USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 956 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 156 LYS NZ :NH3+ 171:sc= 1.03 (180deg=-0.278) USER MOD Set 1.2: A 160 TYR OH : rot -20:sc= 0.0106 USER MOD Set 2.1: A 103 ASN : amide:sc= -2.84! K(o=-1.7!,f=-3.5) USER MOD Set 2.2: A 145 SER OG : rot 61:sc= 1.09 USER MOD Set 3.1: A 141 GLN : amide:sc= 0.643 K(o=-0.34,f=-1.5) USER MOD Set 3.2: A 147 TYR OH : rot 98:sc= -0.98 USER MOD Set 4.1: A 80 HIS : no HE2:sc= -0.0245 K(o=1.8,f=-3.4!) USER MOD Set 4.2: A 104 THR OG1 : rot 56:sc= 1.83 USER MOD Set 5.1: A 76 GLN : amide:sc= -4.29! C(o=-4.3!,f=-11!) USER MOD Set 5.2: A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -1.39 K(o=-1.4,f=-3.3) USER MOD Single : A 85 THR OG1 : rot 120:sc= 0.541 USER MOD Single : A 87 THR OG1 : rot 55:sc= -0.357 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 CYS SG : rot -52:sc= -1.4! USER MOD Single : A 93 SER OG : rot 180:sc= -1.26 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0875) USER MOD Single : A 110 LYS NZ :NH3+ 160:sc= 1.28 (180deg=1.02) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 171:sc=-0.00296 (180deg=-0.0967) USER MOD Single : A 118 HIS : no HE2:sc= -4.06! C(o=-4!,f=-11!) USER MOD Single : A 119 LYS NZ :NH3+ 164:sc= 1.03 (180deg=0.628) USER MOD Single : A 122 ASN : amide:sc= -1.42 K(o=-1.4,f=-11!) USER MOD Single : A 125 LYS NZ :NH3+ -173:sc=-0.00575 (180deg=-0.0805) USER MOD Single : A 128 LYS NZ :NH3+ -166:sc= 1.25 (180deg=1.09) USER MOD Single : A 131 ASN : amide:sc= -1.62 K(o=-1.6,f=-0.0062) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot -130:sc= -0.0441 USER MOD Single : A 140 ASN : amide:sc= -0.716 K(o=-0.72,f=-0.19) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 101:sc= 0.82 USER MOD Single : A 152 LYS NZ :NH3+ 168:sc= -0.017 (180deg=-0.173) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl 144:sc= -0.308 (180deg=-2.96!) USER MOD Single : A 163 LYS NZ :NH3+ -144:sc= -0.277 (180deg=-0.583) USER MOD Single : A 165 TYR OH : rot 120:sc= 0 USER MOD Single : A 166 LYS NZ :NH3+ 141:sc= 1.3 (180deg=0.985) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= -0.025 X(o=-0.025,f=-0.069) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 180 SER OG : rot 64:sc= -4.63! USER MOD Single : A 183 MET CE :methyl -174:sc= -1.7 (180deg=-2.08) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.243 6.251 -2.604 1.00 3.12 N ATOM 2 CA ARG A 73 24.034 4.815 -2.894 1.00 2.69 C ATOM 3 C ARG A 73 22.985 4.237 -1.952 1.00 2.08 C ATOM 4 O ARG A 73 23.288 3.879 -0.814 1.00 2.31 O ATOM 5 CB ARG A 73 25.349 4.044 -2.733 1.00 3.05 C ATOM 6 CG ARG A 73 25.260 2.584 -3.148 1.00 3.69 C ATOM 7 CD ARG A 73 25.196 2.430 -4.660 1.00 4.24 C ATOM 8 NE ARG A 73 26.425 2.891 -5.306 1.00 4.97 N ATOM 9 CZ ARG A 73 26.658 2.825 -6.615 1.00 5.85 C ATOM 10 NH1 ARG A 73 25.741 2.331 -7.435 1.00 6.18 N ATOM 11 NH2 ARG A 73 27.811 3.258 -7.103 1.00 6.67 N ATOM 0 HA ARG A 73 23.686 4.716 -3.922 1.00 2.69 H new ATOM 0 HB2 ARG A 73 26.121 4.534 -3.326 1.00 3.05 H new ATOM 0 HB3 ARG A 73 25.665 4.097 -1.691 1.00 3.05 H new ATOM 0 HG2 ARG A 73 26.125 2.043 -2.764 1.00 3.69 H new ATOM 0 HG3 ARG A 73 24.376 2.132 -2.699 1.00 3.69 H new ATOM 0 HD2 ARG A 73 25.024 1.384 -4.912 1.00 4.24 H new ATOM 0 HD3 ARG A 73 24.348 2.995 -5.047 1.00 4.24 H new ATOM 0 HE ARG A 73 27.153 3.290 -4.713 1.00 4.97 H new ATOM 0 HH11 ARG A 73 24.851 1.999 -7.064 1.00 6.18 H new ATOM 0 HH12 ARG A 73 25.926 2.283 -8.437 1.00 6.18 H new ATOM 0 HH21 ARG A 73 28.518 3.641 -6.476 1.00 6.67 H new ATOM 0 HH22 ARG A 73 27.991 3.208 -8.106 1.00 6.67 H new ATOM 25 N TRP A 74 21.753 4.148 -2.424 1.00 1.61 N ATOM 26 CA TRP A 74 20.674 3.603 -1.619 1.00 1.14 C ATOM 27 C TRP A 74 20.238 2.254 -2.183 1.00 0.96 C ATOM 28 O TRP A 74 19.862 2.152 -3.348 1.00 1.19 O ATOM 29 CB TRP A 74 19.494 4.576 -1.566 1.00 1.25 C ATOM 30 CG TRP A 74 18.471 4.196 -0.547 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.222 3.706 -0.782 1.00 1.14 C ATOM 32 CD2 TRP A 74 18.617 4.267 0.875 1.00 1.26 C ATOM 33 NE1 TRP A 74 16.581 3.467 0.408 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.416 3.807 1.439 1.00 1.34 C ATOM 35 CE3 TRP A 74 19.648 4.677 1.724 1.00 1.43 C ATOM 36 CZ2 TRP A 74 17.219 3.745 2.816 1.00 1.61 C ATOM 37 CZ3 TRP A 74 19.451 4.616 3.089 1.00 1.66 C ATOM 38 CH2 TRP A 74 18.243 4.152 3.625 1.00 1.75 C ATOM 0 H TRP A 74 21.476 4.446 -3.359 1.00 1.61 H new ATOM 0 HA TRP A 74 21.034 3.458 -0.600 1.00 1.14 H new ATOM 0 HB2 TRP A 74 19.865 5.577 -1.345 1.00 1.25 H new ATOM 0 HB3 TRP A 74 19.022 4.620 -2.548 1.00 1.25 H new ATOM 0 HD1 TRP A 74 16.799 3.531 -1.760 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.636 3.096 0.508 1.00 1.26 H new ATOM 0 HE3 TRP A 74 20.583 5.035 1.319 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 16.288 3.387 3.231 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 20.241 4.931 3.754 1.00 1.66 H new ATOM 0 HH2 TRP A 74 18.118 4.115 4.697 1.00 1.75 H new ATOM 49 N ASP A 75 20.299 1.221 -1.353 1.00 0.79 N ATOM 50 CA ASP A 75 20.076 -0.150 -1.816 1.00 0.78 C ATOM 51 C ASP A 75 18.594 -0.469 -1.969 1.00 0.67 C ATOM 52 O ASP A 75 18.217 -1.308 -2.774 1.00 0.92 O ATOM 53 CB ASP A 75 20.700 -1.151 -0.836 1.00 0.92 C ATOM 54 CG ASP A 75 22.173 -0.898 -0.598 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.497 -0.124 0.325 1.00 2.01 O ATOM 56 OD2 ASP A 75 23.013 -1.476 -1.317 1.00 1.86 O ATOM 0 H ASP A 75 20.500 1.302 -0.356 1.00 0.79 H new ATOM 0 HA ASP A 75 20.549 -0.235 -2.794 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.169 -1.101 0.115 1.00 0.92 H new ATOM 0 HB3 ASP A 75 20.567 -2.162 -1.222 1.00 0.92 H new ATOM 61 N GLN A 76 17.764 0.206 -1.196 1.00 0.59 N ATOM 62 CA GLN A 76 16.341 -0.127 -1.098 1.00 0.77 C ATOM 63 C GLN A 76 15.503 0.687 -2.077 1.00 0.69 C ATOM 64 O GLN A 76 14.284 0.741 -1.960 1.00 0.94 O ATOM 65 CB GLN A 76 15.863 0.148 0.322 1.00 1.07 C ATOM 66 CG GLN A 76 16.909 -0.171 1.374 1.00 1.21 C ATOM 67 CD GLN A 76 16.509 0.299 2.749 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.349 0.694 3.544 1.00 2.30 O ATOM 69 NE2 GLN A 76 15.226 0.241 3.047 1.00 2.36 N ATOM 0 H GLN A 76 18.047 0.997 -0.618 1.00 0.59 H new ATOM 0 HA GLN A 76 16.220 -1.181 -1.348 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.579 1.197 0.407 1.00 1.07 H new ATOM 0 HB3 GLN A 76 14.967 -0.441 0.518 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.079 -1.247 1.397 1.00 1.21 H new ATOM 0 HG3 GLN A 76 17.854 0.295 1.095 1.00 1.21 H new ATOM 0 HE21 GLN A 76 14.556 -0.095 2.355 1.00 2.36 H new ATOM 0 HE22 GLN A 76 14.903 0.532 3.970 1.00 2.36 H new ATOM 78 N SER A 77 16.168 1.329 -3.016 1.00 0.51 N ATOM 79 CA SER A 77 15.567 2.387 -3.825 1.00 0.56 C ATOM 80 C SER A 77 14.432 1.916 -4.755 1.00 0.43 C ATOM 81 O SER A 77 13.628 2.738 -5.196 1.00 0.54 O ATOM 82 CB SER A 77 16.668 3.059 -4.653 1.00 0.80 C ATOM 83 OG SER A 77 16.176 4.170 -5.384 1.00 1.52 O ATOM 0 H SER A 77 17.143 1.136 -3.245 1.00 0.51 H new ATOM 0 HA SER A 77 15.103 3.085 -3.128 1.00 0.56 H new ATOM 0 HB2 SER A 77 17.471 3.386 -3.992 1.00 0.80 H new ATOM 0 HB3 SER A 77 17.098 2.333 -5.342 1.00 0.80 H new ATOM 0 HG SER A 77 16.907 4.573 -5.898 1.00 1.52 H new ATOM 89 N ASP A 78 14.326 0.623 -5.043 1.00 0.35 N ATOM 90 CA ASP A 78 13.454 0.197 -6.144 1.00 0.38 C ATOM 91 C ASP A 78 12.376 -0.802 -5.726 1.00 0.33 C ATOM 92 O ASP A 78 12.081 -1.742 -6.459 1.00 0.42 O ATOM 93 CB ASP A 78 14.283 -0.372 -7.305 1.00 0.51 C ATOM 94 CG ASP A 78 13.839 0.172 -8.651 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.268 -0.592 -9.456 1.00 1.66 O ATOM 96 OD2 ASP A 78 14.063 1.372 -8.915 1.00 1.66 O ATOM 0 H ASP A 78 14.811 -0.128 -4.553 1.00 0.35 H new ATOM 0 HA ASP A 78 12.930 1.095 -6.472 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.335 -0.134 -7.148 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.200 -1.459 -7.309 1.00 0.51 H new ATOM 101 N LEU A 79 11.800 -0.618 -4.547 1.00 0.26 N ATOM 102 CA LEU A 79 10.619 -1.394 -4.164 1.00 0.26 C ATOM 103 C LEU A 79 9.375 -0.743 -4.767 1.00 0.30 C ATOM 104 O LEU A 79 9.166 0.460 -4.614 1.00 0.51 O ATOM 105 CB LEU A 79 10.470 -1.492 -2.635 1.00 0.28 C ATOM 106 CG LEU A 79 11.297 -2.584 -1.938 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.891 -3.966 -2.420 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.788 -2.365 -2.144 1.00 0.30 C ATOM 0 H LEU A 79 12.121 0.049 -3.846 1.00 0.26 H new ATOM 0 HA LEU A 79 10.737 -2.408 -4.547 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.742 -0.529 -2.203 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.418 -1.660 -2.404 1.00 0.28 H new ATOM 0 HG LEU A 79 11.091 -2.519 -0.870 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.492 -4.720 -1.911 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.837 -4.133 -2.200 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.053 -4.038 -3.495 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.345 -3.154 -1.639 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.015 -2.386 -3.210 1.00 0.30 H new ATOM 0 HD23 LEU A 79 13.074 -1.398 -1.731 1.00 0.30 H new ATOM 120 N HIS A 80 8.562 -1.523 -5.471 1.00 0.21 N ATOM 121 CA HIS A 80 7.390 -0.972 -6.149 1.00 0.25 C ATOM 122 C HIS A 80 6.151 -1.810 -5.890 1.00 0.22 C ATOM 123 O HIS A 80 6.205 -3.035 -5.912 1.00 0.23 O ATOM 124 CB HIS A 80 7.636 -0.875 -7.655 1.00 0.33 C ATOM 125 CG HIS A 80 8.650 0.157 -8.024 1.00 1.03 C ATOM 126 ND1 HIS A 80 9.937 -0.149 -8.411 1.00 1.94 N ATOM 127 CD2 HIS A 80 8.562 1.506 -8.050 1.00 1.86 C ATOM 128 CE1 HIS A 80 10.593 0.968 -8.658 1.00 2.58 C ATOM 129 NE2 HIS A 80 9.783 1.985 -8.449 1.00 2.50 N ATOM 0 H HIS A 80 8.689 -2.528 -5.588 1.00 0.21 H new ATOM 0 HA HIS A 80 7.221 0.026 -5.745 1.00 0.25 H new ATOM 0 HB2 HIS A 80 7.965 -1.846 -8.025 1.00 0.33 H new ATOM 0 HB3 HIS A 80 6.695 -0.645 -8.155 1.00 0.33 H new ATOM 0 HD1 HIS A 80 10.321 -1.090 -8.493 1.00 1.94 H new ATOM 0 HD2 HIS A 80 7.692 2.096 -7.803 1.00 1.86 H new ATOM 0 HE1 HIS A 80 11.622 1.037 -8.978 1.00 2.58 H new ATOM 138 N ILE A 81 5.036 -1.138 -5.653 1.00 0.23 N ATOM 139 CA ILE A 81 3.770 -1.809 -5.420 1.00 0.23 C ATOM 140 C ILE A 81 3.228 -2.341 -6.745 1.00 0.26 C ATOM 141 O ILE A 81 2.586 -1.616 -7.505 1.00 0.36 O ATOM 142 CB ILE A 81 2.743 -0.853 -4.782 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.343 -0.182 -3.540 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.478 -1.614 -4.411 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.527 0.979 -3.017 1.00 0.27 C ATOM 0 H ILE A 81 4.984 -0.120 -5.617 1.00 0.23 H new ATOM 0 HA ILE A 81 3.938 -2.635 -4.729 1.00 0.23 H new ATOM 0 HB ILE A 81 2.487 -0.080 -5.506 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.445 -0.926 -2.750 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.347 0.170 -3.778 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.760 -0.929 -3.961 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.044 -2.058 -5.307 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.723 -2.402 -3.699 1.00 0.28 H new ATOM 0 HD11 ILE A 81 3.016 1.401 -2.139 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.446 1.744 -3.789 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.531 0.630 -2.746 1.00 0.27 H new ATOM 157 N SER A 82 3.495 -3.611 -7.012 1.00 0.25 N ATOM 158 CA SER A 82 3.210 -4.195 -8.315 1.00 0.29 C ATOM 159 C SER A 82 1.860 -4.909 -8.320 1.00 0.33 C ATOM 160 O SER A 82 1.314 -5.217 -9.381 1.00 0.43 O ATOM 161 CB SER A 82 4.333 -5.165 -8.705 1.00 0.32 C ATOM 162 OG SER A 82 4.178 -5.638 -10.034 1.00 1.10 O ATOM 0 H SER A 82 3.910 -4.259 -6.342 1.00 0.25 H new ATOM 0 HA SER A 82 3.160 -3.391 -9.049 1.00 0.29 H new ATOM 0 HB2 SER A 82 5.297 -4.665 -8.606 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.340 -6.010 -8.016 1.00 0.32 H new ATOM 0 HG SER A 82 4.911 -6.252 -10.250 1.00 1.10 H new ATOM 168 N ASP A 83 1.322 -5.165 -7.137 1.00 0.33 N ATOM 169 CA ASP A 83 0.032 -5.834 -7.019 1.00 0.38 C ATOM 170 C ASP A 83 -0.582 -5.524 -5.668 1.00 0.30 C ATOM 171 O ASP A 83 0.097 -4.999 -4.786 1.00 0.27 O ATOM 172 CB ASP A 83 0.183 -7.351 -7.198 1.00 0.46 C ATOM 173 CG ASP A 83 -1.153 -8.071 -7.253 1.00 1.27 C ATOM 174 OD1 ASP A 83 -2.085 -7.553 -7.903 1.00 2.07 O ATOM 175 OD2 ASP A 83 -1.276 -9.158 -6.654 1.00 1.90 O ATOM 0 H ASP A 83 1.756 -4.921 -6.247 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.625 -5.465 -7.807 1.00 0.38 H new ATOM 0 HB2 ASP A 83 0.737 -7.551 -8.115 1.00 0.46 H new ATOM 0 HB3 ASP A 83 0.774 -7.753 -6.375 1.00 0.46 H new ATOM 180 N GLN A 84 -1.857 -5.835 -5.513 1.00 0.31 N ATOM 181 CA GLN A 84 -2.559 -5.593 -4.270 1.00 0.35 C ATOM 182 C GLN A 84 -3.899 -6.320 -4.268 1.00 0.34 C ATOM 183 O GLN A 84 -4.138 -7.194 -5.104 1.00 0.39 O ATOM 184 CB GLN A 84 -2.786 -4.093 -4.064 1.00 0.49 C ATOM 185 CG GLN A 84 -3.721 -3.476 -5.089 1.00 0.64 C ATOM 186 CD GLN A 84 -4.251 -2.139 -4.638 1.00 1.32 C ATOM 187 OE1 GLN A 84 -3.580 -1.407 -3.921 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.473 -1.826 -5.030 1.00 1.98 N ATOM 0 H GLN A 84 -2.430 -6.260 -6.242 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.946 -5.973 -3.453 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.194 -3.929 -3.067 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.826 -3.579 -4.104 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -3.193 -3.356 -6.035 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -4.555 -4.153 -5.273 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -5.996 -2.466 -5.628 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -5.893 -0.945 -4.735 1.00 1.98 H new ATOM 197 N THR A 85 -4.742 -5.964 -3.306 1.00 0.34 N ATOM 198 CA THR A 85 -6.097 -6.485 -3.194 1.00 0.39 C ATOM 199 C THR A 85 -6.803 -6.552 -4.554 1.00 0.50 C ATOM 200 O THR A 85 -6.908 -5.547 -5.264 1.00 0.54 O ATOM 201 CB THR A 85 -6.912 -5.588 -2.248 1.00 0.32 C ATOM 202 OG1 THR A 85 -6.185 -5.393 -1.028 1.00 0.43 O ATOM 203 CG2 THR A 85 -8.274 -6.194 -1.945 1.00 0.42 C ATOM 0 H THR A 85 -4.500 -5.297 -2.573 1.00 0.34 H new ATOM 0 HA THR A 85 -6.029 -7.499 -2.800 1.00 0.39 H new ATOM 0 HB THR A 85 -7.073 -4.629 -2.741 1.00 0.32 H new ATOM 0 HG1 THR A 85 -6.010 -4.437 -0.901 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.824 -5.535 -1.274 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.833 -6.315 -2.873 1.00 0.42 H new ATOM 0 HG23 THR A 85 -8.142 -7.167 -1.471 1.00 0.42 H new ATOM 211 N ASP A 86 -7.294 -7.738 -4.898 1.00 0.69 N ATOM 212 CA ASP A 86 -7.952 -7.962 -6.182 1.00 0.89 C ATOM 213 C ASP A 86 -9.322 -7.299 -6.185 1.00 0.83 C ATOM 214 O ASP A 86 -10.287 -7.834 -5.641 1.00 1.12 O ATOM 215 CB ASP A 86 -8.089 -9.465 -6.460 1.00 1.20 C ATOM 216 CG ASP A 86 -8.673 -9.765 -7.831 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.907 -9.667 -7.994 1.00 2.32 O ATOM 218 OD2 ASP A 86 -7.901 -10.128 -8.745 1.00 2.23 O ATOM 0 H ASP A 86 -7.248 -8.564 -4.302 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.342 -7.520 -6.970 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -7.109 -9.935 -6.378 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.723 -9.914 -5.695 1.00 1.20 H new ATOM 223 N THR A 87 -9.390 -6.118 -6.776 1.00 0.72 N ATOM 224 CA THR A 87 -10.620 -5.348 -6.815 1.00 0.74 C ATOM 225 C THR A 87 -10.823 -4.718 -8.188 1.00 0.81 C ATOM 226 O THR A 87 -10.406 -3.588 -8.438 1.00 1.42 O ATOM 227 CB THR A 87 -10.609 -4.249 -5.736 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.291 -3.692 -5.631 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.047 -4.801 -4.386 1.00 1.87 C ATOM 0 H THR A 87 -8.600 -5.669 -7.239 1.00 0.72 H new ATOM 0 HA THR A 87 -11.446 -6.031 -6.616 1.00 0.74 H new ATOM 0 HB THR A 87 -11.314 -3.471 -6.029 1.00 1.14 H new ATOM 0 HG1 THR A 87 -8.997 -3.378 -6.512 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.030 -4.003 -3.644 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.058 -5.200 -4.467 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.367 -5.596 -4.080 1.00 1.87 H new ATOM 237 N LYS A 88 -11.462 -5.457 -9.081 1.00 1.18 N ATOM 238 CA LYS A 88 -11.674 -4.989 -10.445 1.00 1.58 C ATOM 239 C LYS A 88 -12.922 -4.116 -10.517 1.00 1.51 C ATOM 240 O LYS A 88 -13.912 -4.461 -11.168 1.00 1.95 O ATOM 241 CB LYS A 88 -11.791 -6.181 -11.401 1.00 1.89 C ATOM 242 CG LYS A 88 -10.713 -7.237 -11.190 1.00 2.02 C ATOM 243 CD LYS A 88 -9.312 -6.644 -11.272 1.00 2.39 C ATOM 244 CE LYS A 88 -8.256 -7.665 -10.886 1.00 2.73 C ATOM 245 NZ LYS A 88 -6.890 -7.083 -10.884 1.00 3.20 N ATOM 0 H LYS A 88 -11.843 -6.383 -8.888 1.00 1.18 H new ATOM 0 HA LYS A 88 -10.817 -4.387 -10.748 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -12.770 -6.643 -11.275 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -11.738 -5.820 -12.428 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -10.852 -7.707 -10.217 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -10.820 -8.020 -11.941 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -9.124 -6.289 -12.285 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -9.242 -5.779 -10.613 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -8.482 -8.063 -9.896 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -8.291 -8.503 -11.582 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -6.201 -7.815 -10.615 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -6.663 -6.727 -11.834 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -6.847 -6.300 -10.201 1.00 3.20 H new ATOM 259 N GLY A 89 -12.862 -2.984 -9.838 1.00 1.22 N ATOM 260 CA GLY A 89 -13.992 -2.085 -9.768 1.00 1.14 C ATOM 261 C GLY A 89 -14.521 -1.984 -8.354 1.00 0.96 C ATOM 262 O GLY A 89 -13.743 -2.010 -7.399 1.00 1.01 O ATOM 0 H GLY A 89 -12.038 -2.668 -9.327 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -13.697 -1.097 -10.121 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -14.782 -2.437 -10.431 1.00 1.14 H new ATOM 266 N THR A 90 -15.833 -1.871 -8.209 1.00 0.97 N ATOM 267 CA THR A 90 -16.446 -1.864 -6.892 1.00 0.88 C ATOM 268 C THR A 90 -16.790 -3.288 -6.469 1.00 0.82 C ATOM 269 O THR A 90 -17.619 -3.947 -7.093 1.00 1.04 O ATOM 270 CB THR A 90 -17.720 -0.994 -6.865 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.408 0.336 -7.312 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.308 -0.936 -5.459 1.00 1.02 C ATOM 0 H THR A 90 -16.490 -1.783 -8.984 1.00 0.97 H new ATOM 0 HA THR A 90 -15.727 -1.436 -6.193 1.00 0.88 H new ATOM 0 HB THR A 90 -18.457 -1.442 -7.531 1.00 1.06 H new ATOM 0 HG1 THR A 90 -18.219 0.885 -7.295 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.205 -0.317 -5.465 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.564 -1.943 -5.130 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.575 -0.506 -4.776 1.00 1.02 H new ATOM 280 N VAL A 91 -16.136 -3.766 -5.424 1.00 0.65 N ATOM 281 CA VAL A 91 -16.347 -5.124 -4.950 1.00 0.77 C ATOM 282 C VAL A 91 -16.853 -5.100 -3.516 1.00 0.55 C ATOM 283 O VAL A 91 -16.429 -4.262 -2.721 1.00 0.46 O ATOM 284 CB VAL A 91 -15.037 -5.943 -5.015 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.258 -7.380 -4.566 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.452 -5.909 -6.417 1.00 1.51 C ATOM 0 H VAL A 91 -15.453 -3.233 -4.886 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.088 -5.596 -5.595 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.325 -5.483 -4.329 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.318 -7.928 -4.624 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -15.620 -7.388 -3.538 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -15.995 -7.854 -5.214 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.531 -6.491 -6.441 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.168 -6.334 -7.120 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.237 -4.878 -6.697 1.00 1.51 H new ATOM 296 N CYS A 92 -17.760 -6.005 -3.181 1.00 0.79 N ATOM 297 CA CYS A 92 -18.216 -6.109 -1.810 1.00 0.64 C ATOM 298 C CYS A 92 -17.387 -7.167 -1.105 1.00 0.62 C ATOM 299 O CYS A 92 -17.429 -8.346 -1.462 1.00 1.20 O ATOM 300 CB CYS A 92 -19.702 -6.482 -1.780 1.00 1.10 C ATOM 301 SG CYS A 92 -20.370 -6.791 -0.128 1.00 1.91 S ATOM 0 H CYS A 92 -18.187 -6.666 -3.830 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.096 -5.153 -1.301 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.274 -5.678 -2.244 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -19.851 -7.373 -2.390 1.00 1.10 H new ATOM 0 HG CYS A 92 -19.622 -7.658 0.487 1.00 1.91 H new ATOM 307 N SER A 93 -16.634 -6.745 -0.108 1.00 0.69 N ATOM 308 CA SER A 93 -15.727 -7.643 0.570 1.00 1.02 C ATOM 309 C SER A 93 -15.391 -7.173 1.977 1.00 0.58 C ATOM 310 O SER A 93 -14.756 -6.131 2.142 1.00 0.73 O ATOM 311 CB SER A 93 -14.444 -7.789 -0.251 1.00 1.83 C ATOM 312 OG SER A 93 -13.943 -6.521 -0.636 1.00 2.58 O ATOM 0 H SER A 93 -16.634 -5.789 0.248 1.00 0.69 H new ATOM 0 HA SER A 93 -16.226 -8.608 0.663 1.00 1.02 H new ATOM 0 HB2 SER A 93 -13.692 -8.319 0.333 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.642 -8.391 -1.138 1.00 1.83 H new ATOM 0 HG SER A 93 -13.122 -6.638 -1.158 1.00 2.58 H new ATOM 318 N PRO A 94 -15.817 -7.902 3.010 1.00 0.78 N ATOM 319 CA PRO A 94 -15.209 -7.777 4.319 1.00 0.67 C ATOM 320 C PRO A 94 -13.942 -8.619 4.336 1.00 0.53 C ATOM 321 O PRO A 94 -14.005 -9.848 4.414 1.00 0.59 O ATOM 322 CB PRO A 94 -16.262 -8.354 5.279 1.00 0.93 C ATOM 323 CG PRO A 94 -17.430 -8.754 4.423 1.00 1.39 C ATOM 324 CD PRO A 94 -16.919 -8.861 3.012 1.00 1.43 C ATOM 0 HA PRO A 94 -14.936 -6.757 4.588 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.866 -9.211 5.823 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.559 -7.614 6.023 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.846 -9.705 4.757 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.229 -8.016 4.490 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.581 -9.870 2.777 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.685 -8.603 2.281 1.00 1.43 H new ATOM 332 N PHE A 95 -12.793 -7.969 4.267 1.00 0.43 N ATOM 333 CA PHE A 95 -11.557 -8.683 3.986 1.00 0.40 C ATOM 334 C PHE A 95 -10.339 -7.865 4.396 1.00 0.33 C ATOM 335 O PHE A 95 -10.394 -6.636 4.451 1.00 0.32 O ATOM 336 CB PHE A 95 -11.521 -8.994 2.480 1.00 0.46 C ATOM 337 CG PHE A 95 -10.354 -9.828 2.027 1.00 0.50 C ATOM 338 CD1 PHE A 95 -9.367 -9.281 1.221 1.00 1.26 C ATOM 339 CD2 PHE A 95 -10.245 -11.160 2.397 1.00 1.35 C ATOM 340 CE1 PHE A 95 -8.298 -10.042 0.797 1.00 1.33 C ATOM 341 CE2 PHE A 95 -9.175 -11.926 1.975 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.200 -11.365 1.174 1.00 0.68 C ATOM 0 H PHE A 95 -12.689 -6.963 4.399 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.527 -9.607 4.564 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.442 -9.510 2.209 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.509 -8.053 1.931 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -9.436 -8.246 0.921 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -11.005 -11.604 3.022 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -7.537 -9.602 0.169 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -9.101 -12.962 2.271 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.362 -11.961 0.843 1.00 0.68 H new ATOM 352 N ALA A 96 -9.258 -8.564 4.719 1.00 0.37 N ATOM 353 CA ALA A 96 -7.987 -7.932 5.031 1.00 0.38 C ATOM 354 C ALA A 96 -7.239 -7.583 3.750 1.00 0.35 C ATOM 355 O ALA A 96 -6.762 -8.467 3.036 1.00 0.51 O ATOM 356 CB ALA A 96 -7.144 -8.845 5.903 1.00 0.49 C ATOM 0 H ALA A 96 -9.240 -9.582 4.771 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.183 -7.011 5.580 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.195 -8.358 6.129 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.675 -9.053 6.832 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -6.956 -9.780 5.375 1.00 0.49 H new ATOM 362 N LEU A 97 -7.131 -6.294 3.480 1.00 0.24 N ATOM 363 CA LEU A 97 -6.543 -5.805 2.240 1.00 0.22 C ATOM 364 C LEU A 97 -5.037 -5.995 2.237 1.00 0.22 C ATOM 365 O LEU A 97 -4.393 -5.944 3.284 1.00 0.24 O ATOM 366 CB LEU A 97 -6.898 -4.328 2.036 1.00 0.23 C ATOM 367 CG LEU A 97 -8.170 -4.066 1.218 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.292 -5.008 1.628 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.615 -2.622 1.384 1.00 1.07 C ATOM 0 H LEU A 97 -7.447 -5.557 4.110 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.955 -6.385 1.414 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -7.012 -3.860 3.014 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.060 -3.835 1.543 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.938 -4.250 0.169 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.180 -4.798 1.031 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.980 -6.039 1.464 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.522 -4.862 2.684 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.518 -2.450 0.798 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.821 -2.423 2.436 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.825 -1.956 1.037 1.00 1.07 H new ATOM 381 N PHE A 98 -4.480 -6.215 1.058 1.00 0.23 N ATOM 382 CA PHE A 98 -3.060 -6.467 0.934 1.00 0.23 C ATOM 383 C PHE A 98 -2.464 -5.694 -0.229 1.00 0.22 C ATOM 384 O PHE A 98 -3.174 -5.276 -1.142 1.00 0.25 O ATOM 385 CB PHE A 98 -2.794 -7.973 0.773 1.00 0.24 C ATOM 386 CG PHE A 98 -3.482 -8.611 -0.409 1.00 0.26 C ATOM 387 CD1 PHE A 98 -2.864 -8.657 -1.651 1.00 1.26 C ATOM 388 CD2 PHE A 98 -4.742 -9.177 -0.273 1.00 1.18 C ATOM 389 CE1 PHE A 98 -3.492 -9.251 -2.730 1.00 1.31 C ATOM 390 CE2 PHE A 98 -5.372 -9.771 -1.353 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.746 -9.807 -2.581 1.00 0.40 C ATOM 0 H PHE A 98 -4.992 -6.224 0.176 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.576 -6.122 1.848 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.720 -8.131 0.679 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -3.113 -8.484 1.681 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -1.882 -8.224 -1.776 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -5.237 -9.154 0.687 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -3.000 -9.280 -3.691 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -6.353 -10.206 -1.234 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.236 -10.270 -3.425 1.00 0.40 H new ATOM 401 N ALA A 99 -1.161 -5.488 -0.161 1.00 0.20 N ATOM 402 CA ALA A 99 -0.410 -4.882 -1.245 1.00 0.19 C ATOM 403 C ALA A 99 0.935 -5.575 -1.369 1.00 0.17 C ATOM 404 O ALA A 99 1.520 -5.991 -0.369 1.00 0.19 O ATOM 405 CB ALA A 99 -0.227 -3.390 -1.022 1.00 0.21 C ATOM 0 H ALA A 99 -0.593 -5.737 0.649 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.969 -5.005 -2.173 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.339 -2.965 -1.851 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -1.203 -2.908 -0.965 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.314 -3.225 -0.090 1.00 0.21 H new ATOM 411 N VAL A 100 1.410 -5.720 -2.586 1.00 0.17 N ATOM 412 CA VAL A 100 2.645 -6.433 -2.844 1.00 0.18 C ATOM 413 C VAL A 100 3.689 -5.509 -3.454 1.00 0.19 C ATOM 414 O VAL A 100 3.487 -4.953 -4.537 1.00 0.22 O ATOM 415 CB VAL A 100 2.396 -7.628 -3.785 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.688 -8.373 -4.073 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.357 -8.565 -3.192 1.00 0.25 C ATOM 0 H VAL A 100 0.956 -5.350 -3.421 1.00 0.17 H new ATOM 0 HA VAL A 100 3.020 -6.804 -1.890 1.00 0.18 H new ATOM 0 HB VAL A 100 2.014 -7.242 -4.730 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.484 -9.211 -4.739 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.400 -7.697 -4.548 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.109 -8.746 -3.139 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.194 -9.403 -3.870 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.711 -8.939 -2.231 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.420 -8.026 -3.049 1.00 0.25 H new ATOM 427 N LEU A 101 4.802 -5.347 -2.757 1.00 0.19 N ATOM 428 CA LEU A 101 5.891 -4.522 -3.243 1.00 0.19 C ATOM 429 C LEU A 101 7.005 -5.406 -3.765 1.00 0.21 C ATOM 430 O LEU A 101 7.617 -6.169 -3.020 1.00 0.23 O ATOM 431 CB LEU A 101 6.432 -3.580 -2.161 1.00 0.19 C ATOM 432 CG LEU A 101 5.478 -2.466 -1.716 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.441 -2.994 -0.734 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.258 -1.305 -1.115 1.00 0.21 C ATOM 0 H LEU A 101 4.973 -5.779 -1.849 1.00 0.19 H new ATOM 0 HA LEU A 101 5.501 -3.900 -4.048 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.700 -4.175 -1.288 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.350 -3.122 -2.529 1.00 0.19 H new ATOM 0 HG LEU A 101 4.946 -2.101 -2.595 1.00 0.22 H new ATOM 0 HD11 LEU A 101 3.777 -2.183 -0.435 1.00 0.30 H new ATOM 0 HD12 LEU A 101 3.858 -3.783 -1.209 1.00 0.30 H new ATOM 0 HD13 LEU A 101 4.944 -3.395 0.146 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.565 -0.523 -0.804 1.00 0.21 H new ATOM 0 HD22 LEU A 101 6.822 -1.654 -0.250 1.00 0.21 H new ATOM 0 HD23 LEU A 101 6.946 -0.905 -1.859 1.00 0.21 H new ATOM 446 N GLU A 102 7.256 -5.303 -5.048 1.00 0.24 N ATOM 447 CA GLU A 102 8.227 -6.143 -5.703 1.00 0.29 C ATOM 448 C GLU A 102 9.583 -5.460 -5.742 1.00 0.28 C ATOM 449 O GLU A 102 9.685 -4.265 -6.029 1.00 0.26 O ATOM 450 CB GLU A 102 7.758 -6.484 -7.120 1.00 0.34 C ATOM 451 CG GLU A 102 8.733 -7.350 -7.898 1.00 0.41 C ATOM 452 CD GLU A 102 8.163 -7.835 -9.212 1.00 0.53 C ATOM 453 OE1 GLU A 102 7.885 -9.047 -9.329 1.00 1.32 O ATOM 454 OE2 GLU A 102 7.980 -7.012 -10.133 1.00 0.95 O ATOM 0 H GLU A 102 6.793 -4.636 -5.665 1.00 0.24 H new ATOM 0 HA GLU A 102 8.327 -7.068 -5.135 1.00 0.29 H new ATOM 0 HB2 GLU A 102 6.798 -6.997 -7.061 1.00 0.34 H new ATOM 0 HB3 GLU A 102 7.591 -5.558 -7.670 1.00 0.34 H new ATOM 0 HG2 GLU A 102 9.644 -6.783 -8.089 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.015 -8.209 -7.290 1.00 0.41 H new ATOM 461 N ASN A 103 10.610 -6.224 -5.419 1.00 0.38 N ATOM 462 CA ASN A 103 11.979 -5.766 -5.544 1.00 0.44 C ATOM 463 C ASN A 103 