USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 804 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 60 SER OG : rot 180:sc= 0.101 USER MOD Set 1.2: A 63 THR OG1 : rot 101:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0219 USER MOD Single : A 3 GLN :FLIP amide:sc= -0.614 F(o=-1.8,f=-0.61) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 180:sc= -1.4! USER MOD Single : A 7 THR OG1 : rot 78:sc= -0.243 USER MOD Single : A 9 ASN : amide:sc= -0.101 K(o=-0.1,f=-1.7) USER MOD Single : A 11 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0278) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0.39) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 39:sc= -2.14! USER MOD Single : A 41 ASN : amide:sc= -1.33 K(o=-1.3,f=-3.1!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0296 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 103:sc= 1.18 USER MOD Single : A 58 SER OG : rot 180:sc= 0.0843 USER MOD Single : A 66 ASN : amide:sc= -0.0252 X(o=-0.025,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.73) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 83 SER OG : rot 180:sc= 0.00912 USER MOD Single : A 86 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 89 SER OG : rot -96:sc= 0.971 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -178:sc= 0 (180deg=-0.00502) USER MOD Single : A 95 ASN :FLIP amide:sc=-0.000116 F(o=-1.6,f=-0.00012) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 98 SER OG : rot 82:sc= 0.0606 USER MOD Single : A 101 GLN : amide:sc= -0.366 K(o=-0.37,f=-2.8!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.279 5.925 -21.586 1.00 0.00 N ATOM 2 CA MET A 1 -5.900 7.329 -21.252 1.00 0.00 C ATOM 3 C MET A 1 -5.380 7.409 -19.808 1.00 0.00 C ATOM 4 O MET A 1 -4.245 7.782 -19.577 1.00 0.00 O ATOM 5 CB MET A 1 -7.191 8.134 -21.402 1.00 0.00 C ATOM 6 CG MET A 1 -7.247 8.756 -22.798 1.00 0.00 C ATOM 7 SD MET A 1 -8.974 9.007 -23.278 1.00 0.00 S ATOM 8 CE MET A 1 -8.924 8.048 -24.812 1.00 0.00 C ATOM 0 H1 MET A 1 -6.629 5.883 -22.564 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.447 5.308 -21.489 1.00 0.00 H new ATOM 0 H3 MET A 1 -7.026 5.603 -20.937 1.00 0.00 H new ATOM 0 HA MET A 1 -5.107 7.707 -21.897 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.055 7.488 -21.246 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.235 8.915 -20.643 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.714 9.707 -22.806 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.749 8.106 -23.518 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.906 8.067 -25.285 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.187 8.481 -25.488 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.650 7.017 -24.588 1.00 0.00 H new ATOM 20 N SER A 2 -6.197 7.064 -18.833 1.00 0.00 N ATOM 21 CA SER A 2 -5.737 7.126 -17.413 1.00 0.00 C ATOM 22 C SER A 2 -6.313 5.946 -16.614 1.00 0.00 C ATOM 23 O SER A 2 -7.368 5.434 -16.937 1.00 0.00 O ATOM 24 CB SER A 2 -6.280 8.451 -16.880 1.00 0.00 C ATOM 25 OG SER A 2 -5.719 9.522 -17.627 1.00 0.00 O ATOM 0 H SER A 2 -7.157 6.744 -18.964 1.00 0.00 H new ATOM 0 HA SER A 2 -4.652 7.065 -17.327 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.367 8.469 -16.957 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.033 8.560 -15.824 1.00 0.00 H new ATOM 0 HG SER A 2 -6.066 10.374 -17.289 1.00 0.00 H new ATOM 31 N GLN A 3 -5.632 5.512 -15.572 1.00 0.00 N ATOM 32 CA GLN A 3 -6.152 4.370 -14.760 1.00 0.00 C ATOM 33 C GLN A 3 -6.481 4.842 -13.335 1.00 0.00 C ATOM 34 O GLN A 3 -6.174 4.166 -12.371 1.00 0.00 O ATOM 35 CB GLN A 3 -5.012 3.347 -14.738 1.00 0.00 C ATOM 36 CG GLN A 3 -5.294 2.236 -15.754 1.00 0.00 C ATOM 37 CD GLN A 3 -5.277 2.822 -17.171 1.00 0.00 C ATOM 38 OE1 GLN A 3 -6.401 3.168 -17.750 1.00 0.00 O flip ATOM 39 NE2 GLN A 3 -4.226 2.966 -17.764 1.00 0.00 N flip ATOM 0 H GLN A 3 -4.744 5.901 -15.255 1.00 0.00 H new ATOM 0 HA GLN A 3 -7.068 3.949 -15.175 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -4.067 3.837 -14.973 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.911 2.922 -13.739 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.545 1.449 -15.665 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -6.262 1.779 -15.550 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.348 2.699 -17.318 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.222 3.354 -18.707 1.00 0.00 H new ATOM 48 N GLU A 4 -7.105 5.996 -13.188 1.00 0.00 N ATOM 49 CA GLU A 4 -7.444 6.491 -11.803 1.00 0.00 C ATOM 50 C GLU A 4 -8.346 5.476 -11.089 1.00 0.00 C ATOM 51 O GLU A 4 -8.178 5.219 -9.911 1.00 0.00 O ATOM 52 CB GLU A 4 -8.181 7.830 -11.973 1.00 0.00 C ATOM 53 CG GLU A 4 -7.161 8.964 -12.084 1.00 0.00 C ATOM 54 CD GLU A 4 -7.824 10.187 -12.719 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.603 10.835 -12.040 1.00 0.00 O ATOM 56 OE2 GLU A 4 -7.543 10.455 -13.877 1.00 0.00 O ATOM 0 H GLU A 4 -7.390 6.608 -13.953 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.544 6.618 -11.202 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.807 7.802 -12.865 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.842 8.003 -11.124 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.775 9.218 -11.097 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.310 8.645 -12.686 1.00 0.00 H new ATOM 63 N GLN A 5 -9.298 4.883 -11.788 1.00 0.00 N ATOM 64 CA GLN A 5 -10.193 3.869 -11.114 1.00 0.00 C ATOM 65 C GLN A 5 -9.334 2.764 -10.472 1.00 0.00 C ATOM 66 O GLN A 5 -9.623 2.308 -9.381 1.00 0.00 O ATOM 67 CB GLN A 5 -11.132 3.290 -12.195 1.00 0.00 C ATOM 68 CG GLN A 5 -10.329 2.525 -13.255 1.00 0.00 C ATOM 69 CD GLN A 5 -11.252 2.145 -14.420 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.136 2.692 -15.498 1.00 0.00 O ATOM 71 NE2 GLN A 5 -12.172 1.225 -14.253 1.00 0.00 N ATOM 0 H GLN A 5 -9.492 5.052 -12.775 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.783 4.328 -10.321 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.861 2.624 -11.733 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.692 4.097 -12.668 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.504 3.140 -13.616 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.890 1.628 -12.817 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -12.273 0.763 -13.349 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -12.786 0.972 -15.027 1.00 0.00 H new ATOM 80 N TYR A 6 -8.257 2.364 -11.117 1.00 0.00 N ATOM 81 CA TYR A 6 -7.364 1.328 -10.498 1.00 0.00 C ATOM 82 C TYR A 6 -6.566 1.989 -9.365 1.00 0.00 C ATOM 83 O TYR A 6 -6.335 1.390 -8.334 1.00 0.00 O ATOM 84 CB TYR A 6 -6.413 0.834 -11.599 1.00 0.00 C ATOM 85 CG TYR A 6 -7.073 -0.278 -12.375 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.090 -1.578 -11.857 1.00 0.00 C ATOM 87 CD2 TYR A 6 -7.665 -0.010 -13.614 1.00 0.00 C ATOM 88 CE1 TYR A 6 -7.698 -2.610 -12.577 1.00 0.00 C ATOM 89 CE2 TYR A 6 -8.276 -1.042 -14.335 1.00 0.00 C ATOM 90 CZ TYR A 6 -8.293 -2.342 -13.817 1.00 0.00 C ATOM 91 OH TYR A 6 -8.894 -3.361 -14.528 1.00 0.00 O ATOM 0 H TYR A 6 -7.962 2.705 -12.032 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.933 0.493 -10.089 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -6.157 1.656 -12.268 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.482 0.480 -11.157 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -6.633 -1.784 -10.900 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -7.650 0.993 -14.014 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -7.709 -3.613 -12.178 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -8.734 -0.835 -15.291 1.00 0.00 H new ATOM 0 HH TYR A 6 -9.258 -3.005 -15.365 1.00 0.00 H new ATOM 101 N THR A 7 -6.152 3.229 -9.546 1.00 0.00 N ATOM 102 CA THR A 7 -5.379 3.927 -8.462 1.00 0.00 C ATOM 103 C THR A 7 -6.242 4.043 -7.198 1.00 0.00 C ATOM 104 O THR A 7 -5.755 3.857 -6.098 1.00 0.00 O ATOM 105 CB THR A 7 -5.036 5.328 -9.008 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.248 5.193 -10.182 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.260 6.139 -7.966 1.00 0.00 C ATOM 0 H THR A 7 -6.315 3.781 -10.388 1.00 0.00 H new ATOM 0 HA THR A 7 -4.476 3.378 -8.196 1.00 0.00 H new ATOM 0 HB THR A 7 -5.964 5.852 -9.238 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.825 4.959 -10.938 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.028 7.124 -8.371 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.866 6.250 -7.067 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.334 5.621 -7.718 1.00 0.00 H new ATOM 115 N GLU A 8 -7.517 4.341 -7.339 1.00 0.00 N ATOM 116 CA GLU A 8 -8.388 4.456 -6.114 1.00 0.00 C ATOM 117 C GLU A 8 -8.581 3.071 -5.489 1.00 0.00 C ATOM 118 O GLU A 8 -8.530 2.923 -4.283 1.00 0.00 O ATOM 119 CB GLU A 8 -9.736 5.034 -6.574 1.00 0.00 C ATOM 120 CG GLU A 8 -9.582 6.531 -6.851 1.00 0.00 C ATOM 121 CD GLU A 8 -10.867 7.067 -7.484 1.00 0.00 C ATOM 122 OE1 GLU A 8 -11.932 6.622 -7.087 1.00 0.00 O ATOM 123 OE2 GLU A 8 -10.766 7.913 -8.357 1.00 0.00 O ATOM 0 H GLU A 8 -7.986 4.507 -8.229 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.934 5.102 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -10.076 4.520 -7.473 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.494 4.871 -5.808 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -9.371 7.064 -5.924 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -8.736 6.703 -7.517 1.00 0.00 H new ATOM 130 N ASN A 9 -8.779 2.050 -6.297 1.00 0.00 N ATOM 131 CA ASN A 9 -8.944 0.672 -5.718 1.00 0.00 C ATOM 132 C ASN A 9 -7.582 0.163 -5.225 1.00 0.00 C ATOM 133 O ASN A 9 -7.494 -0.468 -4.189 1.00 0.00 O ATOM 134 CB ASN A 9 -9.482 -0.225 -6.844 1.00 0.00 C ATOM 135 CG ASN A 9 -10.949 0.124 -7.120 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.262 1.255 -7.432 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.873 -0.802 -7.019 1.00 0.00 N ATOM 0 H ASN A 9 -8.833 2.108 -7.314 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.631 0.671 -4.872 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.888 -0.088 -7.748 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.394 -1.274 -6.561 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.849 -0.570 -7.202 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.615 -1.753 -6.757 1.00 0.00 H new ATOM 144 N LEU A 10 -6.516 0.449 -5.946 1.00 0.00 N ATOM 145 CA LEU A 10 -5.163 -0.011 -5.483 1.00 0.00 C ATOM 146 C LEU A 10 -4.773 0.750 -4.208 1.00 0.00 C ATOM 147 O LEU A 10 -4.195 0.182 -3.300 1.00 0.00 O ATOM 148 CB LEU A 10 -4.171 0.299 -6.617 1.00 0.00 C ATOM 149 CG LEU A 10 -2.774 -0.190 -6.227 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.783 -1.713 -6.090 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.774 0.219 -7.309 1.00 0.00 C ATOM 0 H LEU A 10 -6.524 0.973 -6.821 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.161 -1.077 -5.255 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.493 -0.187 -7.538 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.150 1.371 -6.812 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.485 0.256 -5.275 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.787 -2.059 -5.812 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.497 -2.005 -5.320 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.071 -2.162 -7.040 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.778 -0.128 -7.034 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.064 -0.228 -8.260 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.766 1.305 -7.406 1.00 0.00 H new ATOM 163 N LYS A 11 -5.093 2.028 -4.120 1.00 0.00 N ATOM 164 CA LYS A 11 -4.735 2.798 -2.875 1.00 0.00 C ATOM 165 C LYS A 11 -5.394 2.150 -1.647 1.00 0.00 C ATOM 166 O LYS A 11 -4.820 2.134 -0.574 1.00 0.00 O ATOM 167 CB LYS A 11 -5.259 4.230 -3.067 1.00 0.00 C ATOM 168 CG LYS A 11 -4.575 5.163 -2.066 1.00 0.00 C ATOM 169 CD LYS A 11 -5.409 5.244 -0.787 1.00 0.00 C ATOM 170 CE LYS A 11 -5.151 6.582 -0.091 1.00 0.00 C ATOM 171 NZ LYS A 11 -6.059 7.549 -0.769 1.00 0.00 N ATOM 0 H LYS A 11 -5.577 2.562 -4.842 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.657 2.799 -2.712 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.064 4.566 -4.085 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.339 4.255 -2.924 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.574 4.796 -1.837 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.459 6.156 -2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.468 5.144 -1.024 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.153 4.420 -0.121 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.366 6.520 0.976 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.108 6.884 -0.