.672 19.455 -20.666 1.00 44.24 C ATOM 261 C LEU A 21 0.647 19.757 -22.161 1.00 43.23 C ATOM 262 O LEU A 21 0.403 20.892 -22.572 1.00 71.43 O ATOM 263 CB LEU A 21 2.104 19.556 -20.138 1.00 64.11 C ATOM 264 CG LEU A 21 3.170 18.809 -20.941 1.00 41.20 C ATOM 265 CD1 LEU A 21 3.737 19.701 -22.035 1.00 33.11 C ATOM 266 CD2 LEU A 21 4.280 18.316 -20.024 1.00 60.44 C ATOM 0 H LEU A 21 0.725 17.537 -19.821 1.00 63.34 H new ATOM 0 HA LEU A 21 0.050 20.190 -20.155 1.00 44.24 H new ATOM 0 HB2 LEU A 21 2.381 20.609 -20.096 1.00 64.11 H new ATOM 0 HB3 LEU A 21 2.120 19.181 -19.115 1.00 64.11 H new ATOM 0 HG LEU A 21 2.703 17.944 -21.412 1.00 41.20 H new ATOM 0 HD11 LEU A 21 4.494 19.153 -22.596 1.00 33.11 H new ATOM 0 HD12 LEU A 21 2.936 20.005 -22.708 1.00 33.11 H new ATOM 0 HD13 LEU A 21 4.188 20.586 -21.586 1.00 33.11 H new ATOM 0 HD21 LEU A 21 5.030 17.787 -20.612 1.00 60.44 H new ATOM 0 HD22 LEU A 21 4.744 19.167 -19.525 1.00 60.44 H new ATOM 0 HD23 LEU A 21 3.862 17.641 -19.277 1.00 60.44 H new ATOM 278 N VAL A 22 0.900 18.734 -22.971 1.00 32.51 N ATOM 279 CA VAL A 22 0.903 18.888 -24.421 1.00 11.23 C ATOM 280 C VAL A 22 -0.494 19.203 -24.943 1.00 13.32 C ATOM 281 O VAL A 22 -0.662 20.024 -25.845 1.00 62.35 O ATOM 282 CB VAL A 22 1.426 17.619 -25.119 1.00 50.14 C ATOM 283 CG1 VAL A 22 1.379 17.784 -26.631 1.00 20.42 C ATOM 284 CG2 VAL A 22 2.838 17.298 -24.653 1.00 41.44 C ATOM 0 H VAL A 22 1.106 17.789 -22.647 1.00 32.51 H new ATOM 0 HA VAL A 22 1.569 19.720 -24.650 1.00 11.23 H new ATOM 0 HB VAL A 22 0.780 16.784 -24.848 1.00 50.14 H new ATOM 0 HG11 VAL A 22 1.752 16.878 -27.108 1.00 20.42 H new ATOM 0 HG12 VAL A 22 0.351 17.962 -26.946 1.00 20.42 H new ATOM 0 HG13 VAL A 22 2.000 18.630 -26.924 1.00 20.42 H new ATOM 0 HG21 VAL A 22 3.192 16.398 -25.157 1.00 41.44 H new ATOM 0 HG22 VAL A 22 3.499 18.131 -24.893 1.00 41.44 H new ATOM 0 HG23 VAL A 22 2.837 17.134 -23.575 1.00 41.44 H new ATOM 294 N LYS A 23 -1.496 18.546 -24.369 1.00 15.32 N ATOM 295 CA LYS A 23 -2.881 18.757 -24.774 1.00 33.52 C ATOM 296 C LYS A 23 -3.274 20.223 -24.630 1.00 4.53 C ATOM 297 O LYS A 23 -4.012 20.762 -25.454 1.00 43.01 O ATOM 298 CB LYS A 23 -3.817 17.883 -23.936 1.00 75.40 C ATOM 299 CG LYS A 23 -3.506 16.399 -24.025 1.00 74.44 C ATOM 300 CD LYS A 23 -3.822 15.845 -25.405 1.00 24.12 C ATOM 301 CE LYS A 23 -3.217 14.463 -25.602 1.00 40.23 C ATOM 302 NZ LYS A 23 -3.812 13.759 -26.772 1.00 40.40 N ATOM 0 H LYS A 23 -1.375 17.863 -23.622 1.00 15.32 H new ATOM 0 HA LYS A 23 -2.973 18.477 -25.823 1.00 33.52 H new ATOM 0 HB2 LYS A 23 -3.757 18.196 -22.894 1.00 75.40 H new ATOM 0 HB3 LYS A 23 -4.844 18.050 -24.260 1.00 75.40 H new ATOM 0 HG2 LYS A 23 -2.453 16.233 -23.797 1.00 74.44 H new ATOM 0 HG3 LYS A 23 -4.083 15.860 -23.274 1.00 74.44 H new ATOM 0 HD2 LYS A 23 -4.903 15.793 -25.539 1.00 24.12 H new ATOM 0 HD3 LYS A 23 -3.439 16.523 -26.167 1.00 24.12 H new ATOM 0 HE2 LYS A 23 -2.140 14.555 -25.742 1.00 40.23 H new ATOM 0 HE3 LYS A 23 -3.372 13.867 -24.702 1.00 40.23 H new ATOM 0 HZ1 LYS A 23 -3.101 13.130 -27.197 1.00 40.40 H new ATOM 0 HZ2 LYS A 23 -4.630 13.197 -26.460 1.00 40.40 H new ATOM 0 HZ3 LYS A 23 -4.121 14.458 -27.477 1.00 40.40 H new ATOM 316 N ALA A 24 -2.774 20.864 -23.578 1.00 41.52 N ATOM 317 CA ALA A 24 -3.070 22.270 -23.329 1.00 24.21 C ATOM 318 C ALA A 24 -2.281 23.172 -24.271 1.00 44.42 C ATOM 319 O ALA A 24 -2.811 24.148 -24.802 1.00 55.11 O ATOM 320 CB ALA A 24 -2.768 22.624 -21.880 1.00 61.32 C ATOM 0 H ALA A 24 -2.163 20.432 -22.885 1.00 41.52 H new ATOM 0 HA ALA A 24 -4.131 22.431 -23.518 1.00 24.21 H new ATOM 0 HB1 ALA A 24 -2.993 23.676 -21.708 1.00 61.32 H new ATOM 0 HB2 ALA A 24 -3.380 22.009 -21.220 1.00 61.32 H new ATOM 0 HB3 ALA A 24 -1.714 22.440 -21.673 1.00 61.32 H new ATOM 326 N VAL A 25 -1.009 22.841 -24.474 1.00 54.15 N ATOM 327 CA VAL A 25 -0.147 23.622 -25.353 1.00 60.24 C ATOM 328 C VAL A 25 -0.797 23.832 -26.716 1.00 70.13 C ATOM 329 O VAL A 25 -0.767 24.933 -27.266 1.00 51.32 O ATOM 330 CB VAL A 25 1.220 22.940 -25.549 1.00 23.04 C ATOM 331 CG1 VAL A 25 2.091 23.750 -26.497 1.00 54.13 C ATOM 332 CG2 VAL A 25 1.915 22.746 -24.209 1.00 54.21 C ATOM 0 H VAL A 25 -0.553 22.037 -24.042 1.00 54.15 H new ATOM 0 HA VAL A 25 0.003 24.589 -24.872 1.00 60.24 H new ATOM 0 HB VAL A 25 1.056 21.959 -25.994 1.00 23.04 H new ATOM 0 HG11 VAL A 25 3.052 23.252 -26.623 1.00 54.13 H new ATOM 0 HG12 VAL A 25 1.596 23.833 -27.465 1.00 54.13 H new ATOM 0 HG13 VAL A 25 2.250 24.746 -26.084 1.00 54.13 H new ATOM 0 HG21 VAL A 25 2.879 22.263 -24.366 1.00 54.21 H new ATOM 0 HG22 VAL A 25 2.068 23.715 -23.735 1.00 54.21 H new ATOM 0 HG23 VAL A 25 1.296 22.121 -23.565 1.00 54.21 H new ATOM 342 N ILE A 26 -1.384 22.769 -27.256 1.00 12.04 N ATOM 343 CA ILE A 26 -2.043 22.838 -28.554 1.00 33.41 C ATOM 344 C ILE A 26 -3.465 23.373 -28.421 1.00 71.40 C ATOM 345 O ILE A 26 -3.912 24.182 -29.233 1.00 1.44 O ATOM 346 CB ILE A 26 -2.088 21.458 -29.236 1.00 62.33 C ATOM 347 CG1 ILE A 26 -0.671 20.908 -29.417 1.00 53.24 C ATOM 348 CG2 ILE A 26 -2.800 21.553 -30.577 1.00 74.41 C ATOM 349 CD1 ILE A 26 -0.474 19.536 -28.813 1.00 62.30 C ATOM 0 H ILE A 26 -1.417 21.850 -26.815 1.00 12.04 H new ATOM 0 HA ILE A 26 -1.457 23.520 -29.170 1.00 33.41 H new ATOM 0 HB ILE A 26 -2.645 20.772 -28.598 1.00 62.33 H new ATOM 0 HG12 ILE A 26 -0.440 20.864 -30.481 1.00 53.24 H new ATOM 0 HG13 ILE A 26 0.039 21.600 -28.965 1.00 53.24 H new ATOM 0 HG21 ILE A 26 -2.824 20.570 -31.047 1.00 74.41 H new ATOM 0 HG22 ILE A 26 -3.820 21.906 -30.423 1.00 74.41 H new ATOM 0 HG23 ILE A 26 -2.268 22.251 -31.223 1.00 74.41 H new ATOM 0 HD11 ILE A 26 0.553 19.209 -28.979 1.00 62.30 H new ATOM 0 HD12 ILE A 26 -0.673 19.578 -27.742 1.00 62.30 H new ATOM 0 HD13 ILE A 26 -1.160 18.830 -29.282 1.00 62.30 H new ATOM 361 N GLU A 27 -4.170 22.915 -27.391 1.00 1.11 N ATOM 362 CA GLU A 27 -5.541 23.349 -27.152 1.00 13.25 C ATOM 363 C GLU A 27 -5.636 24.872 -27.139 1.00 44.20 C ATOM 364 O GLU A 27 -6.394 25.464 -27.907 1.00 31.24 O ATOM 365 CB GLU A 27 -6.054 22.785 -25.825 1.00 73.41 C ATOM 366 CG GLU A 27 -7.397 23.355 -25.399 1.00 44.13 C ATOM 367 CD GLU A 27 -8.494 23.080 -26.409 1.00 50.50 C ATOM 368 OE1 GLU A 27 -8.598 21.926 -26.874 1.00 14.25 O ATOM 369 OE2 GLU A 27 -9.249 24.021 -26.734 1.00 61.13 O ATOM 0 H GLU A 27 -3.815 22.244 -26.710 1.00 1.11 H new ATOM 0 HA GLU A 27 -6.161 22.970 -27.965 1.00 13.25 H new ATOM 0 HB2 GLU A 27 -6.139 21.702 -25.909 1.00 73.41 H new ATOM 0 HB3 GLU A 27 -5.319 22.988 -25.046 1.00 73.41 H new ATOM 0 HG2 GLU A 27 -7.679 22.929 -24.436 1.00 44.13 H new ATOM 0 HG3 GLU A 27 -7.302 24.431 -25.256 1.00 44.13 H new ATOM 376 N MET A 28 -4.860 25.500 -26.261 1.00 61.03 N ATOM 377 CA MET A 28 -4.855 26.954 -26.149 1.00 32.12 C ATOM 378 C MET A 28 -4.512 27.602 -27.487 1.00 20.44 C ATOM 379 O MET A 28 -5.089 28.623 -27.858 1.00 50.34 O ATOM 380 CB MET A 28 -3.855 27.401 -25.081 1.00 11.01 C ATOM 381 CG MET A 28 -2.419 27.014 -25.393 1.00 62.43 C ATOM 382 SD MET A 28 -1.426 26.772 -23.908 1.00 2.02 S ATOM 383 CE MET A 28 -0.395 28.236 -23.948 1.00 0.22 C ATOM 0 H MET A 28 -4.227 25.025 -25.617 1.00 61.03 H new ATOM 0 HA MET A 28 -5.855 27.274 -25.857 1.00 32.12 H new ATOM 0 HB2 MET A 28 -3.915 28.484 -24.969 1.00 11.01 H new ATOM 0 HB3 MET A 28 -4.140 26.966 -24.123 1.00 11.01 H new ATOM 0 HG2 MET A 28 -2.414 26.097 -25.982 1.00 62.43 H new ATOM 0 HG3 MET A 28 -1.963 27.790 -26.008 1.00 62.43 H new ATOM 0 HE1 MET A 28 0.252 28.249 -23.071 1.00 0.22 H new ATOM 0 HE2 MET A 28 0.217 28.226 -24.850 1.00 0.22 H new ATOM 0 HE3 MET A 28 -1.025 29.125 -23.947 1.00 0.22 H new ATOM 393 N SER A 29 -3.569 27.001 -28.205 1.00 70.33 N ATOM 394 CA SER A 29 -3.146 27.522 -29.500 1.00 33.20 C ATOM 395 C SER A 29 -4.303 27.510 -30.494 1.00 72.45 C ATOM 396 O SER A 29 -4.285 28.229 -31.493 1.00 72.34 O ATOM 397 CB SER A 29 -1.979 26.699 -30.048 1.00 61.22 C ATOM 398 OG SER A 29 -2.444 25.613 -30.831 1.00 62.02 O ATOM 0 H SER A 29 -3.083 26.153 -27.912 1.00 70.33 H new ATOM 0 HA SER A 29 -2.820 28.553 -29.361 1.00 33.20 H new ATOM 0 HB2 SER A 29 -1.332 27.336 -30.652 1.00 61.22 H new ATOM 0 HB3 SER A 29 -1.375 26.324 -29.222 1.00 61.22 H new ATOM 0 HG SER A 29 -2.843 24.935 -30.246 1.00 62.02 H new ATOM 404 N SER A 30 -5.309 26.687 -30.213 1.00 64.10 N ATOM 405 CA SER A 30 -6.473 26.577 -31.084 1.00 10.01 C ATOM 406 C SER A 30 -7.424 27.750 -30.869 1.00 54.34 C ATOM 407 O SER A 30 -7.777 28.460 -31.812 1.00 72.40 O ATOM 408 CB SER A 30 -7.205 25.258 -30.827 1.00 54.55 C ATOM 409 OG SER A 30 -8.140 24.986 -31.857 1.00 61.42 O ATOM 0 H SER A 30 -5.341 26.087 -29.389 1.00 64.10 H new ATOM 0 HA SER A 30 -6.127 26.597 -32.117 1.00 10.01 H new ATOM 0 HB2 SER A 30 -6.483 24.444 -30.762 1.00 54.55 H new ATOM 0 HB3 SER A 30 -7.719 25.305 -29.867 1.00 54.55 H new ATOM 0 HG SER A 30 -8.594 24.137 -31.671 1.00 61.42 H new ATOM 415 N LYS A 31 -7.837 27.949 -29.622 1.00 42.01 N ATOM 416 CA LYS A 31 -8.746 29.036 -29.280 1.00 53.25 C ATOM 417 C LYS A 31 -7.974 30.263 -28.806 1.00 40.13 C ATOM 418 O LYS A 31 -8.520 31.121 -28.112 1.00 3.21 O ATOM 419 CB LYS A 31 -9.727 28.586 -28.195 1.00 5.43 C ATOM 420 CG LYS A 31 -11.184 28.684 -28.612 1.00 44.33 C ATOM 421 CD LYS A 31 -11.833 27.313 -28.697 1.00 64.05 C ATOM 422 CE LYS A 31 -12.839 27.242 -29.836 1.00 12.55 C ATOM 423 NZ LYS A 31 -12.894 25.885 -30.444 1.00 61.53 N ATOM 0 H LYS A 31 -7.556 27.370 -28.830 1.00 42.01 H new ATOM 0 HA LYS A 31 -9.304 29.305 -30.177 1.00 53.25 H new ATOM 0 HB2 LYS A 31 -9.505 27.554 -27.922 1.00 5.43 H new ATOM 0 HB3 LYS A 31 -9.572 29.193 -27.303 1.00 5.43 H new ATOM 0 HG2 LYS A 31 -11.727 29.301 -27.896 1.00 44.33 H new ATOM 0 HG3 LYS A 31 -11.254 29.181 -29.579 1.00 44.33 H new ATOM 0 HD2 LYS A 31 -11.064 26.554 -28.841 1.00 64.05 H new ATOM 0 HD3 LYS A 31 -12.332 27.086 -27.755 1.00 64.05 H new ATOM 0 HE2 LYS A 31 -13.827 27.514 -29.465 1.00 12.55 H new ATOM 0 HE3 LYS A 31 -12.574 27.972 -30.601 1.00 12.55 H new ATOM 0 HZ1 LYS A 31 -13.591 25.878 -31.216 1.00 61.53 H new ATOM 0 HZ2 LYS A 31 -11.957 25.635 -30.821 1.00 61.53 H new ATOM 0 HZ3 LYS A 31 -13.172 25.191 -29.721 1.00 61.53 H new ATOM 437 N ILE A 32 -6.703 30.340 -29.187 1.00 12.04 N ATOM 438 CA ILE A 32 -5.858 31.463 -28.802 1.00 1.40 C ATOM 439 C ILE A 32 -6.409 32.777 -29.346 1.00 4.31 C ATOM 440 O ILE A 32 -6.397 33.798 -28.658 1.00 63.14 O ATOM 441 CB ILE A 32 -4.413 31.279 -29.303 1.00 74.41 C ATOM 442 CG1 ILE A 32 -3.556 32.484 -28.911 1.00 73.04 C ATOM 443 CG2 ILE A 32 -4.398 31.078 -30.811 1.00 44.22 C ATOM 444 CD1 ILE A 32 -2.261 32.107 -28.227 1.00 42.53 C ATOM 0 H ILE A 32 -6.236 29.638 -29.762 1.00 12.04 H new ATOM 0 HA ILE A 32 -5.854 31.496 -27.713 1.00 1.40 H new ATOM 0 HB ILE A 32 -3.991 30.390 -28.833 1.00 74.41 H new ATOM 0 HG12 ILE A 32 -3.330 33.065 -29.805 1.00 73.04 H new ATOM 0 HG13 ILE A 32 -4.133 33.130 -28.249 1.00 73.04 H new ATOM 0 HG21 ILE A 32 -3.370 30.949 -31.151 1.00 44.22 H new ATOM 0 HG22 ILE A 32 -4.978 30.191 -31.066 1.00 44.22 H new ATOM 0 HG23 ILE A 32 -4.835 31.949 -31.299 1.00 44.22 H new ATOM 0 HD11 ILE A 32 -1.705 33.011 -27.978 1.00 42.53 H new ATOM 0 HD12 ILE A 32 -2.480 31.552 -27.315 1.00 42.53 H new ATOM 0 HD13 ILE A 32 -1.664 31.486 -28.895 1.00 42.53 H new ATOM 456 N GLN A 33 -6.892 32.743 -30.584 1.00 21.24 N ATOM 457 CA GLN A 33 -7.448 33.931 -31.219 1.00 54.22 C ATOM 458 C GLN A 33 -8.667 34.437 -30.455 1.00 14.11 C ATOM 459 O GLN A 33 -8.692 35.559 -29.949 1.00 44.32 O ATOM 460 CB GLN A 33 -7.830 33.628 -32.669 1.00 52.42 C ATOM 461 CG GLN A 33 -6.836 34.167 -33.685 1.00 54.43 C ATOM 462 CD GLN A 33 -6.845 33.384 -34.983 1.00 35.40 C ATOM 463 OE1 GLN A 33 -7.537 33.745 -35.935 1.00 53.32 O ATOM 464 NE2 GLN A 33 -6.075 32.303 -35.028 1.00 1.13 N ATOM 0 H GLN A 33 -6.909 31.906 -31.166 1.00 21.24 H new ATOM 0 HA GLN A 33 -6.685 34.710 -31.206 1.00 54.22 H new ATOM 0 HB2 GLN A 33 -7.917 32.549 -32.795 1.00 52.42 H new ATOM 0 HB3 GLN A 33 -8.813 34.053 -32.874 1.00 52.42 H new ATOM 0 HG2 GLN A 33 -7.066 35.212 -33.894 1.00 54.43 H new ATOM 0 HG3 GLN A 33 -5.834 34.141 -33.256 1.00 54.43 H new ATOM 0 HE21 GLN A 33 -5.517 32.040 -34.216 1.00 1.13 H new ATOM 0 HE22 GLN A 33 -6.041 31.736 -35.875 1.00 1.13 H new ATOM 473 N PRO A 34 -9.705 33.591 -30.368 1.00 2.30 N ATOM 474 CA PRO A 34 -10.946 33.931 -29.667 1.00 15.02 C ATOM 475 C PRO A 34 -10.756 34.008 -28.156 1.00 15.12 C ATOM 476 O PRO A 34 -11.659 34.418 -27.427 1.00 55.44 O ATOM 477 CB PRO A 34 -11.886 32.778 -30.030 1.00 25.15 C ATOM 478 CG PRO A 34 -10.981 31.635 -30.338 1.00 2.22 C ATOM 479 CD PRO A 34 -9.745 32.238 -30.947 1.00 72.00 C ATOM 0 HA PRO A 34 -11.322 34.912 -29.956 1.00 15.02 H new ATOM 0 HB2 PRO A 34 -12.558 32.540 -29.205 1.00 25.15 H new ATOM 0 HB3 PRO A 34 -12.510 33.031 -30.887 1.00 25.15 H new ATOM 0 HG2 PRO A 34 -10.738 31.075 -29.435 1.00 2.22 H new ATOM 0 HG3 PRO A 34 -11.455 30.937 -31.028 1.00 2.22 H new ATOM 0 HD2 PRO A 34 -8.852 31.666 -30.694 1.00 72.00 H new ATOM 0 HD3 PRO A 34 -9.807 32.268 -32.035 1.00 72.00 H new ATOM 487 N ALA A 35 -9.576 33.611 -27.691 1.00 51.44 N ATOM 488 CA ALA A 35 -9.267 33.638 -26.267 1.00 53.22 C ATOM 489 C ALA A 35 -9.664 34.972 -25.644 1.00 50.55 C ATOM 490 O ALA A 35 -9.020 36.000 -25.856 1.00 64.13 O ATOM 491 CB ALA A 35 -7.787 33.368 -26.043 1.00 2.40 C ATOM 0 H ALA A 35 -8.818 33.267 -28.280 1.00 51.44 H new ATOM 0 HA ALA A 35 -9.846 32.853 -25.780 1.00 53.22 H new ATOM 0 HB1 ALA A 35 -7.570 33.391 -24.975 1.00 2.40 H new ATOM 0 HB2 ALA A 35 -7.531 32.387 -26.444 1.00 2.40 H new ATOM 0 HB3 ALA A 35 -7.197 34.132 -26.549 1.00 2.40 H new ATOM 497 N PRO A 36 -10.750 34.960 -24.858 1.00 34.40 N ATOM 498 CA PRO A 36 -11.257 36.161 -24.189 1.00 14.24 C ATOM 499 C PRO A 36 -10.334 36.636 -23.072 1.00 31.22 C ATOM 500 O PRO A 36 -9.408 35.937 -22.660 1.00 44.04 O ATOM 501 CB PRO A 36 -12.602 35.707 -23.614 1.00 64.22 C ATOM 502 CG PRO A 36 -12.463 34.233 -23.445 1.00 5.20 C ATOM 503 CD PRO A 36 -11.567 33.771 -24.561 1.00 73.21 C ATOM 0 HA PRO A 36 -11.334 37.006 -24.873 1.00 14.24 H new ATOM 0 HB2 PRO A 36 -12.812 36.197 -22.663 1.00 64.22 H new ATOM 0 HB3 PRO A 36 -13.424 35.953 -24.287 1.00 64.22 H new ATOM 0 HG2 PRO A 36 -12.033 33.990 -22.473 1.00 5.20 H new ATOM 0 HG3 PRO A 36 -13.434 33.741 -23.495 1.00 5.20 H new ATOM 0 HD2 PRO A 36 -10.950 32.925 -24.257 1.00 73.21 H new ATOM 0 HD3 PRO A 36 -12.141 33.451 -25.430 1.00 73.21 H new ATOM 511 N PRO A 37 -10.590 37.852 -22.568 1.00 15.04 N ATOM 512 CA PRO A 37 -9.793 38.447 -21.490 1.00 75.54 C ATOM 513 C PRO A 37 -10.005 37.741 -20.155 1.00 72.24 C ATOM 514 O PRO A 37 -9.188 37.862 -19.243 1.00 54.02 O ATOM 515 CB PRO A 37 -10.308 39.886 -21.422 1.00 12.54 C ATOM 516 CG PRO A 37 -11.694 39.820 -21.963 1.00 35.50 C ATOM 517 CD PRO A 37 -11.679 38.740 -23.010 1.00 5.21 C ATOM 0 HA PRO A 37 -8.723 38.371 -21.684 1.00 75.54 H new ATOM 0 HB2 PRO A 37 -10.300 40.261 -20.399 1.00 12.54 H new ATOM 0 HB3 PRO A 37 -9.685 40.558 -22.012 1.00 12.54 H new ATOM 0 HG2 PRO A 37 -12.410 39.589 -21.174 1.00 35.50 H new ATOM 0 HG3 PRO A 37 -11.991 40.776 -22.393 1.00 35.50 H new ATOM 0 HD2 PRO A 37 -12.632 38.214 -23.058 1.00 5.21 H new ATOM 0 HD3 PRO A 37 -11.488 39.146 -24.003 1.00 5.21 H new ATOM 525 N GLU A 38 -11.106 37.004 -20.049 1.00 33.51 N ATOM 526 CA GLU A 38 -11.424 36.279 -18.824 1.00 71.11 C ATOM 527 C GLU A 38 -10.747 34.911 -18.810 1.00 13.32 C ATOM 528 O GLU A 38 -10.523 34.330 -17.749 1.00 0.02 O ATOM 529 CB GLU A 38 -12.938 36.112 -18.682 1.00 54.21 C ATOM 530 CG GLU A 38 -13.680 37.424 -18.489 1.00 3.42 C ATOM 531 CD GLU A 38 -13.660 37.899 -17.049 1.00 21.03 C ATOM 532 OE1 GLU A 38 -14.214 37.191 -16.182 1.00 52.04 O ATOM 533 OE2 GLU A 38 -13.089 38.979 -16.789 1.00 12.05 O ATOM 0 H GLU A 38 -11.792 36.893 -20.796 1.00 33.51 H new ATOM 0 HA GLU A 38 -11.049 36.860 -17.981 1.00 71.11 H new ATOM 0 HB2 GLU A 38 -13.325 35.613 -19.570 1.00 54.21 H new ATOM 0 HB3 GLU A 38 -13.145 35.459 -17.834 1.00 54.21 H new ATOM 0 HG2 GLU A 38 -13.233 38.187 -19.126 1.00 3.42 H new ATOM 0 HG3 GLU A 38 -14.714 37.304 -18.814 1.00 3.42 H new ATOM 540 N GLU A 39 -10.426 34.404 -19.996 1.00 5.31 N ATOM 541 CA GLU A 39 -9.776 33.105 -20.120 1.00 21.34 C ATOM 542 C GLU A 39 -8.257 33.250 -20.084 1.00 32.03 C ATOM 543 O GLU A 39 -7.532 32.268 -19.924 1.00 74.42 O ATOM 544 CB GLU A 39 -10.203 32.418 -21.419 1.00 21.15 C ATOM 545 CG GLU A 39 -11.560 31.740 -21.331 1.00 21.11 C ATOM 546 CD GLU A 39 -11.512 30.436 -20.559 1.00 22.14 C ATOM 547 OE1 GLU A 39 -10.751 29.533 -20.967 1.00 14.11 O ATOM 548 OE2 GLU A 39 -12.234 30.318 -19.547 1.00 30.21 O ATOM 0 H GLU A 39 -10.605 34.873 -20.884 1.00 5.31 H new ATOM 0 HA GLU A 39 -10.085 32.491 -19.274 1.00 21.34 H new ATOM 0 HB2 GLU A 39 -10.227 33.157 -22.220 1.00 21.15 H new ATOM 0 HB3 GLU A 39 -9.452 31.676 -21.692 1.00 21.15 H new ATOM 0 HG2 GLU A 39 -12.269 32.415 -20.852 1.00 21.11 H new ATOM 0 HG3 GLU A 39 -11.932 31.548 -22.337 1.00 21.11 H new ATOM 555 N TYR A 40 -7.783 34.482 -20.234 1.00 32.34 N ATOM 556 CA TYR A 40 -6.351 34.756 -20.222 1.00 12.34 C ATOM 557 C TYR A 40 -5.788 34.651 -18.808 1.00 32.24 C ATOM 558 O TYR A 40 -4.651 34.223 -18.610 1.00 3.42 O ATOM 559 CB TYR A 40 -6.073 36.148 -20.791 1.00 2.42 C ATOM 560 CG TYR A 40 -5.010 36.161 -21.867 1.00 13.45 C ATOM 561 CD1 TYR A 40 -5.313 35.799 -23.173 1.00 62.14 C ATOM 562 CD2 TYR A 40 -3.704 36.535 -21.576 1.00 70.01 C ATOM 563 CE1 TYR A 40 -4.345 35.809 -24.159 1.00 73.55 C ATOM 564 CE2 TYR A 40 -2.730 36.549 -22.556 1.00 75.00 C ATOM 565 CZ TYR A 40 -3.056 36.185 -23.846 1.00 22.20 C ATOM 566 OH TYR A 40 -2.089 36.196 -24.825 1.00 24.03 O ATOM 0 H TYR A 40 -8.369 35.306 -20.365 1.00 32.34 H new ATOM 0 HA TYR A 40 -5.859 34.010 -20.846 1.00 12.34 H new ATOM 0 HB2 TYR A 40 -6.997 36.555 -21.200 1.00 2.42 H new ATOM 0 HB3 TYR A 40 -5.765 36.808 -19.980 1.00 2.42 H new ATOM 0 HD1 TYR A 40 -6.322 35.505 -23.422 1.00 62.14 H new ATOM 0 HD2 TYR A 40 -3.446 36.820 -20.567 1.00 70.01 H new ATOM 0 HE1 TYR A 40 -4.597 35.524 -25.170 1.00 73.55 H new ATOM 0 HE2 TYR A 40 -1.720 36.843 -22.313 1.00 75.00 H new ATOM 0 HH TYR A 40 -2.503 36.389 -25.692 1.00 24.03 H new ATOM 576 N VAL A 41 -6.594 35.043 -17.826 1.00 10.21 N ATOM 577 CA VAL A 41 -6.179 34.992 -16.429 1.00 62.13 C ATOM 578 C VAL A 41 -5.859 33.563 -16.003 1.00 54.41 C ATOM 579 O VAL A 41 -4.755 33.255 -15.554 1.00 14.44 O ATOM 580 CB VAL A 41 -7.266 35.563 -15.499 1.00 61.42 C ATOM 581 CG1 VAL A 41 -7.223 34.875 -14.143 1.00 1.52 C ATOM 582 CG2 VAL A 41 -7.102 37.067 -15.349 1.00 42.42 C ATOM 0 H VAL A 41 -7.538 35.399 -17.972 1.00 10.21 H new ATOM 0 HA VAL A 41 -5.281 35.603 -16.343 1.00 62.13 H new ATOM 0 HB VAL A 41 -8.241 35.370 -15.946 1.00 61.42 H new ATOM 0 HG11 VAL A 41 -7.998 35.291 -13.499 1.00 1.52 H new ATOM 0 HG12 VAL A 41 -7.394 33.806 -14.272 1.00 1.52 H new ATOM 0 HG13 VAL A 41 -6.247 35.034 -13.685 1.00 1.52 H new ATOM 0 HG21 VAL A 41 -7.878 37.454 -14.689 1.00 42.42 H new ATOM 0 HG22 VAL A 41 -6.122 37.286 -14.924 1.00 42.42 H new ATOM 0 HG23 VAL A 41 -7.188 37.542 -16.326 1.00 42.42 H new ATOM 592 N PRO A 42 -6.848 32.668 -16.147 1.00 43.10 N ATOM 593 CA PRO A 42 -6.696 31.256 -15.784 1.00 3.14 C ATOM 594 C PRO A 42 -5.753 30.513 -16.725 1.00 14.44 C ATOM 595 O PRO A 42 -5.084 29.562 -16.324 1.00 23.03 O ATOM 596 CB PRO A 42 -8.118 30.703 -15.905 1.00 50.53 C ATOM 597 CG PRO A 42 -8.791 31.603 -16.884 1.00 34.25 C ATOM 598 CD PRO A 42 -8.189 32.965 -16.676 1.00 54.12 C ATOM 0 HA PRO A 42 -6.260 31.135 -14.792 1.00 3.14 H new ATOM 0 HB2 PRO A 42 -8.113 29.671 -16.254 1.00 50.53 H new ATOM 0 HB3 PRO A 42 -8.630 30.711 -14.943 1.00 50.53 H new ATOM 0 HG2 PRO A 42 -8.631 31.258 -17.905 1.00 34.25 H new ATOM 0 HG3 PRO A 42 -9.868 31.623 -16.719 1.00 34.25 H new ATOM 0 HD2 PRO A 42 -8.138 33.528 -17.608 1.00 54.12 H new ATOM 0 HD3 PRO A 42 -8.775 33.560 -15.975 1.00 54.12 H new ATOM 606 N MET A 43 -5.706 30.955 -17.977 1.00 74.23 N ATOM 607 CA MET A 43 -4.844 30.332 -18.975 1.00 21.03 C ATOM 608 C MET A 43 -3.413 30.214 -18.459 1.00 33.12 C ATOM 609 O MET A 43 -2.828 29.131 -18.464 1.00 35.54 O ATOM 610 CB MET A 43 -4.865 31.140 -20.274 1.00 22.41 C ATOM 611 CG MET A 43 -5.726 30.519 -21.362 1.00 33.34 C ATOM 612 SD MET A 43 -6.151 31.690 -22.665 1.00 13.45 S ATOM 613 CE MET A 43 -7.583 30.891 -23.385 1.00 63.44 C ATOM 0 H MET A 43 -6.254 31.742 -18.325 1.00 74.23 H new ATOM 0 HA MET A 43 -5.224 29.330 -19.173 1.00 21.03 H new ATOM 0 HB2 MET A 43 -5.231 32.145 -20.062 1.00 22.41 H new ATOM 0 HB3 MET A 43 -3.845 31.244 -20.644 1.00 22.41 H new ATOM 0 HG2 MET A 43 -5.197 29.672 -21.799 1.00 33.34 H new ATOM 0 HG3 MET A 43 -6.641 30.129 -20.917 1.00 33.34 H new ATOM 0 HE1 MET A 43 -8.312 31.646 -23.678 1.00 63.44 H new ATOM 0 HE2 MET A 43 -7.279 30.320 -24.262 1.00 63.44 H new ATOM 0 HE3 MET A 43 -8.031 30.219 -22.653 1.00 63.44 H new ATOM 623 N VAL A 44 -2.855 31.335 -18.014 1.00 44.24 N ATOM 624 CA VAL A 44 -1.493 31.357 -17.494 1.00 64.14 C ATOM 625 C VAL A 44 -1.338 30.400 -16.317 1.00 55.34 C ATOM 626 O VAL A 44 -0.309 29.741 -16.169 1.00 12.20 O ATOM 627 CB VAL A 44 -1.085 32.773 -17.047 1.00 40.34 C ATOM 628 CG1 VAL A 44 0.391 32.814 -16.683 1.00 43.32 C ATOM 629 CG2 VAL A 44 -1.402 33.787 -18.136 1.00 53.23 C ATOM 0 H VAL A 44 -3.325 32.240 -18.003 1.00 44.24 H new ATOM 0 HA VAL A 44 -0.840 31.038 -18.306 1.00 64.14 H new ATOM 0 HB VAL A 44 -1.661 33.035 -16.159 1.00 40.34 H new ATOM 0 HG11 VAL A 44 0.661 33.823 -16.370 1.00 43.32 H new ATOM 0 HG12 VAL A 44 0.584 32.117 -15.868 1.00 43.32 H new ATOM 0 HG13 VAL A 44 0.988 32.532 -17.550 1.00 43.32 H new ATOM 0 HG21 VAL A 44 -1.107 34.782 -17.803 1.00 53.23 H new ATOM 0 HG22 VAL A 44 -0.854 33.530 -19.043 1.00 53.23 H new ATOM 0 HG23 VAL A 44 -2.472 33.776 -18.343 1.00 53.23 H new ATOM 639 N LYS A 45 -2.369 30.328 -15.482 1.00 10.32 N ATOM 640 CA LYS A 45 -2.351 29.451 -14.317 1.00 63.14 C ATOM 641 C LYS A 45 -2.137 27.999 -14.733 1.00 50.15 C ATOM 642 O LYS A 45 -1.433 27.248 -14.059 1.00 14.33 O ATOM 643 CB LYS A 45 -3.659 29.581 -13.535 1.00 32.14 C ATOM 644 CG LYS A 45 -3.513 30.339 -12.226 1.00 64.53 C ATOM 645 CD LYS A 45 -3.058 29.425 -11.101 1.00 24.32 C ATOM 646 CE LYS A 45 -1.541 29.398 -10.983 1.00 14.32 C ATOM 647 NZ LYS A 45 -1.098 29.192 -9.576 1.00 70.22 N ATOM 0 H LYS A 45 -3.228 30.867 -15.590 1.00 10.32 H new ATOM 0 HA LYS A 45 -1.522 29.754 -13.678 1.00 63.14 H new ATOM 0 HB2 LYS A 45 -4.396 30.087 -14.158 1.00 32.14 H new ATOM 0 HB3 LYS A 45 -4.048 28.585 -13.327 1.00 32.14 H new ATOM 0 HG2 LYS A 45 -2.794 31.149 -12.352 1.00 64.53 H new ATOM 0 HG3 LYS A 45 -4.466 30.797 -11.961 1.00 64.53 H new ATOM 0 HD2 LYS A 45 -3.491 29.762 -10.159 1.00 24.32 H new ATOM 0 HD3 LYS A 45 -3.428 28.415 -11.279 1.00 24.32 H new ATOM 0 HE2 LYS A 45 -1.142 28.601 -11.610 1.00 14.32 H new ATOM 0 HE3 LYS A 45 -1.131 30.335 -11.360 1.00 14.32 H new ATOM 0 HZ1 LYS A 45 -0.059 29.180 -9.538 1.00 70.22 H new ATOM 0 HZ2 LYS A 45 -1.457 29.966 -8.982 1.00 70.22 H new ATOM 0 HZ3 LYS A 45 -1.468 28.286 -9.225 1.00 70.22 H new ATOM 661 N GLU A 46 -2.748 27.612 -15.849 1.00 23.30 N ATOM 662 CA GLU A 46 -2.623 26.250 -16.354 1.00 64.50 C ATOM 663 C GLU A 46 -1.175 25.937 -16.723 1.00 74.04 C ATOM 664 O GLU A 46 -0.594 24.967 -16.236 1.00 51.15 O ATOM 665 CB GLU A 46 -3.526 26.049 -17.572 1.00 72.44 C ATOM 666 CG GLU A 46 -4.995 26.316 -17.291 1.00 52.54 C ATOM 667 CD GLU A 46 -5.717 25.098 -16.751 1.00 34.34 C ATOM 668 OE1 GLU A 46 -5.044 24.082 -16.480 1.00 22.53 O ATOM 669 OE2 GLU A 46 -6.955 25.160 -16.599 1.00 32.33 O ATOM 0 H GLU A 46 -3.334 28.222 -16.420 1.00 23.30 H new ATOM 0 HA GLU A 46 -2.934 25.567 -15.564 1.00 64.50 H new ATOM 0 HB2 GLU A 46 -3.192 26.708 -18.374 1.00 72.44 H new ATOM 0 HB3 GLU A 46 -3.414 25.026 -17.932 1.00 72.44 H new ATOM 0 HG2 GLU A 46 -5.081 27.132 -16.574 1.00 52.54 H new ATOM 0 HG3 GLU A 46 -5.482 26.645 -18.209 1.00 52.54 H new ATOM 676 N VAL A 47 -0.599 26.766 -17.588 1.00 73.13 N ATOM 677 CA VAL A 47 0.780 26.579 -18.023 1.00 53.45 C ATOM 678 C VAL A 47 1.737 26.590 -16.837 1.00 33.03 C ATOM 679 O VAL A 47 2.624 25.744 -16.733 1.00 73.24 O ATOM 680 CB VAL A 47 1.206 27.672 -19.022 1.00 73.12 C ATOM 681 CG1 VAL A 47 2.577 27.360 -19.602 1.00 0.31 C ATOM 682 CG2 VAL A 47 0.171 27.816 -20.128 1.00 34.44 C ATOM 0 H VAL A 47 -1.066 27.573 -18.001 1.00 73.13 H new ATOM 0 HA VAL A 47 0.828 25.608 -18.515 1.00 53.45 H new ATOM 0 HB VAL A 47 1.270 28.621 -18.490 1.00 73.12 H new ATOM 0 HG11 VAL A 47 2.861 28.143 -20.305 1.00 0.31 H new ATOM 0 HG12 VAL A 47 3.310 27.312 -18.797 1.00 0.31 H new ATOM 0 HG13 VAL A 47 2.543 26.402 -20.120 1.00 0.31 H new ATOM 0 HG21 VAL A 47 0.488 28.592 -20.824 1.00 34.44 H new ATOM 0 HG22 VAL A 47 0.073 26.870 -20.660 1.00 34.44 H new ATOM 0 HG23 VAL A 47 -0.790 28.089 -19.693 1.00 34.44 H new ATOM 692 N GLY A 48 1.550 27.555 -15.941 1.00 51.13 N ATOM 693 CA GLY A 48 2.404 27.658 -14.772 1.00 70.15 C ATOM 694 C GLY A 48 2.377 26.403 -13.923 1.00 1.15 C ATOM 695 O GLY A 48 3.375 26.048 -13.294 1.00 2.41 O ATOM 0 H GLY A 48 0.822 28.267 -16.004 1.00 51.13 H new ATOM 0 HA2 GLY A 48 3.428 27.856 -15.090 1.00 70.15 H new ATOM 0 HA3 GLY A 48 2.087 28.508 -14.168 1.00 70.15 H new ATOM 699 N LEU A 49 1.232 25.730 -13.901 1.00 22.22 N ATOM 700 CA LEU A 49 1.078 24.507 -13.120 1.00 2.33 C ATOM 701 C LEU A 49 1.930 23.381 -13.697 1.00 50.41 C ATOM 702 O LEU A 49 2.531 22.603 -12.958 1.00 23.03 O ATOM 703 CB LEU A 49 -0.391 24.084 -13.083 1.00 71.54 C ATOM 704 CG LEU A 49 -0.777 23.092 -11.985 1.00 42.01 C ATOM 705 CD1 LEU A 49 -1.434 23.815 -10.820 1.00 11.32 C ATOM 706 CD2 LEU A 49 -1.701 22.017 -12.538 1.00 31.13 C ATOM 0 H LEU A 49 0.397 26.010 -14.415 1.00 22.22 H new ATOM 0 HA LEU A 49 1.417 24.709 -12.104 1.00 2.33 H new ATOM 0 HB2 LEU A 49 -1.003 24.979 -12.968 1.00 71.54 H new ATOM 0 HB3 LEU A 49 -0.646 23.645 -14.047 1.00 71.54 H new ATOM 0 HG LEU A 49 0.131 22.610 -11.621 1.00 42.01 H new ATOM 0 HD11 LEU A 49 -1.702 23.093 -10.048 1.00 11.32 H new ATOM 0 HD12 LEU A 49 -0.739 24.546 -10.407 1.00 11.32 H new ATOM 0 HD13 LEU A 49 -2.333 24.324 -11.168 1.00 11.32 H new ATOM 0 HD21 LEU A 49 -1.965 21.320 -11.743 1.00 31.13 H new ATOM 0 HD22 LEU A 49 -2.606 22.481 -12.929 1.00 31.13 H new ATOM 0 HD23 LEU A 49 -1.194 21.478 -13.339 1.00 31.13 H new ATOM 718 N ALA A 50 1.978 23.303 -15.023 1.00 32.21 N ATOM 719 CA ALA A 50 2.759 22.275 -15.700 1.00 3.25 C ATOM 720 C ALA A 50 4.231 22.359 -15.310 1.00 1.13 C ATOM 721 O ALA A 50 4.853 21.351 -14.974 1.00 25.44 O ATOM 722 CB ALA A 50 2.603 22.401 -17.208 1.00 32.32 C ATOM 0 H ALA A 50 1.485 23.939 -15.650 1.00 32.21 H new ATOM 0 HA ALA A 50 2.382 21.302 -15.387 1.00 3.25 H new ATOM 0 HB1 ALA A 50 3.192 21.627 -17.701 1.00 32.32 H new ATOM 0 HB2 ALA A 50 1.553 22.284 -17.476 1.00 32.32 H new ATOM 0 HB3 ALA A 50 2.952 23.382 -17.529 1.00 32.32 H new ATOM 728 N LEU A 51 4.783 23.567 -15.357 1.00 71.52 N ATOM 729 CA LEU A 51 6.183 23.782 -15.009 1.00 41.13 C ATOM 730 C LEU A 51 6.441 23.433 -13.547 1.00 12.30 C ATOM 731 O LEU A 51 7.319 22.628 -13.236 1.00 10.50 O ATOM 732 CB LEU A 51 6.577 25.236 -15.276 1.00 23.11 C ATOM 733 CG LEU A 51 6.696 25.640 -16.746 1.00 5.33 C ATOM 734 CD1 LEU A 51 5.423 26.326 -17.216 1.00 0.15 C ATOM 735 CD2 LEU A 51 7.901 26.547 -16.953 1.00 54.33 C ATOM 0 H LEU A 51 4.282 24.412 -15.633 1.00 71.52 H new ATOM 0 HA LEU A 51 6.792 23.127 -15.632 1.00 41.13 H new ATOM 0 HB2 LEU A 51 5.841 25.884 -14.800 1.00 23.11 H new ATOM 0 HB3 LEU A 51 7.533 25.428 -14.789 1.00 23.11 H new ATOM 0 HG LEU A 51 6.838 24.738 -17.341 1.00 5.33 H new ATOM 0 HD11 LEU A 51 5.526 26.606 -18.264 1.00 0.15 H new ATOM 0 HD12 LEU A 51 4.580 25.644 -17.104 1.00 0.15 H new ATOM 0 HD13 LEU A 51 5.249 27.220 -16.617 1.00 0.15 H new ATOM 0 HD21 LEU A 51 7.971 26.825 -18.005 1.00 54.33 H new ATOM 0 HD22 LEU A 51 7.788 27.446 -16.347 1.00 54.33 H new ATOM 0 HD23 LEU A 51 8.808 26.020 -16.656 1.00 54.33 H new ATOM 747 N ARG A 52 5.668 24.043 -12.654 1.00 23.34 N ATOM 748 CA ARG A 52 5.812 23.796 -11.224 1.00 63.20 C ATOM 749 C ARG A 52 5.669 22.309 -10.912 1.00 13.11 C ATOM 750 O ARG A 52 6.411 21.759 -10.097 1.00 41.54 O ATOM 751 CB ARG A 52 4.771 24.596 -10.439 1.00 72.42 C ATOM 752 CG ARG A 52 5.112 24.761 -8.967 1.00 43.14 C ATOM 753 CD ARG A 52 5.578 26.176 -8.659 1.00 72.42 C ATOM 754 NE ARG A 52 6.976 26.384 -9.026 1.00 20.22 N ATOM 755 CZ ARG A 52 7.995 25.823 -8.384 1.00 43.14 C ATOM 756 NH1 ARG A 52 7.773 25.024 -7.350 1.00 1.10 N ATOM 757 NH2 ARG A 52 9.240 26.061 -8.778 1.00 10.01 N ATOM 0 H ARG A 52 4.936 24.711 -12.895 1.00 23.34 H new ATOM 0 HA ARG A 52 6.809 24.118 -10.924 1.00 63.20 H new ATOM 0 HB2 ARG A 52 4.666 25.582 -10.892 1.00 72.42 H new ATOM 0 HB3 ARG A 52 3.804 24.101 -10.526 1.00 72.42 H new ATOM 0 HG2 ARG A 52 4.237 24.525 -8.361 1.00 43.14 H new ATOM 0 HG3 ARG A 52 5.892 24.052 -8.691 1.00 43.14 H new ATOM 0 HD2 ARG A 52 4.952 26.889 -9.196 1.00 72.42 H new ATOM 0 HD3 ARG A 52 5.449 26.377 -7.595 1.00 72.42 H new ATOM 0 HE ARG A 52 7.181 26.993 -9.818 1.00 20.22 H new ATOM 0 HH11 ARG A 52 6.818 24.838 -7.045 1.00 1.10 H new ATOM 0 HH12 ARG A 52 8.558 24.595 -6.859 1.00 1.10 H new ATOM 0 HH21 ARG A 52 9.415 26.675 -9.574 1.00 10.01 H new ATOM 0 HH22 ARG A 52 10.022 25.630 -8.285 1.00 10.01 H new ATOM 771 N THR A 53 4.708 21.663 -11.565 1.00 