12.396 -5.821 -7.002 1.00 0.37 C ATOM 464 O ASN A 103 12.744 -6.882 -7.525 1.00 0.51 O ATOM 465 CB ASN A 103 12.912 -6.631 -4.690 1.00 0.68 C ATOM 466 CG ASN A 103 14.373 -6.425 -5.033 1.00 0.87 C ATOM 467 OD1 ASN A 103 14.778 -5.354 -5.468 1.00 1.76 O ATOM 468 ND2 ASN A 103 15.173 -7.460 -4.849 1.00 1.64 N ATOM 0 H ASN A 103 10.518 -7.176 -5.064 1.00 0.38 H new ATOM 0 HA ASN A 103 12.048 -4.738 -5.188 1.00 0.44 H new ATOM 0 HB2 ASN A 103 12.754 -6.399 -3.637 1.00 0.68 H new ATOM 0 HB3 ASN A 103 12.655 -7.681 -4.827 1.00 0.68 H new ATOM 0 HD21 ASN A 103 16.166 -7.383 -5.071 1.00 1.64 H new ATOM 0 HD22 ASN A 103 14.798 -8.336 -4.485 1.00 1.64 H new ATOM 475 N THR A 104 12.342 -4.681 -7.661 1.00 0.34 N ATOM 476 CA THR A 104 12.680 -4.607 -9.063 1.00 0.38 C ATOM 477 C THR A 104 14.139 -4.207 -9.266 1.00 0.50 C ATOM 478 O THR A 104 14.451 -3.308 -10.048 1.00 0.70 O ATOM 479 CB THR A 104 11.734 -3.642 -9.802 1.00 0.55 C ATOM 480 OG1 THR A 104 11.562 -2.434 -9.051 1.00 0.77 O ATOM 481 CG2 THR A 104 10.381 -4.290 -10.021 1.00 0.73 C ATOM 0 H THR A 104 12.066 -3.792 -7.244 1.00 0.34 H new ATOM 0 HA THR A 104 12.552 -5.602 -9.489 1.00 0.38 H new ATOM 0 HB THR A 104 12.181 -3.405 -10.767 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.438 -2.030 -8.876 1.00 0.77 H new ATOM 0 HG21 THR A 104 9.725 -3.594 -10.544 1.00 0.73 H new ATOM 0 HG22 THR A 104 10.503 -5.193 -10.619 1.00 0.73 H new ATOM 0 HG23 THR A 104 9.941 -4.549 -9.058 1.00 0.73 H new ATOM 489 N GLY A 105 15.033 -4.886 -8.556 1.00 0.52 N ATOM 490 CA GLY A 105 16.454 -4.707 -8.787 1.00 0.72 C ATOM 491 C GLY A 105 17.220 -4.236 -7.567 1.00 0.66 C ATOM 492 O GLY A 105 18.368 -4.631 -7.368 1.00 0.80 O ATOM 0 H GLY A 105 14.799 -5.557 -7.825 1.00 0.52 H new ATOM 0 HA2 GLY A 105 16.878 -5.651 -9.128 1.00 0.72 H new ATOM 0 HA3 GLY A 105 16.593 -3.986 -9.592 1.00 0.72 H new ATOM 496 N GLU A 106 16.598 -3.406 -6.749 1.00 0.60 N ATOM 497 CA GLU A 106 17.263 -2.860 -5.578 1.00 0.56 C ATOM 498 C GLU A 106 16.754 -3.534 -4.311 1.00 0.65 C ATOM 499 O GLU A 106 15.727 -3.141 -3.751 1.00 1.05 O ATOM 500 CB GLU A 106 17.050 -1.350 -5.505 1.00 0.68 C ATOM 501 CG GLU A 106 17.691 -0.594 -6.658 1.00 1.25 C ATOM 502 CD GLU A 106 19.189 -0.787 -6.714 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.672 -1.484 -7.626 1.00 2.54 O ATOM 504 OE2 GLU A 106 19.896 -0.243 -5.840 1.00 2.47 O ATOM 0 H GLU A 106 15.634 -3.095 -6.873 1.00 0.60 H new ATOM 0 HA GLU A 106 18.332 -3.056 -5.663 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.980 -1.141 -5.493 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.457 -0.978 -4.565 1.00 0.68 H new ATOM 0 HG2 GLU A 106 17.249 -0.927 -7.597 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.468 0.468 -6.560 1.00 1.25 H new ATOM 511 N LYS A 107 17.480 -4.558 -3.877 1.00 0.61 N ATOM 512 CA LYS A 107 17.077 -5.381 -2.741 1.00 0.69 C ATOM 513 C LYS A 107 16.913 -4.584 -1.452 1.00 0.66 C ATOM 514 O LYS A 107 17.721 -3.713 -1.122 1.00 0.76 O ATOM 515 CB LYS A 107 18.093 -6.499 -2.507 1.00 0.86 C ATOM 516 CG LYS A 107 17.989 -7.647 -3.496 1.00 1.37 C ATOM 517 CD LYS A 107 18.938 -8.775 -3.131 1.00 1.80 C ATOM 518 CE LYS A 107 18.692 -10.016 -3.975 1.00 2.66 C ATOM 519 NZ LYS A 107 18.973 -9.784 -5.416 1.00 3.32 N ATOM 0 H LYS A 107 18.363 -4.841 -4.301 1.00 0.61 H new ATOM 0 HA LYS A 107 16.103 -5.797 -2.999 1.00 0.69 H new ATOM 0 HB2 LYS A 107 19.098 -6.079 -2.558 1.00 0.86 H new ATOM 0 HB3 LYS A 107 17.962 -6.890 -1.498 1.00 0.86 H new ATOM 0 HG2 LYS A 107 16.966 -8.022 -3.516 1.00 1.37 H new ATOM 0 HG3 LYS A 107 18.216 -7.287 -4.500 1.00 1.37 H new ATOM 0 HD2 LYS A 107 19.967 -8.442 -3.266 1.00 1.80 H new ATOM 0 HD3 LYS A 107 18.819 -9.023 -2.076 1.00 1.80 H new ATOM 0 HE2 LYS A 107 19.319 -10.830 -3.611 1.00 2.66 H new ATOM 0 HE3 LYS A 107 17.656 -10.334 -3.856 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 18.791 -10.658 -5.950 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 18.357 -9.026 -5.772 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 19.968 -9.506 -5.535 1.00 3.32 H new ATOM 533 N LEU A 108 15.855 -4.908 -0.725 1.00 0.59 N ATOM 534 CA LEU A 108 15.638 -4.378 0.610 1.00 0.57 C ATOM 535 C LEU A 108 16.644 -5.041 1.552 1.00 0.63 C ATOM 536 O LEU A 108 16.426 -6.161 2.018 1.00 0.74 O ATOM 537 CB LEU A 108 14.187 -4.675 1.039 1.00 0.60 C ATOM 538 CG LEU A 108 13.635 -3.903 2.248 1.00 0.58 C ATOM 539 CD1 LEU A 108 14.249 -4.383 3.554 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.858 -2.415 2.074 1.00 0.56 C ATOM 0 H LEU A 108 15.125 -5.545 -1.044 1.00 0.59 H new ATOM 0 HA LEU A 108 15.784 -3.298 0.637 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.537 -4.477 0.187 1.00 0.60 H new ATOM 0 HB3 LEU A 108 14.111 -5.740 1.257 1.00 0.60 H new ATOM 0 HG LEU A 108 12.564 -4.097 2.298 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.832 -3.812 4.384 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.026 -5.441 3.694 1.00 0.61 H new ATOM 0 HD13 LEU A 108 15.329 -4.241 3.522 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.461 -1.884 2.939 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.926 -2.215 1.984 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.348 -2.074 1.173 1.00 0.56 H new ATOM 552 N LYS A 109 17.754 -4.363 1.810 1.00 0.62 N ATOM 553 CA LYS A 109 18.860 -4.982 2.529 1.00 0.73 C ATOM 554 C LYS A 109 19.326 -4.128 3.713 1.00 0.75 C ATOM 555 O LYS A 109 20.363 -4.404 4.313 1.00 1.15 O ATOM 556 CB LYS A 109 20.017 -5.211 1.549 1.00 0.92 C ATOM 557 CG LYS A 109 21.071 -6.192 2.038 1.00 1.17 C ATOM 558 CD LYS A 109 22.237 -6.271 1.065 1.00 1.66 C ATOM 559 CE LYS A 109 23.270 -7.295 1.508 1.00 2.07 C ATOM 560 NZ LYS A 109 22.753 -8.686 1.407 1.00 2.72 N ATOM 0 H LYS A 109 17.913 -3.394 1.535 1.00 0.62 H new ATOM 0 HA LYS A 109 18.518 -5.932 2.940 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.611 -5.574 0.605 1.00 0.92 H new ATOM 0 HB3 LYS A 109 20.497 -4.254 1.343 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.432 -5.884 3.019 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.626 -7.180 2.158 1.00 1.17 H new ATOM 0 HD2 LYS A 109 21.867 -6.533 0.074 1.00 1.66 H new ATOM 0 HD3 LYS A 109 22.708 -5.292 0.981 1.00 1.66 H new ATOM 0 HE2 LYS A 109 24.166 -7.195 0.895 1.00 2.07 H new ATOM 0 HE3 LYS A 109 23.564 -7.091 2.538 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 23.533 -9.358 1.554 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 22.024 -8.839 2.132 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 22.340 -8.835 0.464 1.00 2.72 H new ATOM 574 N LYS A 110 18.567 -3.096 4.054 1.00 0.62 N ATOM 575 CA LYS A 110 18.939 -2.223 5.166 1.00 0.73 C ATOM 576 C LYS A 110 17.732 -1.886 6.044 1.00 0.77 C ATOM 577 O LYS A 110 17.350 -2.663 6.919 1.00 1.53 O ATOM 578 CB LYS A 110 19.590 -0.929 4.660 1.00 0.93 C ATOM 579 CG LYS A 110 21.019 -1.089 4.164 1.00 1.14 C ATOM 580 CD LYS A 110 21.590 0.249 3.718 1.00 1.46 C ATOM 581 CE LYS A 110 23.110 0.218 3.619 1.00 1.80 C ATOM 582 NZ LYS A 110 23.599 -0.788 2.641 1.00 1.59 N ATOM 0 H LYS A 110 17.698 -2.842 3.584 1.00 0.62 H new ATOM 0 HA LYS A 110 19.663 -2.769 5.771 1.00 0.73 H new ATOM 0 HB2 LYS A 110 18.982 -0.525 3.851 1.00 0.93 H new ATOM 0 HB3 LYS A 110 19.579 -0.194 5.465 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.639 -1.508 4.957 1.00 1.14 H new ATOM 0 HG3 LYS A 110 21.043 -1.795 3.334 1.00 1.14 H new ATOM 0 HD2 LYS A 110 21.169 0.517 2.749 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.289 1.024 4.422 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.472 1.205 3.331 1.00 1.80 H new ATOM 0 HE3 LYS A 110 23.530 -0.001 4.601 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.572 -0.552 2.358 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.585 -1.732 3.077 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 22.984 -0.785 1.803 1.00 1.59 H new ATOM 596 N SER A 111 17.127 -0.736 5.787 1.00 0.51 N ATOM 597 CA SER A 111 15.982 -0.271 6.553 1.00 0.52 C ATOM 598 C SER A 111 14.698 -0.898 6.015 1.00 0.48 C ATOM 599 O SER A 111 14.744 -1.757 5.139 1.00 0.86 O ATOM 600 CB SER A 111 15.906 1.256 6.469 1.00 0.72 C ATOM 601 OG SER A 111 17.144 1.849 6.825 1.00 1.55 O ATOM 0 H SER A 111 17.416 -0.101 5.043 1.00 0.51 H new ATOM 0 HA SER A 111 16.097 -0.569 7.595 1.00 0.52 H new ATOM 0 HB2 SER A 111 15.634 1.555 5.457 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.121 1.621 7.131 1.00 0.72 H new ATOM 0 HG SER A 111 17.070 2.824 6.762 1.00 1.55 H new ATOM 607 N LYS A 112 13.560 -0.460 6.529 1.00 0.39 N ATOM 608 CA LYS A 112 12.277 -1.033 6.143 1.00 0.32 C ATOM 609 C LYS A 112 11.353 0.052 5.601 1.00 0.28 C ATOM 610 O LYS A 112 11.279 1.145 6.161 1.00 0.33 O ATOM 611 CB LYS A 112 11.629 -1.717 7.350 1.00 0.45 C ATOM 612 CG LYS A 112 12.550 -2.702 8.054 1.00 0.55 C ATOM 613 CD LYS A 112 11.870 -3.358 9.244 1.00 0.69 C ATOM 614 CE LYS A 112 12.801 -4.324 9.956 1.00 0.84 C ATOM 615 NZ LYS A 112 12.126 -5.016 11.085 1.00 1.53 N ATOM 0 H LYS A 112 13.497 0.292 7.216 1.00 0.39 H new ATOM 0 HA LYS A 112 12.444 -1.772 5.359 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.311 -0.956 8.062 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.731 -2.241 7.022 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.869 -3.470 7.349 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.449 -2.184 8.389 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.537 -2.590 9.943 1.00 0.69 H new ATOM 0 HD3 LYS A 112 10.980 -3.890 8.908 1.00 0.69 H new ATOM 0 HE2 LYS A 112 13.169 -5.064 9.245 1.00 0.84 H new ATOM 0 HE3 LYS A 112 13.669 -3.782 10.330 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 12.796 -5.666 11.544 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 11.797 -4.312 11.777 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 11.312 -5.555 10.725 1.00 1.53 H new ATOM 629 N TRP A 113 10.663 -0.249 4.506 1.00 0.24 N ATOM 630 CA TRP A 113 9.686 0.678 3.940 1.00 0.22 C ATOM 631 C TRP A 113 8.462 0.728 4.843 1.00 0.21 C ATOM 632 O TRP A 113 7.968 -0.312 5.280 1.00 0.25 O ATOM 633 CB TRP A 113 9.275 0.248 2.522 1.00 0.22 C ATOM 634 CG TRP A 113 10.310 0.509 1.459 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.632 0.161 1.485 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.093 1.150 0.193 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.250 0.566 0.325 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.327 1.171 -0.483 1.00 0.25 C ATOM 639 CE3 TRP A 113 8.977 1.716 -0.436 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.479 1.729 -1.748 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.130 2.266 -1.696 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.374 2.270 -2.339 1.00 0.32 C ATOM 0 H TRP A 113 10.761 -1.125 3.993 1.00 0.24 H new ATOM 0 HA TRP A 113 10.138 1.668 3.874 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.046 -0.818 2.533 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.357 0.769 2.251 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.120 -0.356 2.298 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.237 0.436 0.103 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.014 1.723 0.054 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.438 1.734 -2.245 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.275 2.700 -2.193 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.461 2.710 -3.322 1.00 0.32 H new ATOM 653 N LYS A 114 7.990 1.930 5.136 1.00 0.20 N ATOM 654 CA LYS A 114 6.860 2.096 6.031 1.00 0.24 C ATOM 655 C LYS A 114 5.613 2.467 5.238 1.00 0.20 C ATOM 656 O LYS A 114 5.673 3.287 4.319 1.00 0.24 O ATOM 657 CB LYS A 114 7.165 3.168 7.073 1.00 0.37 C ATOM 658 CG LYS A 114 6.233 3.127 8.272 1.00 0.58 C ATOM 659 CD LYS A 114 6.512 4.262 9.237 1.00 1.04 C ATOM 660 CE LYS A 114 5.581 4.214 10.436 1.00 1.08 C ATOM 661 NZ LYS A 114 5.836 3.030 11.296 1.00 1.66 N ATOM 0 H LYS A 114 8.372 2.801 4.767 1.00 0.20 H new ATOM 0 HA LYS A 114 6.678 1.153 6.546 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.192 3.048 7.417 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.098 4.150 6.604 1.00 0.37 H new ATOM 0 HG2 LYS A 114 5.199 3.184 7.932 1.00 0.58 H new ATOM 0 HG3 LYS A 114 6.346 2.174 8.789 1.00 0.58 H new ATOM 0 HD2 LYS A 114 7.547 4.207 9.576 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.395 5.216 8.722 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.703 5.123 11.026 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.547 4.195 10.091 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 5.288 3.116 12.176 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.549 2.167 10.792 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 6.850 2.978 11.523 1.00 1.66 H new ATOM 675 N TRP A 115 4.489 1.864 5.596 1.00 0.17 N ATOM 676 CA TRP A 115 3.257 2.058 4.849 1.00 0.15 C ATOM 677 C TRP A 115 2.111 2.476 5.755 1.00 0.16 C ATOM 678 O TRP A 115 2.141 2.243 6.965 1.00 0.18 O ATOM 679 CB TRP A 115 2.880 0.772 4.105 1.00 0.15 C ATOM 680 CG TRP A 115 2.649 -0.400 5.010 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.583 -1.285 5.450 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.402 -0.822 5.577 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.000 -2.225 6.261 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.663 -1.964 6.353 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.093 -0.343 5.507 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.667 -2.635 7.052 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.896 -1.010 6.201 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.605 -2.145 6.965 1.00 0.22 C ATOM 0 H TRP A 115 4.405 1.238 6.397 1.00 0.17 H new ATOM 0 HA TRP A 115 3.432 2.859 4.131 1.00 0.15 H new ATOM 0 HB2 TRP A 115 1.978 0.952 3.520 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.673 0.525 3.400 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.633 -1.252 5.197 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.487 -2.995 6.721 1.00 0.22 H new ATOM 0 HE3 TRP A 115 -0.142 0.533 4.921 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 0.890 -3.511 7.642 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.913 -0.649 6.153 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.402 -2.644 7.497 1.00 0.22 H new ATOM 699 N GLU A 116 1.110 3.102 5.152 1.00 0.17 N ATOM 700 CA GLU A 116 -0.133 3.432 5.830 1.00 0.20 C ATOM 701 C GLU A 116 -1.311 3.146 4.912 1.00 0.19 C ATOM 702 O GLU A 116 -1.275 3.486 3.729 1.00 0.25 O ATOM 703 CB GLU A 116 -0.183 4.911 6.216 1.00 0.32 C ATOM 704 CG GLU A 116 0.866 5.359 7.210 1.00 0.50 C ATOM 705 CD GLU A 116 0.748 6.840 7.497 1.00 0.64 C ATOM 706 OE1 GLU A 116 1.070 7.262 8.627 1.00 1.40 O ATOM 707 OE2 GLU A 116 0.309 7.591 6.592 1.00 1.22 O ATOM 0 H GLU A 116 1.139 3.396 4.176 1.00 0.17 H new ATOM 0 HA GLU A 116 -0.186 2.823 6.732 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.080 5.509 5.310 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -1.168 5.128 6.630 1.00 0.32 H new ATOM 0 HG2 GLU A 116 0.757 4.796 8.137 1.00 0.50 H new ATOM 0 HG3 