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.665 8.508 -0.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.151 7.293 -1.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.995 7.521 -0.317 1.00 0.00 H new ATOM 185 N VAL A 12 -6.587 1.602 -1.792 1.00 0.00 N ATOM 186 CA VAL A 12 -7.245 0.946 -0.608 1.00 0.00 C ATOM 187 C VAL A 12 -6.518 -0.367 -0.295 1.00 0.00 C ATOM 188 O VAL A 12 -6.192 -0.643 0.845 1.00 0.00 O ATOM 189 CB VAL A 12 -8.705 0.673 -1.009 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.433 -0.031 0.136 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.403 2.001 -1.315 1.00 0.00 C ATOM 0 H VAL A 12 -7.122 1.581 -2.660 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.205 1.576 0.281 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.723 0.035 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.467 -0.222 -0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.937 -0.976 0.356 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.415 0.603 1.023 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.438 1.811 -1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.381 2.636 -0.429 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.888 2.503 -2.134 1.00 0.00 H new ATOM 201 N ILE A 13 -6.251 -1.174 -1.299 1.00 0.00 N ATOM 202 CA ILE A 13 -5.528 -2.468 -1.040 1.00 0.00 C ATOM 203 C ILE A 13 -4.111 -2.170 -0.523 1.00 0.00 C ATOM 204 O ILE A 13 -3.612 -2.864 0.344 1.00 0.00 O ATOM 205 CB ILE A 13 -5.480 -3.226 -2.379 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.915 -3.494 -2.859 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.747 -4.558 -2.192 1.00 0.00 C ATOM 208 CD1 ILE A 13 -7.013 -3.263 -4.370 1.00 0.00 C ATOM 0 H ILE A 13 -6.497 -0.998 -2.273 1.00 0.00 H new ATOM 0 HA ILE A 13 -6.034 -3.069 -0.284 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.950 -2.626 -3.119 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -7.202 -4.518 -2.620 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.611 -2.838 -2.336 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.715 -5.092 -3.142 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.730 -4.369 -1.848 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.274 -5.163 -1.453 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -8.033 -3.455 -4.702 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.745 -2.231 -4.598 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.330 -3.938 -4.886 1.00 0.00 H new ATOM 220 N VAL A 14 -3.461 -1.138 -1.029 1.00 0.00 N ATOM 221 CA VAL A 14 -2.082 -0.814 -0.521 1.00 0.00 C ATOM 222 C VAL A 14 -2.179 -0.389 0.953 1.00 0.00 C ATOM 223 O VAL A 14 -1.369 -0.788 1.769 1.00 0.00 O ATOM 224 CB VAL A 14 -1.547 0.344 -1.381 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.136 0.721 -0.920 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.502 -0.091 -2.851 1.00 0.00 C ATOM 0 H VAL A 14 -3.818 -0.519 -1.757 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.415 -1.674 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.205 1.206 -1.274 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.239 1.541 -1.532 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.165 1.031 0.125 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.523 -0.141 -1.025 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.123 0.729 -3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.845 -0.955 -2.955 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.506 -0.357 -3.183 1.00 0.00 H new ATOM 236 N ALA A 15 -3.173 0.406 1.305 1.00 0.00 N ATOM 237 CA ALA A 15 -3.313 0.831 2.746 1.00 0.00 C ATOM 238 C ALA A 15 -3.471 -0.406 3.646 1.00 0.00 C ATOM 239 O ALA A 15 -2.980 -0.429 4.758 1.00 0.00 O ATOM 240 CB ALA A 15 -4.571 1.711 2.830 1.00 0.00 C ATOM 0 H ALA A 15 -3.882 0.773 0.670 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.432 1.378 3.081 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.714 2.044 3.858 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.452 2.579 2.181 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.440 1.135 2.511 1.00 0.00 H new ATOM 246 N GLU A 16 -4.151 -1.442 3.181 1.00 0.00 N ATOM 247 CA GLU A 16 -4.321 -2.674 4.038 1.00 0.00 C ATOM 248 C GLU A 16 -2.947 -3.205 4.485 1.00 0.00 C ATOM 249 O GLU A 16 -2.792 -3.662 5.602 1.00 0.00 O ATOM 250 CB GLU A 16 -5.031 -3.724 3.167 1.00 0.00 C ATOM 251 CG GLU A 16 -5.331 -4.969 4.004 1.00 0.00 C ATOM 252 CD GLU A 16 -5.304 -6.207 3.107 1.00 0.00 C ATOM 253 OE1 GLU A 16 -4.217 -6.680 2.815 1.00 0.00 O ATOM 254 OE2 GLU A 16 -6.369 -6.663 2.727 1.00 0.00 O ATOM 0 H GLU A 16 -4.588 -1.488 2.261 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.899 -2.449 4.934 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.957 -3.312 2.765 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.404 -3.989 2.315 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.595 -5.069 4.802 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.307 -4.873 4.480 1.00 0.00 H new ATOM 261 N LYS A 17 -1.945 -3.144 3.627 1.00 0.00 N ATOM 262 CA LYS A 17 -0.586 -3.645 4.037 1.00 0.00 C ATOM 263 C LYS A 17 0.106 -2.602 4.927 1.00 0.00 C ATOM 264 O LYS A 17 0.584 -2.920 5.998 1.00 0.00 O ATOM 265 CB LYS A 17 0.214 -3.859 2.742 1.00 0.00 C ATOM 266 CG LYS A 17 1.260 -4.953 2.963 1.00 0.00 C ATOM 267 CD LYS A 17 0.677 -6.308 2.559 1.00 0.00 C ATOM 268 CE LYS A 17 0.001 -6.956 3.769 1.00 0.00 C ATOM 269 NZ LYS A 17 -0.089 -8.403 3.431 1.00 0.00 N ATOM 0 H LYS A 17 -2.008 -2.776 2.678 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.658 -4.572 4.606 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.457 -4.141 1.930 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.701 -2.930 2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.153 -4.740 2.376 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.564 -4.974 4.010 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.044 -6.179 1.752 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.467 -6.957 2.180 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.582 -6.798 4.677 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.987 -6.530 3.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -0.543 -8.915 4.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -0.654 -8.523 2.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.866 -8.783 3.276 1.00 0.00 H new ATOM 283 N LEU A 18 0.158 -1.354 4.499 1.00 0.00 N ATOM 284 CA LEU A 18 0.821 -0.303 5.353 1.00 0.00 C ATOM 285 C LEU A 18 0.063 -0.171 6.680 1.00 0.00 C ATOM 286 O LEU A 18 0.653 -0.228 7.742 1.00 0.00 O ATOM 287 CB LEU A 18 0.736 1.013 4.575 1.00 0.00 C ATOM 288 CG LEU A 18 1.536 0.892 3.283 1.00 0.00 C ATOM 289 CD1 LEU A 18 0.867 1.731 2.194 1.00 0.00 C ATOM 290 CD2 LEU A 18 2.961 1.394 3.524 1.00 0.00 C ATOM 0 H LEU A 18 -0.222 -1.022 3.613 1.00 0.00 H new ATOM 0 HA LEU A 18 1.857 -0.563 5.572 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.304 1.249 4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 18 1.125 1.832 5.181 1.00 0.00 H new ATOM 0 HG LEU A 18 1.570 -0.150 2.964 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.437 1.647 1.268 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.148 1.371 2.029 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.835 2.775 2.507 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.537 1.309 2.603 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.931 2.437 3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.431 0.794 4.303 1.00 0.00 H new ATOM 302 N ALA A 19 -1.243 -0.008 6.627 1.00 0.00 N ATOM 303 CA ALA A 19 -2.029 0.109 7.904 1.00 0.00 C ATOM 304 C ALA A 19 -1.866 -1.175 8.743 1.00 0.00 C ATOM 305 O ALA A 19 -1.978 -1.137 9.955 1.00 0.00 O ATOM 306 CB ALA A 19 -3.501 0.298 7.502 1.00 0.00 C ATOM 0 H ALA A 19 -1.792 0.048 5.769 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.679 0.947 8.507 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.114 0.388 8.399 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.601 1.202 6.901 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.833 -0.562 6.921 1.00 0.00 H new ATOM 312 N GLY A 20 -1.602 -2.314 8.120 1.00 0.00 N ATOM 313 CA GLY A 20 -1.437 -3.576 8.901 1.00 0.00 C ATOM 314 C GLY A 20 -0.032 -3.637 9.525 1.00 0.00 C ATOM 315 O GLY A 20 0.134 -4.150 10.616 1.00 0.00 O ATOM 0 H GLY A 20 -1.496 -2.413 7.110 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.193 -3.628 9.684 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.591 -4.437 8.251 1.00 0.00 H new ATOM 319 N ILE A 21 0.987 -3.125 8.852 1.00 0.00 N ATOM 320 CA ILE A 21 2.381 -3.177 9.445 1.00 0.00 C ATOM 321 C ILE A 21 2.367 -2.568 10.870 1.00 0.00 C ATOM 322 O ILE A 21 1.820 -1.502 11.070 1.00 0.00 O ATOM 323 CB ILE A 21 3.286 -2.361 8.491 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.417 -3.111 7.159 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.684 -2.180 9.095 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.730 -2.122 6.031 1.00 0.00 C ATOM 0 H ILE A 21 0.919 -2.682 7.936 1.00 0.00 H new ATOM 0 HA ILE A 21 2.749 -4.199 9.539 1.00 0.00 H new ATOM 0 HB ILE A 21 2.836 -1.380 8.336 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.208 -3.858 7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.492 -3.645 6.940 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.305 -1.604 8.409 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.604 -1.650 10.044 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.138 -3.157 9.262 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.822 -2.662 5.089 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.925 -1.391 5.954 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.667 -1.608 6.247 1.00 0.00 H new ATOM 338 N PRO A 22 2.957 -3.269 11.823 1.00 0.00 N ATOM 339 CA PRO A 22 2.979 -2.767 13.229 1.00 0.00 C ATOM 340 C PRO A 22 3.856 -1.507 13.390 1.00 0.00 C ATOM 341 O PRO A 22 3.685 -0.764 14.339 1.00 0.00 O ATOM 342 CB PRO A 22 3.561 -3.937 14.019 1.00 0.00 C ATOM 343 CG PRO A 22 4.355 -4.716 13.024 1.00 0.00 C ATOM 344 CD PRO A 22 3.654 -4.563 11.703 1.00 0.00 C ATOM 0 HA PRO A 22 1.988 -2.464 13.568 1.00 0.00 H new ATOM 0 HB2 PRO A 22 4.189 -3.587 14.838 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.773 -4.547 14.460 1.00 0.00 H new ATOM 0 HG2 PRO A 22 5.377 -4.343 12.966 1.00 0.00 H new ATOM 0 HG3 PRO A 22 4.415 -5.766 13.312 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.360 -4.561 10.873 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.954 -5.379 11.524 1.00 0.00 H new ATOM 352 N ASN A 23 4.781 -1.244 12.486 1.00 0.00 N ATOM 353 CA ASN A 23 5.631 -0.016 12.628 1.00 0.00 C ATOM 354 C ASN A 23 5.151 1.088 11.668 1.00 0.00 C ATOM 355 O ASN A 23 5.941 1.884 11.197 1.00 0.00 O ATOM 356 CB ASN A 23 7.057 -0.455 12.270 1.00 0.00 C ATOM 357 CG ASN A 23 8.060 0.294 13.155 1.00 0.00 C ATOM 358 OD1 ASN A 23 8.166 1.502 13.079 1.00 0.00 O ATOM 359 ND2 ASN A 23 8.810 -0.371 14.001 1.00 0.00 N ATOM 0 H ASN A 23 4.979 -1.820 11.668 1.00 0.00 H new ATOM 0 HA ASN A 23 5.577 0.395 13.636 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.164 -1.531 12.411 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.259 -0.250 11.219 1.00 0.00 H new ATOM 0 HD21 ASN A 23 9.478 0.126 14.591 1.00 0.00 H new ATOM 0 HD22 ASN A 23 8.726 -1.385 14.069 1.00 0.00 H new ATOM 366 N PHE A 24 3.864 1.152 11.379 1.00 0.00 N ATOM 367 CA PHE A 24 3.353 2.213 10.459 1.00 0.00 C ATOM 368 C PHE A 24 2.180 2.951 11.126 1.00 0.00 C ATOM 369 O PHE A 24 1.044 2.524 11.033 1.00 0.00 O ATOM 370 CB PHE A 24 2.881 1.465 9.202 1.00 0.00 C ATOM 371 CG PHE A 24 3.648 1.952 7.995 1.00 0.00 C ATOM 372 CD1 PHE A 24 3.512 3.278 7.567 1.00 0.00 C ATOM 373 CD2 PHE A 24 4.495 1.077 7.304 1.00 0.00 C ATOM 374 CE1 PHE A 24 4.223 3.730 6.448 1.00 0.00 C ATOM 375 CE2 PHE A 24 5.205 1.528 6.186 1.00 0.00 C ATOM 376 CZ PHE A 24 5.070 2.854 5.757 1.00 0.00 C ATOM 0 H PHE A 24 3.155 0.515 11.742 1.00 0.00 H new ATOM 0 HA PHE A 24 4.110 2.959 10.218 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.029 0.393 9.329 1.00 0.00 H new ATOM 0 HB3 PHE A 24 1.813 1.624 9.053 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.859 3.953 8.100 1.00 0.00 H new ATOM 0 HD2 PHE A 24 4.600 0.054 7.634 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.118 4.753 6.118 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.858 0.853 5.653 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.619 