31.41 N ATOM 772 CA THR A 53 4.465 20.241 -11.356 1.00 63.23 C ATOM 773 C THR A 53 5.600 19.399 -11.930 1.00 54.52 C ATOM 774 O THR A 53 5.991 18.387 -11.348 1.00 44.11 O ATOM 775 CB THR A 53 3.137 19.797 -11.998 1.00 41.42 C ATOM 776 OG1 THR A 53 2.050 20.547 -11.443 1.00 25.30 O ATOM 777 CG2 THR A 53 2.899 18.311 -11.778 1.00 44.03 C ATOM 0 H THR A 53 4.085 22.102 -12.243 1.00 31.41 H new ATOM 0 HA THR A 53 4.409 20.085 -10.279 1.00 63.23 H new ATOM 0 HB THR A 53 3.197 19.984 -13.070 1.00 41.42 H new ATOM 0 HG1 THR A 53 1.906 21.357 -11.975 1.00 25.30 H new ATOM 0 HG21 THR A 53 1.955 18.021 -12.240 1.00 44.03 H new ATOM 0 HG22 THR A 53 3.713 17.742 -12.227 1.00 44.03 H new ATOM 0 HG23 THR A 53 2.858 18.103 -10.709 1.00 44.03 H new ATOM 785 N LEU A 54 6.124 19.824 -13.074 1.00 45.22 N ATOM 786 CA LEU A 54 7.216 19.110 -13.727 1.00 71.32 C ATOM 787 C LEU A 54 8.364 18.862 -12.754 1.00 32.13 C ATOM 788 O LEU A 54 8.927 17.767 -12.706 1.00 55.13 O ATOM 789 CB LEU A 54 7.719 19.901 -14.936 1.00 11.02 C ATOM 790 CG LEU A 54 8.514 19.108 -15.973 1.00 44.24 C ATOM 791 CD1 LEU A 54 8.374 19.739 -17.350 1.00 0.31 C ATOM 792 CD2 LEU A 54 9.979 19.023 -15.571 1.00 24.43 C ATOM 0 H LEU A 54 5.811 20.659 -13.569 1.00 45.22 H new ATOM 0 HA LEU A 54 6.835 18.146 -14.064 1.00 71.32 H new ATOM 0 HB2 LEU A 54 6.860 20.352 -15.433 1.00 11.02 H new ATOM 0 HB3 LEU A 54 8.344 20.718 -14.576 1.00 11.02 H new ATOM 0 HG LEU A 54 8.110 18.097 -16.016 1.00 44.24 H new ATOM 0 HD11 LEU A 54 8.947 19.161 -18.075 1.00 0.31 H new ATOM 0 HD12 LEU A 54 7.324 19.748 -17.641 1.00 0.31 H new ATOM 0 HD13 LEU A 54 8.751 20.761 -17.322 1.00 0.31 H new ATOM 0 HD21 LEU A 54 10.530 18.455 -16.321 1.00 24.43 H new ATOM 0 HD22 LEU A 54 10.395 20.028 -15.499 1.00 24.43 H new ATOM 0 HD23 LEU A 54 10.063 18.525 -14.605 1.00 24.43 H new ATOM 804 N LEU A 55 8.705 19.884 -11.977 1.00 42.23 N ATOM 805 CA LEU A 55 9.785 19.777 -11.002 1.00 51.22 C ATOM 806 C LEU A 55 9.566 18.585 -10.076 1.00 11.53 C ATOM 807 O LEU A 55 10.490 17.819 -9.806 1.00 34.43 O ATOM 808 CB LEU A 55 9.887 21.064 -10.181 1.00 74.03 C ATOM 809 CG LEU A 55 11.286 21.665 -10.046 1.00 22.24 C ATOM 810 CD1 LEU A 55 11.241 23.172 -10.240 1.00 41.42 C ATOM 811 CD2 LEU A 55 11.887 21.318 -8.691 1.00 75.30 C ATOM 0 H LEU A 55 8.249 20.796 -12.003 1.00 42.23 H new ATOM 0 HA LEU A 55 10.718 19.625 -11.545 1.00 51.22 H new ATOM 0 HB2 LEU A 55 9.234 21.811 -10.632 1.00 74.03 H new ATOM 0 HB3 LEU A 55 9.501 20.865 -9.181 1.00 74.03 H new ATOM 0 HG LEU A 55 11.920 21.238 -10.823 1.00 22.24 H new ATOM 0 HD11 LEU A 55 12.246 23.582 -10.140 1.00 41.42 H new ATOM 0 HD12 LEU A 55 10.853 23.400 -11.233 1.00 41.42 H new ATOM 0 HD13 LEU A 55 10.591 23.617 -9.486 1.00 41.42 H new ATOM 0 HD21 LEU A 55 12.883 21.754 -8.612 1.00 75.30 H new ATOM 0 HD22 LEU A 55 11.253 21.716 -7.899 1.00 75.30 H new ATOM 0 HD23 LEU A 55 11.956 20.235 -8.590 1.00 75.30 H new ATOM 823 N ALA A 56 8.337 18.436 -9.594 1.00 35.54 N ATOM 824 CA ALA A 56 7.995 17.335 -8.701 1.00 60.21 C ATOM 825 C ALA A 56 7.970 16.007 -9.451 1.00 43.41 C ATOM 826 O ALA A 56 8.554 15.019 -9.005 1.00 73.31 O ATOM 827 CB ALA A 56 6.651 17.592 -8.036 1.00 2.43 C ATOM 0 H ALA A 56 7.561 19.063 -9.807 1.00 35.54 H new ATOM 0 HA ALA A 56 8.764 17.273 -7.931 1.00 60.21 H new ATOM 0 HB1 ALA A 56 6.409 16.762 -7.372 1.00 2.43 H new ATOM 0 HB2 ALA A 56 6.701 18.515 -7.459 1.00 2.43 H new ATOM 0 HB3 ALA A 56 5.879 17.683 -8.800 1.00 2.43 H new ATOM 833 N THR A 57 7.290 15.991 -10.593 1.00 63.24 N ATOM 834 CA THR A 57 7.188 14.784 -11.404 1.00 52.25 C ATOM 835 C THR A 57 8.565 14.197 -11.693 1.00 33.13 C ATOM 836 O THR A 57 8.810 13.015 -11.450 1.00 0.23 O ATOM 837 CB THR A 57 6.472 15.064 -12.739 1.00 72.33 C ATOM 838 OG1 THR A 57 7.252 15.963 -13.535 1.00 0.01 O ATOM 839 CG2 THR A 57 5.092 15.658 -12.499 1.00 60.33 C ATOM 0 H THR A 57 6.802 16.800 -10.977 1.00 63.24 H new ATOM 0 HA THR A 57 6.603 14.066 -10.829 1.00 52.25 H new ATOM 0 HB THR A 57 6.356 14.118 -13.269 1.00 72.33 H new ATOM 0 HG1 THR A 57 7.682 16.625 -12.954 1.00 0.01 H new ATOM 0 HG21 THR A 57 4.606 15.847 -13.456 1.00 60.33 H new ATOM 0 HG22 THR A 57 4.491 14.958 -11.919 1.00 60.33 H new ATOM 0 HG23 THR A 57 5.189 16.595 -11.950 1.00 60.33 H new ATOM 847 N VAL A 58 9.461 15.030 -12.212 1.00 24.32 N ATOM 848 CA VAL A 58 10.815 14.593 -12.531 1.00 62.05 C ATOM 849 C VAL A 58 11.581 14.209 -11.270 1.00 41.34 C ATOM 850 O VAL A 58 12.411 13.300 -11.288 1.00 44.44 O ATOM 851 CB VAL A 58 11.597 15.689 -13.280 1.00 14.32 C ATOM 852 CG1 VAL A 58 13.017 15.230 -13.569 1.00 64.40 C ATOM 853 CG2 VAL A 58 10.879 16.071 -14.566 1.00 12.14 C ATOM 0 H VAL A 58 9.274 16.011 -12.420 1.00 24.32 H new ATOM 0 HA VAL A 58 10.721 13.719 -13.175 1.00 62.05 H new ATOM 0 HB VAL A 58 11.649 16.572 -12.644 1.00 14.32 H new ATOM 0 HG11 VAL A 58 13.553 16.018 -14.098 1.00 64.40 H new ATOM 0 HG12 VAL A 58 13.527 15.011 -12.631 1.00 64.40 H new ATOM 0 HG13 VAL A 58 12.991 14.331 -14.185 1.00 64.40 H new ATOM 0 HG21 VAL A 58 11.445 16.846 -15.082 1.00 12.14 H new ATOM 0 HG22 VAL A 58 10.794 15.195 -15.209 1.00 12.14 H new ATOM 0 HG23 VAL A 58 9.883 16.446 -14.329 1.00 12.14 H new ATOM 863 N ASP A 59 11.296 14.907 -10.177 1.00 3.34 N ATOM 864 CA ASP A 59 11.957 14.639 -8.905 1.00 21.03 C ATOM 865 C ASP A 59 11.883 13.156 -8.556 1.00 62.42 C ATOM 866 O ASP A 59 12.885 12.546 -8.182 1.00 54.14 O ATOM 867 CB ASP A 59 11.320 15.470 -7.790 1.00 25.15 C ATOM 868 CG ASP A 59 12.311 16.408 -7.129 1.00 3.21 C ATOM 869 OD1 ASP A 59 13.404 15.942 -6.745 1.00 30.21 O ATOM 870 OD2 ASP A 59 11.994 17.609 -6.995 1.00 74.32 O ATOM 0 H ASP A 59 10.612 15.663 -10.146 1.00 3.34 H new ATOM 0 HA ASP A 59 13.006 14.919 -9.003 1.00 21.03 H new ATOM 0 HB2 ASP A 59 10.493 16.050 -8.200 1.00 25.15 H new ATOM 0 HB3 ASP A 59 10.899 14.802 -7.038 1.00 25.15 H new ATOM 875 N GLU A 60 10.690 12.582 -8.680 1.00 43.35 N ATOM 876 CA GLU A 60 10.486 11.171 -8.376 1.00 64.15 C ATOM 877 C GLU A 60 10.966 10.292 -9.528 1.00 32.41 C ATOM 878 O GLU A 60 11.123 9.080 -9.374 1.00 42.42 O ATOM 879 CB GLU A 60 9.008 10.896 -8.092 1.00 24.05 C ATOM 880 CG GLU A 60 8.082 11.326 -9.216 1.00 75.11 C ATOM 881 CD GLU A 60 6.633 10.965 -8.949 1.00 2.14 C ATOM 882 OE1 GLU A 60 6.213 11.027 -7.775 1.00 12.55 O ATOM 883 OE2 GLU A 60 5.920 10.620 -9.914 1.00 42.44 O ATOM 0 H GLU A 60 9.851 13.073 -8.989 1.00 43.35 H new ATOM 0 HA GLU A 60 11.070 10.929 -7.488 1.00 64.15 H new ATOM 0 HB2 GLU A 60 8.874 9.830 -7.910 1.00 24.05 H new ATOM 0 HB3 GLU A 60 8.720 11.414 -7.177 1.00 24.05 H new ATOM 0 HG2 GLU A 60 8.164 12.404 -9.357 1.00 75.11 H new ATOM 0 HG3 GLU A 60 8.404 10.858 -10.146 1.00 75.11 H new ATOM 890 N SER A 61 11.196 10.911 -10.681 1.00 74.45 N ATOM 891 CA SER A 61 11.653 10.185 -11.861 1.00 34.33 C ATOM 892 C SER A 61 13.115 9.776 -11.714 1.00 43.31 C ATOM 893 O SER A 61 13.568 8.813 -12.334 1.00 22.23 O ATOM 894 CB SER A 61 11.474 11.043 -13.115 1.00 21.33 C ATOM 895 OG SER A 61 11.384 10.236 -14.276 1.00 61.22 O ATOM 0 H SER A 61 11.074 11.914 -10.824 1.00 74.45 H new ATOM 0 HA SER A 61 11.050 9.282 -11.959 1.00 34.33 H new ATOM 0 HB2 SER A 61 10.573 11.649 -13.019 1.00 21.33 H new ATOM 0 HB3 SER A 61 12.313 11.732 -13.211 1.00 21.33 H new ATOM 0 HG SER A 61 11.994 9.474 -14.193 1.00 61.22 H new ATOM 901 N LEU A 62 13.850 10.516 -10.890 1.00 74.24 N ATOM 902 CA LEU A 62 15.262 10.232 -10.661 1.00 0.11 C ATOM 903 C LEU A 62 15.472 8.763 -10.311 1.00 23.54 C ATOM 904 O LEU A 62 16.170 8.026 -11.008 1.00 44.53 O ATOM 905 CB LEU A 62 15.805 11.118 -9.538 1.00 53.44 C ATOM 906 CG LEU A 62 16.640 12.322 -9.978 1.00 32.35 C ATOM 907 CD1 LEU A 62 17.090 13.128 -8.770 1.00 1.45 C ATOM 908 CD2 LEU A 62 17.840 11.868 -10.796 1.00 30.14 C ATOM 0 H LEU A 62 13.491 11.317 -10.370 1.00 74.24 H new ATOM 0 HA LEU A 62 15.805 10.448 -11.581 1.00 0.11 H new ATOM 0 HB2 LEU A 62 14.963 11.481 -8.949 1.00 53.44 H new ATOM 0 HB3 LEU A 62 16.414 10.501 -8.877 1.00 53.44 H new ATOM 0 HG LEU A 62 16.019 12.962 -10.605 1.00 32.35 H new ATOM 0 HD11 LEU A 62 17.683 13.981 -9.102 1.00 1.45 H new ATOM 0 HD12 LEU A 62 16.216 13.484 -8.224 1.00 1.45 H new ATOM 0 HD13 LEU A 62 17.694 12.498 -8.117 1.00 1.45 H new ATOM 0 HD21 LEU A 62 18.423 12.737 -11.101 1.00 30.14 H new ATOM 0 HD22 LEU A 62 18.463 11.207 -10.193 1.00 30.14 H new ATOM 0 HD23 LEU A 62 17.496 11.334 -11.681 1.00 30.14 H new ATOM 920 N PRO A 63 14.853 8.323 -9.205 1.00 60.10 N ATOM 921 CA PRO A 63 14.955 6.937 -8.739 1.00 21.04 C ATOM 922 C PRO A 63 14.224 5.962 -9.655 1.00 34.35 C ATOM 923 O PRO A 63 14.692 4.848 -9.893 1.00 52.54 O ATOM 924 CB PRO A 63 14.291 6.977 -7.360 1.00 73.22 C ATOM 925 CG PRO A 63 13.353 8.133 -7.425 1.00 30.41 C ATOM 926 CD PRO A 63 14.005 9.145 -8.325 1.00 61.05 C ATOM 0 HA PRO A 63 15.987 6.588 -8.720 1.00 21.04 H new ATOM 0 HB2 PRO A 63 13.761 6.048 -7.149 1.00 73.22 H new ATOM 0 HB3 PRO A 63 15.029 7.110 -6.569 1.00 73.22 H new ATOM 0 HG2 PRO A 63 12.384 7.827 -7.819 1.00 30.41 H new ATOM 0 HG3 PRO A 63 13.177 8.549 -6.433 1.00 30.41 H new ATOM 0 HD2 PRO A 63 13.267 9.712 -8.893 1.00 61.05 H new ATOM 0 HD3 PRO A 63 14.594 9.866 -7.758 1.00 61.05 H new ATOM 934 N VAL A 64 13.072 6.387 -10.166 1.00 25.14 N ATOM 935 CA VAL A 64 12.277 5.551 -11.057 1.00 52.40 C ATOM 936 C VAL A 64 13.102 5.078 -12.248 1.00 73.14 C ATOM 937 O VAL A 64 12.804 4.047 -12.854 1.00 13.33 O ATOM 938 CB VAL A 64 11.036 6.304 -11.573 1.00 13.04 C ATOM 939 CG1 VAL A 64 10.318 5.486 -12.636 1.00 24.04 C ATOM 940 CG2 VAL A 64 10.099 6.637 -10.422 1.00 35.35 C ATOM 0 H VAL A 64 12.669 7.305 -9.978 1.00 25.14 H new ATOM 0 HA VAL A 64 11.954 4.687 -10.476 1.00 52.40 H new ATOM 0 HB VAL A 64 11.363 7.239 -12.028 1.00 13.04 H new ATOM 0 HG11 VAL A 64 9.444 6.034 -12.988 1.00 24.04 H new ATOM 0 HG12 VAL A 64 10.993 5.303 -13.472 1.00 24.04 H new ATOM 0 HG13 VAL A 64 10.002 4.534 -12.210 1.00 24.04 H new ATOM 0 HG21 VAL A 64 9.228 7.169 -10.804 1.00 35.35 H new ATOM 0 HG22 VAL A 64 9.778 5.716 -9.936 1.00 35.35 H new ATOM 0 HG23 VAL A 64 10.619 7.266 -9.699 1.00 35.35 H new ATOM 950 N LEU A 65 14.141 5.836 -12.580 1.00 53.22 N ATOM 951 CA LEU A 65 15.011 5.494 -13.700 1.00 10.20 C ATOM 952 C LEU A 65 16.393 5.076 -13.208 1.00 12.22 C ATOM 953 O LEU A 65 16.808 5.403 -12.096 1.00 32.03 O ATOM 954 CB LEU A 65 15.135 6.682 -14.656 1.00 63.21 C ATOM 955 CG LEU A 65 14.027 6.821 -15.701 1.00 4.43 C ATOM 956 CD1 LEU A 65 14.439 6.160 -17.007 1.00 33.22 C ATOM 957 CD2 LEU A 65 12.728 6.222 -15.183 1.00 71.02 C ATOM 0 H LEU A 65 14.402 6.692 -12.090 1.00 53.22 H new ATOM 0 HA LEU A 65 14.565 4.653 -14.231 1.00 10.20 H new ATOM 0 HB2 LEU A 65 15.166 7.597 -14.064 1.00 63.21 H new ATOM 0 HB3 LEU A 65 16.090 6.606 -15.176 1.00 63.21 H new ATOM 0 HG LEU A 65 13.864 7.882 -15.891 1.00 4.43 H new ATOM 0 HD11 LEU A 65 13.638 6.269 -17.738 1.00 33.22 H new ATOM 0 HD12 LEU A 65 15.344 6.635 -17.386 1.00 33.22 H new ATOM 0 HD13 LEU A 65 14.631 5.101 -16.834 1.00 33.22 H new ATOM 0 HD21 LEU A 65 11.951 6.330 -15.939 1.00 71.02 H new ATOM 0 HD22 LEU A 65 12.877 5.165 -14.964 1.00 71.02 H new ATOM 0 HD23 LEU A 65 12.425 6.742 -14.274 1.00 71.02 H new ATOM 969 N PRO A 66 17.125 4.338 -14.055 1.00 73.41 N ATOM 970 CA PRO A 66 18.472 3.861 -13.729 1.00 42.32 C ATOM 971 C PRO A 66 19.492 4.994 -13.682 1.00 13.33 C ATOM 972 O PRO A 66 19.537 5.839 -14.576 1.00 22.34 O ATOM 973 CB PRO A 66 18.795 2.899 -14.875 1.00 1.10 C ATOM 974 CG PRO A 66 17.953 3.367 -16.011 1.00 42.14 C ATOM 975 CD PRO A 66 16.693 3.911 -15.397 1.00 22.12 C ATOM 0 HA PRO A 66 18.513 3.399 -12.742 1.00 42.32 H new ATOM 0 HB2 PRO A 66 19.855 2.928 -15.129 1.00 1.10 H new ATOM 0 HB3 PRO A 66 18.560 1.869 -14.606 1.00 1.10 H new ATOM 0 HG2 PRO A 66 18.468 4.135 -16.588 1.00 42.14 H new ATOM 0 HG3 PRO A 66 17.731 2.548 -16.696 1.00 42.14 H new ATOM 0 HD2 PRO A 66 16.292 4.744 -15.974 1.00 22.12 H new ATOM 0 HD3 PRO A 66 15.911 3.153 -15.345 1.00 22.12 H new ATOM 983 N ALA A 67 20.308 5.006 -12.633 1.00 63.32 N ATOM 984 CA ALA A 67 21.329 6.034 -12.471 1.00 71.31 C ATOM 985 C ALA A 67 22.213 6.129 -13.710 1.00 4.44 C ATOM 986 O ALA A 67 22.938 5.191 -14.041 1.00 30.14 O ATOM 987 CB ALA A 67 22.173 5.749 -11.238 1.00 3.12 C ATOM 0 H ALA A 67 20.282 4.315 -11.883 1.00 63.32 H new ATOM 0 HA ALA A 67 20.827 6.993 -12.340 1.00 71.31 H new ATOM 0 HB1 ALA A 67 22.931 6.524 -11.129 1.00 3.12 H new ATOM 0 HB2 ALA A 67 21.535 5.739 -10.355 1.00 3.12 H new ATOM 0 HB3 ALA A 67 22.659 4.779 -11.346 1.00 3.12 H new ATOM 993 N SER A 68 22.149 7.269 -14.391 1.00 34.21 N ATOM 994 CA SER A 68 22.941 7.485 -15.596 1.00 55.00 C ATOM 995 C SER A 68 22.647 8.855 -16.201 1.00 32.43 C ATOM 996 O SER A 68 23.526 9.492 -16.782 1.00 12.01 O ATOM 997 CB SER A 68 22.653 6.389 -16.624 1.00 23.10 C ATOM 998 OG SER A 68 23.715 5.453 -16.681 1.00 64.52 O ATOM 0 H SER A 68 21.557 8.057 -14.129 1.00 34.21 H new ATOM 0 HA SER A 68 23.995 7.447 -15.320 1.00 55.00 H new ATOM 0 HB2 SER A 68 21.726 5.877 -16.365 1.00 23.10 H new ATOM 0 HB3 SER A 68 22.506 6.837 -17.607 1.00 23.10 H new ATOM 0 HG SER A 68 23.839 5.045 -15.799 1.00 64.52 H new ATOM 1004 N THR A 69 21.403 9.302 -16.060 1.00 10.53 N ATOM 1005 CA THR A 69 20.991 10.595 -16.592 1.00 41.10 C ATOM 1006 C THR A 69 20.687 11.581 -15.469 1.00 63.44 C ATOM 1007 O THR A 69 19.895 12.508 -15.641 1.00 31.52 O ATOM 1008 CB THR A 69 19.749 10.462 -17.493 1.00 33.32 C ATOM 1009 OG1 THR A 69 19.426 11.730 -18.073 1.00 15.43 O ATOM 1010 CG2 THR A 69 18.559 9.943 -16.700 1.00 34.11 C ATOM 0 H THR A 69 20.663 8.788 -15.582 1.00 10.53 H new ATOM 0 HA THR A 69 21.824 10.971 -17.186 1.00 41.10 H new ATOM 0 HB THR A 69 19.977 9.749 -18.285 1.00 33.32 H new ATOM 0 HG1 THR A 69 19.409 12.415 -17.373 1.00 15.43 H new ATOM 0 HG21 THR A 69 17.693 9.857 -17.357 1.00 34.11 H new ATOM 0 HG22 THR A 69 18.798 8.964 -16.285 1.00 34.11 H new ATOM 0 HG23 THR A 69 18.332 10.635 -15.889 1.00 34.11 H new ATOM 1018 N HIS A 70 21.323 11.375 -14.320 1.00 14.21 N ATOM 1019 CA HIS A 70 21.121 12.248 -13.168 1.00 73.44 C ATOM 1020 C HIS A 70 21.526 13.682 -13.496 1.00 21.45 C ATOM 1021 O HIS A 70 20.828 14.631 -13.139 1.00 23.15 O ATOM 1022 CB HIS A 70 21.923 11.739 -11.970 1.00 53.20 C ATOM 1023 CG HIS A 70 23.368 11.495 -12.277 1.00 21.31 C ATOM 1024 ND1 HIS A 70 24.343 12.458 -12.124 1.00 62.33 N ATOM 1025 CD2 HIS A 70 24.002 10.387 -12.728 1.00 43.54 C ATOM 1026 CE1 HIS A 70 25.514 11.954 -12.470 1.00 63.03 C ATOM 1027 NE2 HIS A 70 25.335 10.699 -12.840 1.00 61.24 N ATOM 0 H HIS A 70 21.982 10.612 -14.162 1.00 14.21 H new ATOM 0 HA HIS A 70 20.061 12.238 -12.916 1.00 73.44 H new ATOM 0 HB2 HIS A 70 21.850 12.464 -11.160 1.00 53.20 H new ATOM 