GLU A 116 1.859 5.139 6.819 1.00 0.50 H new ATOM 714 N LEU A 117 -2.351 2.534 5.447 1.00 0.17 N ATOM 715 CA LEU A 117 -3.584 2.363 4.702 1.00 0.16 C ATOM 716 C LEU A 117 -4.446 3.594 4.900 1.00 0.15 C ATOM 717 O LEU A 117 -4.731 3.981 6.033 1.00 0.19 O ATOM 718 CB LEU A 117 -4.351 1.125 5.155 1.00 0.19 C ATOM 719 CG LEU A 117 -5.646 0.866 4.380 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.354 0.332 2.987 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.542 -0.085 5.140 1.00 0.25 C ATOM 0 H LEU A 117 -2.367 2.148 6.391 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.336 2.231 3.649 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.703 0.254 5.057 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.589 1.227 6.214 1.00 0.19 H new ATOM 0 HG LEU A 117 -6.168 1.817 4.272 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.292 0.157 2.460 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.758 1.060 2.436 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.802 -0.605 3.065 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.457 -0.256 4.572 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -6.024 -1.033 5.288 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.792 0.347 6.109 1.00 0.25 H new ATOM 733 N HIS A 118 -4.845 4.217 3.810 1.00 0.13 N ATOM 734 CA HIS A 118 -5.585 5.462 3.886 1.00 0.14 C ATOM 735 C HIS A 118 -7.023 5.283 3.448 1.00 0.18 C ATOM 736 O HIS A 118 -7.328 4.451 2.596 1.00 0.21 O ATOM 737 CB HIS A 118 -4.924 6.537 3.023 1.00 0.18 C ATOM 738 CG HIS A 118 -3.626 7.043 3.573 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.214 8.347 3.439 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.647 6.413 4.265 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.041 8.498 4.029 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.672 7.342 4.541 1.00 0.22 N ATOM 0 H HIS A 118 -4.670 3.883 2.862 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.577 5.777 4.929 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.752 6.133 2.025 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.612 7.375 2.913 1.00 0.18 H new ATOM 0 HD1 HIS A 118 -3.732 9.083 2.959 1.00 0.50 H new ATOM 0 HD2 HIS A 118 -2.635 5.371 4.548 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.478 9.418 4.082 1.00 0.45 H new ATOM 751 N LYS A 119 -7.895 6.060 4.063 1.00 0.22 N ATOM 752 CA LYS A 119 -9.271 6.182 3.620 1.00 0.29 C ATOM 753 C LYS A 119 -9.375 7.357 2.659 1.00 0.27 C ATOM 754 O LYS A 119 -9.249 8.513 3.064 1.00 0.43 O ATOM 755 CB LYS A 119 -10.201 6.385 4.823 1.00 0.43 C ATOM 756 CG LYS A 119 -11.640 6.707 4.446 1.00 0.70 C ATOM 757 CD LYS A 119 -12.268 5.602 3.614 1.00 0.84 C ATOM 758 CE LYS A 119 -13.679 5.966 3.189 1.00 1.04 C ATOM 759 NZ LYS A 119 -13.709 7.187 2.336 1.00 1.69 N ATOM 0 H LYS A 119 -7.670 6.624 4.883 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.576 5.268 3.110 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -10.190 5.483 5.434 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -9.808 7.193 5.440 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -12.227 6.858 5.352 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.668 7.643 3.888 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -11.656 5.416 2.731 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.287 4.676 4.189 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.119 5.132 2.643 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.294 6.127 4.074 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -14.627 7.249 1.850 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -13.575 8.029 2.931 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -12.947 7.136 1.630 1.00 1.69 H new ATOM 773 N LEU A 120 -9.587 7.062 1.392 1.00 0.23 N ATOM 774 CA LEU A 120 -9.601 8.091 0.371 1.00 0.26 C ATOM 775 C LEU A 120 -11.031 8.485 0.039 1.00 0.34 C ATOM 776 O LEU A 120 -11.963 7.692 0.201 1.00 0.37 O ATOM 777 CB LEU A 120 -8.860 7.624 -0.893 1.00 0.24 C ATOM 778 CG LEU A 120 -7.360 7.345 -0.717 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.704 8.421 0.133 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.126 5.973 -0.117 1.00 0.21 C ATOM 0 H LEU A 120 -9.752 6.117 1.044 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.080 8.966 0.761 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.340 6.716 -1.259 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -8.982 8.383 -1.666 1.00 0.24 H new ATOM 0 HG LEU A 120 -6.901 7.363 -1.705 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.642 8.201 0.243 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -6.825 9.391 -0.350 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.173 8.444 1.116 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -6.055 5.803 -0.004 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.607 5.916 0.859 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.547 5.212 -0.774 1.00 0.21 H new ATOM 792 N GLU A 121 -11.199 9.721 -0.404 1.00 0.46 N ATOM 793 CA GLU A 121 -12.519 10.261 -0.701 1.00 0.57 C ATOM 794 C GLU A 121 -12.822 10.154 -2.190 1.00 0.58 C ATOM 795 O GLU A 121 -13.928 10.463 -2.635 1.00 0.69 O ATOM 796 CB GLU A 121 -12.585 11.728 -0.282 1.00 0.70 C ATOM 797 CG GLU A 121 -12.188 11.983 1.164 1.00 0.80 C ATOM 798 CD GLU A 121 -12.220 13.454 1.515 1.00 1.63 C ATOM 799 OE1 GLU A 121 -12.850 13.817 2.530 1.00 2.36 O ATOM 800 OE2 GLU A 121 -11.627 14.259 0.764 1.00 2.22 O ATOM 0 H GLU A 121 -10.433 10.374 -0.567 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.258 9.683 -0.146 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -11.933 12.310 -0.934 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -13.600 12.093 -0.438 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -12.862 11.439 1.825 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.186 11.591 1.338 1.00 0.80 H new ATOM 807 N ASN A 122 -11.829 9.723 -2.951 1.00 0.53 N ATOM 808 CA ASN A 122 -11.935 9.658 -4.401 1.00 0.60 C ATOM 809 C ASN A 122 -10.861 8.719 -4.926 1.00 0.62 C ATOM 810 O ASN A 122 -9.773 8.648 -4.357 1.00 1.22 O ATOM 811 CB ASN A 122 -11.762 11.064 -4.991 1.00 0.73 C ATOM 812 CG ASN A 122 -12.230 11.188 -6.433 1.00 1.03 C ATOM 813 OD1 ASN A 122 -12.147 10.249 -7.220 1.00 1.16 O ATOM 814 ND2 ASN A 122 -12.724 12.363 -6.787 1.00 1.87 N ATOM 0 H ASN A 122 -10.930 9.410 -2.584 1.00 0.53 H new ATOM 0 HA ASN A 122 -12.915 9.281 -4.694 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -12.314 11.776 -4.377 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -10.710 11.344 -4.935 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -13.052 12.512 -7.741 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -12.777 13.120 -6.106 1.00 1.87 H new ATOM 821 N ALA A 123 -11.170 7.987 -5.984 1.00 0.67 N ATOM 822 CA ALA A 123 -10.236 7.013 -6.529 1.00 0.66 C ATOM 823 C ALA A 123 -9.715 7.454 -7.891 1.00 0.71 C ATOM 824 O ALA A 123 -8.701 6.949 -8.374 1.00 0.90 O ATOM 825 CB ALA A 123 -10.900 5.649 -6.627 1.00 0.69 C ATOM 0 H ALA A 123 -12.058 8.048 -6.482 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.384 6.942 -5.853 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.192 4.928 -7.036 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -11.215 5.325 -5.635 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.770 5.714 -7.281 1.00 0.69 H new ATOM 831 N ARG A 124 -10.409 8.399 -8.504 1.00 0.72 N ATOM 832 CA ARG A 124 -10.027 8.891 -9.822 1.00 0.83 C ATOM 833 C ARG A 124 -9.267 10.206 -9.709 1.00 0.75 C ATOM 834 O ARG A 124 -8.741 10.722 -10.693 1.00 0.86 O ATOM 835 CB ARG A 124 -11.264 9.057 -10.705 1.00 1.08 C ATOM 836 CG ARG A 124 -11.986 7.747 -10.979 1.00 1.37 C ATOM 837 CD ARG A 124 -13.247 7.952 -11.801 1.00 1.63 C ATOM 838 NE ARG A 124 -13.954 6.690 -12.020 1.00 2.28 N ATOM 839 CZ ARG A 124 -15.121 6.580 -12.653 1.00 2.84 C ATOM 840 NH1 ARG A 124 -15.720 7.655 -13.153 1.00 2.76 N ATOM 841 NH2 ARG A 124 -15.687 5.387 -12.788 1.00 3.84 N ATOM 0 H ARG A 124 -11.240 8.842 -8.112 1.00 0.72 H new ATOM 0 HA ARG A 124 -9.366 8.158 -10.285 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -11.954 9.751 -10.225 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -10.968 9.506 -11.653 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -11.316 7.068 -11.506 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -12.244 7.270 -10.033 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -13.905 8.655 -11.291 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -12.988 8.397 -12.762 1.00 1.63 H new ATOM 0 HE ARG A 124 -13.524 5.836 -11.664 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -15.287 8.573 -13.054 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -16.613 7.563 -13.636 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -15.228 4.559 -12.408 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -16.580 5.298 -13.272 1.00 3.84 H new ATOM 855 N LYS A 125 -9.224 10.742 -8.501 1.00 0.75 N ATOM 856 CA LYS A 125 -8.458 11.945 -8.211 1.00 0.68 C ATOM 857 C LYS A 125 -7.277 11.589 -7.320 1.00 0.55 C ATOM 858 O LYS A 125 -7.258 10.504 -6.736 1.00 0.53 O ATOM 859 CB LYS A 125 -9.338 13.008 -7.538 1.00 0.79 C ATOM 860 CG LYS A 125 -9.895 14.047 -8.503 1.00 0.93 C ATOM 861 CD LYS A 125 -10.820 13.428 -9.538 1.00 1.64 C ATOM 862 CE LYS A 125 -11.226 14.440 -10.596 1.00 1.90 C ATOM 863 NZ LYS A 125 -11.937 15.608 -10.014 1.00 2.26 N ATOM 0 H LYS A 125 -9.717 10.358 -7.695 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.091 12.363 -9.148 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -10.168 12.513 -7.034 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.755 13.515 -6.770 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -10.437 14.808 -7.942 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -9.071 14.550 -9.009 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -10.322 12.583 -10.013 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -11.710 13.038 -9.045 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -10.338 14.785 -11.126 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -11.868 13.956 -11.332 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -12.298 16.212 -10.780 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -12.732 15.276 -9.431 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -11.279 16.155 -9.423 1.00 2.26 H new ATOM 877 N PRO A 126 -6.259 12.467 -7.234 1.00 0.51 N ATOM 878 CA PRO A 126 -5.071 12.229 -6.407 1.00 0.45 C ATOM 879 C PRO A 126 -5.436 11.817 -4.986 1.00 0.39 C ATOM 880 O PRO A 126 -6.313 12.415 -4.355 1.00 0.47 O ATOM 881 CB PRO A 126 -4.346 13.581 -6.400 1.00 0.51 C ATOM 882 CG PRO A 126 -5.322 14.556 -6.969 1.00 0.59 C ATOM 883 CD PRO A 126 -6.177 13.765 -7.913 1.00 0.60 C ATOM 0 HA PRO A 126 -4.463 11.414 -6.800 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -4.052 13.864 -5.389 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -3.436 13.542 -6.998 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.924 15.012 -6.183 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.810 15.366 -7.489 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -7.159 14.217 -8.050 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.724 13.681 -8.901 1.00 0.60 H new ATOM 891 N LEU A 127 -4.768 10.792 -4.491 1.00 0.32 N ATOM 892 CA LEU A 127 -5.083 10.243 -3.187 1.00 0.26 C ATOM 893 C LEU A 127 -4.480 11.098 -2.083 1.00 0.29 C ATOM 894 O LEU A 127 -3.389 11.649 -2.230 1.00 0.37 O ATOM 895 CB LEU A 127 -4.593 8.800 -3.095 1.00 0.24 C ATOM 896 CG LEU A 127 -5.066 7.884 -4.232 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.670 6.446 -3.957 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.572 7.997 -4.434 1.00 0.27 C ATOM 0 H LEU A 127 -4.002 10.322 -4.974 1.00 0.32 H new ATOM 0 HA LEU A 127 -6.165 10.248 -3.056 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.503 8.802 -3.079 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.925 8.379 -2.146 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.578 8.207 -5.152 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.014 5.811 -4.774 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.585 6.377 -3.875 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.126 6.115 -3.024 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -6.881 7.338 -5.245 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.085 7.708 -3.517 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.829 9.026 -4.685 1.00 0.27 H new ATOM 910 N LYS A 128 -5.201 11.203 -0.980 1.00 0.29 N ATOM 911 CA LYS A 128 -4.848 12.125 0.087 1.00 0.36 C ATOM 912 C LYS A 128 -4.202 11.421 1.273 1.00 0.26 C ATOM 913 O LYS A 128 -4.517 10.273 1.597 1.00 0.23 O ATOM 914 CB LYS A 128 -6.096 12.860 0.564 1.00 0.51 C ATOM 915 CG LYS A 128 -6.846 13.573 -0.545 1.00 1.10 C ATOM 916 CD LYS A 128 -8.053 14.317 -0.004 1.00 1.37 C ATOM 917 CE LYS A 128 -8.836 14.997 -1.113 1.00 1.80 C ATOM 918 NZ LYS A 128 -9.941 15.829 -0.570 1.00 2.27 N ATOM 0 H LYS A 128 -6.042 10.656 -0.799 1.00 0.29 H new ATOM 0 HA LYS A 128 -4.121 12.827 -0.321 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -6.766 12.146 1.043 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -5.810 13.588 1.323 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -6.178 14.274 -1.046 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -7.168 12.849 -1.293 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.703 13.620 0.526 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -7.726 15.063 0.721 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -8.165 15.622 -1.703 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -9.244 14.243 -1.786 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -10.593 16.084 -1.339 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -10.456 15.291 0.156 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -9.549 16.694 -0.147 1.00 2.27 H new ATOM 932 N ASP A 129 -3.290 12.128 1.914 1.00 0.32 N ATOM 933 CA ASP A 129 -2.678 11.668 3.148 1.00 0.39 C ATOM 934 C ASP A 129 -3.402 12.276 4.340 1.00 0.45 C ATOM 935 O ASP A 129 -4.096 13.283 4.205 1.00 0.51 O ATOM 936 CB ASP A 129 -1.198 12.053 3.204 1.00 0.59 C ATOM 937 CG ASP A 129 -0.989 13.549 3.343 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.695 14.011 4.466 1.00 1.56 O ATOM 939 OD2 ASP A 129 -1.122 14.269 2.330 1.00 1.88 O ATOM 0 H ASP A 129 -2.953 13.036 1.595 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.756 10.581 3.181 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.726 11.544 4.044 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.701 11.703 2.299 1.00 0.59 H new ATOM 944 N GLY A 130 -3.250 11.658 5.500 1.00 0.51 N ATOM 945 CA GLY A 130 -3.833 12.202 6.708 1.00 0.62 C ATOM 946 C GLY A 130 -4.777 11.235 7.383 1.00 0.60 C ATOM 947 O GLY A 130 -4.790 11.124 8.607 1.00 0.75 O ATOM 0 H GLY A 130 -2.733 10.788 5.627 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -3.037 12.471 7.402 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -4.370 13.120 6.467 1.00 0.62 H new ATOM 951 N ASN A 131 -5.566 