3.201 4.894 1.00 0.00 H new ATOM 386 N ASN A 25 2.442 4.052 11.803 1.00 0.00 N ATOM 387 CA ASN A 25 1.330 4.800 12.475 1.00 0.00 C ATOM 388 C ASN A 25 1.027 6.107 11.724 1.00 0.00 C ATOM 389 O ASN A 25 -0.114 6.388 11.408 1.00 0.00 O ATOM 390 CB ASN A 25 1.836 5.096 13.892 1.00 0.00 C ATOM 391 CG ASN A 25 0.726 4.801 14.910 1.00 0.00 C ATOM 392 OD1 ASN A 25 0.019 5.699 15.326 1.00 0.00 O ATOM 393 ND2 ASN A 25 0.537 3.575 15.336 1.00 0.00 N ATOM 0 H ASN A 25 3.370 4.459 11.917 1.00 0.00 H new ATOM 0 HA ASN A 25 0.405 4.224 12.488 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.714 4.487 14.110 1.00 0.00 H new ATOM 0 HB3 ASN A 25 2.145 6.139 13.968 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -0.200 3.378 16.013 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.127 2.818 14.990 1.00 0.00 H new ATOM 400 N GLU A 26 2.032 6.909 11.433 1.00 0.00 N ATOM 401 CA GLU A 26 1.776 8.191 10.701 1.00 0.00 C ATOM 402 C GLU A 26 2.252 8.073 9.245 1.00 0.00 C ATOM 403 O GLU A 26 2.954 7.143 8.894 1.00 0.00 O ATOM 404 CB GLU A 26 2.583 9.260 11.447 1.00 0.00 C ATOM 405 CG GLU A 26 1.766 10.551 11.536 1.00 0.00 C ATOM 406 CD GLU A 26 2.713 11.750 11.607 1.00 0.00 C ATOM 407 OE1 GLU A 26 3.511 11.905 10.697 1.00 0.00 O ATOM 408 OE2 GLU A 26 2.624 12.495 12.569 1.00 0.00 O ATOM 0 H GLU A 26 3.008 6.730 11.670 1.00 0.00 H new ATOM 0 HA GLU A 26 0.715 8.439 10.672 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.835 8.908 12.447 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.523 9.448 10.929 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.113 10.641 10.668 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.125 10.528 12.417 1.00 0.00 H new ATOM 415 N ASP A 27 1.877 9.006 8.388 1.00 0.00 N ATOM 416 CA ASP A 27 2.307 8.943 6.952 1.00 0.00 C ATOM 417 C ASP A 27 1.967 7.573 6.338 1.00 0.00 C ATOM 418 O ASP A 27 2.735 7.033 5.565 1.00 0.00 O ATOM 419 CB ASP A 27 3.823 9.162 6.972 1.00 0.00 C ATOM 420 CG ASP A 27 4.124 10.627 7.291 1.00 0.00 C ATOM 421 OD1 ASP A 27 3.491 11.160 8.188 1.00 0.00 O ATOM 422 OD2 ASP A 27 4.983 11.192 6.634 1.00 0.00 O ATOM 0 H ASP A 27 1.292 9.807 8.626 1.00 0.00 H new ATOM 0 HA ASP A 27 1.796 9.691 6.346 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.285 8.514 7.717 1.00 0.00 H new ATOM 0 HB3 ASP A 27 4.252 8.894 6.007 1.00 0.00 H new ATOM 427 N ILE A 28 0.824 7.006 6.672 1.00 0.00 N ATOM 428 CA ILE A 28 0.453 5.674 6.093 1.00 0.00 C ATOM 429 C ILE A 28 -0.493 5.858 4.889 1.00 0.00 C ATOM 430 O ILE A 28 -0.373 5.159 3.900 1.00 0.00 O ATOM 431 CB ILE A 28 -0.195 4.878 7.256 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.247 3.378 6.910 1.00 0.00 C ATOM 433 CG2 ILE A 28 -1.608 5.389 7.572 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.171 3.118 5.711 1.00 0.00 C ATOM 0 H ILE A 28 0.141 7.407 7.315 1.00 0.00 H new ATOM 0 HA ILE A 28 1.314 5.131 5.703 1.00 0.00 H new ATOM 0 HB ILE A 28 0.423 5.025 8.142 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.757 3.019 6.684 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.600 2.815 7.774 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.030 4.808 8.392 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.559 6.439 7.859 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.239 5.283 6.690 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.188 2.051 5.490 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.180 3.455 5.949 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.802 3.663 4.842 1.00 0.00 H new ATOM 446 N LYS A 29 -1.418 6.793 4.951 1.00 0.00 N ATOM 447 CA LYS A 29 -2.343 7.000 3.780 1.00 0.00 C ATOM 448 C LYS A 29 -1.553 7.609 2.614 1.00 0.00 C ATOM 449 O LYS A 29 -1.713 7.206 1.477 1.00 0.00 O ATOM 450 CB LYS A 29 -3.447 7.963 4.243 1.00 0.00 C ATOM 451 CG LYS A 29 -4.354 7.252 5.250 1.00 0.00 C ATOM 452 CD LYS A 29 -5.777 7.801 5.133 1.00 0.00 C ATOM 453 CE LYS A 29 -6.751 6.848 5.828 1.00 0.00 C ATOM 454 NZ LYS A 29 -7.940 7.683 6.155 1.00 0.00 N ATOM 0 H LYS A 29 -1.573 7.413 5.746 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.778 6.060 3.442 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.004 8.849 4.698 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.031 8.302 3.387 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.351 6.178 5.063 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.978 7.401 6.262 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.835 8.791 5.586 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.049 7.914 4.084 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.020 6.015 5.178 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.310 6.420 6.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.654 7.098 6.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.655 8.463 6.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.343 8.071 5.279 1.00 0.00 H new ATOM 468 N TYR A 30 -0.687 8.567 2.885 1.00 0.00 N ATOM 469 CA TYR A 30 0.120 9.175 1.769 1.00 0.00 C ATOM 470 C TYR A 30 1.034 8.105 1.148 1.00 0.00 C ATOM 471 O TYR A 30 1.236 8.083 -0.052 1.00 0.00 O ATOM 472 CB TYR A 30 0.963 10.302 2.386 1.00 0.00 C ATOM 473 CG TYR A 30 0.126 11.554 2.496 1.00 0.00 C ATOM 474 CD1 TYR A 30 -0.279 12.227 1.337 1.00 0.00 C ATOM 475 CD2 TYR A 30 -0.243 12.042 3.755 1.00 0.00 C ATOM 476 CE1 TYR A 30 -1.055 13.388 1.438 1.00 0.00 C ATOM 477 CE2 TYR A 30 -1.019 13.203 3.855 1.00 0.00 C ATOM 478 CZ TYR A 30 -1.425 13.876 2.697 1.00 0.00 C ATOM 479 OH TYR A 30 -2.190 15.021 2.797 1.00 0.00 O ATOM 0 H TYR A 30 -0.507 8.948 3.814 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.526 9.565 0.982 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.322 10.004 3.371 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.842 10.492 1.770 1.00 0.00 H new ATOM 0 HD1 TYR A 30 0.007 11.851 0.366 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.071 11.523 4.649 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -1.368 13.907 0.544 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.304 13.579 4.826 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.358 15.221 3.742 1.00 0.00 H new ATOM 489 N VAL A 31 1.585 7.214 1.951 1.00 0.00 N ATOM 490 CA VAL A 31 2.482 6.147 1.377 1.00 0.00 C ATOM 491 C VAL A 31 1.692 5.300 0.360 1.00 0.00 C ATOM 492 O VAL A 31 2.209 4.955 -0.688 1.00 0.00 O ATOM 493 CB VAL A 31 2.973 5.297 2.579 1.00 0.00 C ATOM 494 CG1 VAL A 31 3.595 3.975 2.105 1.00 0.00 C ATOM 495 CG2 VAL A 31 4.035 6.086 3.345 1.00 0.00 C ATOM 0 H VAL A 31 1.456 7.179 2.962 1.00 0.00 H new ATOM 0 HA VAL A 31 3.335 6.567 0.843 1.00 0.00 H new ATOM 0 HB VAL A 31 2.116 5.075 3.216 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.930 3.400 2.968 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.851 3.400 1.553 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.446 4.185 1.457 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.386 5.496 4.192 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.873 6.305 2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.604 7.020 3.707 1.00 0.00 H new ATOM 505 N ALA A 32 0.451 4.972 0.648 1.00 0.00 N ATOM 506 CA ALA A 32 -0.345 4.152 -0.337 1.00 0.00 C ATOM 507 C ALA A 32 -0.518 4.947 -1.637 1.00 0.00 C ATOM 508 O ALA A 32 -0.275 4.437 -2.713 1.00 0.00 O ATOM 509 CB ALA A 32 -1.712 3.879 0.309 1.00 0.00 C ATOM 0 H ALA A 32 -0.040 5.229 1.504 1.00 0.00 H new ATOM 0 HA ALA A 32 0.158 3.215 -0.576 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.324 3.286 -0.371 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.571 3.332 1.241 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.212 4.825 0.516 1.00 0.00 H new ATOM 515 N GLU A 33 -0.921 6.199 -1.549 1.00 0.00 N ATOM 516 CA GLU A 33 -1.088 7.018 -2.807 1.00 0.00 C ATOM 517 C GLU A 33 0.265 7.115 -3.526 1.00 0.00 C ATOM 518 O GLU A 33 0.348 6.947 -4.728 1.00 0.00 O ATOM 519 CB GLU A 33 -1.575 8.423 -2.389 1.00 0.00 C ATOM 520 CG GLU A 33 -2.831 8.788 -3.184 1.00 0.00 C ATOM 521 CD GLU A 33 -3.063 10.298 -3.108 1.00 0.00 C ATOM 522 OE1 GLU A 33 -2.378 11.019 -3.816 1.00 0.00 O ATOM 523 OE2 GLU A 33 -3.921 10.709 -2.345 1.00 0.00 O ATOM 0 H GLU A 33 -1.139 6.684 -0.679 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.809 6.559 -3.484 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.790 8.441 -1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.792 9.159 -2.569 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.719 8.479 -4.223 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.694 8.256 -2.784 1.00 0.00 H new ATOM 530 N TYR A 34 1.331 7.362 -2.793 1.00 0.00 N ATOM 531 CA TYR A 34 2.685 7.440 -3.448 1.00 0.00 C ATOM 532 C TYR A 34 3.024 6.067 -4.045 1.00 0.00 C ATOM 533 O TYR A 34 3.518 5.972 -5.153 1.00 0.00 O ATOM 534 CB TYR A 34 3.688 7.811 -2.336 1.00 0.00 C ATOM 535 CG TYR A 34 5.105 8.008 -2.873 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.381 8.054 -4.256 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.153 8.155 -1.955 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.696 8.244 -4.702 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.463 8.347 -2.405 1.00 0.00 C ATOM 540 CZ TYR A 34 7.735 8.391 -3.775 1.00 0.00 C ATOM 541 OH TYR A 34 9.029 8.584 -4.216 1.00 0.00 O ATOM 0 H TYR A 34 1.325 7.511 -1.784 1.00 0.00 H new ATOM 0 HA TYR A 34 2.714 8.178 -4.250 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.358 8.726 -1.843 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.695 7.026 -1.580 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.579 7.943 -4.971 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.948 8.120 -0.895 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.908 8.277 -5.760 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.266 8.462 -1.692 1.00 0.00 H new ATOM 0 HH TYR A 34 9.023 9.169 -5.002 1.00 0.00 H new ATOM 551 N ILE A 35 2.742 5.001 -3.326 1.00 0.00 N ATOM 552 CA ILE A 35 3.032 3.629 -3.872 1.00 0.00 C ATOM 553 C ILE A 35 2.182 3.405 -5.134 1.00 0.00 C ATOM 554 O ILE A 35 2.691 2.997 -6.161 1.00 0.00 O ATOM 555 CB ILE A 35 2.665 2.637 -2.747 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.706 2.758 -1.631 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.633 1.191 -3.267 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.129 2.185 -0.340 1.00 0.00 C ATOM 0 H ILE A 35 2.328 5.020 -2.394 1.00 0.00 H new ATOM 0 HA ILE A 35 4.075 3.498 -4.159 1.00 0.00 H new ATOM 0 HB ILE A 35 1.671 2.880 -2.372 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.615 2.223 -1.906 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.982 3.803 -1.487 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.372 0.517 -2.451 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.890 1.106 -4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.614 0.923 -3.659 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.867 2.269 0.457 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.232 2.740 -0.064 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.875 1.136 -0.489 1.00 0.00 H new ATOM 570 N VAL A 36 0.897 3.687 -5.073 1.00 0.00 N ATOM 571 CA VAL A 36 0.038 3.503 -6.301 1.00 0.00 C ATOM 572 C VAL A 36 0.560 4.421 -7.418 1.00 0.00 C ATOM 573 O VAL A 36 0.630 4.021 -8.566 1.00 0.00 O ATOM 574 CB VAL A 36 -1.404 3.874 -5.899 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.319 3.857 -7.129 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.917 2.853 -4.880 1.00 0.00 C ATOM 0 H VAL A 36 0.411 4.030 -4.245 1.00 0.00 H new ATOM 0 HA VAL A 36 0.066 2.478 -6.672 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.407 4.874 -5.466 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.334 4.121 -6.831 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.957 4.578 -7.862 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.318 2.860 -7.570 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.936 3.108 -4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.904 1.858 -5.324 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.276 2.865 -3.999 1.00 0.00 H new ATOM 586 N LEU A 37 0.956 5.638 -7.092 1.00 0.00 N ATOM 587 CA LEU A 37 1.505 6.552 -8.161 1.00 0.00 C ATOM 588 C LEU A 37 2.723 5.874 -8.807 1.00 0.00 C ATOM 589 O LEU A 37 2.865 5.867 -10.016 1.00 0.00 O ATOM 590 CB LEU A 37 1.929 7.856 -7.466 1.00 0.00 C ATOM 591 CG LEU A 37 1.999 8.986 -8.494 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.673 9.750 -8.507 1.00 0.00 C ATOM 593 CD2 LEU A 37 3.134 9.944 -8.124 1.00 0.00 C ATOM 0 H LEU A 37 0.925 6.032 -6.152 1.00 0.00 H new