USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1136 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 114 SER OG : rot -70:sc= 1.12 USER MOD Set 1.2: A 119 MET CE :methyl -137:sc= -4.94! (180deg=-9.8!) USER MOD Set 2.1: A 80 TYR OH : rot -123:sc= 1.24 USER MOD Set 2.2: A 137 HIS : no HE2:sc= 0.0159 X(o=1.3,f=0.78) USER MOD Set 3.1: A 19 GLN : amide:sc= 0 K(o=-0.026,f=-4.3!) USER MOD Set 3.2: A 20 LYS NZ :NH3+ -164:sc= -0.0258 (180deg=-0.285) USER MOD Set 4.1: A 4 SER OG : rot -27:sc= 0.551 USER MOD Set 4.2: A 5 ASN : amide:sc= -0.212 K(o=0.34,f=-2.2!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -151:sc= 0.199 (180deg=0.0278) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -1.34! K(o=-1.3!,f=-0.062) USER MOD Single : A 43 SER OG : rot 160:sc= -0.334 USER MOD Single : A 47 LYS NZ :NH3+ -137:sc= 0.475 (180deg=-0.069) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 37:sc= 0.0273 USER MOD Single : A 69 THR OG1 : rot -90:sc= 1.2 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.277 X(o=-0.28,f=0) USER MOD Single : A 73 HIS : no HD1:sc= -0.659 X(o=-0.66,f=-0.17) USER MOD Single : A 75 THR OG1 : rot 180:sc= -1.29 USER MOD Single : A 78 THR OG1 : rot -74:sc= 1.17 USER MOD Single : A 81 GLN : amide:sc= -0.0594 X(o=-0.059,f=0.29) USER MOD Single : A 82 SER OG : rot 110:sc= 1.23 USER MOD Single : A 85 GLN : amide:sc= -0.696 X(o=-0.7,f=-0.49) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 96 ASN : amide:sc= -1.22 K(o=-1.2,f=-0.018) USER MOD Single : A 105 SER OG : rot 75:sc= 1.09 USER MOD Single : A 111 CYS SG : rot -76:sc= -1.29 USER MOD Single : A 117 LYS NZ :NH3+ 146:sc= 1.2 (180deg=1.03) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 174:sc= -4.24! (180deg=-4.31!) USER MOD Single : A 132 THR OG1 : rot 63:sc= 1.21 USER MOD Single : A 133 TYR OH : rot 73:sc= -0.879! USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.16) USER MOD Single : A 145 ASN : amide:sc= 0.999 K(o=1,f=-0.0096) USER MOD Single : A 150 THR OG1 : rot -120:sc= -0.172 USER MOD Single : A 157 ASN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 158 ASN : amide:sc=-0.00374 K(o=-0.0037,f=-1) USER MOD Single : A 163 SER OG : rot 74:sc= 0.426 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= -0.0226 K(o=-0.023,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 5.005 -0.943 13.228 1.00 0.88 N ATOM 49 CA SER A 4 3.714 -0.897 12.551 1.00 0.77 C ATOM 50 C SER A 4 3.879 -0.451 11.099 1.00 0.62 C ATOM 51 O SER A 4 3.214 -0.962 10.198 1.00 0.64 O ATOM 52 CB SER A 4 2.782 0.046 13.308 1.00 1.02 C ATOM 53 OG SER A 4 3.502 1.168 13.795 1.00 1.34 O ATOM 0 HA SER A 4 3.278 -1.896 12.540 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.979 0.379 12.651 1.00 1.02 H new ATOM 0 HB3 SER A 4 2.315 -0.483 14.139 1.00 1.02 H new ATOM 0 HG SER A 4 4.441 0.922 13.927 1.00 1.34 H new ATOM 59 N ASN A 5 4.786 0.492 10.882 1.00 0.59 N ATOM 60 CA ASN A 5 5.084 0.973 9.536 1.00 0.55 C ATOM 61 C ASN A 5 5.787 -0.117 8.729 1.00 0.43 C ATOM 62 O ASN A 5 5.541 -0.276 7.533 1.00 0.44 O ATOM 63 CB ASN A 5 5.941 2.251 9.591 1.00 0.65 C ATOM 64 CG ASN A 5 5.198 3.415 10.231 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.322 3.225 11.074 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.546 4.631 9.842 1.00 0.67 N ATOM 0 H ASN A 5 5.329 0.940 11.620 1.00 0.59 H new ATOM 0 HA ASN A 5 4.145 1.219 9.040 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.853 2.051 10.154 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.244 2.527 8.581 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.084 5.447 10.243 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.277 4.753 9.141 1.00 0.67 H new ATOM 73 N ARG A 6 6.648 -0.875 9.400 1.00 0.41 N ATOM 74 CA ARG A 6 7.296 -2.036 8.803 1.00 0.41 C ATOM 75 C