10.525 6.591 1.00 0.47 N ATOM 952 CA ASN A 131 -6.442 9.500 7.130 1.00 0.46 C ATOM 953 C ASN A 131 -5.747 8.153 7.076 1.00 0.40 C ATOM 954 O ASN A 131 -5.590 7.571 6.005 1.00 0.46 O ATOM 955 CB ASN A 131 -7.762 9.421 6.355 1.00 0.51 C ATOM 956 CG ASN A 131 -8.724 10.557 6.661 1.00 1.32 C ATOM 957 OD1 ASN A 131 -9.941 10.364 6.643 1.00 2.28 O ATOM 958 ND2 ASN A 131 -8.202 11.745 6.927 1.00 1.45 N ATOM 0 H ASN A 131 -5.617 10.640 5.579 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.669 9.765 8.163 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.545 9.419 5.287 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.250 8.473 6.583 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -8.813 12.537 7.126 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -7.189 11.867 6.933 1.00 1.45 H new ATOM 965 N VAL A 132 -5.327 7.665 8.226 1.00 0.36 N ATOM 966 CA VAL A 132 -4.656 6.381 8.302 1.00 0.31 C ATOM 967 C VAL A 132 -5.478 5.402 9.130 1.00 0.28 C ATOM 968 O VAL A 132 -5.942 5.722 10.229 1.00 0.35 O ATOM 969 CB VAL A 132 -3.227 6.509 8.880 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.242 7.220 10.221 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.570 5.143 9.009 1.00 0.71 C ATOM 0 H VAL A 132 -5.438 8.138 9.123 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.564 5.999 7.285 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.640 7.108 8.184 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.224 7.296 10.604 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.659 8.220 10.098 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.853 6.656 10.925 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.566 5.259 9.418 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.162 4.516 9.675 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.510 4.674 8.027 1.00 0.71 H new ATOM 981 N ILE A 133 -5.675 4.222 8.577 1.00 0.23 N ATOM 982 CA ILE A 133 -6.474 3.193 9.214 1.00 0.26 C ATOM 983 C ILE A 133 -5.568 2.139 9.841 1.00 0.28 C ATOM 984 O ILE A 133 -5.743 1.751 10.996 1.00 0.38 O ATOM 985 CB ILE A 133 -7.402 2.519 8.183 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.167 3.572 7.372 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.369 1.568 8.868 1.00 0.38 C ATOM 988 CD1 ILE A 133 -9.074 4.459 8.202 1.00 0.35 C ATOM 0 H ILE A 133 -5.286 3.949 7.674 1.00 0.23 H new ATOM 0 HA ILE A 133 -7.080 3.660 9.991 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.782 1.941 7.497 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.449 4.199 6.844 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.766 3.066 6.615 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -9.014 1.104 8.121 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.808 0.795 9.394 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.980 2.122 9.581 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.577 5.175 7.552 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.818 3.845 8.710 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.480 4.996 8.942 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.589 1.703 9.060 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.626 0.690 9.474 1.00 0.30 C ATOM 1002 C GLU A 134 -2.249 1.113 8.986 1.00 0.23 C ATOM 1003 O GLU A 134 -2.153 1.861 8.013 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.986 -0.675 8.869 1.00 0.43 C ATOM 1005 CG GLU A 134 -5.309 -1.256 9.347 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.217 -1.881 10.726 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -4.896 -3.088 10.812 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -5.465 -1.178 11.727 1.00 1.42 O ATOM 0 H GLU A 134 -4.439 2.046 8.111 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.637 0.598 10.560 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -4.019 -0.578 7.784 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -3.190 -1.382 9.102 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -6.062 -0.468 9.361 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.648 -2.008 8.635 1.00 0.63 H new ATOM 1015 N LYS A 135 -1.193 0.654 9.640 1.00 0.28 N ATOM 1016 CA LYS A 135 0.161 0.995 9.212 1.00 0.25 C ATOM 1017 C LYS A 135 1.188 0.028 9.774 1.00 0.27 C ATOM 1018 O LYS A 135 0.924 -0.686 10.742 1.00 0.34 O ATOM 1019 CB LYS A 135 0.522 2.429 9.613 1.00 0.32 C ATOM 1020 CG LYS A 135 0.330 2.733 11.089 1.00 0.56 C ATOM 1021 CD LYS A 135 0.879 4.106 11.440 1.00 0.62 C ATOM 1022 CE LYS A 135 0.662 4.438 12.905 1.00 0.74 C ATOM 1023 NZ LYS A 135 1.245 5.757 13.265 1.00 1.53 N ATOM 0 H LYS A 135 -1.242 0.051 10.461 1.00 0.28 H new ATOM 0 HA LYS A 135 0.179 0.918 8.125 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.562 2.617 9.348 1.00 0.32 H new ATOM 0 HB3 LYS A 135 -0.086 3.121 9.030 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.730 2.687 11.338 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.831 1.973 11.688 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.944 4.141 11.213 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.396 4.861 10.820 1.00 0.62 H new ATOM 0 HE2 LYS A 135 -0.406 4.441 13.122 1.00 0.74 H new ATOM 0 HE3 LYS A 135 1.111 3.661 13.524 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 1.076 5.948 14.273 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 2.269 5.746 13.081 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 0.799 6.502 12.692 1.00 1.53 H new ATOM 1037 N GLY A 136 2.360 0.017 9.155 1.00 0.30 N ATOM 1038 CA GLY A 136 3.432 -0.853 9.589 1.00 0.38 C ATOM 1039 C GLY A 136 4.608 -0.805 8.641 1.00 0.34 C ATOM 1040 O GLY A 136 4.870 0.232 8.028 1.00 0.29 O ATOM 0 H GLY A 136 2.588 0.602 8.351 1.00 0.30 H new ATOM 0 HA2 GLY A 136 3.757 -0.560 10.587 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.064 -1.876 9.661 1.00 0.38 H new ATOM 1044 N PHE A 137 5.307 -1.922 8.501 1.00 0.38 N ATOM 1045 CA PHE A 137 6.447 -1.996 7.602 1.00 0.32 C ATOM 1046 C PHE A 137 6.249 -3.094 6.557 1.00 0.33 C ATOM 1047 O PHE A 137 5.481 -4.037 6.759 1.00 0.46 O ATOM 1048 CB PHE A 137 7.749 -2.205 8.391 1.00 0.42 C ATOM 1049 CG PHE A 137 7.716 -3.348 9.375 1.00 1.07 C ATOM 1050 CD1 PHE A 137 7.659 -3.099 10.738 1.00 2.05 C ATOM 1051 CD2 PHE A 137 7.756 -4.664 8.943 1.00 1.81 C ATOM 1052 CE1 PHE A 137 7.639 -4.140 11.648 1.00 2.86 C ATOM 1053 CE2 PHE A 137 7.735 -5.708 9.848 1.00 2.60 C ATOM 1054 CZ PHE A 137 7.678 -5.445 11.201 1.00 2.93 C ATOM 0 H PHE A 137 5.104 -2.789 8.999 1.00 0.38 H new ATOM 0 HA PHE A 137 6.526 -1.047 7.072 1.00 0.32 H new ATOM 0 HB2 PHE A 137 8.562 -2.375 7.685 1.00 0.42 H new ATOM 0 HB3 PHE A 137 7.982 -1.287 8.930 1.00 0.42 H new ATOM 0 HD1 PHE A 137 7.630 -2.079 11.093 1.00 2.05 H new ATOM 0 HD2 PHE A 137 7.804 -4.876 7.885 1.00 1.81 H new ATOM 0 HE1 PHE A 137 7.593 -3.932 12.707 1.00 2.86 H new ATOM 0 HE2 PHE A 137 7.763 -6.729 9.496 1.00 2.60 H new ATOM 0 HZ PHE A 137 7.664 -6.260 11.910 1.00 2.93 H new ATOM 1064 N VAL A 138 6.942 -2.950 5.434 1.00 0.27 N ATOM 1065 CA VAL A 138 6.764 -3.833 4.282 1.00 0.41 C ATOM 1066 C VAL A 138 7.559 -5.138 4.421 1.00 0.70 C ATOM 1067 O VAL A 138 7.459 -6.024 3.576 1.00 1.41 O ATOM 1068 CB VAL A 138 7.147 -3.105 2.962 1.00 0.53 C ATOM 1069 CG1 VAL A 138 6.883 -3.972 1.742 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.386 -1.793 2.833 1.00 0.48 C ATOM 0 H VAL A 138 7.642 -2.221 5.294 1.00 0.27 H new ATOM 0 HA VAL A 138 5.707 -4.097 4.247 1.00 0.41 H new ATOM 0 HB VAL A 138 8.217 -2.900 3.007 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.164 -3.427 0.841 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.472 -4.887 1.811 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.824 -4.225 1.698 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.668 -1.299 1.903 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.315 -1.993 2.827 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.630 -1.146 3.676 1.00 0.48 H new ATOM 1080 N SER A 139 8.340 -5.260 5.488 1.00 0.32 N ATOM 1081 CA SER A 139 9.172 -6.444 5.699 1.00 0.51 C ATOM 1082 C SER A 139 8.338 -7.722 5.879 1.00 0.39 C ATOM 1083 O SER A 139 8.058 -8.155 7.001 1.00 1.13 O ATOM 1084 CB SER A 139 10.083 -6.233 6.903 1.00 1.03 C ATOM 1085 OG SER A 139 10.898 -5.091 6.718 1.00 1.68 O ATOM 0 H SER A 139 8.416 -4.555 6.221 1.00 0.32 H new ATOM 0 HA SER A 139 9.776 -6.581 4.802 1.00 0.51 H new ATOM 0 HB2 SER A 139 9.482 -6.115 7.804 1.00 1.03 H new ATOM 0 HB3 SER A 139 10.709 -7.113 7.051 1.00 1.03 H new ATOM 0 HG SER A 139 11.832 -5.322 6.903 1.00 1.68 H new ATOM 1091 N ASN A 140 7.931 -8.291 4.755 1.00 0.51 N ATOM 1092 CA ASN A 140 7.284 -9.592 4.699 1.00 0.34 C ATOM 1093 C ASN A 140 7.669 -10.260 3.383 1.00 0.27 C ATOM 1094 O ASN A 140 7.071 -9.995 2.338 1.00 0.37 O ATOM 1095 CB ASN A 140 5.760 -9.450 4.806 1.00 0.37 C ATOM 1096 CG ASN A 140 5.022 -10.778 4.729 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.899 -10.844 4.227 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.631 -11.839 5.240 1.00 0.88 N ATOM 0 H ASN A 140 8.043 -7.854 3.840 1.00 0.51 H new ATOM 0 HA ASN A 140 7.613 -10.204 5.539 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.514 -8.960 5.748 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.406 -8.799 4.006 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.169 -12.748 5.226 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.561 -11.746 5.648 1.00 0.88 H new ATOM 1105 N GLN A 141 8.691 -11.098 3.440 1.00 0.35 N ATOM 1106 CA GLN A 141 9.269 -11.690 2.245 1.00 0.32 C ATOM 1107 C GLN A 141 8.461 -12.907 1.800 1.00 0.30 C ATOM 1108 O GLN A 141 8.701 -14.024 2.261 1.00 0.36 O ATOM 1109 CB GLN A 141 10.719 -12.105 2.514 1.00 0.39 C ATOM 1110 CG GLN A 141 11.542 -12.328 1.254 1.00 0.39 C ATOM 1111 CD GLN A 141 12.018 -11.028 0.632 1.00 0.52 C ATOM 1112 OE1 GLN A 141 13.105 -10.544 0.938 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.208 -10.446 -0.238 1.00 0.63 N ATOM 0 H GLN A 141 9.141 -11.385 4.309 1.00 0.35 H new ATOM 0 HA GLN A 141 9.247 -10.946 1.449 1.00 0.32 H new ATOM 0 HB2 GLN A 141 11.200 -11.336 3.119 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.720 -13.022 3.104 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.405 -12.950 1.493 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.945 -12.878 0.527 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.313 -10.877 -0.468 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.479 -9.567 -0.678 1.00 0.63 H new ATOM 1122 N ILE A 142 7.499 -12.686 0.914 1.00 0.25 N ATOM 1123 CA ILE A 142 6.697 -13.781 0.375 1.00 0.27 C ATOM 1124 C ILE A 142 7.401 -14.435 -0.810 1.00 0.30 C ATOM 1125 O ILE A 142 7.042 -15.531 -1.244 1.00 0.37 O ATOM 1126 CB ILE A 142 5.286 -13.315 -0.051 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.367 -12.203 -1.105 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.505 -12.843 1.164 1.00 0.29 C ATOM 1129 CD1 ILE A 142 4.033 -11.879 -1.743 1.00 0.26 C ATOM 0 H ILE A 142 7.254 -11.764 0.553 1.00 0.25 H new ATOM 0 HA ILE A 142 6.582 -14.511 1.176 1.00 0.27 H new ATOM 0 HB ILE A 142 4.765 -14.161 -0.499 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.768 -11.302 -0.641 1.00 0.24 H new ATOM 0 HG13 ILE A 142 6.070 -12.501 -1.883 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.512 -12.517 0.854 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.412 -13.662 1.877 1.00 0.29 H new ATOM 0 HG23 ILE A 142 5.030 -12.011 1.634 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.164 -11.085 -2.478 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.640 -12.768 -2.236 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.333 -11.550 -0.975 1.00 0.26 H new ATOM 1141 N GLY A 143 8.408 -13.750 -1.327 1.00 0.28 N ATOM 1142 CA GLY A 143 9.218 -14.292 -2.396 1.00 0.34 C ATOM 1143 C GLY A 143 10.570 -13.630 -2.411 1.00 0.40 C ATOM 1144 O GLY A 143 10.726 -12.585 -1.790 1.00 0.53 O ATOM 0 H GLY A 143 8.681 -12.816 -1.020 1.00 0.28 H new ATOM 0 HA2 GLY A 143 9.333 -15.368 -2.265 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.719 -14.139 -3.353 1.00 0.34 H new ATOM 1148 N ASP A 144 11.531 -14.216 -3.119 1.00 0.48 N ATOM 1149 CA ASP A 144 12.912 -13.713 -3.139 1.00 0.56 C ATOM 1150 C ASP A 144 12.968 -12.203 -3.343 1.00 0.48 C ATOM 1151 O ASP A 144 13.622 -11.482 -2.589 1.00 0.56 O ATOM 1152 CB ASP A 144 13.714 -14.405 -4.242 1.00 0.70 C ATOM 1153 CG ASP A 144 15.038 -13.717 -4.517 1.00 1.63 C ATOM 1154 OD1 ASP A 144 15.133 -12.980 -5.524 1.00 2.49 O ATOM 1155 OD2 ASP A 144 15.987 -13.905 -3.728 1.00 2.30 O ATOM 0 H ASP A 144 11.383 -15.046 -3.692 1.00 0.48 H new ATOM 0 HA ASP A 144 13.349 -13.939 -2.167 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.899 -15.441 -3.957 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.123 -14.427 -5.157 1.00 0.70 H new ATOM 1160 N SER A 145 12.269 -11.730 -4.354 1.00 0.38 N ATOM 1161 CA SER A 145 12.237 -10.316 -4.656 1.00 0.35 C ATOM 1162 C SER A 145 10.805 -9.799 -4.583 1.00 0.31 C ATOM 1163 O SER A 145 10.396 -8.952 -5.372 1.00 0.36 O ATOM 1164 CB SER A 145 12.843 -10.069 -6.040 1.00 0.38 C ATOM 1165 OG SER A 145 14.216 -10.439 -6.064 1.00 1.08 O ATOM 0 H SER A 145 11.713 -12.309 -4.983 1.00 0.38 H new ATOM 0 HA SER A 145 12.830 -9.773 -3.920 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.295 -10.640 -6.789 1.00 0.38 H new ATOM 0 HB3 SER A 145 12.741 -9.016 -6.304 1.00 0.38 H new ATOM 0 HG SER A 145 14.302 -11.393 -5.855 1.00 1.08 H new ATOM 1171 N LEU A 146 10.048 -10.310 -3.621 1.00 0.27 N ATOM 1172 CA LEU A 146 8.650 -9.945 -3.494 1.00 0.22 C ATOM 1173 C LEU A 146 8.280 -9.743 -2.027 1.00 0.21 C ATOM 1174 O LEU A 146 8.476 -10.636 -1.195 1.00 0.23 O ATOM 1175 CB LEU A 146 7.777 -11.035 -4.116 1.00 0.23 C ATOM 1176 CG LEU A 146 6.394 -10.589 -4.573 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.504 -9.610 -5.729 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.556 -11.790 -4.975 1.00 0.27 C ATOM 0 H LEU A 146 10.380 -10.975 -2.922 1.00 0.27 H new ATOM 0 HA LEU A 146 8.480 -9.006 -4.021 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.305 -11.454 -4.972 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.658 -11.839 -3.390 1.00 0.23 H new ATOM 0 HG LEU A 146 5.903 -10.085 -3.741 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.506 -9.303 -6.042 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.071 -8.735 -5.412 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.014 -10.089 -6.564 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.571 -11.454 -5.299 1.00 0.27 H new ATOM 0 HD22 LEU A 146 6.046 -12.318 -5.793 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.449 -12.460 -4.122 1.00 0.27 H new ATOM 1190 N TYR A 147 7.766 -8.565 -1.715 1.00 0.18 N ATOM 1191 CA TYR A 147 7.332 -8.239 -0.364 1.00 0.18 C ATOM 1192 C TYR A 147 5.826 -8.032 -0.335 1.00 0.16 C ATOM 1193 O TYR A 147 5.219 -7.748 -1.363 1.00 0.19 O ATOM 1194 CB TYR A 147 8.031 -6.976 0.143 1.00 0.19 C ATOM 1195 CG TYR A 147 9.467 -7.181 0.578 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.775 -7.417 1.910 