ATOM 0 HA LEU A 37 0.767 6.760 -8.936 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.217 8.109 -6.680 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.899 7.726 -6.987 1.00 0.00 H new ATOM 0 HG LEU A 37 2.185 8.565 -9.482 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.724 10.555 -9.240 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.136 9.069 -8.771 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.486 10.170 -7.519 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.184 10.749 -8.857 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.948 10.364 -7.135 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.080 9.402 -8.116 1.00 0.00 H new ATOM 605 N LEU A 38 3.586 5.270 -8.008 1.00 0.00 N ATOM 606 CA LEU A 38 4.769 4.557 -8.602 1.00 0.00 C ATOM 607 C LEU A 38 4.253 3.373 -9.435 1.00 0.00 C ATOM 608 O LEU A 38 4.714 3.132 -10.534 1.00 0.00 O ATOM 609 CB LEU A 38 5.627 4.051 -7.430 1.00 0.00 C ATOM 610 CG LEU A 38 6.198 5.241 -6.657 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.910 4.738 -5.402 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.196 5.991 -7.542 1.00 0.00 C ATOM 0 H LEU A 38 3.522 5.241 -6.990 1.00 0.00 H new ATOM 0 HA LEU A 38 5.359 5.210 -9.245 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.024 3.430 -6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.437 3.425 -7.804 1.00 0.00 H new ATOM 0 HG LEU A 38 5.388 5.912 -6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.317 5.585 -4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.201 4.202 -4.772 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.721 4.068 -5.688 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.604 6.839 -6.992 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.006 5.320 -7.826 1.00 0.00 H new ATOM 0 HD23 LEU A 38 6.690 6.349 -8.439 1.00 0.00 H new ATOM 624 N ILE A 39 3.278 2.646 -8.921 1.00 0.00 N ATOM 625 CA ILE A 39 2.709 1.486 -9.700 1.00 0.00 C ATOM 626 C ILE A 39 2.108 2.022 -11.009 1.00 0.00 C ATOM 627 O ILE A 39 2.382 1.510 -12.079 1.00 0.00 O ATOM 628 CB ILE A 39 1.607 0.865 -8.804 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.250 0.226 -7.554 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.791 -0.181 -9.585 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.982 -1.074 -7.915 1.00 0.00 C ATOM 0 H ILE A 39 2.856 2.803 -8.006 1.00 0.00 H new ATOM 0 HA ILE A 39 3.463 0.740 -9.952 1.00 0.00 H new ATOM 0 HB ILE A 39 0.926 1.655 -8.489 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.950 0.928 -7.102 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.480 0.020 -6.810 1.00 0.00 H new ATOM 0 HG21 ILE A 39 0.024 -0.603 -8.936 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.318 0.294 -10.444 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.453 -0.976 -9.929 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.426 -1.503 -7.017 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.274 -1.783 -8.345 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.767 -0.860 -8.641 1.00 0.00 H new ATOM 643 N VAL A 40 1.306 3.060 -10.931 1.00 0.00 N ATOM 644 CA VAL A 40 0.708 3.636 -12.186 1.00 0.00 C ATOM 645 C VAL A 40 1.833 4.157 -13.098 1.00 0.00 C ATOM 646 O VAL A 40 1.744 4.062 -14.307 1.00 0.00 O ATOM 647 CB VAL A 40 -0.208 4.799 -11.757 1.00 0.00 C ATOM 648 CG1 VAL A 40 -0.869 5.416 -12.993 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.293 4.281 -10.802 1.00 0.00 C ATOM 0 H VAL A 40 1.041 3.530 -10.065 1.00 0.00 H new ATOM 0 HA VAL A 40 0.143 2.884 -12.736 1.00 0.00 H new ATOM 0 HB VAL A 40 0.389 5.556 -11.248 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.516 6.238 -12.687 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.100 5.791 -13.668 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.462 4.658 -13.505 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.938 5.107 -10.502 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.889 3.520 -11.307 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.824 3.848 -9.919 1.00 0.00 H new ATOM 659 N ASN A 41 2.887 4.709 -12.529 1.00 0.00 N ATOM 660 CA ASN A 41 4.007 5.235 -13.387 1.00 0.00 C ATOM 661 C ASN A 41 4.604 4.115 -14.248 1.00 0.00 C ATOM 662 O ASN A 41 4.989 4.351 -15.378 1.00 0.00 O ATOM 663 CB ASN A 41 5.073 5.799 -12.433 1.00 0.00 C ATOM 664 CG ASN A 41 4.560 7.100 -11.798 1.00 0.00 C ATOM 665 OD1 ASN A 41 3.649 7.720 -12.312 1.00 0.00 O ATOM 666 ND2 ASN A 41 5.107 7.549 -10.694 1.00 0.00 N ATOM 0 H ASN A 41 3.019 4.817 -11.523 1.00 0.00 H new ATOM 0 HA ASN A 41 3.641 6.005 -14.066 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.303 5.070 -11.656 1.00 0.00 H new ATOM 0 HB3 ASN A 41 5.999 5.988 -12.977 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.768 8.413 -10.272 1.00 0.00 H new ATOM 0 HD22 ASN A 41 5.872 7.034 -10.258 1.00 0.00 H new ATOM 673 N GLY A 42 4.693 2.900 -13.740 1.00 0.00 N ATOM 674 CA GLY A 42 5.280 1.800 -14.576 1.00 0.00 C ATOM 675 C GLY A 42 5.090 0.440 -13.893 1.00 0.00 C ATOM 676 O GLY A 42 4.457 -0.446 -14.437 1.00 0.00 O ATOM 0 H GLY A 42 4.391 2.630 -12.804 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.805 1.789 -15.557 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.342 1.986 -14.738 1.00 0.00 H new ATOM 680 N GLY A 43 5.632 0.266 -12.708 1.00 0.00 N ATOM 681 CA GLY A 43 5.479 -1.037 -12.005 1.00 0.00 C ATOM 682 C GLY A 43 6.849 -1.717 -11.860 1.00 0.00 C ATOM 683 O GLY A 43 7.027 -2.849 -12.270 1.00 0.00 O ATOM 0 H GLY A 43 6.170 0.971 -12.204 1.00 0.00 H new ATOM 0 HA2 GLY A 43 5.035 -0.880 -11.022 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.800 -1.683 -12.562 1.00 0.00 H new ATOM 687 N THR A 44 7.813 -1.047 -11.264 1.00 0.00 N ATOM 688 CA THR A 44 9.157 -1.666 -11.074 1.00 0.00 C ATOM 689 C THR A 44 9.467 -1.718 -9.570 1.00 0.00 C ATOM 690 O THR A 44 9.659 -0.696 -8.940 1.00 0.00 O ATOM 691 CB THR A 44 10.120 -0.737 -11.815 1.00 0.00 C ATOM 692 OG1 THR A 44 9.821 0.614 -11.480 1.00 0.00 O ATOM 693 CG2 THR A 44 9.958 -0.943 -13.324 1.00 0.00 C ATOM 0 H THR A 44 7.721 -0.098 -10.903 1.00 0.00 H new ATOM 0 HA THR A 44 9.229 -2.686 -11.453 1.00 0.00 H new ATOM 0 HB THR A 44 11.147 -0.962 -11.527 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.437 1.212 -11.952 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.642 -0.283 -13.857 1.00 0.00 H new ATOM 0 HG22 THR A 44 10.183 -1.979 -13.576 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.933 -0.714 -13.615 1.00 0.00 H new ATOM 701 N VAL A 45 9.489 -2.897 -8.977 1.00 0.00 N ATOM 702 CA VAL A 45 9.751 -2.988 -7.489 1.00 0.00 C ATOM 703 C VAL A 45 11.032 -2.227 -7.095 1.00 0.00 C ATOM 704 O VAL A 45 11.105 -1.673 -6.014 1.00 0.00 O ATOM 705 CB VAL A 45 9.883 -4.487 -7.138 1.00 0.00 C ATOM 706 CG1 VAL A 45 10.210 -4.648 -5.646 1.00 0.00 C ATOM 707 CG2 VAL A 45 8.560 -5.207 -7.435 1.00 0.00 C ATOM 0 H VAL A 45 9.340 -3.789 -9.448 1.00 0.00 H new ATOM 0 HA VAL A 45 8.931 -2.529 -6.937 1.00 0.00 H new ATOM 0 HB VAL A 45 10.684 -4.919 -7.739 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.302 -5.707 -5.406 1.00 0.00 H new ATOM 0 HG12 VAL A 45 11.150 -4.143 -5.423 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.411 -4.208 -5.049 1.00 0.00 H new ATOM 0 HG21 VAL A 45 8.657 -6.264 -7.186 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.763 -4.765 -6.837 1.00 0.00 H new ATOM 0 HG23 VAL A 45 8.319 -5.104 -8.493 1.00 0.00 H new ATOM 717 N GLU A 46 12.038 -2.191 -7.940 1.00 0.00 N ATOM 718 CA GLU A 46 13.290 -1.454 -7.548 1.00 0.00 C ATOM 719 C GLU A 46 13.021 0.053 -7.532 1.00 0.00 C ATOM 720 O GLU A 46 13.186 0.697 -6.512 1.00 0.00 O ATOM 721 CB GLU A 46 14.365 -1.802 -8.590 1.00 0.00 C ATOM 722 CG GLU A 46 15.756 -1.592 -7.984 1.00 0.00 C ATOM 723 CD GLU A 46 16.295 -0.220 -8.394 1.00 0.00 C ATOM 724 OE1 GLU A 46 15.497 0.693 -8.537 1.00 0.00 O ATOM 725 OE2 GLU A 46 17.499 -0.104 -8.559 1.00 0.00 O ATOM 0 H GLU A 46 12.051 -2.627 -8.862 1.00 0.00 H new ATOM 0 HA GLU A 46 13.621 -1.742 -6.550 1.00 0.00 H new ATOM 0 HB2 GLU A 46 14.251 -2.837 -8.913 1.00 0.00 H new ATOM 0 HB3 GLU A 46 14.244 -1.176 -9.474 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.705 -1.663 -6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 46 16.433 -2.376 -8.323 1.00 0.00 H new ATOM 732 N SER A 47 12.589 0.623 -8.636 1.00 0.00 N ATOM 733 CA SER A 47 12.297 2.098 -8.627 1.00 0.00 C ATOM 734 C SER A 47 11.116 2.375 -7.686 1.00 0.00 C ATOM 735 O SER A 47 11.083 3.392 -7.018 1.00 0.00 O ATOM 736 CB SER A 47 11.947 2.505 -10.065 1.00 0.00 C ATOM 737 OG SER A 47 12.473 3.799 -10.327 1.00 0.00 O ATOM 0 H SER A 47 12.429 0.146 -9.523 1.00 0.00 H new ATOM 0 HA SER A 47 13.155 2.670 -8.274 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.358 1.783 -10.770 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.866 2.504 -10.203 1.00 0.00 H new ATOM 0 HG SER A 47 12.253 4.062 -11.245 1.00 0.00 H new ATOM 743 N VAL A 48 10.150 1.476 -7.612 1.00 0.00 N ATOM 744 CA VAL A 48 8.991 1.714 -6.688 1.00 0.00 C ATOM 745 C VAL A 48 9.463 1.599 -5.236 1.00 0.00 C ATOM 746 O VAL A 48 9.146 2.443 -4.423 1.00 0.00 O ATOM 747 CB VAL A 48 7.927 0.641 -7.007 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.730 0.793 -6.062 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.444 0.818 -8.449 1.00 0.00 C ATOM 0 H VAL A 48 10.117 0.605 -8.142 1.00 0.00 H new ATOM 0 HA VAL A 48 8.571 2.711 -6.824 1.00 0.00 H new ATOM 0 HB VAL A 48 8.370 -0.347 -6.878 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.984 0.032 -6.294 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.063 0.673 -5.031 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.290 1.782 -6.188 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.693 0.062 -8.677 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.008 1.810 -8.567 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.287 0.709 -9.131 1.00 0.00 H new ATOM 759 N VAL A 49 10.234 0.584 -4.901 1.00 0.00 N ATOM 760 CA VAL A 49 10.716 0.478 -3.478 1.00 0.00 C ATOM 761 C VAL A 49 11.761 1.572 -3.218 1.00 0.00 C ATOM 762 O VAL A 49 11.781 2.170 -2.157 1.00 0.00 O ATOM 763 CB VAL A 49 11.319 -0.932 -3.311 1.00 0.00 C ATOM 764 CG1 VAL A 49 11.958 -1.073 -1.925 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.206 -1.972 -3.453 1.00 0.00 C ATOM 0 H VAL A 49 10.544 -0.156 -5.531 1.00 0.00 H new ATOM 0 HA VAL A 49 9.908 0.619 -2.760 1.00 0.00 H new ATOM 0 HB VAL A 49 12.081 -1.087 -4.075 1.00 0.00 H new ATOM 0 HG11 VAL A 49 12.380 -2.072 -1.819 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.749 -0.331 -1.812 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.200 -0.916 -1.157 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.625 -2.971 -3.336 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.450 -1.803 -2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.749 -1.883 -4.438 1.00 0.00 H new ATOM 775 N ASP A 50 12.616 1.859 -4.179 1.00 0.00 N ATOM 776 CA ASP A 50 13.636 2.944 -3.961 1.00 0.00 C ATOM 777 C ASP A 50 12.930 4.289 -3.714 1.00 0.00 C ATOM 778 O ASP A 50 13.437 5.125 -2.989 1.00 0.00 O ATOM 779 CB ASP A 50 14.486 3.020 -5.239 1.00 0.00 C ATOM 780 CG ASP A 50 15.611 1.985 -5.166 1.00 0.00 C ATOM 781 OD1 ASP A 50 16.272 1.928 -4.142 1.00 0.00 O ATOM 782 OD2 ASP A 50 15.792 1.266 -6.134 1.00 0.00 O ATOM 0 H ASP A 50 12.653 1.399 -5.088 1.00 0.00 H new ATOM 0 HA ASP A 50 14.257 2.728 -3.092 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.863 2.835 -6.114 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.904 4.020 -5.351 1.00 0.00 H new ATOM 787 N GLU A 51 11.770 4.514 -4.307 1.00 0.00 N ATOM 788 CA GLU A 51 11.066 5.826 -4.079 1.00 0.00 C ATOM 789 C GLU A 51 10.554 5.915 -2.637 1.00 0.00 C ATOM 790 O GLU A 51 10.664 6.952 -2.008 1.00 0.00 O ATOM 791 CB GLU A 51 9.896 5.886 -5.074 1.00 0.00 C ATOM 792 CG GLU A 51 10.384 6.482 -6.396 1.00 0.00 C ATOM 793 CD GLU A 51 10.650 7.978 -6.214 1.00 0.00 C ATOM 794 OE1 GLU A 51 11.742 8.318 -5.791 1.00 0.00 O ATOM 795 OE2 GLU A 51 9.756 8.758 -6.501 1.00 0.00 O ATOM 0 H GLU A 51 11.290 3.860 -4.926 1.00 0.00 H new ATOM 0 HA GLU A 51 11.746 6.664 -4.233 1.00 0.00 H new ATOM 0 HB2 GLU A 51 9.493 4.887 -5.239 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.087 6.492 -4.666 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.294 5.977 -6.721 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.637 6.327 -7.175 1.00 0.00 H new ATOM 802 N LEU A 52 10.017 4.842 -2.091 1.00 0.00 N ATOM 803 CA LEU A 52 9.536 4.910 -0.668 1.00 0.00 C ATOM 804 C LEU A 52 10.751 