ARG A 6 6.252 -3.041 8.324 1.00 0.37 C ATOM 76 O ARG A 6 6.394 -3.642 7.258 1.00 0.38 O ATOM 77 CB ARG A 6 8.210 -2.706 9.833 1.00 0.54 C ATOM 78 CG ARG A 6 8.896 -3.964 9.326 1.00 0.65 C ATOM 79 CD ARG A 6 9.432 -4.805 10.476 1.00 0.83 C ATOM 80 NE ARG A 6 8.357 -5.284 11.349 1.00 1.50 N ATOM 81 CZ ARG A 6 8.525 -5.642 12.621 1.00 2.14 C ATOM 82 NH1 ARG A 6 9.725 -5.583 13.185 1.00 2.16 N ATOM 83 NH2 ARG A 6 7.484 -6.065 13.323 1.00 3.18 N ATOM 0 H ARG A 6 6.915 -0.702 10.369 1.00 0.41 H new ATOM 0 HA ARG A 6 7.887 -1.703 7.949 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.971 -1.991 10.148 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.623 -2.956 10.717 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.191 -4.554 8.739 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.715 -3.691 8.660 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.983 -5.657 10.077 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.138 -4.214 11.060 1.00 0.83 H new ATOM 0 HE ARG A 6 7.418 -5.348 10.957 1.00 1.50 H new ATOM 0 HH11 ARG A 6 10.528 -5.262 12.644 1.00 2.16 H new ATOM 0 HH12 ARG A 6 9.845 -5.859 14.160 1.00 2.16 H new ATOM 0 HH21 ARG A 6 6.562 -6.115 12.889 1.00 3.18 H new ATOM 0 HH22 ARG A 6 7.604 -6.341 14.298 1.00 3.18 H new ATOM 97 N GLU A 7 5.198 -3.203 9.119 1.00 0.36 N ATOM 98 CA GLU A 7 4.134 -4.154 8.812 1.00 0.37 C ATOM 99 C GLU A 7 3.456 -3.806 7.502 1.00 0.29 C ATOM 100 O GLU A 7 3.124 -4.686 6.716 1.00 0.29 O ATOM 101 CB GLU A 7 3.091 -4.182 9.931 1.00 0.46 C ATOM 102 CG GLU A 7 3.645 -4.646 11.264 1.00 0.60 C ATOM 103 CD GLU A 7 4.371 -5.965 11.149 1.00 1.39 C ATOM 104 OE1 GLU A 7 3.734 -6.963 10.767 1.00 1.58 O ATOM 105 OE2 GLU A 7 5.588 -6.006 11.422 1.00 2.00 O ATOM 0 H GLU A 7 5.058 -2.684 9.986 1.00 0.36 H new ATOM 0 HA GLU A 7 4.591 -5.140 8.724 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.670 -3.184 10.049 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.273 -4.840 9.638 1.00 0.46 H new ATOM 0 HG2 GLU A 7 4.326 -3.891 11.656 1.00 0.60 H new ATOM 0 HG3 GLU A 7 2.830 -4.743 11.981 1.00 0.60 H new ATOM 112 N LEU A 8 3.275 -2.516 7.267 1.00 0.27 N ATOM 113 CA LEU A 8 2.604 -2.040 6.067 1.00 0.28 C ATOM 114 C LEU A 8 3.387 -2.455 4.832 1.00 0.28 C ATOM 115 O LEU A 8 2.814 -2.774 3.794 1.00 0.39 O ATOM 116 CB LEU A 8 2.458 -0.521 6.121 1.00 0.31 C ATOM 117 CG LEU A 8 1.818 0.017 7.396 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.727 1.530 7.346 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.443 -0.600 7.595 1.00 0.35 C ATOM 0 H LEU A 8 3.586 -1.775 7.896 1.00 0.27 H new ATOM 0 HA LEU A 8 1.610 -2.485 6.013 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.445 -0.071 6.009 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.862 -0.197 5.268 1.00 0.31 H new ATOM 0 HG LEU A 8 2.444 -0.258 8.245 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.268 1.897 8.264 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.727 1.952 7.247 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.120 1.830 6.492 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.003 -0.208 8.509 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.193 -0.353 6.745 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.538 -1.683 7.674 1.00 0.35 H new ATOM 131 N VAL A 9 4.703 -2.454 4.966 1.00 0.26 N ATOM 132 CA VAL A 9 5.583 -2.923 3.914 1.00 0.28 C ATOM 133 C VAL A 9 5.522 -4.442 3.818 1.00 0.29 C ATOM 134 O VAL A 9 5.081 -4.994 2.811 1.00 0.31 O ATOM 135 CB VAL A 9 7.035 -2.496 4.187 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.968 -3.070 3.133 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.140 -0.981 4.238 1.00 0.31 C ATOM 0 H VAL A 9 5.187 -2.130 5.803 1.00 0.26 H new ATOM 0 HA VAL A 9 5.251 -2.480 2.975 1.00 0.28 H new ATOM 0 HB VAL A 9 