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.511 -7.130 -0.336 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.080 -7.595 2.322 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.821 -7.310 0.068 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.098 -7.541 1.399 1.00 0.36 C ATOM 1201 OH TYR A 147 13.398 -7.721 1.808 1.00 0.43 O ATOM 0 H TYR A 147 7.637 -7.809 -2.388 1.00 0.18 H new ATOM 0 HA TYR A 147 7.598 -9.071 0.288 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.008 -6.223 -0.645 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.464 -6.576 0.984 1.00 0.19 H new ATOM 0 HD1 TYR A 147 8.979 -7.462 2.638 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.296 -6.947 -1.379 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.301 -7.776 3.364 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.623 -7.270 -0.655 1.00 1.10 H new ATOM 0 HH TYR A 147 13.665 -8.651 1.651 1.00 0.43 H new ATOM 1211 N LYS A 148 5.230 -8.163 0.836 1.00 0.17 N ATOM 1212 CA LYS A 148 3.787 -8.037 0.967 1.00 0.18 C ATOM 1213 C LYS A 148 3.406 -7.295 2.246 1.00 0.19 C ATOM 1214 O LYS A 148 4.087 -7.398 3.265 1.00 0.28 O ATOM 1215 CB LYS A 148 3.154 -9.430 0.952 1.00 0.26 C ATOM 1216 CG LYS A 148 1.635 -9.439 1.040 1.00 0.34 C ATOM 1217 CD LYS A 148 1.098 -10.855 0.930 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.406 -10.912 1.146 1.00 0.62 C ATOM 1219 NZ LYS A 148 -0.936 -12.287 0.967 1.00 0.84 N ATOM 0 H LYS A 148 5.720 -8.356 1.709 1.00 0.17 H new ATOM 0 HA LYS A 148 3.412 -7.454 0.126 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.454 -9.941 0.037 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.556 -10.006 1.785 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.318 -8.997 1.985 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.216 -8.823 0.244 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.339 -11.259 -0.054 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.594 -11.489 1.665 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.643 -10.559 2.150 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -0.900 -10.238 0.446 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -1.964 -12.286 1.122 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.732 -12.615 0.001 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.483 -12.925 1.652 1.00 0.84 H new ATOM 1233 N ILE A 149 2.331 -6.527 2.168 1.00 0.15 N ATOM 1234 CA ILE A 149 1.772 -5.849 3.326 1.00 0.18 C ATOM 1235 C ILE A 149 0.277 -6.103 3.400 1.00 0.22 C ATOM 1236 O ILE A 149 -0.386 -6.220 2.370 1.00 0.35 O ATOM 1237 CB ILE A 149 2.042 -4.328 3.295 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.619 -3.713 1.958 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.507 -4.061 3.559 1.00 0.19 C ATOM 1240 CD1 ILE A 149 1.844 -2.218 1.877 1.00 0.20 C ATOM 0 H ILE A 149 1.822 -6.356 1.301 1.00 0.15 H new ATOM 0 HA ILE A 149 2.263 -6.253 4.211 1.00 0.18 H new ATOM 0 HB ILE A 149 1.445 -3.860 4.077 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.172 -4.199 1.154 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.562 -3.922 1.790 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.691 -2.987 3.536 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.778 -4.454 4.539 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.110 -4.549 2.793 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.521 -1.854 0.902 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.270 -1.721 2.659 1.00 0.20 H new ATOM 0 HD13 ILE A 149 2.904 -2.002 2.012 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.244 -6.214 4.611 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.651 -6.529 4.812 1.00 0.27 C ATOM 1254 C GLU A 150 -2.244 -5.693 5.927 1.00 0.24 C ATOM 1255 O GLU A 150 -1.529 -5.200 6.799 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.823 -8.001 5.179 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.430 -8.974 4.088 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.637 -10.410 4.512 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -0.665 -11.042 4.977 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -2.775 -10.910 4.395 1.00 2.30 O ATOM 0 H GLU A 150 0.287 -6.090 5.473 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.167 -6.311 3.877 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -1.228 -8.212 6.067 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.865 -8.176 5.445 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -2.017 -8.772 3.192 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -0.384 -8.821 3.824 1.00 1.08 H new ATOM 1267 N THR A 151 -3.555 -5.538 5.889 1.00 0.21 N ATOM 1268 CA THR A 151 -4.286 -4.985 7.010 1.00 0.23 C ATOM 1269 C THR A 151 -4.579 -6.115 7.986 1.00 0.24 C ATOM 1270 O THR A 151 -5.000 -7.202 7.581 1.00 0.27 O ATOM 1271 CB THR A 151 -5.603 -4.318 6.554 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.517 -5.296 6.044 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.332 -3.285 5.476 1.00 0.29 C ATOM 0 H THR A 151 -4.136 -5.789 5.089 1.00 0.21 H new ATOM 0 HA THR A 151 -3.684 -4.212 7.487 1.00 0.23 H new ATOM 0 HB THR A 151 -6.045 -3.830 7.422 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.191 -5.501 6.726 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.271 -2.826 5.168 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.664 -2.517 5.867 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.865 -3.769 4.618 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.329 -5.877 9.265 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.471 -6.922 10.269 1.00 0.38 C ATOM 1283 C LYS A 152 -5.939 -7.271 10.476 1.00 0.39 C ATOM 1284 O LYS A 152 -6.277 -8.395 10.843 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.837 -6.489 11.592 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.856 -7.574 12.656 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.244 -7.089 13.956 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.293 -8.164 15.032 1.00 1.99 C ATOM 1289 NZ LYS A 152 -2.508 -9.367 14.651 1.00 2.42 N ATOM 0 H LYS A 152 -4.028 -4.974 9.631 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.951 -7.810 9.911 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.805 -6.187 11.410 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.364 -5.612 11.969 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.883 -7.893 12.833 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.308 -8.446 12.298 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.209 -6.792 13.784 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.776 -6.203 14.301 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -2.906 -7.759 15.967 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -4.329 -8.449 15.213 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -2.396 -9.985 15.480 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -3.007 -9.883 13.899 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -1.571 -9.075 14.308 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.808 -6.308 10.220 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.235 -6.512 10.384 1.00 0.43 C ATOM 1305 C LYS A 153 -8.950 -6.366 9.047 1.00 0.40 C ATOM 1306 O LYS A 153 -8.403 -5.792 8.098 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.802 -5.519 11.406 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.712 -4.060 10.978 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.238 -3.138 12.066 1.00 0.66 C ATOM 1310 CE LYS A 153 -9.207 -1.681 11.637 1.00 0.69 C ATOM 1311 NZ LYS A 153 -9.655 -0.777 12.728 1.00 1.29 N ATOM 0 H LYS A 153 -6.548 -5.376 9.897 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.400 -7.523 10.755 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.847 -5.766 11.595 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.270 -5.642 12.349 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.676 -3.807 10.752 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.284 -3.910 10.062 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.260 -3.420 12.319 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -8.640 -3.264 12.969 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -8.195 -1.412 11.334 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.847 -1.545 10.765 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -9.620 0.209 12.398 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -10.630 -1.017 13.000 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -9.029 -0.889 13.551 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.159 -6.906 8.974 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.975 -6.794 7.776 1.00 0.44 C ATOM 1327 C LYS A 154 -11.485 -5.370 7.637 1.00 0.53 C ATOM 1328 O LYS A 154 -11.943 -4.768 8.610 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.143 -7.782 7.822 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.702 -9.237 7.875 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.887 -10.187 7.831 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.432 -11.638 7.860 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.572 -12.587 7.761 1.00 1.41 N ATOM 0 H LYS A 154 -10.596 -7.427 9.734 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.363 -7.039 6.908 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.759 -7.565 8.695 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.771 -7.632 6.944 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -11.037 -9.446 7.037 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -11.130 -9.411 8.787 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.544 -9.992 8.679 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.469 -10.004 6.928 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.741 -11.817 7.037 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.884 -11.827 8.783 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -13.214 -13.563 7.785 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -14.220 -12.436 8.561 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -14.081 -12.426 6.868 1.00 1.41 H new ATOM 1347 N MET A 155 -11.398 -4.832 6.432 1.00 0.61 N ATOM 1348 CA MET A 155 -11.679 -3.427 6.211 1.00 0.76 C ATOM 1349 C MET A 155 -13.156 -3.179 5.927 1.00 0.62 C ATOM 1350 O MET A 155 -13.840 -4.011 5.327 1.00 0.57 O ATOM 1351 CB MET A 155 -10.816 -2.905 5.062 1.00 1.01 C ATOM 1352 CG MET A 155 -10.751 -1.390 5.002 1.00 1.22 C ATOM 1353 SD MET A 155 -10.348 -0.660 6.603 1.00 0.95 S ATOM 1354 CE MET A 155 -8.877 -1.585 7.050 1.00 0.80 C ATOM 0 H MET A 155 -11.135 -5.349 5.593 1.00 0.61 H new ATOM 0 HA MET A 155 -11.434 -2.886 7.125 1.00 0.76 H new ATOM 0 HB2 MET A 155 -9.806 -3.301 5.166 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.211 -3.283 4.119 1.00 1.01 H new ATOM 0 HG2 MET A 155 -10.003 -1.089 4.269 1.00 1.22 H new ATOM 0 HG3 MET A 155 -11.709 -1.000 4.658 1.00 1.22 H new ATOM 0 HE1 MET A 155 -8.182 -0.931 7.576 1.00 0.80 H new ATOM 0 HE2 MET A 155 -9.153 -2.417 7.698 1.00 0.80 H new ATOM 0 HE3 MET A 155 -8.401 -1.970 6.148 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.633 -2.033 6.395 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.007 -1.596 6.178 1.00 0.59 C ATOM 1366 C LYS A 156 -15.128 -0.922 4.806 1.00 0.44 C ATOM 1367 O LYS A 156 -14.114 -0.533 4.231 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.411 -0.629 7.302 1.00 0.72 C ATOM 1369 CG LYS A 156 -14.466 0.550 7.452 1.00 1.28 C ATOM 1370 CD LYS A 156 -14.890 1.472 8.580 1.00 1.79 C ATOM 1371 CE LYS A 156 -13.956 2.666 8.698 1.00 2.54 C ATOM 1372 NZ LYS A 156 -13.955 3.496 7.465 1.00 3.40 N ATOM 0 H LYS A 156 -13.074 -1.376 6.939 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.678 -2.455 6.194 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -16.417 -0.257 7.107 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -15.451 -1.175 8.244 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -13.456 0.185 7.641 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -14.433 1.110 6.518 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -15.908 1.820 8.405 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -14.899 0.920 9.520 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -14.257 3.279 9.548 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -12.944 2.316 8.900 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -13.428 4.376 7.639 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -13.502 2.968 6.692 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -14.934 3.725 7.200 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.356 -0.777 4.262 1.00 0.46 N ATOM 1387 CA PRO A 157 -16.578 -0.205 2.921 1.00 0.41 C ATOM 1388 C PRO A 157 -15.952 1.180 2.733 1.00 0.37 C ATOM 1389 O PRO A 157 -15.804 1.950 3.688 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.107 -0.110 2.805 1.00 0.52 C ATOM 1391 CG PRO A 157 -18.621 -0.280 4.192 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.629 -1.160 4.890 1.00 0.63 C ATOM 0 HA PRO A 157 -16.110 -0.826 2.157 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.410 0.851 2.389 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.499 -0.882 2.143 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -18.713 0.682 4.696 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.612 -0.734 4.189 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.619 -0.984 5.966 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -17.851 -2.217 4.742 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.588 1.481 1.492 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.019 2.767 1.160 1.00 0.33 C ATOM 1402 C GLY A 158 -13.845 2.636 0.212 1.00 0.27 C ATOM 1403 O GLY A 158 -13.482 1.525 -0.177 1.00 0.27 O ATOM 0 H GLY A 158 -15.680 0.844 0.701 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.784 3.396 0.706 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.695 3.267 2.073 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.254 3.759 -0.165 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.079 3.749 -1.025 1.00 0.26 C ATOM 1409 C ILE A 159 -10.816 3.775 -0.174 1.00 0.21 C ATOM 1410 O ILE A 159 -10.633 4.676 0.646 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.063 4.954 -1.993 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.371 5.023 -2.787 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -10.873 4.851 -2.938 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.515 6.279 -3.619 1.00 0.44 C ATOM 0 H ILE A 159 -13.568 4.689 0.111 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.116 2.836 -1.619 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.968 5.869 -1.408 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.433 4.155 -3.443 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.210 4.959 -2.094 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -10.871 5.705 -3.616 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -9.949 4.845 -2.360 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -10.946 3.930 -3.516 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.465 6.255 -4.152 