4.933 0.262 1.00 0.00 C ATOM 805 O LEU A 52 10.769 5.655 1.234 1.00 0.00 O ATOM 806 CB LEU A 52 8.685 3.652 -0.385 1.00 0.00 C ATOM 807 CG LEU A 52 7.257 3.769 -0.961 1.00 0.00 C ATOM 808 CD1 LEU A 52 6.607 5.106 -0.581 1.00 0.00 C ATOM 809 CD2 LEU A 52 7.309 3.635 -2.482 1.00 0.00 C ATOM 0 H LEU A 52 9.893 3.943 -2.557 1.00 0.00 H new ATOM 0 HA LEU A 52 8.938 5.806 -0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.177 2.779 -0.814 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.628 3.489 0.691 1.00 0.00 H new ATOM 0 HG LEU A 52 6.651 2.968 -0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.603 5.155 -1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.549 5.187 0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.206 5.927 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.301 3.717 -2.889 1.00 0.00 H new ATOM 0 HD22 LEU A 52 7.934 4.427 -2.896 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.729 2.665 -2.748 1.00 0.00 H new ATOM 821 N ALA A 53 11.775 4.158 -0.032 1.00 0.00 N ATOM 822 CA ALA A 53 12.990 4.170 0.854 1.00 0.00 C ATOM 823 C ALA A 53 13.646 5.560 0.818 1.00 0.00 C ATOM 824 O ALA A 53 14.132 6.042 1.823 1.00 0.00 O ATOM 825 CB ALA A 53 13.957 3.109 0.305 1.00 0.00 C ATOM 0 H ALA A 53 11.823 3.528 -0.833 1.00 0.00 H new ATOM 0 HA ALA A 53 12.726 3.950 1.888 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.856 3.083 0.920 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.475 2.132 0.326 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.227 3.359 -0.721 1.00 0.00 H new ATOM 831 N SER A 54 13.661 6.214 -0.330 1.00 0.00 N ATOM 832 CA SER A 54 14.291 7.584 -0.399 1.00 0.00 C ATOM 833 C SER A 54 13.597 8.543 0.584 1.00 0.00 C ATOM 834 O SER A 54 14.236 9.394 1.173 1.00 0.00 O ATOM 835 CB SER A 54 14.112 8.084 -1.840 1.00 0.00 C ATOM 836 OG SER A 54 14.786 7.202 -2.729 1.00 0.00 O ATOM 0 H SER A 54 13.272 5.867 -1.207 1.00 0.00 H new ATOM 0 HA SER A 54 15.346 7.540 -0.127 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.053 8.133 -2.091 1.00 0.00 H new ATOM 0 HB3 SER A 54 14.510 9.094 -1.939 1.00 0.00 H new ATOM 0 HG SER A 54 14.133 6.620 -3.170 1.00 0.00 H new ATOM 842 N LEU A 55 12.298 8.415 0.769 1.00 0.00 N ATOM 843 CA LEU A 55 11.585 9.332 1.725 1.00 0.00 C ATOM 844 C LEU A 55 11.406 8.638 3.084 1.00 0.00 C ATOM 845 O LEU A 55 11.608 9.238 4.123 1.00 0.00 O ATOM 846 CB LEU A 55 10.218 9.629 1.082 1.00 0.00 C ATOM 847 CG LEU A 55 10.059 11.139 0.871 1.00 0.00 C ATOM 848 CD1 LEU A 55 9.271 11.395 -0.415 1.00 0.00 C ATOM 849 CD2 LEU A 55 9.307 11.743 2.059 1.00 0.00 C ATOM 0 H LEU A 55 11.708 7.724 0.306 1.00 0.00 H new ATOM 0 HA LEU A 55 12.146 10.250 1.903 1.00 0.00 H new ATOM 0 HB2 LEU A 55 10.134 9.109 0.128 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.417 9.256 1.720 1.00 0.00 H new ATOM 0 HG LEU A 55 11.043 11.600 0.791 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.158 12.469 -0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.806 10.965 -1.261 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.286 10.934 -0.336 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.193 12.817 1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.323 11.282 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 55 9.868 11.561 2.975 1.00 0.00 H new ATOM 861 N PHE A 56 11.040 7.376 3.085 1.00 0.00 N ATOM 862 CA PHE A 56 10.859 6.640 4.373 1.00 0.00 C ATOM 863 C PHE A 56 11.997 5.623 4.537 1.00 0.00 C ATOM 864 O PHE A 56 11.809 4.439 4.330 1.00 0.00 O ATOM 865 CB PHE A 56 9.506 5.918 4.261 1.00 0.00 C ATOM 866 CG PHE A 56 8.416 6.909 3.913 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.128 7.967 4.783 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.704 6.772 2.715 1.00 0.00 C ATOM 869 CE1 PHE A 56 7.124 8.887 4.457 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.702 7.695 2.389 1.00 0.00 C ATOM 871 CZ PHE A 56 6.412 8.751 3.259 1.00 0.00 C ATOM 0 H PHE A 56 10.859 6.826 2.246 1.00 0.00 H new ATOM 0 HA PHE A 56 10.877 7.306 5.235 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.561 5.142 3.497 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.270 5.422 5.203 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.680 8.074 5.705 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.927 5.956 2.044 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.899 9.701 5.130 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.153 7.591 1.465 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.639 9.462 3.007 1.00 0.00 H new ATOM 881 N ASP A 57 13.179 6.073 4.907 1.00 0.00 N ATOM 882 CA ASP A 57 14.322 5.115 5.081 1.00 0.00 C ATOM 883 C ASP A 57 14.538 4.777 6.570 1.00 0.00 C ATOM 884 O ASP A 57 15.638 4.443 6.971 1.00 0.00 O ATOM 885 CB ASP A 57 15.554 5.830 4.514 1.00 0.00 C ATOM 886 CG ASP A 57 16.541 4.795 3.970 1.00 0.00 C ATOM 887 OD1 ASP A 57 16.263 4.233 2.923 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.556 4.580 4.611 1.00 0.00 O ATOM 0 H ASP A 57 13.398 7.051 5.094 1.00 0.00 H new ATOM 0 HA ASP A 57 14.128 4.172 4.570 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.256 6.516 3.721 1.00 0.00 H new ATOM 0 HB3 ASP A 57 16.030 6.428 5.291 1.00 0.00 H new ATOM 893 N SER A 58 13.506 4.840 7.392 1.00 0.00 N ATOM 894 CA SER A 58 13.685 4.496 8.843 1.00 0.00 C ATOM 895 C SER A 58 13.293 3.029 9.087 1.00 0.00 C ATOM 896 O SER A 58 13.935 2.334 9.851 1.00 0.00 O ATOM 897 CB SER A 58 12.760 5.438 9.623 1.00 0.00 C ATOM 898 OG SER A 58 11.560 5.635 8.885 1.00 0.00 O ATOM 0 H SER A 58 12.561 5.112 7.122 1.00 0.00 H new ATOM 0 HA SER A 58 14.721 4.613 9.160 1.00 0.00 H new ATOM 0 HB2 SER A 58 12.533 5.016 10.602 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.256 6.393 9.795 1.00 0.00 H new ATOM 0 HG SER A 58 10.965 6.235 9.381 1.00 0.00 H new ATOM 904 N VAL A 59 12.249 2.548 8.441 1.00 0.00 N ATOM 905 CA VAL A 59 11.839 1.113 8.647 1.00 0.00 C ATOM 906 C VAL A 59 12.680 0.188 7.749 1.00 0.00 C ATOM 907 O VAL A 59 13.193 0.606 6.729 1.00 0.00 O ATOM 908 CB VAL A 59 10.340 1.022 8.288 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.121 1.308 6.792 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.831 -0.383 8.622 1.00 0.00 C ATOM 0 H VAL A 59 11.670 3.078 7.789 1.00 0.00 H new ATOM 0 HA VAL A 59 12.004 0.797 9.677 1.00 0.00 H new ATOM 0 HB VAL A 59 9.791 1.766 8.865 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.058 1.239 6.560 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.479 2.310 6.557 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.670 0.578 6.198 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.773 -0.456 8.371 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.392 -1.119 8.046 1.00 0.00 H new ATOM 0 HG23 VAL A 59 9.966 -0.575 9.686 1.00 0.00 H new ATOM 920 N SER A 60 12.831 -1.066 8.127 1.00 0.00 N ATOM 921 CA SER A 60 13.655 -2.012 7.285 1.00 0.00 C ATOM 922 C SER A 60 13.139 -2.042 5.833 1.00 0.00 C ATOM 923 O SER A 60 11.947 -2.012 5.597 1.00 0.00 O ATOM 924 CB SER A 60 13.512 -3.403 7.919 1.00 0.00 C ATOM 925 OG SER A 60 12.305 -3.456 8.669 1.00 0.00 O ATOM 0 H SER A 60 12.426 -1.474 8.970 1.00 0.00 H new ATOM 0 HA SER A 60 14.696 -1.692 7.255 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.506 -4.170 7.144 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.365 -3.610 8.566 1.00 0.00 H new ATOM 0 HG SER A 60 12.210 -4.343 9.074 1.00 0.00 H new ATOM 931 N ARG A 61 14.029 -2.109 4.860 1.00 0.00 N ATOM 932 CA ARG A 61 13.577 -2.146 3.417 1.00 0.00 C ATOM 933 C ARG A 61 12.544 -3.265 3.195 1.00 0.00 C ATOM 934 O ARG A 61 11.643 -3.125 2.390 1.00 0.00 O ATOM 935 CB ARG A 61 14.829 -2.416 2.564 1.00 0.00 C ATOM 936 CG ARG A 61 15.411 -1.086 2.073 1.00 0.00 C ATOM 937 CD ARG A 61 16.546 -0.641 3.003 1.00 0.00 C ATOM 938 NE ARG A 61 17.793 -0.835 2.212 1.00 0.00 N ATOM 939 CZ ARG A 61 18.416 0.197 1.712 1.00 0.00 C ATOM 940 NH1 ARG A 61 17.797 0.995 0.885 1.00 0.00 N ATOM 941 NH2 ARG A 61 19.657 0.432 2.039 1.00 0.00 N ATOM 0 H ARG A 61 15.039 -2.139 4.998 1.00 0.00 H new ATOM 0 HA ARG A 61 13.103 -1.203 3.143 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.572 -2.956 3.151 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.573 -3.049 1.714 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.785 -1.196 1.055 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.631 -0.325 2.046 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.426 0.401 3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.562 -1.234 3.917 1.00 0.00 H new ATOM 0 HE ARG A 61 18.160 -1.775 2.061 1.00 0.00 H new ATOM 0 HH11 ARG A 61 16.827 0.812 0.630 1.00 0.00 H new ATOM 0 HH12 ARG A 61 18.284 1.802 0.494 1.00 0.00 H new ATOM 0 HH21 ARG A 61 20.141 -0.191 2.686 1.00 0.00 H new ATOM 0 HH22 ARG A 61 20.143 1.239 1.648 1.00 0.00 H new ATOM 955 N ASP A 62 12.662 -4.375 3.900 1.00 0.00 N ATOM 956 CA ASP A 62 11.664 -5.492 3.707 1.00 0.00 C ATOM 957 C ASP A 62 10.233 -4.983 3.947 1.00 0.00 C ATOM 958 O ASP A 62 9.308 -5.397 3.273 1.00 0.00 O ATOM 959 CB ASP A 62 12.014 -6.583 4.732 1.00 0.00 C ATOM 960 CG ASP A 62 11.420 -7.919 4.279 1.00 0.00 C ATOM 961 OD1 ASP A 62 10.217 -7.973 4.081 1.00 0.00 O ATOM 962 OD2 ASP A 62 12.178 -8.864 4.138 1.00 0.00 O ATOM 0 H ASP A 62 13.392 -4.555 4.589 1.00 0.00 H new ATOM 0 HA ASP A 62 11.709 -5.879 2.689 1.00 0.00 H new ATOM 0 HB2 ASP A 62 13.096 -6.669 4.832 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.624 -6.313 5.713 1.00 0.00 H new ATOM 967 N THR A 63 10.040 -4.085 4.893 1.00 0.00 N ATOM 968 CA THR A 63 8.650 -3.562 5.147 1.00 0.00 C ATOM 969 C THR A 63 8.184 -2.732 3.943 1.00 0.00 C ATOM 970 O THR A 63 7.053 -2.849 3.509 1.00 0.00 O ATOM 971 CB THR A 63 8.724 -2.685 6.412 1.00 0.00 C ATOM 972 OG1 THR A 63 9.151 -3.480 7.514 1.00 0.00 O ATOM 973 CG2 THR A 63 7.343 -2.098 6.716 1.00 0.00 C ATOM 0 H THR A 63 10.770 -3.697 5.491 1.00 0.00 H new ATOM 0 HA THR A 63 7.939 -4.376 5.288 1.00 0.00 H new ATOM 0 HB THR A 63 9.433 -1.874 6.247 1.00 0.00 H new ATOM 0 HG1 THR A 63 10.104 -3.322 7.682 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.400 -1.479 7.611 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.013 -1.489 5.874 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.632 -2.907 6.880 1.00 0.00 H new ATOM 981 N LEU A 64 9.047 -1.906 3.391 1.00 0.00 N ATOM 982 CA LEU A 64 8.628 -1.089 2.198 1.00 0.00 C ATOM 983 C LEU A 64 8.445 -2.021 0.995 1.00 0.00 C ATOM 984 O LEU A 64 7.486 -1.904 0.256 1.00 0.00 O ATOM 985 CB LEU A 64 9.753 -0.074 1.926 1.00 0.00 C ATOM 986 CG LEU A 64 10.029 0.764 3.190 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.473 0.552 3.649 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.815 2.249 2.885 1.00 0.00 C ATOM 0 H LEU A 64 10.006 -1.762 3.706 1.00 0.00 H new ATOM 0 HA LEU A 64 7.687 -0.569 2.377 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.660 -0.597 1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.471 0.580 1.101 1.00 0.00 H new ATOM 0 HG LEU A 64 9.345 0.449 3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.662 1.147 4.543 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.632 -0.502 3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.156 0.860 2.857 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.011 2.837 3.782 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.495 2.559 2.092 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.786 2.410 2.564 1.00 0.00 H new ATOM 1000 N ALA A 65 9.349 -2.959 0.803 1.00 0.00 N ATOM 1001 CA ALA A 65 9.199 -3.911 -0.355 1.00 0.00 C ATOM 1002 C ALA A 65 7.915 -4.743 -0.192 1.00 0.00 C ATOM 1003 O ALA A 65 7.261 -5.066 -1.166 1.00 0.00 O ATOM 1004 CB ALA A 65 10.432 -4.830 -0.338 1.00 0.00 C ATOM 0 H ALA A 65 10.172 -3.107 1.387 1.00 0.00 H new ATOM 0 HA ALA A 65 9.128 -3.371 -1.299 1.00 0.00 H new ATOM 0 HB1 ALA A 65 10.368 -5.540 -1.162 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.335 -4.229 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.468 -5.373 0.606 1.00 0.00 H new ATOM 1010 N ASN A 66 7.547 -5.095 1.025 1.00 0.00 N ATOM 1011 CA ASN A 66 6.294 -5.913 1.216 1.00 0.00 C ATOM 1012 C ASN A 66 5.066 -5.119 0.745 1.00 0.00 C ATOM 1013 O ASN A 66 4.174 -5.675 0.130 1.00 0.00 O ATOM 1014 CB ASN A 66 6.184 -6.219 2.717 1.00 0.00 C ATOM 1015 CG ASN A 66 5.172 -7.352 2.937 1.00 0.00 C ATOM 1016 OD1 ASN A 66 4.178 -7.166 3.609 1.00 0.00 O ATOM 1017 ND2 ASN A 66 5.380 -8.528 2.396 1.00 0.00 N ATOM 0 H ASN A 66 8.049 -4.857 1.880 1.00 0.00 H new ATOM 0 HA ASN A 66 6.337 -6.833 0.634 