7.338 -2.892 5.157 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.991 -2.757 3.343 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.911 -4.158 3.150 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.672 -2.707 2.149 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.174 -0.694 4.432 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.820 -0.562 3.284 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.502 -0.599 5.035 1.00 0.31 H new ATOM 147 N VAL A 10 5.952 -5.103 4.890 1.00 0.30 N ATOM 148 CA VAL A 10 6.047 -6.558 4.936 1.00 0.32 C ATOM 149 C VAL A 10 4.750 -7.229 4.505 1.00 0.35 C ATOM 150 O VAL A 10 4.759 -8.118 3.651 1.00 0.36 O ATOM 151 CB VAL A 10 6.421 -7.032 6.353 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.328 -8.544 6.464 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.819 -6.558 6.715 1.00 0.38 C ATOM 0 H VAL A 10 6.245 -4.643 5.752 1.00 0.30 H new ATOM 0 HA VAL A 10 6.829 -6.847 4.234 1.00 0.32 H new ATOM 0 HB VAL A 10 5.710 -6.598 7.056 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.597 -8.852 7.474 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.308 -8.863 6.247 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.012 -9.004 5.750 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.071 -6.900 7.719 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.537 -6.965 6.003 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.854 -5.469 6.683 1.00 0.38 H new ATOM 163 N ASP A 11 3.638 -6.799 5.085 1.00 0.39 N ATOM 164 CA ASP A 11 2.351 -7.415 4.796 1.00 0.46 C ATOM 165 C ASP A 11 1.977 -7.230 3.334 1.00 0.44 C ATOM 166 O ASP A 11 1.415 -8.131 2.712 1.00 0.50 O ATOM 167 CB ASP A 11 1.244 -6.840 5.681 1.00 0.55 C ATOM 168 CG ASP A 11 -0.056 -7.590 5.504 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.188 -8.689 6.080 1.00 0.92 O ATOM 170 OD2 ASP A 11 -0.942 -7.103 4.772 1.00 0.84 O ATOM 0 H ASP A 11 3.601 -6.030 5.755 1.00 0.39 H new ATOM 0 HA ASP A 11 2.450 -8.479 5.009 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.552 -6.886 6.726 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.094 -5.788 5.439 1.00 0.55 H new ATOM 175 N PHE A 12 2.317 -6.074 2.783 1.00 0.41 N ATOM 176 CA PHE A 12 1.979 -5.762 1.403 1.00 0.42 C ATOM 177 C PHE A 12 2.832 -6.598 0.455 1.00 0.37 C ATOM 178 O PHE A 12 2.361 -7.045 -0.593 1.00 0.41 O ATOM 179 CB PHE A 12 2.179 -4.267 1.119 1.00 0.44 C ATOM 180 CG PHE A 12 1.439 -3.779 -0.093 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.033 -3.830 -1.344 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.154 -3.269 0.015 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.362 -3.383 -2.463 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.521 -2.820 -1.103 1.00 0.68 C ATOM 185 CZ PHE A 12 0.057 -2.874 -2.326 1.00 0.60 C ATOM 0 H PHE A 12 2.827 -5.337 3.271 1.00 0.41 H new ATOM 0 HA PHE A 12 0.928 -6.003 1.241 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.854 -3.694 1.988 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.243 -4.070 0.988 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.033 -4.225 -1.444 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.323 -3.222 0.983 1.00 0.62 H new ATOM 0 HE1 PHE A 12 1.833 -3.423 -3.434 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.520 -2.422 -1.001 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.482 -2.527 -3.195 1.00 0.60 H new ATOM 195 N LEU A 13 4.086 -6.817 0.835 1.00 0.33 N ATOM 196 CA LEU A 13 4.987 -7.631 0.036 1.00 0.32 C ATOM 197 C LEU A 13 4.547 -9.086 0.098 1.00 0.33 C ATOM 198 O LEU A 13 4.462 -9.768 -0.923 1.00 0.35 O ATOM 199 CB LEU A 13 6.433 -7.494 0.527 1.00 0.32 C ATOM 200 CG LEU A 13 6.919 -6.059 0.745 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.411 -6.036 1.017 