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.486 7.152 -2.967 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -12.697 6.335 -4.338 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.962 2.780 -0.354 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.734 2.681 0.422 1.00 0.17 C ATOM 1428 C TYR A 160 -7.543 2.471 -0.496 1.00 0.16 C ATOM 1429 O TYR A 160 -7.697 2.038 -1.636 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.822 1.531 1.435 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.945 1.691 2.436 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.232 1.282 2.124 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.725 2.258 3.687 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -12.266 1.434 3.019 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.761 2.409 4.591 1.00 1.24 C ATOM 1436 CZ TYR A 160 -12.028 1.997 4.250 1.00 0.35 C ATOM 1437 OH TYR A 160 -13.066 2.142 5.140 1.00 0.43 O ATOM 0 H TYR A 160 -10.096 2.029 -1.031 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.601 3.616 0.967 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.957 0.593 0.897 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.876 1.457 1.971 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.427 0.836 1.160 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.731 2.585 3.956 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -13.262 1.112 2.755 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -10.576 2.848 5.560 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.918 2.107 4.657 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.364 2.797 0.010 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.122 2.614 -0.721 1.00 0.14 C ATOM 1449 C ALA A 161 -3.953 2.622 0.247 1.00 0.14 C ATOM 1450 O ALA A 161 -4.060 3.152 1.357 1.00 0.14 O ATOM 1451 CB ALA A 161 -4.947 3.707 -1.764 1.00 0.14 C ATOM 0 H ALA A 161 -6.242 3.196 0.941 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.156 1.654 -1.235 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.011 3.552 -2.300 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.778 3.674 -2.468 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -4.926 4.679 -1.272 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.845 2.037 -0.166 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.658 1.991 0.668 1.00 0.15 C ATOM 1459 C PHE A 162 -0.682 3.082 0.253 1.00 0.15 C ATOM 1460 O PHE A 162 -0.295 3.173 -0.912 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.973 0.624 0.570 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.787 -0.518 1.120 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.691 -0.873 2.457 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.637 -1.245 0.299 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.424 -1.930 2.963 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.374 -2.301 0.803 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.266 -2.644 2.136 1.00 0.24 C ATOM 0 H PHE A 162 -2.741 1.586 -1.075 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.965 2.154 1.701 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.743 0.420 -0.476 1.00 0.17 H new ATOM 0 HB3 PHE A 162 -0.023 0.668 1.103 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -1.036 -0.317 3.111 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.724 -0.983 -0.745 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -2.337 -2.197 4.006 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.034 -2.857 0.154 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.840 -3.470 2.530 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.306 3.919 1.206 1.00 0.16 N ATOM 1478 CA LYS A 163 0.676 4.960 0.959 1.00 0.18 C ATOM 1479 C LYS A 163 1.997 4.561 1.576 1.00 0.20 C ATOM 1480 O LYS A 163 2.189 4.695 2.787 1.00 0.23 O ATOM 1481 CB LYS A 163 0.228 6.308 1.545 1.00 0.23 C ATOM 1482 CG LYS A 163 1.211 7.451 1.270 1.00 0.31 C ATOM 1483 CD LYS A 163 0.758 8.752 1.928 1.00 0.45 C ATOM 1484 CE LYS A 163 1.784 9.871 1.762 1.00 0.74 C ATOM 1485 NZ LYS A 163 3.101 9.528 2.367 1.00 1.28 N ATOM 0 H LYS A 163 -0.667 3.897 2.160 1.00 0.16 H new ATOM 0 HA LYS A 163 0.781 5.076 -0.120 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.746 6.569 1.131 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.099 6.202 2.622 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.199 7.179 1.642 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.305 7.600 0.194 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.192 9.065 1.494 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.581 8.578 2.989 1.00 0.45 H new ATOM 0 HE2 LYS A 163 1.919 10.082 0.701 1.00 0.74 H new ATOM 0 HE3 LYS A 163 1.402 10.782 2.223 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.525 10.382 2.782 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 2.966 8.812 3.109 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 3.733 9.150 1.632 1.00 1.28 H new ATOM 1499 N VAL A 164 2.896 4.048 0.763 1.00 0.22 N ATOM 1500 CA VAL A 164 4.219 3.726 1.242 1.00 0.26 C ATOM 1501 C VAL A 164 5.123 4.923 0.983 1.00 0.33 C ATOM 1502 O VAL A 164 5.117 5.494 -0.109 1.00 0.34 O ATOM 1503 CB VAL A 164 4.783 2.424 0.601 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.737 1.319 0.630 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.272 2.645 -0.822 1.00 0.29 C ATOM 0 H VAL A 164 2.735 3.847 -0.224 1.00 0.22 H new ATOM 0 HA VAL A 164 4.173 3.523 2.312 1.00 0.26 H new ATOM 0 HB VAL A 164 5.644 2.122 1.198 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.148 0.417 0.178 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.455 1.112 1.662 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.857 1.636 0.070 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.656 1.708 -1.225 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.445 2.994 -1.441 1.00 0.29 H new ATOM 0 HG23 VAL A 164 6.066 3.392 -0.822 1.00 0.29 H new ATOM 1515 N TYR A 165 5.842 5.358 2.001 1.00 0.45 N ATOM 1516 CA TYR A 165 6.658 6.553 1.871 1.00 0.57 C ATOM 1517 C TYR A 165 8.121 6.247 2.107 1.00 0.70 C ATOM 1518 O TYR A 165 8.785 6.888 2.926 1.00 1.67 O ATOM 1519 CB TYR A 165 6.166 7.678 2.791 1.00 0.62 C ATOM 1520 CG TYR A 165 5.627 7.213 4.123 1.00 0.63 C ATOM 1521 CD1 TYR A 165 6.461 7.029 5.215 1.00 1.30 C ATOM 1522 CD2 TYR A 165 4.270 6.967 4.285 1.00 1.38 C ATOM 1523 CE1 TYR A 165 5.959 6.609 6.431 1.00 1.31 C ATOM 1524 CE2 TYR A 165 3.762 6.548 5.495 1.00 1.45 C ATOM 1525 CZ TYR A 165 4.609 6.370 6.565 1.00 0.79 C ATOM 1526 OH TYR A 165 4.104 5.945 7.774 1.00 0.93 O ATOM 0 H TYR A 165 5.879 4.909 2.916 1.00 0.45 H new ATOM 0 HA TYR A 165 6.555 6.907 0.845 1.00 0.57 H new ATOM 0 HB2 TYR A 165 6.989 8.370 2.969 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.386 8.237 2.274 1.00 0.62 H new ATOM 0 HD1 TYR A 165 7.520 7.217 5.113 1.00 1.30 H new ATOM 0 HD2 TYR A 165 3.602 7.107 3.448 1.00 1.38 H new ATOM 0 HE1 TYR A 165 6.621 6.469 7.272 1.00 1.31 H new ATOM 0 HE2 TYR A 165 2.704 6.360 5.603 1.00 1.45 H new ATOM 0 HH TYR A 165 3.447 6.595 8.101 1.00 0.93 H new ATOM 1536 N LYS A 166 8.609 5.251 1.369 1.00 0.48 N ATOM 1537 CA LYS A 166 10.024 4.905 1.355 1.00 0.49 C ATOM 1538 C LYS A 166 10.458 4.350 2.725 1.00 0.46 C ATOM 1539 O LYS A 166 9.643 4.274 3.647 1.00 0.55 O ATOM 1540 CB LYS A 166 10.844 6.142 0.926 1.00 0.57 C ATOM 1541 CG LYS A 166 10.389 6.745 -0.405 1.00 0.71 C ATOM 1542 CD LYS A 166 10.502 5.754 -1.559 1.00 0.94 C ATOM 1543 CE LYS A 166 11.843 5.854 -2.274 1.00 1.35 C ATOM 1544 NZ LYS A 166 11.828 6.907 -3.326 1.00 1.53 N ATOM 0 H LYS A 166 8.033 4.664 0.766 1.00 0.48 H new ATOM 0 HA LYS A 166 10.210 4.113 0.629 1.00 0.49 H new ATOM 0 HB2 LYS A 166 10.773 6.903 1.703 1.00 0.57 H new ATOM 0 HB3 LYS A 166 11.895 5.862 0.849 1.00 0.57 H new ATOM 0 HG2 LYS A 166 9.355 7.079 -0.316 1.00 0.71 H new ATOM 0 HG3 LYS A 166 10.990 7.627 -0.626 1.00 0.71 H new ATOM 0 HD2 LYS A 166 10.369 4.741 -1.180 1.00 0.94 H new ATOM 0 HD3 LYS A 166 9.698 5.936 -2.272 1.00 0.94 H new ATOM 0 HE2 LYS A 166 12.626 6.075 -1.549 1.00 1.35 H new ATOM 0 HE3 LYS A 166 12.088 4.892 -2.725 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 12.739 7.408 -3.328 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 11.673 6.467 -4.255 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 11.062 7.582 -3.130 1.00 1.53 H new ATOM 1558 N PRO A 167 11.718 3.898 2.878 1.00 0.44 N ATOM 1559 CA PRO A 167 12.205 3.363 4.159 1.00 0.47 C ATOM 1560 C PRO A 167 12.078 4.363 5.300 1.00 0.47 C ATOM 1561 O PRO A 167 12.346 5.552 5.129 1.00 0.50 O ATOM 1562 CB PRO A 167 13.680 3.064 3.882 1.00 0.58 C ATOM 1563 CG PRO A 167 13.748 2.874 2.410 1.00 0.60 C ATOM 1564 CD PRO A 167 12.761 3.839 1.836 1.00 0.49 C ATOM 0 HA PRO A 167 11.627 2.495 4.477 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.320 3.885 4.207 1.00 0.58 H new ATOM 0 HB3 PRO A 167 14.011 2.172 4.414 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.752 3.071 2.035 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.500 1.849 2.135 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.209 4.816 1.656 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.362 3.491 0.883 1.00 0.49 H new ATOM 1572 N ALA A 168 11.645 3.882 6.458 1.00 0.53 N ATOM 1573 CA ALA A 168 11.584 4.717 7.645 1.00 0.64 C ATOM 1574 C ALA A 168 12.994 5.137 8.044 1.00 0.71 C ATOM 1575 O ALA A 168 13.831 4.293 8.371 1.00 0.76 O ATOM 1576 CB ALA A 168 10.898 3.981 8.788 1.00 0.72 C ATOM 0 H ALA A 168 11.332 2.921 6.598 1.00 0.53 H new ATOM 0 HA ALA A 168 10.996 5.608 7.423 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.863 4.625 9.667 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.883 3.715 8.493 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.456 3.075 9.024 1.00 0.72 H new ATOM 1582 N GLY A 169 13.258 6.435 8.006 1.00 0.82 N ATOM 1583 CA GLY A 169 14.607 6.923 8.228 1.00 0.95 C ATOM 1584 C GLY A 169 15.206 7.519 6.967 1.00 0.96 C ATOM 1585 O GLY A 169 16.321 8.042 6.984 1.00 1.14 O ATOM 0 H GLY A 169 12.564 7.160 7.826 1.00 0.82 H new ATOM 0 HA2 GLY A 169 14.596 7.676 9.016 1.00 0.95 H new ATOM 0 HA3 GLY A 169 15.236 6.105 8.578 1.00 0.95 H new ATOM 1589 N TYR A 170 14.473 7.417 5.866 1.00 0.80 N ATOM 1590 CA TYR A 170 14.876 8.042 4.614 1.00 0.82 C ATOM 1591 C TYR A 170 14.436 9.507 4.621 1.00 0.86 C ATOM 1592 O TYR A 170 13.270 9.798 4.896 1.00 0.89 O ATOM 1593 CB TYR A 170 14.237 7.294 3.434 1.00 0.83 C ATOM 1594 CG TYR A 170 14.720 7.738 2.065 1.00 0.91 C ATOM 1595 CD1 TYR A 170 15.822 7.138 1.462 1.00 1.15 C ATOM 1596 CD2 TYR A 170 14.064 8.747 1.369 1.00 1.74 C ATOM 1597 CE1 TYR A 170 16.252 7.533 0.208 1.00 1.21 C ATOM 1598 CE2 TYR A 170 14.490 9.148 0.118 1.00 1.82 C ATOM 1599 CZ TYR A 170 15.584 8.538 -0.458 1.00 1.11 C ATOM 1600 OH TYR A 170 16.008 8.930 -1.708 1.00 1.24 O ATOM 0 H TYR A 170 13.592 6.905 5.815 1.00 0.80 H new ATOM 0 HA TYR A 170 15.960 7.996 4.508 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.436 6.228 3.546 1.00 0.83 H new ATOM 0 HB3 TYR A 170 13.156 7.423 3.482 1.00 0.83 H new ATOM 0 HD1 TYR A 170 16.350 6.352 1.981 1.00 1.15 H new ATOM 0 HD2 TYR A 170 13.205 9.226 1.815 1.00 1.74 H new ATOM 0 HE1 TYR A 170 17.107 7.056 -0.247 1.00 1.21 H new ATOM 0 HE2 TYR A 170 13.969 9.935 -0.406 1.00 1.82 H new ATOM 0 HH TYR A 170 15.429 9.648 -2.040 1.00 1.24 H new ATOM 1610 N PRO A 171 15.364 10.448 4.353 1.00 0.97 N ATOM 1611 CA PRO A 171 15.060 11.887 4.355 1.00 1.10 C ATOM 1612 C PRO A 171 13.900 12.245 3.424 1.00 1.07 C ATOM 1613 O PRO A 171 13.752 11.658 2.349 1.00 1.05 O ATOM 1614 CB PRO A 171 16.362 12.543 3.868 1.00 1.25 C ATOM 1615 CG PRO A 171 17.181 11.435 3.297 1.00 1.31 C ATOM 1616 CD PRO A 171 16.778 10.194 4.037 1.00 1.07 C ATOM 0 HA PRO A 171 14.745 12.225 5.342 1.00 1.10 H new ATOM 0 HB2 PRO A 171 16.159 13.307 3.118 1.00 1.25 H new ATOM 0 HB3 PRO A 171 16.885 13.034 4.689 1.00 1.25 H new ATOM 0 HG2 PRO A 171 16.999 11.327 2.228 1.00 1.31 H new ATOM 0 HG3 PRO A 171 18.246 11.634 3.421 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.902 9.300 3.425 1.00 1.07 H new ATOM 0 HD3 PRO A 171 17.374 10.049 4.938 1.00 1.07 H new ATOM 1624 N ALA A 172 13.091 13.219 3.833 1.00 1.22 N ATOM 1625 CA ALA A 172 11.888 13.583 3.088 1.00 1.31 C ATOM 1626 C ALA A 172 12.222 14.432 1.862 1.00 1.40 C ATOM 1627 O ALA A 172 12.004 15.645 1.852 1.00 1.67 O ATOM 1628 CB ALA A 172 10.906 14.312 3.992 1.00 1.60 C ATOM 0 H ALA A 172 13.246 13.771 4.677 1.00 1.22 H new ATOM 0 HA ALA A 172 11.424 12.662 2.734 1.00 1.31 H new ATOM 0 HB1 ALA A 172 10.015 14.577 3.423 1.00 1.60 H new ATOM 0 HB2 ALA A 172 10.627 13.664 4.823 1.00 1.60 H new ATOM 0 HB3 ALA A 172 11.372 15.218 4.379 1.00 1.60 H new ATOM 1634 N ASN A 173 12.757 13.778 0.840 1.00 1.38 N ATOM 1635 CA ASN A 173 13.092 14.426 -0.424 1.00 1.53 C ATOM 1636 C ASN A 173 13.479 13.371 -1.448 1.00 1.91 C ATOM 1637 O ASN A 173 14.093 12.359 -1.098 1.00 2.60 O ATOM 1638 CB ASN A 173 14.249 15.415 -0.236 1.00 1.89 C ATOM 1639 CG ASN A 173 14.668 16.085 -1.534 1.00 2.51 C ATOM 1640 OD1 ASN A 173 15.552 15.600 -2.241 1.00 2.97 O ATOM 1641 ND2 ASN A 173 14.033 17.199 -1.857 1.00 3.18 N ATOM 0 H ASN A 173 12.972 12.781 0.863 1.00 1.38 H new ATOM 0 HA ASN A 173 12.220 14.977 -0.776 1.00 1.53 H new ATOM 0 HB2 ASN A 173 13.954 16.179 0.483 1.00 1.89 H new ATOM 0 HB3 ASN A 173 15.104 14.890 0.189 1.00 1.89 H new ATOM 0 HD21 ASN A 173 14.270 17.689 -2.720 1.00 3.18 H new ATOM 0 HD22 ASN A 173 13.306 17.568 -1.244 1.00 3.18 H new ATOM 1648 N GLY A 174 13.115 13.589 -2.703 1.00 2.02 N ATOM 1649 CA GLY A 174 13.501 12.659 -3.745 1.00 2.69 C ATOM 1650 C GLY A 174 12.415 11.655 -4.061 1.00 2.26 C ATOM 1651 O GLY A 174 12.711 10.494 -4.339 1.00 2.93 O ATOM 0 H GLY A 174 12.563 14.387 -3.018 1.00 2.02 H new ATOM 0 HA2 GLY A 174 13.751 13.215 -4.649 1.00 2.69 H new ATOM 0 HA3 GLY A 174 14.402 12.129 -3.438 1.00 2.69 H new ATOM 1655 N SER A 175 11.159 12.099 -3.983 1.00 1.44 N ATOM 1656 CA SER A 175 9.998 11.244 -4.231 1.00 1.23 C ATOM 1657 C SER A 175 9.816 10.251 -3.091 1.00 0.94 C ATOM 1658 O SER A 175 10.402 9.168 -3.088 1.00 1.36 O ATOM 1659 CB SER A 175 10.124 10.508 -5.571 1.00 1.79 C ATOM 1660 OG SER A 175 10.263 11.424 -6.646 1.00 2.26 O ATOM 0 H SER A 175 10.919 13.062 -3.746 1.00 1.44 H new ATOM 0 HA SER A 175 9.116 11.883 -4.283 1.00 1.23 H new ATOM 0 HB2 SER A 175 10.986 9.841 -5.544 1.00 1.79 H new ATOM 0 HB3 SER A 175 9.244 9.885 -5.731 1.00 1.79 H new ATOM 0 HG SER A 175 10.343 10.930 -7.489 1.00 2.26 H new ATOM 1666 N THR A 176 9.017 10.632 -2.110 1.00 0.64 N ATOM 1667 CA THR A 176 8.822 9.802 -0.941 1.00 0.90 C ATOM 1668 C THR A 176 7.509 9.028 -0.982 1.00 0.80 C ATOM 1669 O THR A 176 7.446 7.896 -0.516 1.00 1.05 O ATOM 1670 CB THR A 176 8.894 10.640 0.343 1.00 1.30 C ATOM 1671 OG1 THR A 176 8.273 11.915 0.129 1.00 1.49 O ATOM 1672 CG2 THR A 176 10.338 10.833 0.779 1.00 1.76 C ATOM 0 H THR A 176 8.495 11.509 -2.102 1.00 0.64 H new ATOM 0 HA THR A 176 9.632 9.073 -0.943 1.00 0.90 H new ATOM 0 HB THR A 176 8.363 10.109 1.133 1.00 1.30 H new ATOM 0 HG1 