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.158 -6.506 3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.870 -5.327 3.259 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.708 -9.282 2.540 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.214 -8.689 1.831 1.00 0.00 H new ATOM 1024 N VAL A 67 5.007 -3.829 1.016 1.00 0.00 N ATOM 1025 CA VAL A 67 3.812 -3.036 0.552 1.00 0.00 C ATOM 1026 C VAL A 67 3.863 -2.857 -0.978 1.00 0.00 C ATOM 1027 O VAL A 67 2.840 -2.870 -1.636 1.00 0.00 O ATOM 1028 CB VAL A 67 3.863 -1.679 1.270 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.651 -0.842 0.860 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.828 -1.903 2.786 1.00 0.00 C ATOM 0 H VAL A 67 5.716 -3.301 1.526 1.00 0.00 H new ATOM 0 HA VAL A 67 2.880 -3.550 0.788 1.00 0.00 H new ATOM 0 HB VAL A 67 4.780 -1.158 0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.685 0.121 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.666 -0.684 -0.218 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.736 -1.366 1.137 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.864 -0.941 3.297 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.909 -2.423 3.056 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.686 -2.505 3.085 1.00 0.00 H new ATOM 1040 N VAL A 68 5.039 -2.718 -1.560 1.00 0.00 N ATOM 1041 CA VAL A 68 5.110 -2.583 -3.060 1.00 0.00 C ATOM 1042 C VAL A 68 4.758 -3.941 -3.691 1.00 0.00 C ATOM 1043 O VAL A 68 4.076 -3.997 -4.696 1.00 0.00 O ATOM 1044 CB VAL A 68 6.559 -2.181 -3.397 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.745 -2.112 -4.916 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.860 -0.809 -2.788 1.00 0.00 C ATOM 0 H VAL A 68 5.935 -2.692 -1.074 1.00 0.00 H new ATOM 0 HA VAL A 68 4.414 -1.837 -3.444 1.00 0.00 H new ATOM 0 HB VAL A 68 7.240 -2.926 -2.986 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.772 -1.827 -5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.533 -3.088 -5.353 1.00 0.00 H new ATOM 0 HG13 VAL A 68 6.062 -1.372 -5.333 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.885 -0.523 -3.025 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.172 -0.070 -3.199 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.738 -0.856 -1.706 1.00 0.00 H new ATOM 1056 N GLN A 69 5.210 -5.039 -3.107 1.00 0.00 N ATOM 1057 CA GLN A 69 4.880 -6.385 -3.699 1.00 0.00 C ATOM 1058 C GLN A 69 3.363 -6.600 -3.715 1.00 0.00 C ATOM 1059 O GLN A 69 2.815 -7.056 -4.702 1.00 0.00 O ATOM 1060 CB GLN A 69 5.555 -7.442 -2.809 1.00 0.00 C ATOM 1061 CG GLN A 69 5.455 -8.814 -3.479 1.00 0.00 C ATOM 1062 CD GLN A 69 6.298 -8.822 -4.761 1.00 0.00 C ATOM 1063 OE1 GLN A 69 5.795 -8.534 -5.828 1.00 0.00 O ATOM 1064 NE2 GLN A 69 7.568 -9.141 -4.705 1.00 0.00 N ATOM 0 H GLN A 69 5.782 -5.060 -2.263 1.00 0.00 H new ATOM 0 HA GLN A 69 5.235 -6.455 -4.727 1.00 0.00 H new ATOM 0 HB2 GLN A 69 6.601 -7.181 -2.646 1.00 0.00 H new ATOM 0 HB3 GLN A 69 5.076 -7.468 -1.830 1.00 0.00 H new ATOM 0 HG2 GLN A 69 5.804 -9.589 -2.797 1.00 0.00 H new ATOM 0 HG3 GLN A 69 4.415 -9.041 -3.714 1.00 0.00 H new ATOM 0 HE21 GLN A 69 7.994 -9.383 -3.810 1.00 0.00 H new ATOM 0 HE22 GLN A 69 8.130 -9.147 -5.556 1.00 0.00 H new ATOM 1073 N THR A 70 2.672 -6.273 -2.641 1.00 0.00 N ATOM 1074 CA THR A 70 1.177 -6.472 -2.645 1.00 0.00 C ATOM 1075 C THR A 70 0.520 -5.572 -3.706 1.00 0.00 C ATOM 1076 O THR A 70 -0.508 -5.923 -4.249 1.00 0.00 O ATOM 1077 CB THR A 70 0.655 -6.141 -1.233 1.00 0.00 C ATOM 1078 OG1 THR A 70 -0.750 -6.347 -1.195 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.962 -4.688 -0.877 1.00 0.00 C ATOM 0 H THR A 70 3.064 -5.887 -1.782 1.00 0.00 H new ATOM 0 HA THR A 70 0.928 -7.502 -2.898 1.00 0.00 H new ATOM 0 HB THR A 70 1.149 -6.792 -0.511 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.087 -6.139 -0.298 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.587 -4.471 0.123 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.040 -4.527 -0.903 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.479 -4.027 -1.597 1.00 0.00 H new ATOM 1087 N ALA A 71 1.100 -4.427 -4.031 1.00 0.00 N ATOM 1088 CA ALA A 71 0.471 -3.556 -5.090 1.00 0.00 C ATOM 1089 C ALA A 71 0.532 -4.288 -6.440 1.00 0.00 C ATOM 1090 O ALA A 71 -0.419 -4.271 -7.197 1.00 0.00 O ATOM 1091 CB ALA A 71 1.279 -2.247 -5.152 1.00 0.00 C ATOM 0 H ALA A 71 1.961 -4.066 -3.619 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.572 -3.340 -4.860 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.851 -1.591 -5.910 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.244 -1.752 -4.182 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.315 -2.470 -5.408 1.00 0.00 H new ATOM 1097 N PHE A 72 1.638 -4.949 -6.744 1.00 0.00 N ATOM 1098 CA PHE A 72 1.719 -5.696 -8.050 1.00 0.00 C ATOM 1099 C PHE A 72 0.689 -6.829 -8.033 1.00 0.00 C ATOM 1100 O PHE A 72 -0.167 -6.906 -8.893 1.00 0.00 O ATOM 1101 CB PHE A 72 3.141 -6.269 -8.151 1.00 0.00 C ATOM 1102 CG PHE A 72 4.092 -5.165 -8.528 1.00 0.00 C ATOM 1103 CD1 PHE A 72 4.150 -4.716 -9.850 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.909 -4.581 -7.555 1.00 0.00 C ATOM 1105 CE1 PHE A 72 5.023 -3.683 -10.200 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.783 -3.549 -7.905 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.840 -3.098 -9.223 1.00 0.00 C ATOM 0 H PHE A 72 2.470 -5.002 -6.156 1.00 0.00 H new ATOM 0 HA PHE A 72 1.510 -5.049 -8.902 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.437 -6.711 -7.200 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.174 -7.064 -8.896 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.520 -5.168 -10.602 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.864 -4.928 -6.533 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.068 -3.336 -11.222 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.415 -3.100 -7.154 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.514 -2.298 -9.491 1.00 0.00 H new ATOM 1117 N PHE A 73 0.746 -7.696 -7.040 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.267 -8.808 -6.964 1.00 0.00 C ATOM 1119 C PHE A 73 -1.676 -8.194 -6.855 1.00 0.00 C ATOM 1120 O PHE A 73 -2.616 -8.687 -7.450 1.00 0.00 O ATOM 1121 CB PHE A 73 0.075 -9.625 -5.701 1.00 0.00 C ATOM 1122 CG PHE A 73 -0.948 -10.716 -5.486 1.00 0.00 C ATOM 1123 CD1 PHE A 73 -1.261 -11.602 -6.525 1.00 0.00 C ATOM 1124 CD2 PHE A 73 -1.581 -10.839 -4.244 1.00 0.00 C ATOM 1125 CE1 PHE A 73 -2.209 -12.611 -6.319 1.00 0.00 C ATOM 1126 CE2 PHE A 73 -2.529 -11.849 -4.040 1.00 0.00 C ATOM 1127 CZ PHE A 73 -2.844 -12.735 -5.077 1.00 0.00 C ATOM 0 H PHE A 73 1.438 -7.683 -6.291 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.246 -9.447 -7.847 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.068 -10.063 -5.802 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.103 -8.968 -4.832 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.772 -11.507 -7.483 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -1.339 -10.156 -3.444 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -2.451 -13.295 -7.119 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.018 -11.945 -3.082 1.00 0.00 H new ATOM 0 HZ PHE A 73 -3.576 -13.513 -4.919 1.00 0.00 H new ATOM 1137 N ALA A 74 -1.826 -7.111 -6.111 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.183 -6.471 -5.995 1.00 0.00 C ATOM 1139 C ALA A 74 -3.669 -6.029 -7.380 1.00 0.00 C ATOM 1140 O ALA A 74 -4.838 -6.143 -7.685 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.029 -5.251 -5.074 1.00 0.00 C ATOM 0 H ALA A 74 -1.080 -6.652 -5.589 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.913 -7.171 -5.589 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.993 -4.755 -4.962 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -2.672 -5.576 -4.097 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.312 -4.555 -5.509 1.00 0.00 H new ATOM 1147 N LEU A 75 -2.789 -5.525 -8.228 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.250 -5.086 -9.599 1.00 0.00 C ATOM 1149 C LEU A 75 -3.948 -6.248 -10.324 1.00 0.00 C ATOM 1150 O LEU A 75 -4.932 -6.046 -11.012 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.999 -4.648 -10.393 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.902 -3.116 -10.440 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -3.164 -2.519 -11.091 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.739 -2.568 -9.017 1.00 0.00 C ATOM 0 H LEU A 75 -1.795 -5.400 -8.038 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.961 -4.264 -9.514 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.103 -5.061 -9.929 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.046 -5.047 -11.406 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.036 -2.834 -11.038 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.081 -1.433 -11.117 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.264 -2.900 -12.107 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.042 -2.802 -10.510 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.670 -1.481 -9.051 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.600 -2.858 -8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.831 -2.975 -8.572 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.458 -7.462 -10.172 1.00 0.00 N ATOM 1167 CA GLU A 76 -4.129 -8.619 -10.864 1.00 0.00 C ATOM 1168 C GLU A 76 -5.467 -8.911 -10.180 1.00 0.00 C ATOM 1169 O GLU A 76 -6.478 -9.079 -10.838 1.00 0.00 O ATOM 1170 CB GLU A 76 -3.185 -9.826 -10.742 1.00 0.00 C ATOM 1171 CG GLU A 76 -1.900 -9.548 -11.524 1.00 0.00 C ATOM 1172 CD GLU A 76 -2.163 -9.726 -13.020 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -2.344 -10.857 -13.440 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -2.179 -8.728 -13.722 1.00 0.00 O ATOM 0 H GLU A 76 -2.640 -7.699 -9.611 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.327 -8.398 -11.913 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.952 -10.015 -9.694 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.671 -10.722 -11.127 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.552 -8.535 -11.323 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -1.111 -10.226 -11.200 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.493 -8.948 -8.866 1.00 0.00 N ATOM 1182 CA ALA A 77 -6.796 -9.204 -8.161 1.00 0.00 C ATOM 1183 C ALA A 77 -7.731 -8.007 -8.380 1.00 0.00 C ATOM 1184 O ALA A 77 -8.923 -8.176 -8.544 1.00 0.00 O ATOM 1185 CB ALA A 77 -6.477 -9.374 -6.668 1.00 0.00 C ATOM 0 H ALA A 77 -4.684 -8.815 -8.259 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.290 -10.097 -8.544 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.399 -9.562 -6.118 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.797 -10.215 -6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.008 -8.465 -6.290 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.206 -6.795 -8.412 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.098 -5.602 -8.657 1.00 0.00 C ATOM 1193 C LEU A 78 -8.852 -5.785 -9.988 1.00 0.00 C ATOM 1194 O LEU A 78 -9.993 -5.383 -10.113 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.185 -4.367 -8.733 1.00 0.00 C ATOM 1196 CG LEU A 78 -7.952 -3.133 -8.255 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -6.983 -1.960 -8.089 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -9.022 -2.769 -9.288 1.00 0.00 C ATOM 0 H LEU A 78 -6.217 -6.582 -8.282 1.00 0.00 H new ATOM 0 HA LEU A 78 -8.834 -5.490 -7.861 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.299 -4.519 -8.116 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.840 -4.220 -9.756 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.427 -3.348 -7.298 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -7.531 -1.081 -7.748 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.220 -2.219 -7.355 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -6.507 -1.743 -9.045 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.570 -1.890 -8.950 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.546 -2.554 -10.245 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.713 -3.604 -9.406 1.00 0.00 H new ATOM 1210 N GLN A 79 -8.231 -6.403 -10.980 1.00 0.00 N ATOM 1211 CA GLN A 79 -8.947 -6.617 -12.286 1.00 0.00 C ATOM 1212 C GLN A 79 -9.860 -7.863 -12.221 1.00 0.00 C ATOM 1213 O GLN A 79 -10.772 -7.995 -13.016 1.00 0.00 O ATOM 1214 CB GLN A 79 -7.860 -6.828 -13.353 1.00 0.00 C ATOM 1215 CG GLN A 79 -6.926 -5.618 -13.394 1.00 0.00 C ATOM 1216 CD GLN A 79 -5.709 -5.941 -14.270 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -5.813 -6.703 -15.209 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -4.548 -5.391 -14.004 1.00 0.00 N ATOM 0 H GLN A 79 -7.277 -6.761 -10.940 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.580 -5.760 -12.517 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -7.290 -7.730 -13.130 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -8.321 -6.975 -14.330 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -7.454 -4.751 -13.791 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.603 -5.360 -12.385 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -4.456 -4.750 -13.216 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -3.737 -5.604 -14.585 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.623 -8.788 -11.303 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.477 -10.015 -11.232 1.00 0.00 C ATOM 1229 C GLN A 80 -10.544 -10.553 -9.790 1.00 0.00 C ATOM 1230 O GLN A 80 -10.227 -11.703 -9.542 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.761 -11.020 -12.132 1.00 0.00 C ATOM 1232 CG GLN A 80 -10.654 -12.244 -12.346 1.00 0.00 C ATOM 1233 CD GLN A 80 -10.195 -13.000 -13.599 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -9.025 -12.989 -13.929 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -11.066 -13.662 -14.321 1.00 0.00 N ATOM 0 H GLN A 80 -8.878 -8.739 -10.608 1.00 0.00 H new ATOM 0 HA GLN A 80 -11.504 -9.822 -11.541 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.522 -10.559 -13.091 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.816 -11.321 -11.679 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.606 -12.899 -11.476 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.693 -11.934 -12.456 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.049 -13.675 -14.049 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -10.761 -14.164 -15.155 1.00 0.00 H new ATOM 1244 N GLY A 81 -10.941 -9.739 -8.834 1.00 0.00 N ATOM 1245 CA GLY A 81 -11.004 -10.229 -7.424 1.00 0.00 C ATOM 1246 C GLY A 81 -12.255 -9.681 -6.726 1.00 0.00 C ATOM 1247 O GLY A 81 -13.241 -10.381 -6.584 1.00 0.00 O ATOM 0 H GLY A 81 -11.220 -8.768 -8.972 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -11.020 -11.319 -7.411 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -10.111 -9.917 -6.883 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.227 -8.443 -6.276 1.00 0.00 N ATOM 1252 CA GLU A 82 -13.426 -7.877 -5.572 1.00 0.00 C ATOM 1253 C GLU A 82 -13.301 -6.350 -5.403 1.00 0.00 C ATOM 1254 O GLU A 82 -12.494 -5.717 -6.058 1.00 0.00 O ATOM 1255 CB GLU A 82 -13.434 -8.572 -4.207 1.00 0.00 C ATOM 1256 CG GLU A 82 -14.869 -8.945 -3.829 1.00 0.00 C ATOM 1257 CD GLU A 82 -15.155 -10.383 -4.262 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -14.325 -11.237 -3.998 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -16.201 -10.608 -4.851 1.00 0.00 O ATOM 0 H GLU A 82 -11.434 -7.808 -6.365 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.346 -8.045 -6.132 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.812 -9.466 -4.239 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.007 -7.914 -3.450 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -15.011 -8.843 -2.753 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -15.571 -8.263 -4.309 1.00 0.00 H new ATOM 1266 N SER A 83 -14.091 -5.752 -4.530 1.00 0.00 N ATOM 1267 CA SER A 83 -13.999 -4.263 -4.336 1.00 0.00 C ATOM 1268 C SER A 83 -12.891 -3.925 -3.326 1.00 0.00 C ATOM 1269 O SER A 83 -12.435 -4.781 -2.594 1.00 0.00 O ATOM 1270 CB SER A 83 -15.363 -3.809 -3.797 1.00 0.00 C ATOM 1271 OG SER A 83 -16.380 -4.653 -4.321 1.00 0.00 O ATOM 0 H SER A 83 -14.786 -6.225 -3.952 1.00 0.00 H new ATOM 0 HA SER A 83 -13.756 -3.759 -5.271 1.00 0.00 H new ATOM 0 HB2 SER A 83 -15.368 -3.848 -2.708 1.00 0.00 H new ATOM 0 HB3 SER A 83 -15.552 -2.773 -4.080 1.00 0.00 H new ATOM 0 HG SER A 83 -17.252 -4.367 -3.977 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.458 -2.681 -3.278 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.377 -2.300 -2.305 1.00 0.00 C ATOM 1279 C ALA A 84 -11.980 -1.666 -1.035 1.00 0.00 C ATOM 1280 O ALA A 84 -11.467 -1.858 0.050 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.485 -1.293 -3.044 1.00 0.00 C ATOM 0 H ALA A 84 -12.803 -1.921 -3.864 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.810 -3.172 -1.978 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.675 -0.975 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.067 -1.762 -3.935 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.078 -0.426 -3.335 1.00 0.00 H new ATOM 1287 N GLU A 85 -13.064 -0.913 -1.149 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.675 -0.281 0.082 1.00 0.00 C ATOM 1289 C GLU A 85 -13.916 -1.340 1.171 1.00 0.00 C ATOM 1290 O GLU A 85 -13.751 -1.071 2.347 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.014 0.336 -0.355 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.517 1.288 0.732 1.00 0.00 C ATOM 1293 CD GLU A 85 -16.731 2.060 0.213 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -17.786 1.458 0.097 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -16.586 3.240 -0.059 1.00 0.00 O ATOM 0 H GLU A 85 -13.545 -0.712 -2.026 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.008 0.473 0.499 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -14.889 0.874 -1.295 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.748 -0.450 -0.533 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.785 0.726 1.627 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.726 1.982 1.017 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.298 -2.544 0.793 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.537 -3.614 1.831 1.00 0.00 C ATOM 1304 C ASN A 86 -13.260 -3.837 2.660 1.00 0.00 C ATOM 1305 O ASN A 86 -13.327 -4.037 3.859 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.904 -4.898 1.071 1.00 0.00 C ATOM 1307 CG ASN A 86 -16.397 -4.877 0.724 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.949 -3.831 0.447 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -17.085 -5.995 0.724 1.00 0.00 N ATOM 0 H ASN A 86 -14.453 -2.831 -0.173 1.00 0.00 H new ATOM 0 HA ASN A 86 -15.334 -3.325 2.516 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -14.309 -4.977 0.161 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -14.673 -5.772 1.680 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -18.078 -5.983 0.492 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -16.626 -6.876 0.956 1.00 0.00 H new ATOM 1316 N ILE A 87 -12.097 -3.795 2.038 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.827 -4.000 2.823 1.00 0.00 C ATOM 1318 C ILE A 87 -10.692 -2.905 3.900 1.00 0.00 C ATOM 1319 O ILE A 87 -10.226 -3.167 4.992 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.664 -3.920 1.813 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.798 -5.055 0.792 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -8.324 -4.058 2.544 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -9.326 -4.568 -0.580 1.00 0.00 C ATOM 0 H ILE A 87 -11.973 -3.631 1.039 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.826 -4.963 3.334 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.700 -2.956 1.305 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -9.206 -5.914 1.108 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.835 -5.386 0.735 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.509 -4.000 1.823 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.222 -3.253 3.272 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.287 -5.019 3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.422 -5.376 -1.306 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -9.937 -3.722 -0.896 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -8.283 -4.258 -0.517 1.00 0.00 H new ATOM 1335 N VAL A 88 -11.096 -1.680 3.608 1.00 0.00 N ATOM 1336 CA VAL A 88 -10.975 -0.591 4.647 1.00 0.00 C ATOM 1337 C VAL A 88 -11.777 -0.966 5.905 1.00 0.00 C ATOM 1338 O VAL A 88 -11.347 -0.705 7.012 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.534 0.700 4.019 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.451 1.850 5.028 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.708 1.061 2.784 1.00 0.00 C ATOM 0 H VAL A 88 -11.496 -1.392 2.715 1.00 0.00 H new ATOM 0 HA VAL A 88 -9.936 -0.454 4.946 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.575 0.538 3.738 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -11.848 2.759 4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.035 1.600 5.914 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.411 2.010 5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.101 1.974 2.337 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.669 1.217 3.074 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.764 0.249 2.059 1.00 0.00 H new ATOM 1351 N SER A 89 -12.935 -1.579 5.751 1.00 0.00 N ATOM 1352 CA SER A 89 -13.742 -1.965 6.970 1.00 0.00 C ATOM 1353 C SER A 89 -12.892 -2.856 7.888 1.00 0.00 C ATOM 1354 O SER A 89 -12.889 -2.684 9.093 1.00 0.00 O ATOM 1355 CB SER A 89 -14.970 -2.739 6.466 1.00 0.00 C ATOM 1356 OG SER A 89 -14.579 -4.060 6.113 1.00 0.00 O ATOM 0 H SER A 89 -13.352 -1.826 4.854 1.00 0.00 H new ATOM 0 HA SER A 89 -14.047 -1.087 7.539 1.00 0.00 H new ATOM 0 HB2 SER A 89 -15.738 -2.769 7.239 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.405 -2.233 5.604 1.00 0.00 H new ATOM 0 HG SER A 89 -14.402 -4.103 5.150 1.00 0.00 H new ATOM 1362 N LYS A 90 -12.153 -3.791 7.327 1.00 0.00 N ATOM 1363 CA LYS A 90 -11.284 -4.666 8.192 1.00 0.00 C ATOM 1364 C LYS A 90 -10.125 -3.840 8.769 1.00 0.00 C ATOM 1365 O LYS A 90 -9.711 -4.059 9.892 1.00 0.00 O ATOM 1366 CB LYS A 90 -10.744 -5.790 7.292 1.00 0.00 C ATOM 1367 CG LYS A 90 -10.104 -6.877 8.158 1.00 0.00 C ATOM 1368 CD LYS A 90 -9.299 -7.828 7.271 1.00 0.00 C ATOM 1369 CE LYS A 90 -10.216 -8.930 6.738 1.00 0.00 C ATOM 1370 NZ LYS A 90 -9.561 -9.403 5.486 1.00 0.00 N ATOM 0 H LYS A 90 -12.113 -3.985 6.326 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.848 -5.080 9.028 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.553 -6.214 6.697 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.010 -5.389 6.593 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.455 -6.424 8.907 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.875 -7.429 8.696 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.853 -7.279 6.442 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.479 -8.266 7.840 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.320 -9.740 7.460 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.218 -8.549 6.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -10.132 -10.161 5.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -9.481 -8.612 4.