0 HB3 HIS A 70 21.475 10.813 -11.610 1.00 53.20 H new ATOM 0 HD2 HIS A 70 23.545 9.436 -12.957 1.00 43.54 H new ATOM 0 HE1 HIS A 70 26.458 12.479 -12.453 1.00 63.03 H new ATOM 0 HE2 HIS A 70 26.068 10.064 -13.157 1.00 61.24 H new ATOM 1035 N ARG A 71 22.658 13.831 -14.176 1.00 22.24 N ATOM 1036 CA ARG A 71 23.157 15.149 -14.549 1.00 22.13 C ATOM 1037 C ARG A 71 22.075 15.959 -15.256 1.00 43.54 C ATOM 1038 O ARG A 71 21.706 17.044 -14.807 1.00 75.40 O ATOM 1039 CB ARG A 71 24.384 15.016 -15.453 1.00 53.13 C ATOM 1040 CG ARG A 71 25.154 16.315 -15.630 1.00 32.42 C ATOM 1041 CD ARG A 71 24.844 16.968 -16.967 1.00 42.44 C ATOM 1042 NE ARG A 71 25.808 16.590 -17.998 1.00 12.15 N ATOM 1043 CZ ARG A 71 25.774 17.054 -19.242 1.00 14.23 C ATOM 1044 NH1 ARG A 71 24.829 17.910 -19.608 1.00 62.41 N ATOM 1045 NH2 ARG A 71 26.686 16.663 -20.122 1.00 71.14 N ATOM 0 H ARG A 71 23.247 13.055 -14.480 1.00 22.24 H new ATOM 0 HA ARG A 71 23.442 15.674 -13.637 1.00 22.13 H new ATOM 0 HB2 ARG A 71 25.052 14.262 -15.037 1.00 53.13 H new ATOM 0 HB3 ARG A 71 24.067 14.655 -16.431 1.00 53.13 H new ATOM 0 HG2 ARG A 71 24.902 17.001 -14.822 1.00 32.42 H new ATOM 0 HG3 ARG A 71 26.224 16.118 -15.559 1.00 32.42 H new ATOM 0 HD2 ARG A 71 23.842 16.683 -17.286 1.00 42.44 H new ATOM 0 HD3 ARG A 71 24.845 18.052 -16.850 1.00 42.44 H new ATOM 0 HE ARG A 71 26.548 15.934 -17.749 1.00 12.15 H new ATOM 0 HH11 ARG A 71 24.127 18.213 -18.933 1.00 62.41 H new ATOM 0 HH12 ARG A 71 24.805 18.265 -20.564 1.00 62.41 H new ATOM 0 HH21 ARG A 71 27.414 16.005 -19.844 1.00 71.14 H new ATOM 0 HH22 ARG A 71 26.659 17.020 -21.077 1.00 71.14 H new ATOM 1059 N GLU A 72 21.573 15.426 -16.366 1.00 23.55 N ATOM 1060 CA GLU A 72 20.535 16.101 -17.135 1.00 61.34 C ATOM 1061 C GLU A 72 19.286 16.322 -16.287 1.00 41.52 C ATOM 1062 O GLU A 72 18.718 17.415 -16.274 1.00 2.02 O ATOM 1063 CB GLU A 72 20.181 15.285 -18.381 1.00 10.32 C ATOM 1064 CG GLU A 72 21.378 14.971 -19.263 1.00 35.52 C ATOM 1065 CD GLU A 72 21.002 14.158 -20.487 1.00 43.30 C ATOM 1066 OE1 GLU A 72 20.354 14.720 -21.395 1.00 32.22 O ATOM 1067 OE2 GLU A 72 21.356 12.962 -20.537 1.00 45.05 O ATOM 0 H GLU A 72 21.869 14.529 -16.752 1.00 23.55 H new ATOM 0 HA GLU A 72 20.921 17.073 -17.443 1.00 61.34 H new ATOM 0 HB2 GLU A 72 19.713 14.350 -18.072 1.00 10.32 H new ATOM 0 HB3 GLU A 72 19.443 15.833 -18.966 1.00 10.32 H new ATOM 0 HG2 GLU A 72 21.846 15.903 -19.580 1.00 35.52 H new ATOM 0 HG3 GLU A 72 22.120 14.424 -18.681 1.00 35.52 H new ATOM 1074 N ILE A 73 18.864 15.279 -15.582 1.00 24.44 N ATOM 1075 CA ILE A 73 17.684 15.359 -14.731 1.00 13.14 C ATOM 1076 C ILE A 73 17.795 16.516 -13.744 1.00 3.05 C ATOM 1077 O ILE A 73 16.856 17.292 -13.574 1.00 52.30 O ATOM 1078 CB ILE A 73 17.463 14.051 -13.948 1.00 64.12 C ATOM 1079 CG1 ILE A 73 16.964 12.949 -14.885 1.00 33.13 C ATOM 1080 CG2 ILE A 73 16.478 14.274 -12.811 1.00 22.35 C ATOM 1081 CD1 ILE A 73 15.581 13.210 -15.441 1.00 64.50 C ATOM 0 H ILE A 73 19.322 14.368 -15.583 1.00 24.44 H new ATOM 0 HA ILE A 73 16.832 15.526 -15.390 1.00 13.14 H new ATOM 0 HB ILE A 73 18.415 13.735 -13.520 1.00 64.12 H new ATOM 0 HG12 ILE A 73 17.665 12.841 -15.712 1.00 33.13 H new ATOM 0 HG13 ILE A 73 16.958 12.001 -14.347 1.00 33.13 H new ATOM 0 HG21 ILE A 73 16.332 13.341 -12.267 1.00 22.35 H new ATOM 0 HG22 ILE A 73 16.871 15.032 -12.133 1.00 22.35 H new ATOM 0 HG23 ILE A 73 15.524 14.610 -13.217 1.00 22.35 H new ATOM 0 HD11 ILE A 73 15.291 12.389 -16.097 1.00 64.50 H new ATOM 0 HD12 ILE A 73 14.868 13.288 -14.620 1.00 64.50 H new ATOM 0 HD13 ILE A 73 15.586 14.142 -16.007 1.00 64.50 H new ATOM 1093 N GLU A 74 18.951 16.625 -13.096 1.00 43.12 N ATOM 1094 CA GLU A 74 19.186 17.689 -12.127 1.00 34.34 C ATOM 1095 C GLU A 74 19.059 19.061 -12.783 1.00 24.44 C ATOM 1096 O GLU A 74 18.301 19.913 -12.322 1.00 33.01 O ATOM 1097 CB GLU A 74 20.572 17.538 -11.496 1.00 52.23 C ATOM 1098 CG GLU A 74 20.535 17.276 -10.000 1.00 71.11 C ATOM 1099 CD GLU A 74 21.914 17.040 -9.415 1.00 12.40 C ATOM 1100 OE1 GLU A 74 22.799 17.897 -9.621 1.00 22.00 O ATOM 1101 OE2 GLU A 74 22.108 16.000 -8.752 1.00 11.53 O ATOM 0 H GLU A 74 19.739 15.990 -13.225 1.00 43.12 H new ATOM 0 HA GLU A 74 18.429 17.608 -11.347 1.00 34.34 H new ATOM 0 HB2 GLU A 74 21.098 16.719 -11.987 1.00 52.23 H new ATOM 0 HB3 GLU A 74 21.148 18.444 -11.683 1.00 52.23 H new ATOM 0 HG2 GLU A 74 20.072 18.125 -9.498 1.00 71.11 H new ATOM 0 HG3 GLU A 74 19.907 16.407 -9.802 1.00 71.11 H new ATOM 1108 N MET A 75 19.809 19.266 -13.861 1.00 20.33 N ATOM 1109 CA MET A 75 19.781 20.533 -14.581 1.00 12.52 C ATOM 1110 C MET A 75 18.384 20.820 -15.123 1.00 61.42 C ATOM 1111 O MET A 75 18.007 21.975 -15.313 1.00 15.55 O ATOM 1112 CB MET A 75 20.792 20.515 -15.728 1.00 44.44 C ATOM 1113 CG MET A 75 22.218 20.239 -15.278 1.00 35.31 C ATOM 1114 SD MET A 75 23.275 21.695 -15.387 1.00 25.31 S ATOM 1115 CE MET A 75 23.526 21.799 -17.157 1.00 65.03 C ATOM 0 H MET A 75 20.443 18.571 -14.255 1.00 20.33 H new ATOM 0 HA MET A 75 20.050 21.325 -13.882 1.00 12.52 H new ATOM 0 HB2 MET A 75 20.495 19.756 -16.451 1.00 44.44 H new ATOM 0 HB3 MET A 75 20.762 21.475 -16.243 1.00 44.44 H new ATOM 0 HG2 MET A 75 22.207 19.879 -14.249 1.00 35.31 H new ATOM 0 HG3 MET A 75 22.640 19.442 -15.890 1.00 35.31 H new ATOM 0 HE1 MET A 75 24.177 22.643 -17.383 1.00 65.03 H new ATOM 0 HE2 MET A 75 23.988 20.878 -17.514 1.00 65.03 H new ATOM 0 HE3 MET A 75 22.566 21.939 -17.653 1.00 65.03 H new ATOM 1125 N ALA A 76 17.622 19.760 -15.371 1.00 72.43 N ATOM 1126 CA ALA A 76 16.267 19.898 -15.890 1.00 73.22 C ATOM 1127 C ALA A 76 15.349 20.551 -14.862 1.00 43.53 C ATOM 1128 O ALA A 76 14.451 21.314 -15.216 1.00 53.22 O ATOM 1129 CB ALA A 76 15.718 18.540 -16.302 1.00 22.41 C ATOM 0 H ALA A 76 17.920 18.796 -15.221 1.00 72.43 H new ATOM 0 HA ALA A 76 16.305 20.544 -16.767 1.00 73.22 H new ATOM 0 HB1 ALA A 76 14.705 18.659 -16.688 1.00 22.41 H new ATOM 0 HB2 ALA A 76 16.353 18.111 -17.077 1.00 22.41 H new ATOM 0 HB3 ALA A 76 15.701 17.877 -15.437 1.00 22.41 H new ATOM 1135 N GLN A 77 15.582 20.247 -13.590 1.00 20.23 N ATOM 1136 CA GLN A 77 14.775 20.805 -12.511 1.00 74.53 C ATOM 1137 C GLN A 77 14.833 22.328 -12.520 1.00 10.53 C ATOM 1138 O GLN A 77 13.807 22.999 -12.632 1.00 13.34 O ATOM 1139 CB GLN A 77 15.253 20.271 -11.160 1.00 12.44 C ATOM 1140 CG GLN A 77 15.443 18.763 -11.133 1.00 15.40 C ATOM 1141 CD GLN A 77 14.744 18.108 -9.958 1.00 74.13 C ATOM 1142 OE1 GLN A 77 15.115 18.319 -8.803 1.00 52.34 O ATOM 1143 NE2 GLN A 77 13.725 17.307 -10.247 1.00 71.42 N ATOM 0 H GLN A 77 16.323 19.618 -13.281 1.00 20.23 H new ATOM 0 HA GLN A 77 13.741 20.499 -12.668 1.00 74.53 H new ATOM 0 HB2 GLN A 77 16.196 20.752 -10.902 1.00 12.44 H new ATOM 0 HB3 GLN A 77 14.532 20.552 -10.392 1.00 12.44 H new ATOM 0 HG2 GLN A 77 15.063 18.336 -12.061 1.00 15.40 H new ATOM 0 HG3 GLN A 77 16.508 18.535 -11.090 1.00 15.40 H new ATOM 0 HE21 GLN A 77 13.451 17.160 -11.219 1.00 71.42 H new ATOM 0 HE22 GLN A 77 13.216 16.838 -9.497 1.00 71.42 H new ATOM 1152 N LYS A 78 16.040 22.870 -12.400 1.00 64.01 N ATOM 1153 CA LYS A 78 16.234 24.315 -12.395 1.00 2.13 C ATOM 1154 C LYS A 78 15.775 24.931 -13.712 1.00 75.34 C ATOM 1155 O LYS A 78 15.257 26.048 -13.740 1.00 52.02 O ATOM 1156 CB LYS A 78 17.707 24.652 -12.148 1.00 74.14 C ATOM 1157 CG LYS A 78 17.953 26.121 -11.850 1.00 31.31 C ATOM 1158 CD LYS A 78 19.437 26.423 -11.726 1.00 52.54 C ATOM 1159 CE LYS A 78 19.729 27.893 -11.985 1.00 41.55 C ATOM 1160 NZ LYS A 78 19.969 28.165 -13.430 1.00 15.11 N ATOM 0 H LYS A 78 16.900 22.329 -12.305 1.00 64.01 H new ATOM 0 HA LYS A 78 15.631 24.734 -11.589 1.00 2.13 H new ATOM 0 HB2 LYS A 78 18.073 24.054 -11.313 1.00 74.14 H new ATOM 0 HB3 LYS A 78 18.289 24.365 -13.024 1.00 74.14 H new ATOM 0 HG2 LYS A 78 17.521 26.731 -12.643 1.00 31.31 H new ATOM 0 HG3 LYS A 78 17.446 26.396 -10.925 1.00 31.31 H new ATOM 0 HD2 LYS A 78 19.783 26.152 -10.728 1.00 52.54 H new ATOM 0 HD3 LYS A 78 19.995 25.810 -12.434 1.00 52.54 H new ATOM 0 HE2 LYS A 78 18.891 28.497 -11.636 1.00 41.55 H new ATOM 0 HE3 LYS A 78 20.603 28.197 -11.408 1.00 41.55 H new ATOM 0 HZ1 LYS A 78 20.164 29.178 -13.565 1.00 15.11 H new ATOM 0 HZ2 LYS A 78 20.784 27.608 -13.757 1.00 15.11 H new ATOM 0 HZ3 LYS A 78 19.126 27.899 -13.978 1.00 15.11 H new ATOM 1174 N LEU A 79 15.965 24.195 -14.802 1.00 4.20 N ATOM 1175 CA LEU A 79 15.569 24.668 -16.124 1.00 14.43 C ATOM 1176 C LEU A 79 14.104 25.094 -16.133 1.00 0.45 C ATOM 1177 O LEU A 79 13.783 26.247 -16.427 1.00 62.41 O ATOM 1178 CB LEU A 79 15.800 23.576 -17.169 1.00 21.21 C ATOM 1179 CG LEU A 79 16.030 24.056 -18.602 1.00 51.03 C ATOM 1180 CD1 LEU A 79 14.794 24.766 -19.132 1.00 73.21 C ATOM 1181 CD2 LEU A 79 17.243 24.972 -18.670 1.00 2.12 C ATOM 0 H LEU A 79 16.391 23.268 -14.796 1.00 4.20 H new ATOM 0 HA LEU A 79 16.183 25.534 -16.371 1.00 14.43 H new ATOM 0 HB2 LEU A 79 16.663 22.984 -16.862 1.00 21.21 H new ATOM 0 HB3 LEU A 79 14.938 22.909 -17.165 1.00 21.21 H new ATOM 0 HG LEU A 79 16.221 23.186 -19.230 1.00 51.03 H new ATOM 0 HD11 LEU A 79 14.976 25.101 -20.153 1.00 73.21 H new ATOM 0 HD12 LEU A 79 13.947 24.080 -19.121 1.00 73.21 H new ATOM 0 HD13 LEU A 79 14.571 25.627 -18.502 1.00 73.21 H new ATOM 0 HD21 LEU A 79 17.391 25.304 -19.698 1.00 2.12 H new ATOM 0 HD22 LEU A 79 17.081 25.838 -18.029 1.00 2.12 H new ATOM 0 HD23 LEU A 79 18.127 24.431 -18.332 1.00 2.12 H new ATOM 1193 N LEU A 80 13.219 24.159 -15.806 1.00 63.21 N ATOM 1194 CA LEU A 80 11.788 24.437 -15.774 1.00 13.50 C ATOM 1195 C LEU A 80 11.487 25.638 -14.883 1.00 54.30 C ATOM 1196 O LEU A 80 10.671 26.492 -15.230 1.00 30.44 O ATOM 1197 CB LEU A 80 11.021 23.212 -15.274 1.00 53.00 C ATOM 1198 CG LEU A 80 10.089 22.544 -16.286 1.00 43.23 C ATOM 1199 CD1 LEU A 80 9.128 23.562 -16.880 1.00 43.41 C ATOM 1200 CD2 LEU A 80 10.894 21.864 -17.384 1.00 43.42 C ATOM 0 H LEU A 80 13.468 23.201 -15.559 1.00 63.21 H new ATOM 0 HA LEU A 80 11.465 24.670 -16.789 1.00 13.50 H new ATOM 0 HB2 LEU A 80 11.743 22.471 -14.931 1.00 53.00 H new ATOM 0 HB3 LEU A 80 10.431 23.507 -14.406 1.00 53.00 H new ATOM 0 HG LEU A 80 9.505 21.784 -15.767 1.00 43.23 H new ATOM 0 HD11 LEU A 80 8.473 23.068 -17.598 1.00 43.41 H new ATOM 0 HD12 LEU A 80 8.528 24.003 -16.084 1.00 43.41 H new ATOM 0 HD13 LEU A 80 9.694 24.345 -17.384 1.00 43.41 H new ATOM 0 HD21 LEU A 80 10.215 21.394 -18.095 1.00 43.42 H new ATOM 0 HD22 LEU A 80 11.504 22.605 -17.900 1.00 43.42 H new ATOM 0 HD23 LEU A 80 11.541 21.105 -16.944 1.00 43.42 H new ATOM 1212 N ASN A 81 12.153 25.698 -13.734 1.00 54.34 N ATOM 1213 CA ASN A 81 11.957 26.796 -12.794 1.00 64.11 C ATOM 1214 C ASN A 81 12.141 28.144 -13.485 1.00 65.52 C ATOM 1215 O ASN A 81 11.211 28.946 -13.562 1.00 71.51 O ATOM 1216 CB ASN A 81 12.935 26.672 -11.624 1.00 3.51 C ATOM 1217 CG ASN A 81 12.371 27.243 -10.337 1.00 25.33 C ATOM 1218 OD1 ASN A 81 11.707 28.279 -10.343 1.00 1.15 O ATOM 1219 ND2 ASN A 81 12.635 26.566 -9.225 1.00 2.43 N ATOM 0 H ASN A 81 12.832 25.000 -13.432 1.00 54.34 H new ATOM 0 HA ASN A 81 10.937 26.739 -12.415 1.00 64.11 H new ATOM 0 HB2 ASN A 81 13.186 25.622 -11.473 1.00 3.51 H new ATOM 0 HB3 ASN A 81 13.862 27.189 -11.872 1.00 3.51 H new ATOM 0 HD21 ASN A 81 12.283 26.901 -8.328 1.00 2.43 H new ATOM 0 HD22 ASN A 81 13.190 25.711 -9.268 1.00 2.43 H new ATOM 1226 N SER A 82 13.348 28.385 -13.987 1.00 43.02 N ATOM 1227 CA SER A 82 13.656 29.637 -14.669 1.00 60.54 C ATOM 1228 C SER A 82 12.644 29.915 -15.776 1.00 54.13 C ATOM 1229 O SER A 82 12.085 31.009 -15.861 1.00 32.23 O ATOM 1230 CB SER A 82 15.069 29.589 -15.255 1.00 34.20 C ATOM 1231 OG SER A 82 15.869 30.640 -14.743 1.00 11.14 O ATOM 0 H SER A 82 14.128 27.730 -13.934 1.00 43.02 H new ATOM 0 HA SER A 82 13.601 30.444 -13.938 1.00 60.54 H new ATOM 0 HB2 SER A 82 15.531 28.630 -15.022 1.00 34.20 H new ATOM 0 HB3 SER A 82 15.018 29.662 -16.341 1.00 34.20 H new ATOM 0 HG SER A 82 16.767 30.586 -15.131 1.00 11.14 H new ATOM 1237 N ASP A 83 12.413 28.918 -16.623 1.00 31.42 N ATOM 1238 CA ASP A 83 11.467 29.053 -17.725 1.00 2.24 C ATOM 1239 C ASP A 83 10.090 29.463 -17.212 1.00 22.24 C ATOM 1240 O ASP A 83 9.345 30.167 -17.895 1.00 63.41 O ATOM 1241 CB ASP A 83 11.366 27.740 -18.502 1.00 73.01 C ATOM 1242 CG ASP A 83 12.661 27.380 -19.202 1.00 25.44 C ATOM 1243 OD1 ASP A 83 13.701 27.989 -18.874 1.00 61.34 O ATOM 1244 OD2 ASP A 83 12.636 26.489 -20.077 1.00 32.00 O ATOM 0 H ASP A 83 12.868 28.007 -16.568 1.00 31.42 H new ATOM 0 HA ASP A 83 11.833 29.833 -18.392 1.00 2.24 H new ATOM 0 HB2 ASP A 83 11.091 26.937 -17.818 1.00 73.01 H new ATOM 0 HB3 ASP A 83 10.567 27.818 -19.240 1.00 73.01 H new ATOM 1249 N LEU A 84 9.758 29.017 -16.005 1.00 55.42 N ATOM 1250 CA LEU A 84 8.469 29.337 -15.400 1.00 60.42 C ATOM 1251 C LEU A 84 8.309 30.843 -15.223 1.00 51.11 C ATOM 1252 O LEU A 84 7.427 31.458 -15.821 1.00 54.02 O ATOM 1253 CB LEU A 84 8.330 28.635 -14.048 1.00 5.00 C ATOM 1254 CG LEU A 84 6.912 28.537 -13.485 1.00 62.41 C ATOM 1255 CD1 LEU A 84 6.717 27.214 -12.759 1.00 55.54 C ATOM 1256 CD2 LEU A 84 6.626 29.706 -12.554 1.00 75.41 C ATOM 0 H LEU A 84 10.363 28.434 -15.427 1.00 55.42 H new ATOM 0 HA LEU A 84 7.684 28.984 -16.068 1.00 60.42 H new ATOM 0 HB2 LEU A 84 8.733 27.626 -14.142 1.00 5.00 H new ATOM 0 HB3 LEU A 84 8.952 29.160 -13.323 1.00 5.00 H new ATOM 0 HG LEU A 84 6.207 28.580 -14.316 1.00 62.41 H new ATOM 0 HD11 LEU A 84 5.702 27.161 -12.365 1.00 55.54 H new ATOM 0 HD12 LEU A 84 6.879 26.390 -13.454 1.00 55.54 H new ATOM 0 HD13 LEU A 84 7.430 27.141 -11.937 1.00 55.54 H new ATOM 0 HD21 LEU A 84 5.612 29.620 -12.163 1.00 75.41 H new ATOM 0 HD22 LEU A 84 7.336 29.695 -11.727 1.00 75.41 H new ATOM 0 HD23 LEU A 84 6.724 30.642 -13.104 1.00 75.41 H new ATOM 1268 N ALA A 85 9.170 31.432 -14.399 1.00 34.40 N ATOM 1269 CA ALA A 85 9.126 32.867 -14.147 1.00 24.44 C ATOM 1270 C ALA A 85 9.124 33.654 -15.453 1.00 25.24 C ATOM 1271 O ALA A 85 8.381 34.623 -15.602 1.00 72.31 O ATOM 1272 CB ALA A 85 10.303 33.285 -13.277 1.00 50.25 C ATOM 0 H ALA A 85 9.906 30.937 -13.895 1.00 34.40 H new ATOM 0 HA ALA A 85 8.200 33.091 -13.618 1.00 24.44 H new ATOM 0 HB1 ALA A 85 10.258 34.359 -13.096 1.00 50.25 H new ATOM 0 HB2 ALA A 85 10.259 32.755 -12.326 1.00 50.25 H new ATOM 0 HB3 ALA A 85 11.236 33.041 -13.785 1.00 50.25 H new ATOM 1278 N GLU A 86 9.962 33.231 -16.394 1.00 41.14 N ATOM 1279 CA GLU A 86 10.057 33.899 -17.687 1.00 72.02 C ATOM 1280 C GLU A 86 8.750 33.769 -18.464 1.00 14.33 C ATOM 1281 O GLU A 86 8.302 34.717 -19.112 1.00 24.43 O ATOM 1282 CB GLU A 86 11.209 33.313 -18.506 1.00 2.04 C ATOM 1283 CG GLU A 86 12.194 34.357 -19.004 1.00 40.14 C ATOM 1284 CD GLU A 86 12.995 34.987 -17.881 