THR A 176 8.321 12.444 0.952 1.00 1.49 H new ATOM 0 HG21 THR A 176 10.366 11.430 1.691 1.00 1.76 H new ATOM 0 HG22 THR A 176 10.794 9.861 0.967 1.00 1.76 H new ATOM 0 HG23 THR A 176 10.890 11.347 -0.008 1.00 1.76 H new ATOM 1680 N PHE A 177 6.470 9.607 -1.564 1.00 0.52 N ATOM 1681 CA PHE A 177 5.158 8.972 -1.518 1.00 0.45 C ATOM 1682 C PHE A 177 4.923 8.092 -2.740 1.00 0.41 C ATOM 1683 O PHE A 177 5.193 8.489 -3.874 1.00 0.50 O ATOM 1684 CB PHE A 177 4.028 10.012 -1.381 1.00 0.49 C ATOM 1685 CG PHE A 177 3.931 11.005 -2.515 1.00 0.55 C ATOM 1686 CD1 PHE A 177 3.092 10.762 -3.594 1.00 1.37 C ATOM 1687 CD2 PHE A 177 4.664 12.183 -2.496 1.00 1.31 C ATOM 1688 CE1 PHE A 177 2.990 11.670 -4.630 1.00 1.46 C ATOM 1689 CE2 PHE A 177 4.566 13.092 -3.532 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.728 12.836 -4.600 1.00 0.86 C ATOM 0 H PHE A 177 6.504 10.496 -2.064 1.00 0.52 H new ATOM 0 HA PHE A 177 5.143 8.338 -0.632 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.078 9.484 -1.298 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.171 10.560 -0.450 1.00 0.49 H new ATOM 0 HD1 PHE A 177 2.512 9.852 -3.624 1.00 1.37 H new ATOM 0 HD2 PHE A 177 5.318 12.392 -1.662 1.00 1.31 H new ATOM 0 HE1 PHE A 177 2.333 11.468 -5.463 1.00 1.46 H new ATOM 0 HE2 PHE A 177 5.145 14.003 -3.507 1.00 1.38 H new ATOM 0 HZ PHE A 177 3.650 13.547 -5.410 1.00 0.86 H new ATOM 1700 N GLU A 178 4.447 6.882 -2.490 1.00 0.34 N ATOM 1701 CA GLU A 178 4.072 5.960 -3.542 1.00 0.32 C ATOM 1702 C GLU A 178 2.740 5.313 -3.177 1.00 0.28 C ATOM 1703 O GLU A 178 2.626 4.644 -2.146 1.00 0.28 O ATOM 1704 CB GLU A 178 5.160 4.897 -3.729 1.00 0.37 C ATOM 1705 CG GLU A 178 4.918 3.962 -4.902 1.00 0.40 C ATOM 1706 CD GLU A 178 4.825 4.695 -6.223 1.00 1.20 C ATOM 1707 OE1 GLU A 178 5.848 5.244 -6.683 1.00 1.91 O ATOM 1708 OE2 GLU A 178 3.730 4.716 -6.816 1.00 1.96 O ATOM 0 H GLU A 178 4.311 6.514 -1.548 1.00 0.34 H new ATOM 0 HA GLU A 178 3.965 6.497 -4.484 1.00 0.32 H new ATOM 0 HB2 GLU A 178 6.120 5.395 -3.867 1.00 0.37 H new ATOM 0 HB3 GLU A 178 5.236 4.306 -2.816 1.00 0.37 H new ATOM 0 HG2 GLU A 178 5.726 3.232 -4.952 1.00 0.40 H new ATOM 0 HG3 GLU A 178 3.996 3.406 -4.734 1.00 0.40 H new ATOM 1715 N TRP A 179 1.731 5.545 -3.999 1.00 0.28 N ATOM 1716 CA TRP A 179 0.396 5.033 -3.731 1.00 0.26 C ATOM 1717 C TRP A 179 0.164 3.699 -4.417 1.00 0.27 C ATOM 1718 O TRP A 179 0.792 3.383 -5.427 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.671 6.021 -4.212 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.808 7.244 -3.359 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.323 8.493 -3.621 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.493 7.334 -2.104 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.675 9.355 -2.613 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.389 8.669 -1.672 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.190 6.421 -1.306 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.954 9.113 -0.482 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.748 6.862 -0.124 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.628 8.199 0.278 1.00 0.24 C ATOM 0 H TRP A 179 1.810 6.086 -4.860 1.00 0.28 H new ATOM 0 HA TRP A 179 0.319 4.899 -2.652 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.433 6.328 -5.230 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.633 5.509 -4.250 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.253 8.763 -4.494 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.441 10.347 -2.573 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.290 5.389 -1.610 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.864 10.143 -0.170 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.286 6.165 0.502 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -3.078 8.514 1.208 1.00 0.24 H new ATOM 1739 N SER A 180 -0.733 2.916 -3.844 1.00 0.23 N ATOM 1740 CA SER A 180 -1.232 1.721 -4.493 1.00 0.28 C ATOM 1741 C SER A 180 -2.521 2.071 -5.231 1.00 0.28 C ATOM 1742 O SER A 180 -3.014 3.196 -5.109 1.00 0.36 O ATOM 1743 CB SER A 180 -1.496 0.637 -3.449 1.00 0.33 C ATOM 1744 OG SER A 180 -0.492 0.647 -2.453 1.00 1.06 O ATOM 0 H SER A 180 -1.133 3.091 -2.922 1.00 0.23 H new ATOM 0 HA SER A 180 -0.495 1.343 -5.202 1.00 0.28 H new ATOM 0 HB2 SER A 180 -2.472 0.797 -2.990 1.00 0.33 H new ATOM 0 HB3 SER A 180 -1.527 -0.340 -3.932 1.00 0.33 H new ATOM 0 HG SER A 180 -0.525 1.495 -1.964 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.061 1.132 -5.994 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.340 1.353 -6.655 1.00 0.38 C ATOM 1752 C GLU A 181 -5.427 1.557 -5.603 1.00 0.34 C ATOM 1753 O GLU A 181 -5.430 0.884 -4.576 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.702 0.164 -7.546 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.765 -0.032 -8.729 1.00 0.74 C ATOM 1756 CD GLU A 181 -3.799 1.134 -9.693 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -2.832 1.920 -9.719 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -4.794 1.269 -10.433 1.00 1.91 O ATOM 0 H GLU A 181 -2.640 0.220 -6.170 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.261 2.242 -7.281 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.702 -0.743 -6.941 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.717 0.298 -7.919 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -2.747 -0.168 -8.364 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -4.039 -0.945 -9.258 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.357 2.492 -5.818 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.430 2.726 -4.868 1.00 0.26 C ATOM 1767 C PRO A 182 -8.527 1.678 -5.010 1.00 0.28 C ATOM 1768 O PRO A 182 -9.225 1.632 -6.025 1.00 0.32 O ATOM 1769 CB PRO A 182 -7.963 4.121 -5.236 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.193 4.572 -6.442 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.450 3.380 -6.980 1.00 0.39 C ATOM 0 HA PRO A 182 -7.087 2.665 -3.835 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.031 4.083 -5.451 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.829 4.817 -4.408 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -7.867 4.976 -7.197 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -6.498 5.368 -6.177 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.986 2.910 -7.804 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.465 3.656 -7.356 1.00 0.39 H new ATOM 1779 N MET A 183 -8.672 0.835 -4.000 1.00 0.28 N ATOM 1780 CA MET A 183 -9.703 -0.187 -4.013 1.00 0.30 C ATOM 1781 C MET A 183 -10.915 0.286 -3.239 1.00 0.26 C ATOM 1782 O MET A 183 -10.796 0.803 -2.128 1.00 0.25 O ATOM 1783 CB MET A 183 -9.205 -1.527 -3.453 1.00 0.34 C ATOM 1784 CG MET A 183 -8.490 -1.438 -2.115 1.00 0.29 C ATOM 1785 SD MET A 183 -6.792 -0.858 -2.284 1.00 0.31 S ATOM 1786 CE MET A 183 -6.245 -0.891 -0.585 1.00 0.27 C ATOM 0 H MET A 183 -8.089 0.839 -3.163 1.00 0.28 H new ATOM 0 HA MET A 183 -9.978 -0.356 -5.054 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.057 -2.199 -3.349 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.530 -1.979 -4.180 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.038 -0.764 -1.457 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.491 -2.419 -1.639 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.247 -0.457 -0.515 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.935 -0.314 0.031 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.218 -1.922 -0.231 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.075 0.116 -3.837 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.308 0.568 -3.238 1.00 0.29 C ATOM 1798 C ARG A 184 -14.118 -0.620 -2.762 1.00 0.31 C ATOM 1799 O ARG A 184 -14.729 -1.333 -3.562 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.110 1.385 -4.246 1.00 0.35 C ATOM 1801 CG ARG A 184 -15.306 2.103 -3.646 1.00 1.17 C ATOM 1802 CD ARG A 184 -16.138 2.765 -4.729 1.00 1.16 C ATOM 1803 NE ARG A 184 -15.309 3.502 -5.683 1.00 1.88 N ATOM 1804 CZ ARG A 184 -15.794 4.205 -6.705 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -17.105 4.310 -6.882 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -14.961 4.800 -7.550 1.00 3.32 N ATOM 0 H ARG A 184 -12.188 -0.336 -4.745 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.076 1.200 -2.381 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -13.452 2.121 -4.708 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.457 0.724 -5.040 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -15.921 1.394 -3.092 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -14.965 2.854 -2.934 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -16.713 2.006 -5.259 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -16.855 3.446 -4.270 1.00 1.16 H new ATOM 0 HE ARG A 184 -14.297 3.476 -5.558 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -17.745 3.851 -6.234 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -17.472 4.849 -7.666 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -13.953 4.718 -7.415 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -15.329 5.339 -8.334 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.105 -0.836 -1.462 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.840 -1.933 -0.872 1.00 0.32 C ATOM 1822 C LEU A 185 -16.266 -1.499 -0.609 1.00 0.36 C ATOM 1823 O LEU A 185 -16.515 -0.359 -0.225 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.201 -2.384 0.442 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.704 -2.682 0.391 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.249 -3.229 1.731 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.373 -3.658 -0.729 1.00 0.74 C ATOM 0 H LEU A 185 -13.591 -0.263 -0.793 1.00 0.28 H new ATOM 0 HA LEU A 185 -14.822 -2.770 -1.570 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.372 -1.610 1.190 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.718 -3.280 0.786 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.172 -1.754 0.183 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.181 -3.441 1.693 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.445 -2.493 2.510 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.794 -4.147 1.953 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.300 -3.850 -0.739 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -12.907 -4.594 -0.566 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.674 -3.230 -1.685 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.194 -2.394 -0.837 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.582 -2.134 -0.537 1.00 0.77 C ATOM 1841 C ALA A 186 -19.134 -3.229 0.361 1.00 1.02 C ATOM 1842 O ALA A 186 -18.513 -4.281 0.516 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.385 -2.039 -1.825 1.00 1.00 C ATOM 0 H ALA A 186 -17.013 -3.317 -1.233 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.662 -1.183 -0.011 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.431 -1.843 -1.588 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.994 -1.228 -2.439 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.307 -2.978 -2.372 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.272 -2.966 0.978 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.001 -3.988 1.708 1.00 1.11 C ATOM 1851 C LYS A 187 -22.454 -3.987 1.264 1.00 1.49 C ATOM 1852 O LYS A 187 -23.283 -3.239 1.787 1.00 1.61 O ATOM 1853 CB LYS A 187 -20.894 -3.790 3.223 1.00 1.11 C ATOM 1854 CG LYS A 187 -19.567 -4.258 3.797 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.587 -4.263 5.315 1.00 1.45 C ATOM 1856 CE LYS A 187 -18.309 -4.858 5.887 1.00 1.82 C ATOM 1857 NZ LYS A 187 -18.353 -4.961 7.371 1.00 2.78 N ATOM 0 H LYS A 187 -20.714 -2.047 0.988 1.00 0.89 H new ATOM 0 HA LYS A 187 -20.554 -4.956 1.482 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -21.030 -2.734 3.455 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -21.704 -4.331 3.711 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -19.345 -5.261 3.432 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -18.767 -3.606 3.445 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -19.711 -3.244 5.682 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -20.445 -4.835 5.667 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.148 -5.848 5.460 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -17.460 -4.242 5.592 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -17.462 -5.371 7.717 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -18.480 -4.014 7.781 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -19.147 -5.570 7.653 1.00 2.78 H new ATOM 1871 N CYS A 188 -22.742 -4.815 0.278 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.066 -4.893 -0.308 1.00 2.29 C ATOM 1873 C CYS A 188 -24.535 -6.338 -0.309 1.00 2.51 C ATOM 1874 O CYS A 188 -23.855 -7.213 -0.852 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.035 -4.357 -1.743 1.00 2.71 C ATOM 1876 SG CYS A 188 -23.266 -2.730 -1.914 1.00 3.14 S ATOM 0 H CYS A 188 -22.064 -5.453 -0.139 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.756 -4.288 0.281 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -23.498 -5.067 -2.372 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.056 -4.305 -2.121 1.00 2.71 H new ATOM 0 HG CYS A 188 -23.288 -2.369 -3.163 1.00 3.14 H new ATOM 1882 N ASP A 189 -25.681 -6.597 0.303 1.00 2.70 N ATOM 1883 CA ASP A 189 -26.225 -7.948 0.330 1.00 3.08 C ATOM 1884 C ASP A 189 -26.833 -8.280 -1.019 1.00 3.61 C ATOM 1885 O ASP A 189 -28.031 -8.104 -1.248 1.00 3.87 O ATOM 1886 CB ASP A 189 -27.260 -8.115 1.444 1.00 3.12 C ATOM 1887 CG ASP A 189 -26.663 -7.881 2.814 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -26.968 -6.838 3.428 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -25.868 -8.728 3.277 1.00 4.05 O ATOM 0 H ASP A 189 -26.248 -5.898 0.783 1.00 2.70 H new ATOM 0 HA ASP A 189 -25.410 -8.642 0.538 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -28.081 -7.417 1.283 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -27.682 -9.119 1.399 1.00 3.12 H new ATOM 1894 N GLU A 190 -25.982 -8.739 -1.912 1.00 3.97 N ATOM 1895 CA GLU A 190 -26.366 -9.050 -3.268 1.00 4.63 C ATOM 1896 C GLU A 190 -25.482 -10.172 -3.788 1.00 5.25 C ATOM 1897 O GLU A 190 -24.347 -9.884 -4.222 1.00 5.64 O ATOM 1898 CB GLU A 190 -26.230 -7.802 -4.144 1.00 4.83 C ATOM 1899 CG GLU A 190 -26.545 -8.036 -5.610 1.00 5.57 C ATOM 1900 CD GLU A 190 -26.342 -6.790 -6.443 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -27.338 -6.105 -6.745 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -25.180 -6.483 -6.788 1.00 6.43 O ATOM 1903 OXT GLU A 190 -25.915 -11.339 -3.727 1.00 5.62 O ATOM 0 H GLU A 190 -24.996 -8.907 -1.713 1.00 3.97 H new ATOM 0 HA GLU A 190 -27.406 -9.375 -3.296 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -26.894 -7.028 -3.760 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -25.213 -7.420 -4.059 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -25.910 -8.835 -5.993 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -27.577 -8.373 -5.709 1.00 5.57 H new TER 1910 GLU A 190