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.612 -9.767 5.707 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.606 -2.877 8.027 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.486 -2.040 8.581 1.00 0.00 C ATOM 1386 C ILE A 91 -9.033 -1.118 9.680 1.00 0.00 C ATOM 1387 O ILE A 91 -8.387 -0.905 10.688 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.917 -1.213 7.409 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.397 -2.146 6.302 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.766 -0.337 7.910 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -6.349 -3.112 6.869 1.00 0.00 C ATOM 0 H ILE A 91 -9.904 -2.640 7.081 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.704 -2.659 9.021 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.711 -0.585 7.005 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -8.226 -2.709 5.872 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.960 -1.557 5.496 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.365 0.246 7.081 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.132 0.337 8.684 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.980 -0.970 8.322 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.990 -3.766 6.075 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.513 -2.544 7.277 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.798 -3.714 7.659 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.219 -0.571 9.500 1.00 0.00 N ATOM 1404 CA ARG A 92 -10.789 0.332 10.562 1.00 0.00 C ATOM 1405 C ARG A 92 -10.935 -0.432 11.886 1.00 0.00 C ATOM 1406 O ARG A 92 -10.717 0.124 12.947 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.165 0.799 10.062 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.720 1.862 11.014 1.00 0.00 C ATOM 1409 CD ARG A 92 -13.897 2.577 10.349 1.00 0.00 C ATOM 1410 NE ARG A 92 -14.813 2.929 11.469 1.00 0.00 N ATOM 1411 CZ ARG A 92 -14.810 4.139 11.960 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -15.383 5.110 11.304 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -14.234 4.375 13.106 1.00 0.00 N ATOM 0 H ARG A 92 -10.808 -0.707 8.679 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.132 1.183 10.743 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.079 1.207 9.055 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -12.850 -0.047 10.006 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -13.042 1.398 11.946 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.941 2.580 11.268 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.567 3.467 9.814 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -14.391 1.933 9.622 1.00 0.00 H new ATOM 0 HE ARG A 92 -15.443 2.225 11.853 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -15.833 4.924 10.408 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -15.381 6.055 11.687 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.786 3.615 13.618 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.231 5.320 13.490 1.00 0.00 H new ATOM 1427 N MET A 93 -11.293 -1.701 11.843 1.00 0.00 N ATOM 1428 CA MET A 93 -11.432 -2.470 13.131 1.00 0.00 C ATOM 1429 C MET A 93 -10.043 -2.745 13.720 1.00 0.00 C ATOM 1430 O MET A 93 -9.843 -2.631 14.915 1.00 0.00 O ATOM 1431 CB MET A 93 -12.145 -3.789 12.791 1.00 0.00 C ATOM 1432 CG MET A 93 -13.634 -3.522 12.570 1.00 0.00 C ATOM 1433 SD MET A 93 -14.490 -3.516 14.164 1.00 0.00 S ATOM 1434 CE MET A 93 -15.956 -4.436 13.638 1.00 0.00 C ATOM 0 H MET A 93 -11.491 -2.228 10.992 1.00 0.00 H new ATOM 0 HA MET A 93 -12.003 -1.907 13.870 1.00 0.00 H new ATOM 0 HB2 MET A 93 -11.707 -4.231 11.896 1.00 0.00 H new ATOM 0 HB3 MET A 93 -12.010 -4.507 13.600 1.00 0.00 H new ATOM 0 HG2 MET A 93 -13.772 -2.564 12.068 1.00 0.00 H new ATOM 0 HG3 MET A 93 -14.059 -4.287 11.920 1.00 0.00 H new ATOM 0 HE1 MET A 93 -16.635 -4.551 14.482 1.00 0.00 H new ATOM 0 HE2 MET A 93 -16.460 -3.892 12.839 1.00 0.00 H new ATOM 0 HE3 MET A 93 -15.658 -5.420 13.275 1.00 0.00 H new ATOM 1444 N MET A 94 -9.075 -3.083 12.894 1.00 0.00 N ATOM 1445 CA MET A 94 -7.694 -3.334 13.435 1.00 0.00 C ATOM 1446 C MET A 94 -7.037 -1.997 13.802 1.00 0.00 C ATOM 1447 O MET A 94 -6.340 -1.902 14.795 1.00 0.00 O ATOM 1448 CB MET A 94 -6.899 -4.039 12.324 1.00 0.00 C ATOM 1449 CG MET A 94 -5.652 -4.690 12.923 1.00 0.00 C ATOM 1450 SD MET A 94 -4.457 -5.030 11.606 1.00 0.00 S ATOM 1451 CE MET A 94 -5.239 -6.535 10.974 1.00 0.00 C ATOM 0 H MET A 94 -9.178 -3.195 11.885 1.00 0.00 H new ATOM 0 HA MET A 94 -7.723 -3.951 14.333 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.520 -4.794 11.841 1.00 0.00 H new ATOM 0 HB3 MET A 94 -6.614 -3.321 11.555 1.00 0.00 H new ATOM 0 HG2 MET A 94 -5.208 -4.032 13.670 1.00 0.00 H new ATOM 0 HG3 MET A 94 -5.921 -5.615 13.433 1.00 0.00 H new ATOM 0 HE1 MET A 94 -4.638 -6.944 10.162 1.00 0.00 H new ATOM 0 HE2 MET A 94 -5.315 -7.270 11.775 1.00 0.00 H new ATOM 0 HE3 MET A 94 -6.236 -6.299 10.603 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.265 -0.956 13.026 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.654 0.375 13.373 1.00 0.00 C ATOM 1463 C ASN A 95 -7.345 0.957 14.617 1.00 0.00 C ATOM 1464 O ASN A 95 -6.711 1.607 15.427 1.00 0.00 O ATOM 1465 CB ASN A 95 -6.860 1.299 12.161 1.00 0.00 C ATOM 1466 CG ASN A 95 -5.672 1.153 11.199 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.399 -0.013 10.665 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -4.982 2.116 10.928 1.00 0.00 N flip ATOM 0 H ASN A 95 -7.837 -0.969 12.182 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.592 0.273 13.598 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -7.789 1.045 11.650 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.950 2.334 12.490 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.190 3.025 11.341 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.194 2.015 10.288 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.635 0.724 14.788 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.330 1.275 16.006 1.00 0.00 C ATOM 1477 C ALA A 96 -8.817 0.562 17.268 1.00 0.00 C ATOM 1478 O ALA A 96 -8.653 1.182 18.302 1.00 0.00 O ATOM 1479 CB ALA A 96 -10.832 1.013 15.820 1.00 0.00 C ATOM 0 H ALA A 96 -9.224 0.188 14.151 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.135 2.341 16.122 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.378 1.397 16.682 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.180 1.515 14.917 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.006 -0.059 15.729 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.553 -0.728 17.194 1.00 0.00 N ATOM 1486 CA GLN A 97 -8.039 -1.448 18.415 1.00 0.00 C ATOM 1487 C GLN A 97 -6.638 -0.931 18.766 1.00 0.00 C ATOM 1488 O GLN A 97 -6.327 -0.714 19.922 1.00 0.00 O ATOM 1489 CB GLN A 97 -7.984 -2.944 18.062 1.00 0.00 C ATOM 1490 CG GLN A 97 -7.579 -3.746 19.301 1.00 0.00 C ATOM 1491 CD GLN A 97 -6.749 -4.964 18.872 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -5.638 -4.815 18.405 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -7.241 -6.171 19.011 1.00 0.00 N ATOM 0 H GLN A 97 -8.668 -1.304 16.360 1.00 0.00 H new ATOM 0 HA GLN A 97 -8.685 -1.280 19.276 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -8.956 -3.279 17.700 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.269 -3.113 17.257 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.001 -3.119 19.980 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -8.467 -4.070 19.844 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.174 -6.299 19.403 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -6.691 -6.982 18.727 1.00 0.00 H new ATOM 1502 N SER A 98 -5.792 -0.721 17.779 1.00 0.00 N ATOM 1503 CA SER A 98 -4.410 -0.202 18.082 1.00 0.00 C ATOM 1504 C SER A 98 -4.506 1.178 18.751 1.00 0.00 C ATOM 1505 O SER A 98 -3.743 1.489 19.646 1.00 0.00 O ATOM 1506 CB SER A 98 -3.671 -0.089 16.740 1.00 0.00 C ATOM 1507 OG SER A 98 -3.479 -1.390 16.200 1.00 0.00 O ATOM 0 H SER A 98 -5.992 -0.883 16.792 1.00 0.00 H new ATOM 0 HA SER A 98 -3.880 -0.869 18.762 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.245 0.525 16.046 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.709 0.404 16.881 1.00 0.00 H new ATOM 0 HG SER A 98 -4.299 -1.682 15.750 1.00 0.00 H new ATOM 1513 N LEU A 99 -5.439 2.007 18.330 1.00 0.00 N ATOM 1514 CA LEU A 99 -5.578 3.359 18.951 1.00 0.00 C ATOM 1515 C LEU A 99 -6.944 3.491 19.648 1.00 0.00 C ATOM 1516 O LEU A 99 -7.547 4.547 19.630 1.00 0.00 O ATOM 1517 CB LEU A 99 -5.479 4.342 17.783 1.00 0.00 C ATOM 1518 CG LEU A 99 -5.102 5.727 18.311 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -3.582 5.889 18.283 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -5.745 6.801 17.430 1.00 0.00 C ATOM 0 H LEU A 99 -6.105 1.802 17.586 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.817 3.543 19.709 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.732 3.998 17.067 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.430 4.390 17.253 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.459 5.834 19.335 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.314 6.876 18.659 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.123 5.125 18.910 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.223 5.782 17.259 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -5.477 7.788 17.806 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.388 6.693 16.406 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.829 6.687 17.450 1.00 0.00 H new ATOM 1532 N GLY A 100 -7.440 2.434 20.263 1.00 0.00 N ATOM 1533 CA GLY A 100 -8.762 2.522 20.951 1.00 0.00 C ATOM 1534 C GLY A 100 -8.708 1.747 22.277 1.00 0.00 C ATOM 1535 O GLY A 100 -8.900 2.318 23.335 1.00 0.00 O ATOM 0 H GLY A 100 -6.984 1.523 20.314 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.017 3.565 21.138 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.544 2.113 20.311 1.00 0.00 H new ATOM 1539 N GLN A 101 -8.443 0.457 22.235 1.00 0.00 N ATOM 1540 CA GLN A 101 -8.373 -0.332 23.509 1.00 0.00 C ATOM 1541 C GLN A 101 -6.907 -0.531 23.918 1.00 0.00 C ATOM 1542 O GLN A 101 -6.048 -0.718 23.076 1.00 0.00 O ATOM 1543 CB GLN A 101 -9.038 -1.680 23.207 1.00 0.00 C ATOM 1544 CG GLN A 101 -10.529 -1.601 23.541 1.00 0.00 C ATOM 1545 CD GLN A 101 -10.727 -1.785 25.050 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -10.334 -0.938 25.828 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -11.322 -2.859 25.507 1.00 0.00 N ATOM 0 H GLN A 101 -8.274 -0.077 21.382 1.00 0.00 H new ATOM 0 HA GLN A 101 -8.874 0.178 24.332 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -8.903 -1.937 22.156 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.565 -2.470 23.791 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -10.932 -0.639 23.225 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -11.076 -2.370 22.996 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -11.654 -3.573 24.859 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -11.453 -2.981 26.511 1.00 0.00 H new ATOM 1556 N SER A 102 -6.604 -0.486 25.204 1.00 0.00 N ATOM 1557 CA SER A 102 -5.184 -0.665 25.658 1.00 0.00 C ATOM 1558 C SER A 102 -4.255 0.319 24.924 1.00 0.00 C ATOM 1559 O SER A 102 -3.150 -0.029 24.552 1.00 0.00 O ATOM 1560 CB SER A 102 -4.820 -2.111 25.308 1.00 0.00 C ATOM 1561 OG SER A 102 -5.772 -2.990 25.895 1.00 0.00 O ATOM 0 H SER A 102 -7.280 -0.333 25.953 1.00 0.00 H new ATOM 0 HA SER A 102 -5.073 -0.468 26.724 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.805 -2.243 24.226 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.819 -2.345 25.672 1.00 0.00 H new ATOM 0 HG SER A 102 -5.543 -3.916 25.672 1.00 0.00 H new ATOM 1567 N ASP A 103 -4.694 1.544 24.710 1.00 0.00 N ATOM 1568 CA ASP A 103 -3.833 2.537 24.000 1.00 0.00 C ATOM 1569 C ASP A 103 -3.488 3.706 24.936 1.00 0.00 C ATOM 1570 O ASP A 103 -4.101 4.754 24.873 1.00 0.00 O ATOM 1571 CB ASP A 103 -4.679 3.024 22.820 1.00 0.00 C ATOM 1572 CG ASP A 103 -3.862 4.004 21.976 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -2.783 3.629 21.548 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -4.329 5.112 21.773 1.00 0.00 O ATOM 0 H ASP A 103 -5.609 1.892 24.998 1.00 0.00 H new ATOM 0 HA ASP A 103 -2.888 2.104 23.672 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.993 2.177 22.210 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.585 3.509 23.184 1.00 0.00 H new ATOM 1579 N ILE A 104 -2.509 3.538 25.805 1.00 0.00 N ATOM 1580 CA ILE A 104 -2.137 4.646 26.736 1.00 0.00 C ATOM 1581 C ILE A 104 -0.699 5.113 26.448 1.00 0.00 C ATOM 1582 O ILE A 104 0.252 4.496 26.887 1.00 0.00 O ATOM 1583 CB ILE A 104 -2.239 4.041 28.141 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -3.670 3.555 28.388 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -1.879 5.100 29.187 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -3.694 2.639 29.614 1.00 0.00 C ATOM 0 H ILE A 104 -1.959 2.685 25.904 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.784 5.516 26.625 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.548 3.202 28.220 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -4.333 4.406 28.544 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -4.040 3.019 27.513 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.953 4.666 30.184 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.860 5.448 29.017 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -2.568 5.941 29.105 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.713 2.293 29.790 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.044 1.781 29.440 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.342 3.190 30.486 1.00 0.00 H new ATOM 1598 N ALA A 105 -0.533 6.195 25.715 1.00 0.00 N ATOM 1599 CA ALA A 105 0.844 6.687 25.409 1.00 0.00 C ATOM 1600 C ALA A 105 0.887 8.217 25.479 1.00 0.00 C ATOM 1601 O ALA A 105 -0.139 8.805 25.775 1.00 0.00 O ATOM 1602 CB ALA A 105 1.128 6.208 23.985 1.00 0.00 C ATOM 1603 OXT ALA A 105 1.945 8.771 25.235 1.00 0.00 O ATOM 0 H ALA A 105 -1.291 6.752 25.320 1.00 0.00 H new ATOM 0 HA ALA A 105 1.583 6.316 26.119 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.125 6.531 23.685 1.00 0.00 H new ATOM 0 HB2 ALA A 105 1.073 5.120 23.949 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.389 6.631 23.305 1.00 0.00 H new TER 1609 ALA A 105