1.00 51.14 C ATOM 1285 OE1 GLU A 86 13.202 34.315 -16.850 1.00 63.51 O ATOM 1286 OE2 GLU A 86 13.415 36.153 -18.035 1.00 14.42 O ATOM 0 H GLU A 86 10.584 32.430 -16.286 1.00 41.14 H new ATOM 0 HA GLU A 86 10.250 34.957 -17.507 1.00 72.02 H new ATOM 0 HB2 GLU A 86 11.743 32.584 -17.897 1.00 2.04 H new ATOM 0 HB3 GLU A 86 10.799 32.775 -19.361 1.00 2.04 H new ATOM 0 HG2 GLU A 86 12.877 33.896 -19.717 1.00 40.14 H new ATOM 0 HG3 GLU A 86 11.652 35.136 -19.540 1.00 40.14 H new ATOM 1293 N LEU A 87 8.142 32.590 -18.394 1.00 53.21 N ATOM 1294 CA LEU A 87 6.886 32.335 -19.091 1.00 35.35 C ATOM 1295 C LEU A 87 5.763 33.196 -18.522 1.00 14.13 C ATOM 1296 O LEU A 87 5.150 33.988 -19.239 1.00 63.20 O ATOM 1297 CB LEU A 87 6.513 30.855 -18.984 1.00 55.03 C ATOM 1298 CG LEU A 87 5.159 30.460 -19.575 1.00 15.11 C ATOM 1299 CD1 LEU A 87 5.239 29.087 -20.223 1.00 30.42 C ATOM 1300 CD2 LEU A 87 4.081 30.483 -18.501 1.00 30.24 C ATOM 0 H LEU A 87 8.498 31.796 -17.862 1.00 53.21 H new ATOM 0 HA LEU A 87 7.022 32.595 -20.141 1.00 35.35 H new ATOM 0 HB2 LEU A 87 7.288 30.269 -19.478 1.00 55.03 H new ATOM 0 HB3 LEU A 87 6.523 30.573 -17.931 1.00 55.03 H new ATOM 0 HG LEU A 87 4.894 31.186 -20.343 1.00 15.11 H new ATOM 0 HD11 LEU A 87 4.266 28.823 -20.638 1.00 30.42 H new ATOM 0 HD12 LEU A 87 5.981 29.104 -21.021 1.00 30.42 H new ATOM 0 HD13 LEU A 87 5.527 28.348 -19.475 1.00 30.42 H new ATOM 0 HD21 LEU A 87 3.124 30.199 -18.940 1.00 30.24 H new ATOM 0 HD22 LEU A 87 4.340 29.779 -17.710 1.00 30.24 H new ATOM 0 HD23 LEU A 87 4.005 31.487 -18.083 1.00 30.24 H new ATOM 1312 N ILE A 88 5.499 33.038 -17.229 1.00 23.40 N ATOM 1313 CA ILE A 88 4.453 33.803 -16.564 1.00 15.33 C ATOM 1314 C ILE A 88 4.626 35.299 -16.807 1.00 70.42 C ATOM 1315 O ILE A 88 3.649 36.030 -16.964 1.00 20.44 O ATOM 1316 CB ILE A 88 4.440 33.540 -15.046 1.00 63.23 C ATOM 1317 CG1 ILE A 88 4.242 32.049 -14.767 1.00 72.42 C ATOM 1318 CG2 ILE A 88 3.349 34.360 -14.375 1.00 74.21 C ATOM 1319 CD1 ILE A 88 4.235 31.705 -13.294 1.00 52.30 C ATOM 0 H ILE A 88 5.996 32.386 -16.622 1.00 23.40 H new ATOM 0 HA ILE A 88 3.505 33.475 -16.990 1.00 15.33 H new ATOM 0 HB ILE A 88 5.401 33.844 -14.631 1.00 63.23 H new ATOM 0 HG12 ILE A 88 3.300 31.727 -15.211 1.00 72.42 H new ATOM 0 HG13 ILE A 88 5.036 31.487 -15.259 1.00 72.42 H new ATOM 0 HG21 ILE A 88 3.353 34.163 -13.303 1.00 74.21 H new ATOM 0 HG22 ILE A 88 3.531 35.420 -14.550 1.00 74.21 H new ATOM 0 HG23 ILE A 88 2.380 34.085 -14.791 1.00 74.21 H new ATOM 0 HD11 ILE A 88 4.090 30.632 -13.172 1.00 52.30 H new ATOM 0 HD12 ILE A 88 5.186 31.996 -12.848 1.00 52.30 H new ATOM 0 HD13 ILE A 88 3.424 32.239 -12.799 1.00 52.30 H new ATOM 1331 N ASN A 89 5.877 35.746 -16.840 1.00 1.02 N ATOM 1332 CA ASN A 89 6.179 37.155 -17.066 1.00 23.30 C ATOM 1333 C ASN A 89 5.694 37.601 -18.442 1.00 1.12 C ATOM 1334 O ASN A 89 4.858 38.498 -18.557 1.00 70.41 O ATOM 1335 CB ASN A 89 7.684 37.402 -16.939 1.00 31.24 C ATOM 1336 CG ASN A 89 8.050 38.859 -17.147 1.00 63.53 C ATOM 1337 OD1 ASN A 89 8.228 39.609 -16.188 1.00 2.02 O ATOM 1338 ND2 ASN A 89 8.164 39.265 -18.406 1.00 44.23 N ATOM 0 H ASN A 89 6.698 35.154 -16.713 1.00 1.02 H new ATOM 0 HA ASN A 89 5.656 37.739 -16.309 1.00 23.30 H new ATOM 0 HB2 ASN A 89 8.020 37.083 -15.952 1.00 31.24 H new ATOM 0 HB3 ASN A 89 8.213 36.789 -17.669 1.00 31.24 H new ATOM 0 HD21 ASN A 89 8.408 40.234 -18.609 1.00 44.23 H new ATOM 0 HD22 ASN A 89 8.007 38.608 -19.170 1.00 44.23 H new ATOM 1345 N LYS A 90 6.224 36.969 -19.484 1.00 11.33 N ATOM 1346 CA LYS A 90 5.845 37.298 -20.853 1.00 13.55 C ATOM 1347 C LYS A 90 4.340 37.147 -21.052 1.00 21.22 C ATOM 1348 O LYS A 90 3.677 38.054 -21.554 1.00 33.33 O ATOM 1349 CB LYS A 90 6.594 36.402 -21.841 1.00 33.42 C ATOM 1350 CG LYS A 90 6.481 36.860 -23.284 1.00 53.04 C ATOM 1351 CD LYS A 90 7.848 37.096 -23.903 1.00 62.54 C ATOM 1352 CE LYS A 90 7.885 36.655 -25.359 1.00 15.31 C ATOM 1353 NZ LYS A 90 9.060 35.787 -25.647 1.00 14.04 N ATOM 0 H LYS A 90 6.918 36.225 -19.406 1.00 11.33 H new ATOM 0 HA LYS A 90 6.116 38.337 -21.039 1.00 13.55 H new ATOM 0 HB2 LYS A 90 7.647 36.368 -21.561 1.00 33.42 H new ATOM 0 HB3 LYS A 90 6.209 35.385 -21.760 1.00 33.42 H new ATOM 0 HG2 LYS A 90 5.943 36.110 -23.864 1.00 53.04 H new ATOM 0 HG3 LYS A 90 5.896 37.779 -23.330 1.00 53.04 H new ATOM 0 HD2 LYS A 90 8.101 38.154 -23.836 1.00 62.54 H new ATOM 0 HD3 LYS A 90 8.604 36.551 -23.337 1.00 62.54 H new ATOM 0 HE2 LYS A 90 6.968 36.116 -25.598 1.00 15.31 H new ATOM 0 HE3 LYS A 90 7.916 37.533 -26.004 1.00 15.31 H new ATOM 0 HZ1 LYS A 90 9.048 35.508 -26.649 1.00 14.04 H new ATOM 0 HZ2 LYS A 90 9.936 36.309 -25.443 1.00 14.04 H new ATOM 0 HZ3 LYS A 90 9.018 34.936 -25.050 1.00 14.04 H new ATOM 1367 N MET A 91 3.808 35.996 -20.654 1.00 22.30 N ATOM 1368 CA MET A 91 2.381 35.727 -20.787 1.00 11.51 C ATOM 1369 C MET A 91 1.558 36.810 -20.097 1.00 13.44 C ATOM 1370 O MET A 91 0.577 37.308 -20.651 1.00 63.31 O ATOM 1371 CB MET A 91 2.040 34.358 -20.197 1.00 25.34 C ATOM 1372 CG MET A 91 1.720 33.306 -21.246 1.00 43.15 C ATOM 1373 SD MET A 91 0.012 32.735 -21.159 1.00 64.11 S ATOM 1374 CE MET A 91 -0.870 34.290 -21.257 1.00 13.34 C ATOM 0 H MET A 91 4.344 35.235 -20.237 1.00 22.30 H new ATOM 0 HA MET A 91 2.134 35.728 -21.849 1.00 11.51 H new ATOM 0 HB2 MET A 91 2.879 34.013 -19.593 1.00 25.34 H new ATOM 0 HB3 MET A 91 1.186 34.463 -19.527 1.00 25.34 H new ATOM 0 HG2 MET A 91 1.911 33.717 -22.237 1.00 43.15 H new ATOM 0 HG3 MET A 91 2.390 32.456 -21.119 1.00 43.15 H new ATOM 0 HE1 MET A 91 -1.934 34.097 -21.394 1.00 13.34 H new ATOM 0 HE2 MET A 91 -0.719 34.852 -20.336 1.00 13.34 H new ATOM 0 HE3 MET A 91 -0.494 34.869 -22.101 1.00 13.34 H new ATOM 1384 N LYS A 92 1.962 37.172 -18.884 1.00 32.45 N ATOM 1385 CA LYS A 92 1.263 38.196 -18.117 1.00 52.21 C ATOM 1386 C LYS A 92 1.249 39.523 -18.869 1.00 54.21 C ATOM 1387 O LYS A 92 0.357 40.350 -18.672 1.00 44.55 O ATOM 1388 CB LYS A 92 1.925 38.380 -16.750 1.00 32.14 C ATOM 1389 CG LYS A 92 1.412 37.419 -15.691 1.00 74.34 C ATOM 1390 CD LYS A 92 2.139 37.603 -14.370 1.00 42.53 C ATOM 1391 CE LYS A 92 1.604 38.802 -13.602 1.00 41.32 C ATOM 1392 NZ LYS A 92 2.423 39.097 -12.394 1.00 35.15 N ATOM 0 H LYS A 92 2.771 36.771 -18.410 1.00 32.45 H new ATOM 0 HA LYS A 92 0.233 37.868 -17.974 1.00 52.21 H new ATOM 0 HB2 LYS A 92 3.002 38.249 -16.857 1.00 32.14 H new ATOM 0 HB3 LYS A 92 1.761 39.403 -16.411 1.00 32.14 H new ATOM 0 HG2 LYS A 92 0.343 37.576 -15.544 1.00 74.34 H new ATOM 0 HG3 LYS A 92 1.539 36.393 -16.037 1.00 74.34 H new ATOM 0 HD2 LYS A 92 2.029 36.703 -13.765 1.00 42.53 H new ATOM 0 HD3 LYS A 92 3.205 37.734 -14.555 1.00 42.53 H new ATOM 0 HE2 LYS A 92 1.592 39.675 -14.254 1.00 41.32 H new ATOM 0 HE3 LYS A 92 0.573 38.612 -13.304 1.00 41.32 H new ATOM 0 HZ1 LYS A 92 2.026 39.920 -11.898 1.00 35.15 H new ATOM 0 HZ2 LYS A 92 2.414 38.273 -11.759 1.00 35.15 H new ATOM 0 HZ3 LYS A 92 3.401 39.304 -12.680 1.00 35.15 H new ATOM 1406 N LEU A 93 2.240 39.720 -19.732 1.00 33.24 N ATOM 1407 CA LEU A 93 2.340 40.946 -20.515 1.00 3.31 C ATOM 1408 C LEU A 93 1.236 41.014 -21.565 1.00 14.24 C ATOM 1409 O LEU A 93 0.510 42.004 -21.653 1.00 51.10 O ATOM 1410 CB LEU A 93 3.709 41.031 -21.192 1.00 41.34 C ATOM 1411 CG LEU A 93 4.535 42.280 -20.882 1.00 41.35 C ATOM 1412 CD1 LEU A 93 6.000 42.049 -21.219 1.00 71.33 C ATOM 1413 CD2 LEU A 93 3.994 43.480 -21.645 1.00 52.55 C ATOM 0 H LEU A 93 2.985 39.046 -19.907 1.00 33.24 H new ATOM 0 HA LEU A 93 2.223 41.791 -19.837 1.00 3.31 H new ATOM 0 HB2 LEU A 93 4.290 40.155 -20.903 1.00 41.34 H new ATOM 0 HB3 LEU A 93 3.563 40.975 -22.271 1.00 41.34 H new ATOM 0 HG LEU A 93 4.457 42.487 -19.815 1.00 41.35 H new ATOM 0 HD11 LEU A 93 6.572 42.949 -20.992 1.00 71.33 H new ATOM 0 HD12 LEU A 93 6.382 41.217 -20.628 1.00 71.33 H new ATOM 0 HD13 LEU A 93 6.097 41.816 -22.279 1.00 71.33 H new ATOM 0 HD21 LEU A 93 4.594 44.360 -21.412 1.00 52.55 H new ATOM 0 HD22 LEU A 93 4.041 43.282 -22.716 1.00 52.55 H new ATOM 0 HD23 LEU A 93 2.959 43.659 -21.354 1.00 52.55 H new ATOM 1425 N ALA A 94 1.113 39.954 -22.357 1.00 2.14 N ATOM 1426 CA ALA A 94 0.094 39.892 -23.397 1.00 63.42 C ATOM 1427 C ALA A 94 -1.290 40.184 -22.828 1.00 60.23 C ATOM 1428 O ALA A 94 -2.099 40.864 -23.459 1.00 45.10 O ATOM 1429 CB ALA A 94 0.113 38.528 -24.072 1.00 54.35 C ATOM 0 H ALA A 94 1.707 39.127 -22.298 1.00 2.14 H new ATOM 0 HA ALA A 94 0.320 40.657 -24.140 1.00 63.42 H new ATOM 0 HB1 ALA A 94 -0.653 38.495 -24.847 1.00 54.35 H new ATOM 0 HB2 ALA A 94 1.091 38.358 -24.521 1.00 54.35 H new ATOM 0 HB3 ALA A 94 -0.086 37.753 -23.332 1.00 54.35 H new ATOM 1435 N GLN A 95 -1.556 39.665 -21.634 1.00 24.40 N ATOM 1436 CA GLN A 95 -2.843 39.869 -20.982 1.00 15.43 C ATOM 1437 C GLN A 95 -3.143 41.356 -20.824 1.00 12.43 C ATOM 1438 O GLN A 95 -4.304 41.762 -20.767 1.00 23.14 O ATOM 1439 CB GLN A 95 -2.861 39.185 -19.614 1.00 3.33 C ATOM 1440 CG GLN A 95 -4.258 38.843 -19.122 1.00 62.44 C ATOM 1441 CD GLN A 95 -4.841 39.917 -18.227 1.00 14.35 C ATOM 1442 OE1 GLN A 95 -4.110 40.690 -17.606 1.00 62.44 O ATOM 1443 NE2 GLN A 95 -6.166 39.973 -18.154 1.00 32.21 N ATOM 0 H GLN A 95 -0.897 39.100 -21.099 1.00 24.40 H new ATOM 0 HA GLN A 95 -3.615 39.426 -21.611 1.00 15.43 H new ATOM 0 HB2 GLN A 95 -2.270 38.271 -19.667 1.00 3.33 H new ATOM 0 HB3 GLN A 95 -2.378 39.836 -18.885 1.00 3.33 H new ATOM 0 HG2 GLN A 95 -4.915 38.694 -19.979 1.00 62.44 H new ATOM 0 HG3 GLN A 95 -4.226 37.899 -18.577 1.00 62.44 H new ATOM 0 HE21 GLN A 95 -6.734 39.313 -18.685 1.00 32.21 H new ATOM 0 HE22 GLN A 95 -6.615 40.676 -17.567 1.00 32.21 H new ATOM 1452 N GLN A 96 -2.089 42.163 -20.753 1.00 54.22 N ATOM 1453 CA GLN A 96 -2.241 43.605 -20.600 1.00 41.44 C ATOM 1454 C GLN A 96 -2.083 44.314 -21.941 1.00 43.44 C ATOM 1455 O GLN A 96 -2.617 45.405 -22.145 1.00 60.23 O ATOM 1456 CB GLN A 96 -1.216 44.144 -19.601 1.00 43.22 C ATOM 1457 CG GLN A 96 -1.737 45.294 -18.755 1.00 13.31 C ATOM 1458 CD GLN A 96 -1.791 46.603 -19.518 1.00 74.14 C ATOM 1459 OE1 GLN A 96 -2.854 47.210 -19.658 1.00 64.24 O ATOM 1460 NE2 GLN A 96 -0.643 47.045 -20.017 1.00 51.41 N ATOM 0 H GLN A 96 -1.122 41.843 -20.799 1.00 54.22 H new ATOM 0 HA GLN A 96 -3.244 43.801 -20.222 1.00 41.44 H new ATOM 0 HB2 GLN A 96 -0.901 43.334 -18.943 1.00 43.22 H new ATOM 0 HB3 GLN A 96 -0.331 44.476 -20.144 1.00 43.22 H new ATOM 0 HG2 GLN A 96 -2.735 45.049 -18.391 1.00 13.31 H new ATOM 0 HG3 GLN A 96 -1.099 45.414 -17.880 1.00 13.31 H new ATOM 0 HE21 GLN A 96 0.214 46.510 -19.877 1.00 51.41 H new ATOM 0 HE22 GLN A 96 -0.618 47.920 -20.541 1.00 51.41 H new ATOM 1469 N TYR A 97 -1.346 43.689 -22.852 1.00 64.33 N ATOM 1470 CA TYR A 97 -1.115 44.261 -24.173 1.00 44.22 C ATOM 1471 C TYR A 97 -2.106 43.703 -25.190 1.00 0.22 C ATOM 1472 O TYR A 97 -1.828 43.663 -26.388 1.00 61.13 O ATOM 1473 CB TYR A 97 0.317 43.978 -24.632 1.00 31.03 C ATOM 1474 CG TYR A 97 1.322 44.997 -24.144 1.00 53.33 C ATOM 1475 CD1 TYR A 97 1.487 45.244 -22.787 1.00 4.11 C ATOM 1476 CD2 TYR A 97 2.105 45.714 -25.041 1.00 15.13 C ATOM 1477 CE1 TYR A 97 2.404 46.175 -22.337 1.00 33.02 C ATOM 1478 CE2 TYR A 97 3.024 46.646 -24.600 1.00 22.34 C ATOM 1479 CZ TYR A 97 3.170 46.873 -23.247 1.00 30.30 C ATOM 1480 OH TYR A 97 4.084 47.801 -22.804 1.00 21.13 O ATOM 0 H TYR A 97 -0.898 42.785 -22.700 1.00 64.33 H new ATOM 0 HA TYR A 97 -1.261 45.339 -24.104 1.00 44.22 H new ATOM 0 HB2 TYR A 97 0.614 42.990 -24.280 1.00 31.03 H new ATOM 0 HB3 TYR A 97 0.341 43.949 -25.721 1.00 31.03 H new ATOM 0 HD1 TYR A 97 0.889 44.699 -22.072 1.00 4.11 H new ATOM 0 HD2 TYR A 97 1.993 45.539 -26.101 1.00 15.13 H new ATOM 0 HE1 TYR A 97 2.520 46.355 -21.278 1.00 33.02 H new ATOM 0 HE2 TYR A 97 3.625 47.194 -25.310 1.00 22.34 H new ATOM 0 HH TYR A 97 4.541 48.202 -23.572 1.00 21.13 H new ATOM 1490 N VAL A 98 -3.265 43.274 -24.702 1.00 34.34 N ATOM 1491 CA VAL A 98 -4.300 42.719 -25.566 1.00 15.30 C ATOM 1492 C VAL A 98 -5.480 43.676 -25.694 1.00 14.21 C ATOM 1493 O VAL A 98 -6.134 43.736 -26.735 1.00 33.53 O ATOM 1494 CB VAL A 98 -4.807 41.365 -25.037 1.00 34.42 C ATOM 1495 CG1 VAL A 98 -5.406 41.524 -23.648 1.00 14.13 C ATOM 1496 CG2 VAL A 98 -5.822 40.763 -25.998 1.00 3.41 C ATOM 0 H VAL A 98 -3.511 43.300 -23.712 1.00 34.34 H new ATOM 0 HA VAL A 98 -3.847 42.571 -26.546 1.00 15.30 H new ATOM 0 HB VAL A 98 -3.960 40.683 -24.965 1.00 34.42 H new ATOM 0 HG11 VAL A 98 -5.759 40.556 -23.291 1.00 14.13 H new ATOM 0 HG12 VAL A 98 -4.647 41.908 -22.966 1.00 14.13 H new ATOM 0 HG13 VAL A 98 -6.242 42.222 -23.690 1.00 14.13 H new ATOM 0 HG21 VAL A 98 -6.169 39.806 -25.608 1.00 3.41 H new ATOM 0 HG22 VAL A 98 -6.669 41.441 -26.104 1.00 3.41 H new ATOM 0 HG23 VAL A 98 -5.355 40.610 -26.971 1.00 3.41 H new ATOM 1506 N MET A 99 -5.747 44.424 -24.628 1.00 45.43 N ATOM 1507 CA MET A 99 -6.847 45.381 -24.622 1.00 74.22 C ATOM 1508 C MET A 99 -6.510 46.603 -25.470 1.00 11.43 C ATOM 1509 O MET A 99 -7.400 47.335 -25.905 1.00 61.13 O ATOM 1510 CB MET A 99 -7.169 45.812 -23.190 1.00 30.41 C ATOM 1511 CG MET A 99 -8.448 46.625 -23.073 1.00 4.34 C ATOM 1512 SD MET A 99 -8.212 48.162 -22.160 1.00 3.15 S ATOM 1513 CE MET A 99 -6.964 48.964 -23.163 1.00 43.03 C ATOM 0 H MET A 99 -5.217 44.386 -23.758 1.00 45.43 H new ATOM 0 HA MET A 99 -7.722 44.893 -25.052 1.00 74.22 H new ATOM 0 HB2 MET A 99 -7.254 44.925 -22.563 1.00 30.41 H new ATOM 0 HB3 MET A 99 -6.338 46.400 -22.801 1.00 30.41 H new ATOM 0 HG2 MET A 99 -8.821 46.853 -24.071 1.00 4.34 H new ATOM 0 HG3 MET A 99 -9.211 46.025 -22.577 1.00 4.34 H new ATOM 0 HE1 MET A 99 -6.776 49.966 -22.777 1.00 43.03 H new ATOM 0 HE2 MET A 99 -6.042 48.383 -23.130 1.00 43.03 H new ATOM 0 HE3 MET A 99 -7.313 49.032 -24.193 1.00 43.03 H new ATOM 1523 N THR A 100 -5.219 46.820 -25.700 1.00 41.42 N ATOM 1524 CA THR A 100 -4.764 47.955 -26.494 1.00 73.11 C ATOM 1525 C THR A 100 -4.955 47.695 -27.984 1.00 41.10 C ATOM 1526 O THR A 100 -5.850 48.259 -28.613 1.00 15.14 O ATOM 1527 CB THR A 100 -3.281 48.270 -26.225 1.00 43.32 C ATOM 1528 OG1 THR A 100 -3.092 48.597 -24.844 1.00 22.42 O ATOM 1529 CG2 THR A 100 -2.807 49.426 -27.094 1.00 31.11 C ATOM 0 H THR A 100 -4.470 46.225 -25.348 1.00 41.42 H new ATOM 0 HA THR A 100 -5.369 48.812 -26.197 1.00 73.11 H new ATOM 0 HB THR A 100 -2.694 47.385 -26.472 1.00 43.32 H new ATOM 0 HG1 THR A 100 -2.146 48.794 -24.681 1.00 22.42 H new ATOM 0 HG21 THR A 100 -1.757 49.630 -26.886 1.00 31.11 H new ATOM 0 HG22 THR A 100 -2.925 49.163 -28.145 1.00 31.11 H new ATOM 0 HG23 THR A 100 -3.400 50.314 -26.874 1.00 31.11 H new ATOM 1537 N SER A 101 -4.108 46.837 -28.544 1.00 3.34 N ATOM 1538 CA SER A 101 -4.181 46.505 -29.961 1.00 74.05 C ATOM 1539 C SER A 101 -3.105 45.492 -30.339 1.00 20.34 C ATOM 1540 O SER A 101 -3.320 44.627 -31.189 1.00 35.55 O ATOM 1541 CB SER A 101 -4.029 47.768 -30.812 1.00 33.15 C ATOM 1542 OG SER A 101 -3.388 47.480 -32.042 1.00 3.31 O ATOM 0 H SER A 101 -3.363 46.359 -28.037 1.00 3.34 H new ATOM 0 HA SER A 101 -5.158 46.061 -30.154 1.00 74.05 H new ATOM 0 HB2 SER A 101 -5.010 48.202 -31.003 1.00 33.15 H new ATOM 0 HB3 SER A 101 -3.452 48.513 -30.263 1.00 33.15 H new ATOM 0 HG SER A 101 -3.304 48.303 -32.568 1.00 3.31 H new ATOM 1548 N LEU A 102 -1.945 45.605 -29.701 1.00 12.32 N ATOM 1549 CA LEU A 102 -0.833 44.700 -29.968 1.00 72.21 C ATOM 1550 C LEU A 102 -1.062 43.346 -29.304 1.00 22.20 C ATOM 1551 O LEU A 102 -0.330 42.960 -28.393 1.00 15.15 O ATOM 1552 CB LEU A 102 0.478 45.310 -29.470 1.00 21.10 C ATOM 1553 CG LEU A 102 0.638 46.817 -29.676 1.00 64.52 C ATOM 1554 CD1 LEU A 102 1.975 47.291 -29.128 1.00 2.11 C ATOM 1555 CD2 LEU A 102 0.509 47.170 -31.151 1.00 30.23 C ATOM 0 H LEU A 102 -1.750 46.315 -28.995 1.00 12.32 H new ATOM 0 HA LEU A 102 -0.770 44.550 -31.046 1.00 72.21 H new ATOM 0 HB2 LEU A 102 0.573 45.097 -28.405 1.00 21.10 H new ATOM 0 HB3 LEU A 102 1.304 44.805 -29.971 1.00 21.10 H new ATOM 0 HG LEU A 102 -0.157 47.326 -29.130 1.00 64.52 H new ATOM 0 HD11 LEU A 102 2.072 48.366 -29.283 1.00 2.11 H new ATOM 0 HD12 LEU A 102 2.029 47.072 -28.062 1.00 2.11 H new ATOM 0 HD13 LEU A 102 2.784 46.776 -29.646 1.00 2.11 H new ATOM 0 HD21 LEU A 102 0.625 48.246 -31.279 1.00 30.23 H new ATOM 0 HD22 LEU A 102 1.282 46.651 -31.718 1.00 30.23 H new ATOM 0 HD23 LEU A 102 -0.473 46.866 -31.513 1.00 30.23 H new ATOM 1567 N GLN A 103 -2.080 42.629 -29.769 1.00 22.21 N ATOM 1568 CA GLN A 103 -2.403 41.317 -29.221 1.00 11.05 C ATOM 1569 C GLN A 103 -1.776 40.207 -30.058 1.00 52.30 C ATOM 1570 O GLN A 103 -1.056 39.356 -29.537 1.00 51.11 O ATOM 1571 CB GLN A 103 -3.920 41.128 -29.155 1.00 23.01 C ATOM 1572 CG GLN A 103 -4.341 39.754 -28.659 1.00 4.12 C ATOM 1573 CD GLN A 103 -5.825 39.501 -28.831 1.00 14.11 C ATOM 1574 OE1 GLN A 103 -6.564 40.367 -29.300 1.00 12.42 O ATOM 1575 NE2 GLN A 103 -6.271 38.309 -28.452 1.00 1.14 N ATOM 0 H GLN A 103 -2.695 42.934 -30.523 1.00 22.21 H new ATOM 0 HA GLN A 103 -1.993 41.262 -28.213 1.00 11.05 H new ATOM 0 HB2 GLN A 103 -4.344 41.888 -28.499 1.00 23.01 H new ATOM 0 HB3 GLN A 103 -4.342 41.292 -30.147 1.00 23.01 H new ATOM 0 HG2 GLN A 103 -3.781 38.990 -29.198 1.00 4.12 H new ATOM 0 HG3 GLN A 103 -4.079 39.656 -27.605 1.00 4.12 H new ATOM 0 HE21 GLN A 103 -5.624 37.621 -28.068 1.00 1.14 H new ATOM 0 HE22 GLN A 103 -7.261 38.082 -28.545 1.00 1.14 H new ATOM 1584 N GLN A 104 -2.056 40.224 -31.357 1.00 63.53 N ATOM 1585 CA GLN A 104 -1.519 39.217 -32.266 1.00 54.21 C ATOM 1586 C GLN A 104 -0.006 39.102 -32.119 1.00 2.11 C ATOM 1587 O GLN A 104 0.562 38.022 -32.280 1.00 10.43 O ATOM 1588 CB GLN A 104 -1.878 39.563 -33.712 1.00 72.24 C ATOM 1589 CG GLN A 104 -3.375 39.633 -33.968 1.00 31.52 C ATOM 1590 CD GLN A 104 -3.794 38.853 -35.199 1.00 11.13 C ATOM 1591 OE1 GLN A 104 -4.658 37.978 -35.130 1.00 1.35 O ATOM 1592 NE2 GLN A 104 -3.183 39.167 -36.335 1.00 62.00 N ATOM 0 H GLN A 104 -2.650 40.922 -31.804 1.00 63.53 H new ATOM 0 HA GLN A 104 -1.964 38.256 -32.008 1.00 54.21 H new ATOM 0 HB2 GLN A 104 -1.429 40.522 -33.969 1.00 72.24 H new ATOM 0 HB3 GLN A 104 -1.439 38.817 -34.375 1.00 72.24 H new ATOM 0 HG2 GLN A 104 -3.907 39.246 -33.099 1.00 31.52 H new ATOM 0 HG3 GLN A 104 -3.671 40.675 -34.085 1.00 31.52 H new ATOM 0 HE21 GLN A 104 -2.473 39.899 -36.347 1.00 62.00 H new ATOM 0 HE22 GLN A 104 -3.424 38.676 -37.196 1.00 62.00 H new ATOM 1601 N GLU A 105 0.641 40.222 -31.813 1.00 1.44 N ATOM 1602 CA GLU A 105 2.089 40.246 -31.645 1.00 44.02 C ATOM 1603 C GLU A 105 2.521 39.320 -30.512 1.00 23.11 C ATOM 1604 O GLU A 105 3.272 38.368 -30.726 1.00 24.05 O ATOM 1605 CB GLU A 105 2.569 41.672 -31.365 1.00 25.43 C ATOM 1606 CG GLU A 105 4.038 41.755 -30.983 1.00 51.33 C ATOM 1607 CD GLU A 105 4.643 43.112 -31.288 1.00 23.21 C ATOM 1608 OE1 GLU A 105 4.444 44.044 -30.481 1.00 4.11 O ATOM 1609 OE2 GLU A 105 5.315 43.241 -32.332 1.00 42.33 O ATOM 0 H GLU A 105 0.185 41.124 -31.676 1.00 1.44 H new ATOM 0 HA GLU A 105 2.542 39.893 -32.571 1.00 44.02 H new ATOM 0 HB2 GLU A 105 2.397 42.285 -32.250 1.00 25.43 H new ATOM 0 HB3 GLU A 105 1.968 42.097 -30.561 1.00 25.43 H new ATOM 0 HG2 GLU A 105 4.146 41.544 -29.919 1.00 51.33 H new ATOM 0 HG3 GLU A 105 4.593 40.985 -31.519 1.00 51.33 H new ATOM 1616 N TYR A 106 2.042 39.606 -29.307 1.00 12.53 N ATOM 1617 CA TYR A 106 2.380 38.802 -28.139 1.00 10.15 C ATOM 1618 C TYR A 106 1.930 37.356 -28.324 1.00 44.01 C ATOM 1619 O TYR A 106 2.519 36.433 -27.761 1.00 60.21 O ATOM 1620 CB TYR A 106 1.735 39.391 -26.883 1.00 55.42 C ATOM 1621 CG TYR A 106 2.450 40.612 -26.351 1.00 2.25 C ATOM 1622 CD1 TYR A 106 2.294 41.853 -26.956 1.00 21.11 C ATOM 1623 CD2 TYR A 106 3.282 40.525 -25.241 1.00 31.22 C ATOM 1624 CE1 TYR A 106 2.947 42.970 -26.473 1.00 13.50 C ATOM 1625 CE2 TYR A 106 3.937 41.637 -24.750 1.00 44.50 C ATOM 1626 CZ TYR A 106 3.767 42.858 -25.370 1.00 30.22 C ATOM 1627 OH TYR A 106 4.418 43.969 -24.885 1.00 13.12 O ATOM 0 H TYR A 106 1.418 40.389 -29.113 1.00 12.53 H new ATOM 0 HA TYR A 106 3.464 38.815 -28.023 1.00 10.15 H new ATOM 0 HB2 TYR A 106 0.701 39.654 -27.105 1.00 55.42 H new ATOM 0 HB3 TYR A 106 1.710 38.627 -26.105 1.00 55.42 H new ATOM 0 HD1 TYR A 106 1.651 41.946 -27.819 1.00 21.11 H new ATOM 0 HD2 TYR A 106 3.419 39.571 -24.754 1.00 31.22 H new ATOM 0 HE1 TYR A 106 2.816 43.927 -26.957 1.00 13.50 H new ATOM 0 HE2 TYR A 106 4.579 41.552 -23.886 1.00 44.50 H new ATOM 0 HH TYR A 106 3.767 44.577 -24.476 1.00 13.12 H new ATOM 1637 N LYS A 107 0.883 37.167 -29.119 1.00 33.41 N ATOM 1638 CA LYS A 107 0.353 35.834 -29.383 1.00 13.14 C ATOM 1639 C LYS A 107 1.382 34.972 -30.106 1.00 44.55 C ATOM 1640 O LYS A 107 1.640 33.834 -29.715 1.00 4.12 O ATOM 1641 CB LYS A 107 -0.927 35.928 -30.217 1.00 22.50 C ATOM 1642 CG LYS A 107 -1.425 34.583 -30.719 1.00 12.42 C ATOM 1643 CD LYS A 107 -0.881 34.268 -32.102 1.00 74.01 C ATOM 1644 CE LYS A 107 -2.001 33.952 -33.082 1.00 43.24 C ATOM 1645 NZ LYS A 107 -1.557 33.009 -34.146 1.00 31.44 N ATOM 0 H LYS A 107 0.384 37.920 -29.592 1.00 33.41 H new ATOM 0 HA LYS A 107 0.122 35.366 -28.426 1.00 13.14 H new ATOM 0 HB2 LYS A 107 -1.708 36.395 -29.617 1.00 22.50 H new ATOM 0 HB3 LYS A 107 -0.747 36.581 -31.071 1.00 22.50 H new ATOM 0 HG2 LYS A 107 -1.126 33.800 -30.022 1.00 12.42 H new ATOM 0 HG3 LYS A 107 -2.515 34.585 -30.747 1.00 12.42 H new ATOM 0 HD2 LYS A 107 -0.303 35.116 -32.469 1.00 74.01 H new ATOM 0 HD3 LYS A 107 -0.199 33.420 -32.042 1.00 74.01 H new ATOM 0 HE2 LYS A 107 -2.844 33.520 -32.543 1.00 43.24 H new ATOM 0 HE3 LYS A 107 -2.355 34.876 -33.540 1.00 43.24 H new ATOM 0 HZ1 LYS A 107 -2.348 32.819 -34.794 1.00 31.44 H new ATOM 0 HZ2 LYS A 107 -0.769 33.431 -34.677 1.00 31.44 H new ATOM 0 HZ3 LYS A 107 -1.243 32.118 -33.711 1.00 31.44 H new ATOM 1659 N LYS A 108 1.969 35.523 -31.164 1.00 25.12 N ATOM 1660 CA LYS A 108 2.974 34.807 -31.941 1.00 75.44 C ATOM 1661 C LYS A 108 4.130 34.358 -31.054 1.00 64.33 C ATOM 1662 O LYS A 108 4.414 33.165 -30.946 1.00 14.02 O ATOM 1663 CB LYS A 108 3.499 35.692 -33.074 1.00 11.25 C ATOM 1664 CG LYS A 108 4.104 34.910 -34.226 1.00 44.34 C ATOM 1665 CD LYS A 108 3.734 35.519 -35.568 1.00 40.14 C ATOM 1666 CE LYS A 108 4.813 35.269 -36.611 1.00 3.34 C ATOM 1667 NZ LYS A 108 4.442 35.830 -37.939 1.00 73.23 N ATOM 0 H LYS A 108 1.766 36.463 -31.503 1.00 25.12 H new ATOM 0 HA LYS A 108 2.503 33.922 -32.369 1.00 75.44 H new ATOM 0 HB2 LYS A 108 2.682 36.306 -33.452 1.00 11.25 H new ATOM 0 HB3 LYS A 108 4.250 36.373 -32.674 1.00 11.25 H new ATOM 0 HG2 LYS A 108 5.189 34.888 -34.122 1.00 44.34 H new ATOM 0 HG3 LYS A 108 3.759 33.877 -34.187 1.00 44.34 H new ATOM 0 HD2 LYS A 108 2.790 35.097 -35.912 1.00 40.14 H new ATOM 0 HD3 LYS A 108 3.581 36.592 -35.452 1.00 40.14 H new ATOM 0 HE2 LYS A 108 5.750 35.715 -36.278 1.00 3.34 H new ATOM 0 HE3 LYS A 108 4.985 34.197 -36.705 1.00 3.34 H new ATOM 0 HZ1 LYS A 108 5.203 35.639 -38.622 1.00 73.23 H new ATOM 0 HZ2 LYS A 108 3.561 35.387 -38.269 1.00 73.23 H new ATOM 0 HZ3 LYS A 108 4.302 36.857 -37.855 1.00 73.23 H new ATOM 1681 N GLN A 109 4.793 35.320 -30.422 1.00 3.52 N ATOM 1682 CA GLN A 109 5.919 35.023 -29.544 1.00 34.43 C ATOM 1683 C GLN A 109 5.531 33.986 -28.495 1.00 30.42 C ATOM 1684 O GLN A 109 6.373 33.222 -28.023 1.00 35.15 O ATOM 1685 CB GLN A 109 6.410 36.299 -28.859 1.00 22.01 C ATOM 1686 CG GLN A 109 5.360 36.963 -27.983 1.00 73.22 C ATOM 1687 CD GLN A 109 5.872 38.219 -27.308 1.00 4.34 C ATOM 1688 OE1 GLN A 109 6.649 38.978 -27.889 1.00 21.23 O ATOM 1689 NE2 GLN A 109 5.439 38.447 -26.073 1.00 64.30 N ATOM 0 H GLN A 109 4.570 36.312 -30.501 1.00 3.52 H new ATOM 0 HA GLN A 109 6.725 34.614 -30.154 1.00 34.43 H new ATOM 0 HB2 GLN A 109 7.282 36.062 -28.250 1.00 22.01 H new ATOM 0 HB3 GLN A 109 6.737 37.007 -29.620 1.00 22.01 H new ATOM 0 HG2 GLN A 109 4.490 37.211 -28.591 1.00 73.22 H new ATOM 0 HG3 GLN A 109 5.027 36.256 -27.223 1.00 73.22 H new ATOM 0 HE21 GLN A 109 4.795 37.792 -25.629 1.00 64.30 H new ATOM 0 HE22 GLN A 109 5.750 39.277 -25.569 1.00 64.30 H new ATOM 1698 N MET A 110 4.252 33.965 -28.135 1.00 32.03 N ATOM 1699 CA MET A 110 3.753 33.021 -27.142 1.00 20.43 C ATOM 1700 C MET A 110 3.978 31.583 -27.598 1.00 22.52 C ATOM 1701 O MET A 110 4.573 30.778 -26.879 1.00 13.33 O ATOM 1702 CB MET A 110 2.264 33.259 -26.883 1.00 21.31 C ATOM 1703 CG MET A 110 1.817 32.853 -25.488 1.00 2.12 C ATOM 1704 SD MET A 110 1.671 31.066 -25.297 1.00 42.04 S ATOM 1705 CE MET A 110 0.417 30.696 -26.521 1.00 51.54 C ATOM 0 H MET A 110 3.542 34.591 -28.516 1.00 32.03 H new ATOM 0 HA MET A 110 4.305 33.181 -26.216 1.00 20.43 H new ATOM 0 HB2 MET A 110 2.042 34.315 -27.034 1.00 21.31 H new ATOM 0 HB3 MET A 110 1.682 32.703 -27.618 1.00 21.31 H new ATOM 0 HG2 MET A 110 2.529 33.235 -24.757 1.00 2.12 H new ATOM 0 HG3 MET A 110 0.855 33.317 -25.269 1.00 2.12 H new ATOM 0 HE1 MET A 110 -0.381 30.114 -26.060 1.00 51.54 H new ATOM 0 HE2 MET A 110 0.007 31.626 -26.915 1.00 51.54 H new ATOM 0 HE3 MET A 110 0.861 30.122 -27.334 1.00 51.54 H new ATOM 1715 N LEU A 111 3.500 31.265 -28.796 1.00 31.13 N ATOM 1716 CA LEU A 111 3.649 29.923 -29.348 1.00 30.22 C ATOM 1717 C LEU A 111 5.116 29.504 -29.374 1.00 14.53 C ATOM 1718 O LEU A 111 5.456 28.371 -29.034 1.00 73.42 O ATOM 1719 CB LEU A 111 3.065 29.863 -30.760 1.00 52.32 C ATOM 1720 CG LEU A 111 2.286 28.595 -31.112 1.00 12.25 C ATOM 1721 CD1 LEU A 111 0.871 28.668 -30.559 1.00 31.53 C ATOM 1722 CD2 LEU A 111 2.262 28.384 -32.618 1.00 55.44 C ATOM 0 H LEU A 111 3.006 31.918 -29.404 1.00 31.13 H new ATOM 0 HA LEU A 111 3.104 29.231 -28.706 1.00 30.22 H new ATOM 0 HB2 LEU A 111 2.405 30.720 -30.895 1.00 52.32 H new ATOM 0 HB3 LEU A 111 3.881 29.974 -31.474 1.00 52.32 H new ATOM 0 HG LEU A 111 2.790 27.743 -30.655 1.00 12.25 H new ATOM 0 HD11 LEU A 111 0.331 27.757 -30.819 1.00 31.53 H new ATOM 0 HD12 LEU A 111 0.909 28.770 -29.474 1.00 31.53 H new ATOM 0 HD13 LEU A 111 0.357 29.529 -30.987 1.00 31.53 H new ATOM 0 HD21 LEU A 111 1.703 27.477 -32.849 1.00 55.44 H new ATOM 0 HD22 LEU A 111 1.783 29.238 -33.097 1.00 55.44 H new ATOM 0 HD23 LEU A 111 3.283 28.286 -32.988 1.00 55.44 H new ATOM 1734 N THR A 112 5.982 30.428 -29.777 1.00 43.41 N ATOM 1735 CA THR A 112 7.412 30.156 -29.846 1.00 44.44 C ATOM 1736 C THR A 112 7.935 29.621 -28.518 1.00 42.42 C ATOM 1737 O THR A 112 8.464 28.512 -28.450 1.00 12.21 O ATOM 1738 CB THR A 112 8.207 31.420 -30.226 1.00 52.32 C ATOM 1739 OG1 THR A 112 7.584 32.075 -31.337 1.00 61.11 O ATOM 1740 CG2 THR A 112 9.645 31.070 -30.578 1.00 53.13 C ATOM 0 H THR A 112 5.718 31.372 -30.061 1.00 43.41 H new ATOM 0 HA THR A 112 7.553 29.401 -30.619 1.00 44.44 H new ATOM 0 HB THR A 112 8.213 32.090 -29.367 1.00 52.32 H new ATOM 0 HG1 THR A 112 8.094 32.878 -31.571 1.00 61.11 H new ATOM 0 HG21 THR A 112 10.186 31.978 -30.843 1.00 53.13 H new ATOM 0 HG22 THR A 112 10.125 30.599 -29.720 1.00 53.13 H new ATOM 0 HG23 THR A 112 9.656 30.382 -31.423 1.00 53.13 H new ATOM 1748 N ALA A 113 7.784 30.417 -27.464 1.00 74.33 N ATOM 1749 CA ALA A 113 8.238 30.021 -26.137 1.00 42.21 C ATOM 1750 C ALA A 113 7.531 28.754 -25.669 1.00 73.14 C ATOM 1751 O ALA A 113 8.175 27.777 -25.289 1.00 33.32 O ATOM 1752 CB ALA A 113 8.013 31.151 -25.143 1.00 54.14 C ATOM 0 H ALA A 113 7.351 31.340 -27.504 1.00 74.33 H new ATOM 0 HA ALA A 113 9.306 29.809 -26.194 1.00 42.21 H new ATOM 0 HB1 ALA A 113 8.357 30.841 -24.156 1.00 54.14 H new ATOM 0 HB2 ALA A 113 8.570 32.032 -25.461 1.00 54.14 H new ATOM 0 HB3 ALA A 113 6.951 31.390 -25.099 1.00 54.14 H new ATOM 1758 N ALA A 114 6.202 28.778 -25.700 1.00 63.32 N ATOM 1759 CA ALA A 114 5.408 27.630 -25.281 1.00 32.14 C ATOM 1760 C ALA A 114 5.864 26.358 -25.988 1.00 0.30 C ATOM 1761 O ALA A 114 5.783 25.263 -25.431 1.00 65.00 O ATOM 1762 CB ALA A 114 3.932 27.884 -25.548 1.00 34.05 C ATOM 0 H ALA A 114 5.653 29.580 -26.011 1.00 63.32 H new ATOM 0 HA ALA A 114 5.554 27.491 -24.210 1.00 32.14 H new ATOM 0 HB1 ALA A 114 3.351 27.018 -25.230 1.00 34.05 H new ATOM 0 HB2 ALA A 114 3.608 28.763 -24.991 1.00 34.05 H new ATOM 0 HB3 ALA A 114 3.779 28.053 -26.614 1.00 34.05 H new ATOM 1768 N HIS A 115 6.343 26.511 -27.219 1.00 33.53 N ATOM 1769 CA HIS A 115 6.812 25.373 -28.003 1.00 11.44 C ATOM 1770 C HIS A 115 8.012 24.710 -27.333 1.00 34.11 C ATOM 1771 O HIS A 115 7.962 23.534 -26.974 1.00 1.05 O ATOM 1772 CB HIS A 115 7.185 25.821 -29.416 1.00 70.43 C ATOM 1773 CG HIS A 115 7.467 24.684 -30.349 1.00 72.44 C ATOM 1774 ND1 HIS A 115 8.623 23.934 -30.295 1.00 42.41 N ATOM 1775 CD2 HIS A 115 6.733 24.168 -31.363 1.00 64.15 C ATOM 1776 CE1 HIS A 115 8.590 23.008 -31.237 1.00 13.24 C ATOM 1777 NE2 HIS A 115 7.453 23.128 -31.899 1.00 1.13 N ATOM 0 H HIS A 115 6.417 27.410 -27.695 1.00 33.53 H new ATOM 0 HA HIS A 115 6.003 24.645 -28.062 1.00 11.44 H new ATOM 0 HB2 HIS A 115 6.373 26.422 -29.824 1.00 70.43 H new ATOM 0 HB3 HIS A 115 8.063 26.465 -29.364 1.00 70.43 H new ATOM 0 HD2 HIS A 115 5.762 24.510 -31.690 1.00 64.15 H new ATOM 0 HE1 HIS A 115 9.361 22.278 -31.432 1.00 13.24 H new ATOM 0 HE2 HIS A 115 7.158 22.543 -32.681 1.00 1.13 H new ATOM 1785 N ALA A 116 9.088 25.472 -27.169 1.00 61.15 N ATOM 1786 CA ALA A 116 10.299 24.958 -26.542 1.00 45.23 C ATOM 1787 C ALA A 116 10.005 24.402 -25.153 1.00 70.23 C ATOM 1788 O ALA A 116 10.588 23.399 -24.738 1.00 43.43 O ATOM 1789 CB ALA A 116 11.356 26.050 -26.462 1.00 62.15 C ATOM 0 H ALA A 116 9.146 26.447 -27.462 1.00 61.15 H new ATOM 0 HA ALA A 116 10.679 24.143 -27.158 1.00 45.23 H new ATOM 0 HB1 ALA A 116 12.255 25.652 -25.992 1.00 62.15 H new ATOM 0 HB2 ALA A 116 11.596 26.398 -27.467 1.00 62.15 H new ATOM 0 HB3 ALA A 116 10.975 26.883 -25.871 1.00 62.15 H new ATOM 1795 N LEU A 117 9.098 25.058 -24.439 1.00 13.04 N ATOM 1796 CA LEU A 117 8.726 24.629 -23.095 1.00 10.13 C ATOM 1797 C LEU A 117 8.112 23.233 -23.119 1.00 62.10 C ATOM 1798 O LEU A 117 8.662 22.292 -22.546 1.00 51.45 O ATOM 1799 CB LEU A 117 7.740 25.621 -22.476 1.00 11.32 C ATOM 1800 CG LEU A 117 8.302 26.535 -21.387 1.00 2.54 C ATOM 1801 CD1 LEU A 117 8.624 25.737 -20.133 1.00 33.11 C ATOM 1802 CD2 LEU A 117 9.540 27.265 -21.889 1.00 30.52 C ATOM 0 H LEU A 117 8.606 25.889 -24.768 1.00 13.04 H new ATOM 0 HA LEU A 117 9.630 24.598 -22.487 1.00 10.13 H new ATOM 0 HB2 LEU A 117 7.335 26.245 -23.273 1.00 11.32 H new ATOM 0 HB3 LEU A 117 6.906 25.059 -22.056 1.00 11.32 H new ATOM 0 HG LEU A 117 7.544 27.277 -21.136 1.00 2.54 H new ATOM 0 HD11 LEU A 117 9.023 26.405 -19.369 1.00 33.11 H new ATOM 0 HD12 LEU A 117 7.716 25.262 -19.761 1.00 33.11 H new ATOM 0 HD13 LEU A 117 9.364 24.972 -20.369 1.00 33.11 H new ATOM 0 HD21 LEU A 117 9.926 27.911 -21.101 1.00 30.52 H new ATOM 0 HD22 LEU A 117 10.303 26.538 -22.169 1.00 30.52 H new ATOM 0 HD23 LEU A 117 9.279 27.869 -22.758 1.00 30.52 H new ATOM 1814 N ALA A 118 6.971 23.106 -23.788 1.00 33.55 N ATOM 1815 CA ALA A 118 6.285 21.824 -23.890 1.00 75.43 C ATOM 1816 C ALA A 118 7.231 20.732 -24.379 1.00 53.22 C ATOM 1817 O ALA A 118 7.350 19.676 -23.758 1.00 4.22 O ATOM 1818 CB ALA A 118 5.085 21.940 -24.819 1.00 61.01 C ATOM 0 H ALA A 118 6.502 23.875 -24.267 1.00 33.55 H new ATOM 0 HA ALA A 118 5.936 21.547 -22.895 1.00 75.43 H new ATOM 0 HB1 ALA A 118 4.582 20.975 -24.886 1.00 61.01 H new ATOM 0 HB2 ALA A 118 4.392 22.684 -24.427 1.00 61.01 H new ATOM 0 HB3 ALA A 118 5.421 22.244 -25.811 1.00 61.01 H new ATOM 1824 N VAL A 119 7.901 20.993 -25.497 1.00 51.50 N ATOM 1825 CA VAL A 119 8.837 20.033 -26.069 1.00 41.33 C ATOM 1826 C VAL A 119 9.867 19.588 -25.037 1.00 60.13 C ATOM 1827 O VAL A 119 10.261 18.422 -25.002 1.00 1.15 O ATOM 1828 CB VAL A 119 9.570 20.623 -27.289 1.00 22.31 C ATOM 1829 CG1 VAL A 119 10.562 19.617 -27.853 1.00 42.11 C ATOM 1830 CG2 VAL A 119 8.572 21.054 -28.353 1.00 21.02 C ATOM 0 H VAL A 119 7.813 21.862 -26.025 1.00 51.50 H new ATOM 0 HA VAL A 119 8.251 19.171 -26.388 1.00 41.33 H new ATOM 0 HB VAL A 119 10.125 21.504 -26.967 1.00 22.31 H new ATOM 0 HG11 VAL A 119 11.070 20.051 -28.714 1.00 42.11 H new ATOM 0 HG12 VAL A 119 11.296 19.362 -27.089 1.00 42.11 H new ATOM 0 HG13 VAL A 119 10.031 18.716 -28.161 1.00 42.11 H new ATOM 0 HG21 VAL A 119 9.107 21.468 -29.207 1.00 21.02 H new ATOM 0 HG22 VAL A 119 7.988 20.192 -28.674 1.00 21.02 H new ATOM 0 HG23 VAL A 119 7.905 21.811 -27.941 1.00 21.02 H new ATOM 1840 N ASP A 120 10.299 20.523 -24.199 1.00 11.50 N ATOM 1841 CA ASP A 120 11.283 20.228 -23.164 1.00 34.51 C ATOM 1842 C ASP A 120 10.739 19.200 -22.176 1.00 24.02 C ATOM 1843 O ASP A 120 11.396 18.202 -21.880 1.00 34.04 O ATOM 1844 CB ASP A 120 11.676 21.507 -22.424 1.00 23.23 C ATOM 1845 CG ASP A 120 12.953 21.342 -21.622 1.00 53.53 C ATOM 1846 OD1 ASP A 120 12.917 20.647 -20.585 1.00 42.32 O ATOM 1847 OD2 ASP A 120 13.987 21.908 -22.033 1.00 3.34 O ATOM 0 H ASP A 120 9.983 21.493 -24.216 1.00 11.50 H new ATOM 0 HA ASP A 120 12.167 19.811 -23.646 1.00 34.51 H new ATOM 0 HB2 ASP A 120 11.804 22.315 -23.144 1.00 23.23 H new ATOM 0 HB3 ASP A 120 10.866 21.801 -21.756 1.00 23.23 H new ATOM 1852 N ALA A 121 9.537 19.452 -21.668 1.00 43.45 N ATOM 1853 CA ALA A 121 8.906 18.549 -20.715 1.00 13.24 C ATOM 1854 C ALA A 121 8.830 17.131 -21.269 1.00 24.41 C ATOM 1855 O ALA A 121 8.835 16.157 -20.515 1.00 54.11 O ATOM 1856 CB ALA A 121 7.516 19.051 -20.353 1.00 55.23 C ATOM 0 H ALA A 121 8.981 20.275 -21.901 1.00 43.45 H new ATOM 0 HA ALA A 121 9.519 18.526 -19.814 1.00 13.24 H new ATOM 0 HB1 ALA A 121 7.056 18.367 -19.640 1.00 55.23 H new ATOM 0 HB2 ALA A 121 7.592 20.043 -19.907 1.00 55.23 H new ATOM 0 HB3 ALA A 121 6.903 19.104 -21.252 1.00 55.23 H new ATOM 1862 N LYS A 122 8.761 17.020 -22.591 1.00 72.11 N ATOM 1863 CA LYS A 122 8.685 15.720 -23.248 1.00 1.23 C ATOM 1864 C LYS A 122 10.077 15.130 -23.448 1.00 42.14 C ATOM 1865 O LYS A 122 10.363 14.022 -22.997 1.00 75.21 O ATOM 1866 CB LYS A 122 7.974 15.848 -24.597 1.00 3.20 C ATOM 1867 CG LYS A 122 7.703 14.514 -25.270 1.00 41.04 C ATOM 1868 CD LYS A 122 8.894 14.053 -26.094 1.00 73.03 C ATOM 1869 CE LYS A 122 8.503 12.957 -27.074 1.00 32.24 C ATOM 1870 NZ LYS A 122 7.757 11.855 -26.404 1.00 42.14 N ATOM 0 H LYS A 122 8.756 17.815 -23.229 1.00 72.11 H new ATOM 0 HA LYS A 122 8.114 15.049 -22.606 1.00 1.23 H new ATOM 0 HB2 LYS A 122 7.029 16.371 -24.452 1.00 3.20 H new ATOM 0 HB3 LYS A 122 8.580 16.464 -25.261 1.00 3.20 H new ATOM 0 HG2 LYS A 122 7.471 13.764 -24.514 1.00 41.04 H new ATOM 0 HG3 LYS A 122 6.827 14.601 -25.912 1.00 41.04 H new ATOM 0 HD2 LYS A 122 9.309 14.900 -26.640 1.00 73.03 H new ATOM 0 HD3 LYS A 122 9.677 13.687 -25.430 1.00 73.03 H new ATOM 0 HE2 LYS A 122 7.888 13.382 -27.868 1.00 32.24 H new ATOM 0 HE3 LYS A 122 9.399 12.555 -27.546 1.00 32.24 H new ATOM 0 HZ1 LYS A 122 7.406 11.188 -27.120 1.00 42.14 H new ATOM 0 HZ2 LYS A 122 8.390 11.356 -25.747 1.00 42.14 H new ATOM 0 HZ3 LYS A 122 6.953 12.251 -25.876 1.00 42.14 H new ATOM 1884 N ASN A 123 10.940 15.879 -24.127 1.00 63.03 N ATOM 1885 CA ASN A 123 12.303 15.430 -24.387 1.00 23.44 C ATOM 1886 C ASN A 123 12.982 14.980 -23.097 1.00 25.04 C ATOM 1887 O ASN A 123 13.825 14.082 -23.106 1.00 63.31 O ATOM 1888 CB ASN A 123 13.116 16.549 -25.041 1.00 12.04 C ATOM 1889 CG ASN A 123 14.610 16.308 -24.948 1.00 42.52 C ATOM 1890 OD1 ASN A 123 15.153 15.438 -25.629 1.00 44.40 O ATOM 1891 ND2 ASN A 123 15.282 17.081 -24.103 1.00 25.24 N ATOM 0 H ASN A 123 10.720 16.800 -24.507 1.00 63.03 H new ATOM 0 HA ASN A 123 12.255 14.580 -25.068 1.00 23.44 H new ATOM 0 HB2 ASN A 123 12.830 16.638 -26.089 1.00 12.04 H new ATOM 0 HB3 ASN A 123 12.873 17.498 -24.563 1.00 12.04 H new ATOM 0 HD21 ASN A 123 16.290 16.966 -23.998 1.00 25.24 H new ATOM 0 HD22 ASN A 123 14.790 17.790 -23.559 1.00 25.24 H new ATOM 1898 N LEU A 124 12.610 15.610 -21.988 1.00 31.32 N ATOM 1899 CA LEU A 124 13.182 15.275 -20.688 1.00 61.55 C ATOM 1900 C LEU A 124 13.052 13.781 -20.405 1.00 44.41 C ATOM 1901 O LEU A 124 14.050 13.089 -20.195 1.00 14.52 O ATOM 1902 CB LEU A 124 12.493 16.077 -19.583 1.00 73.34 C ATOM 1903 CG LEU A 124 13.410 16.673 -18.515 1.00 51.21 C ATOM 1904 CD1 LEU A 124 12.591 17.332 -17.416 1.00 21.54 C ATOM 1905 CD2 LEU A 124 14.321 15.601 -17.935 1.00 72.01 C ATOM 0 H LEU A 124 11.915 16.356 -21.963 1.00 31.32 H new ATOM 0 HA LEU A 124 14.241 15.532 -20.708 1.00 61.55 H new ATOM 0 HB2 LEU A 124 11.933 16.889 -20.046 1.00 73.34 H new ATOM 0 HB3 LEU A 124 11.767 15.430 -19.090 1.00 73.34 H new ATOM 0 HG LEU A 124 14.033 17.436 -18.982 1.00 51.21 H new ATOM 0 HD11 LEU A 124 13.261 17.751 -16.665 1.00 21.54 H new ATOM 0 HD12 LEU A 124 11.982 18.129 -17.844 1.00 21.54 H new ATOM 0 HD13 LEU A 124 11.942 16.590 -16.951 1.00 21.54 H new ATOM 0 HD21 LEU A 124 14.967 16.044 -17.176 1.00 72.01 H new ATOM 0 HD22 LEU A 124 13.716 14.815 -17.483 1.00 72.01 H new ATOM 0 HD23 LEU A 124 14.934 15.175 -18.730 1.00 72.01 H new ATOM 1917 N LEU A 125 11.818 13.290 -20.403 1.00 42.01 N ATOM 1918 CA LEU A 125 11.558 11.878 -20.148 1.00 75.51 C ATOM 1919 C LEU A 125 11.989 11.021 -21.334 1.00 44.22 C ATOM 1920 O LEU A 125 12.456 9.895 -21.162 1.00 42.13 O ATOM 1921 CB LEU A 125 10.072 11.657 -19.859 1.00 74.15 C ATOM 1922 CG LEU A 125 9.718 11.260 -18.426 1.00 0.33 C ATOM 1923 CD1 LEU A 125 10.363 12.215 -17.433 1.00 42.12 C ATOM 1924 CD2 LEU A 125 8.208 11.232 -18.237 1.00 63.10 C ATOM 0 H LEU A 125 10.982 13.849 -20.575 1.00 42.01 H new ATOM 0 HA LEU A 125 12.141 11.579 -19.277 1.00 75.51 H new ATOM 0 HB2 LEU A 125 9.535 12.573 -20.104 1.00 74.15 H new ATOM 0 HB3 LEU A 125 9.703 10.882 -20.531 1.00 74.15 H new ATOM 0 HG LEU A 125 10.106 10.258 -18.241 1.00 0.33 H new ATOM 0 HD11 LEU A 125 10.100 11.917 -16.418 1.00 42.12 H new ATOM 0 HD12 LEU A 125 11.446 12.185 -17.551 1.00 42.12 H new ATOM 0 HD13 LEU A 125 10.006 13.228 -17.618 1.00 42.12 H new ATOM 0 HD21 LEU A 125 7.975 10.947 -17.211 1.00 63.10 H new ATOM 0 HD22 LEU A 125 7.797 12.221 -18.441 1.00 63.10 H new ATOM 0 HD23 LEU A 125 7.769 10.508 -18.923 1.00 63.10 H new ATOM 1936 N ASP A 126 11.833 11.563 -22.537 1.00 15.43 N ATOM 1937 CA ASP A 126 12.209 10.851 -23.752 1.00 23.31 C ATOM 1938 C ASP A 126 13.685 10.466 -23.721 1.00 3.31 C ATOM 1939 O ASP A 126 14.053 9.344 -24.069 1.00 12.11 O ATOM 1940 CB ASP A 126 11.919 11.710 -24.983 1.00 60.15 C ATOM 1941 CG ASP A 126 10.970 11.032 -25.952 1.00 20.31 C ATOM 1942 OD1 ASP A 126 9.984 10.423 -25.487 1.00 54.44 O ATOM 1943 OD2 ASP A 126 11.214 11.109 -27.174 1.00 63.55 O ATOM 0 H ASP A 126 11.448 12.494 -22.696 1.00 15.43 H new ATOM 0 HA ASP A 126 11.615 9.939 -23.808 1.00 23.31 H new ATOM 0 HB2 ASP A 126 11.492 12.661 -24.666 1.00 60.15 H new ATOM 0 HB3 ASP A 126 12.855 11.936 -25.494 1.00 60.15 H new ATOM 1948 N VAL A 127 14.528 11.406 -23.303 1.00 34.22 N ATOM 1949 CA VAL A 127 15.964 11.166 -23.226 1.00 73.23 C ATOM 1950 C VAL A 127 16.287 10.094 -22.191 1.00 45.24 C ATOM 1951 O VAL A 127 16.856 9.052 -22.519 1.00 41.32 O ATOM 1952 CB VAL A 127 16.730 12.454 -22.872 1.00 51.21 C ATOM 1953 CG1 VAL A 127 18.210 12.160 -22.679 1.00 73.33 C ATOM 1954 CG2 VAL A 127 16.524 13.509 -23.948 1.00 53.25 C ATOM 0 H VAL A 127 14.241 12.341 -23.013 1.00 34.22 H new ATOM 0 HA VAL A 127 16.281 10.823 -24.211 1.00 73.23 H new ATOM 0 HB VAL A 127 16.336 12.843 -21.933 1.00 51.21 H new ATOM 0 HG11 VAL A 127 18.735 13.082 -22.429 1.00 73.33 H new ATOM 0 HG12 VAL A 127 18.336 11.441 -21.870 1.00 73.33 H new ATOM 0 HG13 VAL A 127 18.622 11.746 -23.599 1.00 73.33 H new ATOM 0 HG21 VAL A 127 17.072 14.412 -23.681 1.00 53.25 H new ATOM 0 HG22 VAL A 127 16.889 13.131 -24.903 1.00 53.25 H new ATOM 0 HG23 VAL A 127 15.462 13.741 -24.032 1.00 53.25 H new ATOM 1964 N ILE A 128 15.922 10.357 -20.941 1.00 75.05 N ATOM 1965 CA ILE A 128 16.172 9.414 -19.858 1.00 73.05 C ATOM 1966 C ILE A 128 15.558 8.051 -20.163 1.00 45.53 C ATOM 1967 O ILE A 128 15.991 7.031 -19.628 1.00 20.22 O ATOM 1968 CB ILE A 128 15.609 9.930 -18.521 1.00 54.22 C ATOM 1969 CG1 ILE A 128 14.079 9.918 -18.548 1.00 72.22 C ATOM 1970 CG2 ILE A 128 16.127 11.331 -18.234 1.00 4.24 C ATOM 1971 CD1 ILE A 128 13.448 10.473 -17.291 1.00 12.14 C ATOM 0 H ILE A 128 15.452 11.215 -20.653 1.00 75.05 H new ATOM 0 HA ILE A 128 17.254 9.312 -19.772 1.00 73.05 H new ATOM 0 HB ILE A 128 15.945 9.268 -17.723 1.00 54.22 H new ATOM 0 HG12 ILE A 128 13.734 10.498 -19.404 1.00 72.22 H new ATOM 0 HG13 ILE A 128 13.734 8.895 -18.696 1.00 72.22 H new ATOM 0 HG21 ILE A 128 15.720 11.682 -17.286 1.00 4.24 H new ATOM 0 HG22 ILE A 128 17.215 11.312 -18.177 1.00 4.24 H new ATOM 0 HG23 ILE A 128 15.817 12.004 -19.033 1.00 4.24 H new ATOM 0 HD11 ILE A 128 12.362 10.433 -17.381 1.00 12.14 H new ATOM 0 HD12 ILE A 128 13.763 9.879 -16.433 1.00 12.14 H new ATOM 0 HD13 ILE A 128 13.763 11.507 -17.152 1.00 12.14 H new ATOM 1983 N ASP A 129 14.550 8.043 -21.028 1.00 20.00 N ATOM 1984 CA ASP A 129 13.878 6.805 -21.407 1.00 45.33 C ATOM 1985 C ASP A 129 14.878 5.790 -21.954 1.00 13.34 C ATOM 1986 O ASP A 129 14.789 4.599 -21.659 1.00 25.31 O ATOM 1987 CB ASP A 129 12.796 7.086 -22.451 1.00 0.44 C ATOM 1988 CG ASP A 129 11.430 6.593 -22.015 1.00 42.12 C ATOM 1989 OD1 ASP A 129 11.121 6.692 -20.810 1.00 13.14 O ATOM 1990 OD2 ASP A 129 10.671 6.107 -22.880 1.00 1.11 O ATOM 0 H ASP A 129 14.180 8.879 -21.480 1.00 20.00 H new ATOM 0 HA ASP A 129 13.412 6.386 -20.515 1.00 45.33 H new ATOM 0 HB2 ASP A 129 12.748 8.158 -22.641 1.00 0.44 H new ATOM 0 HB3 ASP A 129 13.069 6.607 -23.391 1.00 0.44 H new ATOM 1995 N GLN A 130 15.826 6.271 -22.751 1.00 51.22 N ATOM 1996 CA GLN A 130 16.840 5.405 -23.340 1.00 22.11 C ATOM 1997 C GLN A 130 17.624 4.670 -22.257 1.00 55.11 C ATOM 1998 O GLN A 130 18.104 3.558 -22.472 1.00 21.32 O ATOM 1999 CB GLN A 130 17.796 6.222 -24.211 1.00 75.15 C ATOM 2000 CG GLN A 130 17.434 6.209 -25.688 1.00 33.11 C ATOM 2001 CD GLN A 130 17.301 7.603 -26.268 1.00 52.05 C ATOM 2002 OE1 GLN A 130 16.215 8.184 -26.276 1.00 61.23 O ATOM 2003 NE2 GLN A 130 18.408 8.148 -26.759 1.00 12.53 N ATOM 0 H GLN A 130 15.913 7.255 -23.004 1.00 51.22 H new ATOM 0 HA GLN A 130 16.334 4.667 -23.962 1.00 22.11 H new ATOM 0 HB2 GLN A 130 17.806 7.253 -23.857 1.00 75.15 H new ATOM 0 HB3 GLN A 130 18.807 5.833 -24.090 1.00 75.15 H new ATOM 0 HG2 GLN A 130 18.197 5.661 -26.240 1.00 33.11 H new ATOM 0 HG3 GLN A 130 16.495 5.672 -25.823 1.00 33.11 H new ATOM 0 HE21 GLN A 130 19.287 7.631 -26.732 1.00 12.53 H new ATOM 0 HE22 GLN A 130 18.380 9.084 -27.163 1.00 12.53 H new ATOM 2012 N ALA A 131 17.748 5.300 -21.093 1.00 63.15 N ATOM 2013 CA ALA A 131 18.472 4.705 -19.977 1.00 11.14 C ATOM 2014 C ALA A 131 17.681 3.557 -19.359 1.00 15.33 C ATOM 2015 O ALA A 131 18.238 2.506 -19.043 1.00 73.23 O ATOM 2016 CB ALA A 131 18.781 5.761 -18.926 1.00 4.11 C ATOM 0 H ALA A 131 17.357 6.222 -20.899 1.00 63.15 H new ATOM 0 HA ALA A 131 19.410 4.301 -20.358 1.00 11.14 H new ATOM 0 HB1 ALA A 131 19.322 5.303 -18.098 1.00 4.11 H new ATOM 0 HB2 ALA A 131 19.393 6.547 -19.369 1.00 4.11 H new ATOM 0 HB3 ALA A 131 17.850 6.191 -18.557 1.00 4.11 H new ATOM 2022 N ARG A 132 16.379 3.766 -19.188 1.00 2.51 N ATOM 2023 CA ARG A 132 15.512 2.749 -18.606 1.00 10.54 C ATOM 2024 C ARG A 132 15.645 1.427 -19.356 1.00 13.42 C ATOM 2025 O ARG A 132 15.770 0.365 -18.746 1.00 24.24 O ATOM 2026 CB ARG A 132 14.056 3.217 -18.628 1.00 55.03 C ATOM 2027 CG ARG A 132 13.289 2.884 -17.359 1.00 21.32 C ATOM 2028 CD ARG A 132 11.896 3.493 -17.373 1.00 10.32 C ATOM 2029 NE ARG A 132 10.856 2.486 -17.186 1.00 34.43 N ATOM 2030 CZ ARG A 132 10.408 1.702 -18.160 1.00 61.32 C ATOM 2031 NH1 ARG A 132 10.908 1.808 -19.384 1.00 14.53 N ATOM 2032 NH2 ARG A 132 9.459 0.808 -17.912 1.00 0.24 N ATOM 0 H ARG A 132 15.902 4.630 -19.444 1.00 2.51 H new ATOM 0 HA ARG A 132 15.820 2.592 -17.572 1.00 10.54 H new ATOM 0 HB2 ARG A 132 14.032 4.296 -18.784 1.00 55.03 H new ATOM 0 HB3 ARG A 132 13.550 2.761 -19.479 1.00 55.03 H new ATOM 0 HG2 ARG A 132 13.213 1.802 -17.252 1.00 21.32 H new ATOM 0 HG3 ARG A 132 13.839 3.252 -16.493 1.00 21.32 H new ATOM 0 HD2 ARG A 132 11.820 4.243 -16.585 1.00 10.32 H new ATOM 0 HD3 ARG A 132 11.735 4.008 -18.320 1.00 10.32 H new ATOM 0 HE ARG A 132 10.451 2.378 -16.256 1.00 34.43 H new ATOM 0 HH11 ARG A 132 11.638 2.493 -19.579 1.00 14.53 H new ATOM 0 HH12 ARG A 132 10.562 1.205 -20.130 1.00 14.53 H new ATOM 0 HH21 ARG A 132 9.072 0.722 -16.972 1.00 0.24 H new ATOM 0 HH22 ARG A 132 9.116 0.207 -18.661 1.00 0.24 H new ATOM 2046 N LEU A 133 15.615 1.500 -20.682 1.00 3.21 N ATOM 2047 CA LEU A 133 15.732 0.309 -21.516 1.00 52.33 C ATOM 2048 C LEU A 133 17.153 -0.244 -21.480 1.00 34.55 C ATOM 2049 O LEU A 133 17.367 -1.445 -21.646 1.00 62.30 O ATOM 2050 CB LEU A 133 15.335 0.632 -22.958 1.00 61.10 C ATOM 2051 CG LEU A 133 14.029 0.007 -23.451 1.00 3.23 C ATOM 2052 CD1 LEU A 133 14.166 -1.504 -23.555 1.00 4.21 C ATOM 2053 CD2 LEU A 133 12.879 0.378 -22.526 1.00 72.41 C ATOM 0 H LEU A 133 15.511 2.371 -21.203 1.00 3.21 H new ATOM 0 HA LEU A 133 15.057 -0.450 -21.120 1.00 52.33 H new ATOM 0 HB2 LEU A 133 15.257 1.715 -23.058 1.00 61.10 H new ATOM 0 HB3 LEU A 133 16.141 0.308 -23.617 1.00 61.10 H new ATOM 0 HG LEU A 133 13.812 0.400 -24.444 1.00 3.23 H new ATOM 0 HD11 LEU A 133 13.227 -1.931 -23.907 1.00 4.21 H new ATOM 0 HD12 LEU A 133 14.962 -1.750 -24.257 1.00 4.21 H new ATOM 0 HD13 LEU A 133 14.407 -1.916 -22.575 1.00 4.21 H new ATOM 0 HD21 LEU A 133 11.957 -0.075 -22.892 1.00 72.41 H new ATOM 0 HD22 LEU A 133 13.089 0.013 -21.520 1.00 72.41 H new ATOM 0 HD23 LEU A 133 12.766 1.462 -22.503 1.00 72.41 H new ATOM 2065 N LYS A 134 18.121 0.638 -21.258 1.00 54.43 N ATOM 2066 CA LYS A 134 19.521 0.239 -21.196 1.00 25.04 C ATOM 2067 C LYS A 134 19.734 -0.836 -20.134 1.00 73.15 C ATOM 2068 O LYS A 134 20.456 -1.807 -20.358 1.00 32.34 O ATOM 2069 CB LYS A 134 20.406 1.451 -20.893 1.00 34.11 C ATOM 2070 CG LYS A 134 21.868 1.239 -21.244 1.00 2.52 C ATOM 2071 CD LYS A 134 22.736 2.374 -20.726 1.00 14.43 C ATOM 2072 CE LYS A 134 24.189 2.198 -21.138 1.00 21.24 C ATOM 2073 NZ LYS A 134 25.073 3.216 -20.505 1.00 34.24 N ATOM 0 H LYS A 134 17.961 1.636 -21.118 1.00 54.43 H new ATOM 0 HA LYS A 134 19.798 -0.173 -22.166 1.00 25.04 H new ATOM 0 HB2 LYS A 134 20.030 2.312 -21.445 1.00 34.11 H new ATOM 0 HB3 LYS A 134 20.327 1.692 -19.833 1.00 34.11 H new ATOM 0 HG2 LYS A 134 22.211 0.295 -20.821 1.00 2.52 H new ATOM 0 HG3 LYS A 134 21.976 1.162 -22.326 1.00 2.52 H new ATOM 0 HD2 LYS A 134 22.361 3.324 -21.108 1.00 14.43 H new ATOM 0 HD3 LYS A 134 22.668 2.418 -19.639 1.00 14.43 H new ATOM 0 HE2 LYS A 134 24.527 1.200 -20.859 1.00 21.24 H new ATOM 0 HE3 LYS A 134 24.270 2.271 -22.223 1.00 21.24 H new ATOM 0 HZ1 LYS A 134 26.055 3.062 -20.811 1.00 34.24 H new ATOM 0 HZ2 LYS A 134 24.767 4.168 -20.791 1.00 34.24 H new ATOM 0 HZ3 LYS A 134 25.016 3.130 -19.470 1.00 34.24 H new ATOM 2087 N MET A 135 19.099 -0.656 -18.981 1.00 32.01 N ATOM 2088 CA MET A 135 19.217 -1.613 -17.887 1.00 13.23 C ATOM 2089 C MET A 135 18.355 -2.844 -18.146 1.00 71.42 C ATOM 2090 O MET A 135 18.850 -3.972 -18.143 1.00 3.34 O ATOM 2091 CB MET A 135 18.809 -0.960 -16.564 1.00 64.42 C ATOM 2092 CG MET A 135 19.520 -1.545 -15.354 1.00 42.51 C ATOM 2093 SD MET A 135 18.387 -2.344 -14.202 1.00 71.20 S ATOM 2094 CE MET A 135 17.520 -0.924 -13.539 1.00 72.03 C ATOM 0 H MET A 135 18.498 0.143 -18.780 1.00 32.01 H new ATOM 0 HA MET A 135 20.259 -1.928 -17.823 1.00 13.23 H new ATOM 0 HB2 MET A 135 19.017 0.109 -16.616 1.00 64.42 H new ATOM 0 HB3 MET A 135 17.733 -1.069 -16.431 1.00 64.42 H new ATOM 0 HG2 MET A 135 20.262 -2.270 -15.689 1.00 42.51 H new ATOM 0 HG3 MET A 135 20.059 -0.752 -14.836 1.00 42.51 H new ATOM 0 HE1 MET A 135 16.859 -1.245 -12.734 1.00 72.03 H new ATOM 0 HE2 MET A 135 18.242 -0.206 -13.151 1.00 72.03 H new ATOM 0 HE3 MET A 135 16.931 -0.456 -14.328 1.00 72.03 H new ATOM 2104 N ILE A 136 17.064 -2.621 -18.370 1.00 64.45 N ATOM 2105 CA ILE A 136 16.135 -3.713 -18.632 1.00 62.44 C ATOM 2106 C ILE A 136 16.644 -4.611 -19.756 1.00 11.44 C ATOM 2107 O ILE A 136 16.957 -5.781 -19.536 1.00 11.40 O ATOM 2108 CB ILE A 136 14.737 -3.186 -19.005 1.00 41.21 C ATOM 2109 CG1 ILE A 136 14.186 -2.301 -17.885 1.00 24.44 C ATOM 2110 CG2 ILE A 136 13.792 -4.344 -19.286 1.00 74.04 C ATOM 2111 CD1 ILE A 136 13.980 -3.038 -16.579 1.00 45.25 C ATOM 0 H ILE A 136 16.638 -1.694 -18.375 1.00 64.45 H new ATOM 0 HA ILE A 136 16.062 -4.292 -17.712 1.00 62.44 H new ATOM 0 HB ILE A 136 14.821 -2.584 -19.910 1.00 41.21 H new ATOM 0 HG12 ILE A 136 14.871 -1.469 -17.720 1.00 24.44 H new ATOM 0 HG13 ILE A 136 13.236 -1.873 -18.205 1.00 24.44 H new ATOM 0 HG21 ILE A 136 12.808 -3.955 -19.548 1.00 74.04 H new ATOM 0 HG22 ILE A 136 14.180 -4.938 -20.114 1.00 74.04 H new ATOM 0 HG23 ILE A 136 13.710 -4.970 -18.398 1.00 74.04 H new ATOM 0 HD11 ILE A 136 13.588 -2.349 -15.831 1.00 45.25 H new ATOM 0 HD12 ILE A 136 13.272 -3.853 -16.729 1.00 45.25 H new ATOM 0 HD13 ILE A 136 14.932 -3.443 -16.236 1.00 45.25 H new ATOM 2123 N SER A 137 16.725 -4.053 -20.960 1.00 24.53 N ATOM 2124 CA SER A 137 17.194 -4.804 -22.119 1.00 5.42 C ATOM 2125 C SER A 137 18.713 -4.947 -22.095 1.00 2.22 C ATOM 2126 O SER A 137 19.415 -4.360 -22.918 1.00 60.22 O ATOM 2127 CB SER A 137 16.756 -4.112 -23.411 1.00 64.45 C ATOM 2128 OG SER A 137 15.458 -4.528 -23.797 1.00 15.41 O ATOM 0 H SER A 137 16.472 -3.085 -21.158 1.00 24.53 H new ATOM 0 HA SER A 137 16.752 -5.800 -22.080 1.00 5.42 H new ATOM 0 HB2 SER A 137 16.768 -3.031 -23.271 1.00 64.45 H new ATOM 0 HB3 SER A 137 17.466 -4.338 -24.207 1.00 64.45 H new ATOM 0 HG SER A 137 15.200 -4.070 -24.624 1.00 15.41 H new ATOM 2272 N GLU A 162 2.304 9.382 -30.431 1.00 22.10 N ATOM 2273 CA GLU A 162 1.128 10.227 -30.258 1.00 64.20 C ATOM 2274 C GLU A 162 1.526 11.620 -29.779 1.00 55.44 C ATOM 2275 O GLU A 162 1.090 12.628 -30.338 1.00 4.53 O ATOM 2276 CB GLU A 162 0.158 9.590 -29.261 1.00 11.52 C ATOM 2277 CG GLU A 162 -1.302 9.894 -29.554 1.00 2.43 C ATOM 2278 CD GLU A 162 -2.012 10.536 -28.377 1.00 64.31 C ATOM 2279 OE1 GLU A 162 -1.999 11.781 -28.284 1.00 44.14 O ATOM 2280 OE2 GLU A 162 -2.579 9.793 -27.549 1.00 74.04 O ATOM 0 HA GLU A 162 0.634 10.322 -31.225 1.00 64.20 H new ATOM 0 HB2 GLU A 162 0.303 8.510 -29.265 1.00 11.52 H new ATOM 0 HB3 GLU A 162 0.399 9.941 -28.257 1.00 11.52 H new ATOM 0 HG2 GLU A 162 -1.365 10.557 -30.417 1.00 2.43 H new ATOM 0 HG3 GLU A 162 -1.815 8.970 -29.823 1.00 2.43 H new ATOM 2287 N LEU A 163 2.354 11.669 -28.742 1.00 51.20 N ATOM 2288 CA LEU A 163 2.810 12.939 -28.187 1.00 23.44 C ATOM 2289 C LEU A 163 3.683 13.689 -29.188 1.00 35.01 C ATOM 2290 O LEU A 163 3.587 14.910 -29.317 1.00 22.40 O ATOM 2291 CB LEU A 163 3.590 12.701 -26.892 1.00 34.40 C ATOM 2292 CG LEU A 163 2.750 12.431 -25.643 1.00 32.20 C ATOM 2293 CD1 LEU A 163 2.141 11.038 -25.699 1.00 45.14 C ATOM 2294 CD2 LEU A 163 3.593 12.596 -24.387 1.00 63.12 C ATOM 0 H LEU A 163 2.723 10.845 -28.268 1.00 51.20 H new ATOM 0 HA LEU A 163 1.933 13.548 -27.970 1.00 23.44 H new ATOM 0 HB2 LEU A 163 4.260 11.855 -27.045 1.00 34.40 H new ATOM 0 HB3 LEU A 163 4.216 13.573 -26.703 1.00 34.40 H new ATOM 0 HG LEU A 163 1.939 13.159 -25.611 1.00 32.20 H new ATOM 0 HD11 LEU A 163 1.547 10.864 -24.802 1.00 45.14 H new ATOM 0 HD12 LEU A 163 1.503 10.955 -26.579 1.00 45.14 H new ATOM 0 HD13 LEU A 163 2.937 10.295 -25.757 1.00 45.14 H new ATOM 0 HD21 LEU A 163 2.979 12.400 -23.508 1.00 63.12 H new ATOM 0 HD22 LEU A 163 4.425 11.892 -24.412 1.00 63.12 H new ATOM 0 HD23 LEU A 163 3.980 13.614 -24.340 1.00 63.12 H new ATOM 2306 N ASP A 164 4.530 12.951 -29.896 1.00 24.24 N ATOM 2307 CA ASP A 164 5.418 13.546 -30.888 1.00 74.35 C ATOM 2308 C ASP A 164 4.617 14.247 -31.981 1.00 43.33 C ATOM 2309 O ASP A 164 4.836 15.425 -32.266 1.00 24.12 O ATOM 2310 CB ASP A 164 6.318 12.475 -31.506 1.00 72.52 C ATOM 2311 CG ASP A 164 7.311 11.908 -30.511 1.00 1.44 C ATOM 2312 OD1 ASP A 164 6.952 11.782 -29.321 1.00 25.32 O ATOM 2313 OD2 ASP A 164 8.447 11.591 -30.921 1.00 52.22 O ATOM 0 H ASP A 164 4.621 11.939 -29.802 1.00 24.24 H new ATOM 0 HA ASP A 164 6.040 14.286 -30.386 1.00 74.35 H new ATOM 0 HB2 ASP A 164 5.700 11.667 -31.898 1.00 72.52 H new ATOM 0 HB3 ASP A 164 6.858 12.902 -32.351 1.00 72.52 H new ATOM 2318 N ARG A 165 3.690 13.516 -32.591 1.00 22.11 N ATOM 2319 CA ARG A 165 2.859 14.067 -33.654 1.00 50.42 C ATOM 2320 C ARG A 165 2.202 15.371 -33.210 1.00 35.44 C ATOM 2321 O ARG A 165 2.088 16.319 -33.988 1.00 25.40 O ATOM 2322 CB ARG A 165 1.787 13.058 -34.068 1.00 34.12 C ATOM 2323 CG ARG A 165 1.898 12.609 -35.516 1.00 5.42 C ATOM 2324 CD ARG A 165 0.829 13.255 -36.383 1.00 45.42 C ATOM 2325 NE ARG A 165 0.674 12.569 -37.663 1.00 25.00 N ATOM 2326 CZ ARG A 165 -0.330 12.797 -38.502 1.00 65.13 C ATOM 2327 NH1 ARG A 165 -1.262 13.689 -38.199 1.00 33.13 N ATOM 2328 NH2 ARG A 165 -0.402 12.132 -39.648 1.00 43.14 N ATOM 0 H ARG A 165 3.496 12.540 -32.367 1.00 22.11 H new ATOM 0 HA ARG A 165 3.500 14.277 -34.510 1.00 50.42 H new ATOM 0 HB2 ARG A 165 1.853 12.184 -33.420 1.00 34.12 H new ATOM 0 HB3 ARG A 165 0.803 13.500 -33.908 1.00 34.12 H new ATOM 0 HG2 ARG A 165 2.885 12.864 -35.903 1.00 5.42 H new ATOM 0 HG3 ARG A 165 1.805 11.524 -35.570 1.00 5.42 H new ATOM 0 HD2 ARG A 165 -0.122 13.248 -35.851 1.00 45.42 H new ATOM 0 HD3 ARG A 165 1.088 14.299 -36.560 1.00 45.42 H new ATOM 0 HE ARG A 165 1.375 11.877 -37.927 1.00 25.00 H new ATOM 0 HH11 ARG A 165 -1.210 14.203 -37.319 1.00 33.13 H new ATOM 0 HH12 ARG A 165 -2.032 13.862 -38.845 1.00 33.13 H new ATOM 0 HH21 ARG A 165 0.314 11.445 -39.885 1.00 43.14 H new ATOM 0 HH22 ARG A 165 -1.173 12.308 -40.292 1.00 43.14 H new ATOM 2342 N LEU A 166 1.769 15.411 -31.954 1.00 60.32 N ATOM 2343 CA LEU A 166 1.122 16.597 -31.405 1.00 50.54 C ATOM 2344 C LEU A 166 2.053 17.804 -31.469 1.00 23.24 C ATOM 2345 O LEU A 166 1.668 18.875 -31.938 1.00 51.32 O ATOM 2346 CB LEU A 166 0.693 16.345 -29.959 1.00 54.50 C ATOM 2347 CG LEU A 166 -0.681 15.701 -29.769 1.00 61.23 C ATOM 2348 CD1 LEU A 166 -0.953 15.449 -28.294 1.00 54.34 C ATOM 2349 CD2 LEU A 166 -1.769 16.577 -30.373 1.00 32.32 C ATOM 0 H LEU A 166 1.855 14.635 -31.297 1.00 60.32 H new ATOM 0 HA LEU A 166 0.239 16.811 -32.007 1.00 50.54 H new ATOM 0 HB2 LEU A 166 1.440 15.707 -29.486 1.00 54.50 H new ATOM 0 HB3 LEU A 166 0.703 17.296 -29.427 1.00 54.50 H new ATOM 0 HG LEU A 166 -0.686 14.742 -30.287 1.00 61.23 H new ATOM 0 HD11 LEU A 166 -1.935 14.990 -28.178 1.00 54.34 H new ATOM 0 HD12 LEU A 166 -0.191 14.781 -27.892 1.00 54.34 H new ATOM 0 HD13 LEU A 166 -0.928 16.395 -27.753 1.00 54.34 H new ATOM 0 HD21 LEU A 166 -2.740 16.103 -30.228 1.00 32.32 H new ATOM 0 HD22 LEU A 166 -1.765 17.551 -29.884 1.00 32.32 H new ATOM 0 HD23 LEU A 166 -1.583 16.705 -31.439 1.00 32.32 H new ATOM 2361 N LEU A 167 3.281 17.622 -30.995 1.00 0.11 N ATOM 2362 CA LEU A 167 4.269 18.695 -30.999 1.00 44.14 C ATOM 2363 C LEU A 167 4.455 19.259 -32.405 1.00 34.05 C ATOM 2364 O LEU A 167 4.488 20.475 -32.598 1.00 1.13 O ATOM 2365 CB LEU A 167 5.608 18.185 -30.462 1.00 35.21 C ATOM 2366 CG LEU A 167 5.925 18.536 -29.008 1.00 12.30 C ATOM 2367 CD1 LEU A 167 4.778 18.126 -28.097 1.00 40.22 C ATOM 2368 CD2 LEU A 167 7.221 17.871 -28.569 1.00 60.31 C ATOM 0 H LEU A 167 3.616 16.742 -30.603 1.00 0.11 H new ATOM 0 HA LEU A 167 3.905 19.493 -30.352 1.00 44.14 H new ATOM 0 HB2 LEU A 167 5.629 17.100 -30.566 1.00 35.21 H new ATOM 0 HB3 LEU A 167 6.404 18.581 -31.092 1.00 35.21 H new ATOM 0 HG LEU A 167 6.051 19.616 -28.935 1.00 12.30 H new ATOM 0 HD11 LEU A 167 5.022 18.384 -27.066 1.00 40.22 H new ATOM 0 HD12 LEU A 167 3.870 18.650 -28.397 1.00 40.22 H new ATOM 0 HD13 LEU A 167 4.619 17.050 -28.174 1.00 40.22 H new ATOM 0 HD21 LEU A 167 7.431 18.132 -27.532 1.00 60.31 H new ATOM 0 HD22 LEU A 167 7.123 16.789 -28.658 1.00 60.31 H new ATOM 0 HD23 LEU A 167 8.039 18.215 -29.202 1.00 60.31 H new ATOM 2380 N LEU A 168 4.572 18.368 -33.383 1.00 3.20 N ATOM 2381 CA LEU A 168 4.752 18.777 -34.772 1.00 34.41 C ATOM 2382 C LEU A 168 3.668 19.764 -35.193 1.00 42.14 C ATOM 2383 O LEU A 168 3.944 20.745 -35.883 1.00 2.44 O ATOM 2384 CB LEU A 168 4.728 17.554 -35.691 1.00 24.23 C ATOM 2385 CG LEU A 168 5.766 17.539 -36.814 1.00 72.50 C ATOM 2386 CD1 LEU A 168 5.605 16.293 -37.672 1.00 41.31 C ATOM 2387 CD2 LEU A 168 5.648 18.794 -37.666 1.00 2.23 C ATOM 0 H LEU A 168 4.546 17.358 -33.240 1.00 3.20 H new ATOM 0 HA LEU A 168 5.720 19.270 -34.858 1.00 34.41 H new ATOM 0 HB2 LEU A 168 4.870 16.662 -35.080 1.00 24.23 H new ATOM 0 HB3 LEU A 168 3.737 17.480 -36.138 1.00 24.23 H new ATOM 0 HG LEU A 168 6.759 17.521 -36.365 1.00 72.50 H new ATOM 0 HD11 LEU A 168 6.352 16.299 -38.466 1.00 41.31 H new ATOM 0 HD12 LEU A 168 5.740 15.406 -37.054 1.00 41.31 H new ATOM 0 HD13 LEU A 168 4.608 16.281 -38.112 1.00 41.31 H new ATOM 0 HD21 LEU A 168 6.394 18.766 -38.460 1.00 2.23 H new ATOM 0 HD22 LEU A 168 4.652 18.843 -38.106 1.00 2.23 H new ATOM 0 HD23 LEU A 168 5.813 19.673 -37.043 1.00 2.23 H new ATOM 2399 N GLU A 169 2.436 19.498 -34.772 1.00 74.13 N ATOM 2400 CA GLU A 169 1.311 20.365 -35.106 1.00 24.35 C ATOM 2401 C GLU A 169 1.544 21.781 -34.587 1.00 33.23 C ATOM 2402 O GLU A 169 1.340 22.759 -35.307 1.00 1.33 O ATOM 2403 CB GLU A 169 0.014 19.802 -34.521 1.00 1.01 C ATOM 2404 CG GLU A 169 -1.204 20.666 -34.800 1.00 33.10 C ATOM 2405 CD GLU A 169 -2.253 19.947 -35.626 1.00 65.45 C ATOM 2406 OE1 GLU A 169 -1.873 19.264 -36.601 1.00 21.32 O ATOM 2407 OE2 GLU A 169 -3.452 20.067 -35.300 1.00 24.44 O ATOM 0 H GLU A 169 2.191 18.690 -34.200 1.00 74.13 H new ATOM 0 HA GLU A 169 1.224 20.404 -36.192 1.00 24.35 H new ATOM 0 HB2 GLU A 169 -0.156 18.806 -34.929 1.00 1.01 H new ATOM 0 HB3 GLU A 169 0.130 19.689 -33.443 1.00 1.01 H new ATOM 0 HG2 GLU A 169 -1.645 20.982 -33.855 1.00 33.10 H new ATOM 0 HG3 GLU A 169 -0.892 21.570 -35.323 1.00 33.10 H new ATOM 2414 N LEU A 170 1.971 21.882 -33.333 1.00 14.41 N ATOM 2415 CA LEU A 170 2.231 23.178 -32.716 1.00 13.52 C ATOM 2416 C LEU A 170 3.153 24.022 -33.590 1.00 10.42 C ATOM 2417 O LEU A 170 2.942 25.223 -33.753 1.00 3.45 O ATOM 2418 CB LEU A 170 2.853 22.991 -31.331 1.00 74.50 C ATOM 2419 CG LEU A 170 2.744 24.182 -30.379 1.00 43.31 C ATOM 2420 CD1 LEU A 170 1.343 24.274 -29.796 1.00 31.44 C ATOM 2421 CD2 LEU A 170 3.780 24.074 -29.270 1.00 0.55 C ATOM 0 H LEU A 170 2.144 21.082 -32.724 1.00 14.41 H new ATOM 0 HA LEU A 170 1.280 23.700 -32.613 1.00 13.52 H new ATOM 0 HB2 LEU A 170 2.383 22.129 -30.857 1.00 74.50 H new ATOM 0 HB3 LEU A 170 3.908 22.749 -31.458 1.00 74.50 H new ATOM 0 HG LEU A 170 2.939 25.093 -30.944 1.00 43.31 H new ATOM 0 HD11 LEU A 170 1.285 25.128 -29.121 1.00 31.44 H new ATOM 0 HD12 LEU A 170 0.621 24.400 -30.603 1.00 31.44 H new ATOM 0 HD13 LEU A 170 1.117 23.361 -29.246 1.00 31.44 H new ATOM 0 HD21 LEU A 170 3.688 24.930 -28.602 1.00 0.55 H new ATOM 0 HD22 LEU A 170 3.616 23.155 -28.707 1.00 0.55 H new ATOM 0 HD23 LEU A 170 4.779 24.059 -29.706 1.00 0.55 H new