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.581 -5.181 -0.449 1.00 0.38 C ATOM 0 H LEU A 13 4.498 -6.442 1.689 1.00 0.33 H new ATOM 0 HA LEU A 13 4.948 -7.283 -0.996 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.534 -8.040 1.465 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.091 -7.977 -0.195 1.00 0.32 H new ATOM 0 HG LEU A 13 6.402 -5.658 1.617 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.737 -5.007 1.169 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.627 -6.621 1.911 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.943 -6.463 0.167 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.937 -4.167 -0.268 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.062 -5.580 -1.342 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.501 -5.165 -0.595 1.00 0.38 H new ATOM 214 N SER A 14 4.230 -9.541 1.306 1.00 0.34 N ATOM 215 CA SER A 14 3.776 -10.909 1.517 1.00 0.38 C ATOM 216 C SER A 14 2.442 -11.148 0.810 1.00 0.39 C ATOM 217 O SER A 14 2.155 -12.261 0.382 1.00 0.41 O ATOM 218 CB SER A 14 3.646 -11.212 3.016 1.00 0.45 C ATOM 219 OG SER A 14 3.225 -12.549 3.239 1.00 1.14 O ATOM 0 H SER A 14 4.280 -8.979 2.156 1.00 0.34 H new ATOM 0 HA SER A 14 4.520 -11.583 1.092 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.604 -11.044 3.507 1.00 0.45 H new ATOM 0 HB3 SER A 14 2.931 -10.524 3.467 1.00 0.45 H new ATOM 0 HG SER A 14 3.153 -12.713 4.203 1.00 1.14 H new ATOM 225 N TYR A 15 1.641 -10.094 0.667 1.00 0.42 N ATOM 226 CA TYR A 15 0.352 -10.208 -0.009 1.00 0.47 C ATOM 227 C TYR A 15 0.567 -10.553 -1.477 1.00 0.45 C ATOM 228 O TYR A 15 -0.188 -11.328 -2.062 1.00 0.52 O ATOM 229 CB TYR A 15 -0.449 -8.905 0.118 1.00 0.55 C ATOM 230 CG TYR A 15 -1.848 -8.985 -0.462 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.890 -9.578 0.245 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.129 -8.460 -1.718 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.166 -9.643 -0.282 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.401 -8.522 -2.251 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.417 -9.146 -1.524 1.00 1.02 C ATOM 236 OH TYR A 15 -5.688 -9.174 -2.055 1.00 1.20 O ATOM 0 H TYR A 15 1.860 -9.158 1.008 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.219 -11.005 0.467 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.518 -8.634 1.171 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.096 -8.105 -0.382 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.698 -9.995 1.223 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.338 -7.995 -2.287 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.965 -10.089 0.292 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.608 -8.092 -3.220 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.677 -8.775 -2.950 1.00 1.20 H new ATOM 246 N LYS A 16 1.617 -9.992 -2.062 1.00 0.40 N ATOM 247 CA LYS A 16 1.944 -10.264 -3.450 1.00 0.41 C ATOM 248 C LYS A 16 2.632 -11.618 -3.576 1.00 0.35 C ATOM 249 O LYS A 16 2.292 -12.416 -4.447 1.00 0.39 O ATOM 250 CB LYS A 16 2.841 -9.166 -4.020 1.00 0.49 C ATOM 251 CG LYS A 16 2.147 -7.823 -4.206 1.00 0.90 C ATOM 252 CD LYS A 16 1.020 -7.910 -5.225 1.00 0.83 C ATOM 253 CE LYS A 16 0.609 -6.532 -5.725 1.00 1.35 C ATOM 254 NZ LYS A 16 0.130 -5.651 -4.626 1.00 1.39 N ATOM 0 H LYS A 16 2.254 -9.347 -1.595 1.00 0.40 H new ATOM 0 HA LYS A 16 1.016 -10.284 -4.021 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.696 -9.031 -3.358 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.232 -9.496 -4.982 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.748 -7.484 -3.250 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.875 -7.079 -4.530 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.337 -8.524 -6.068 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.160 -8.406 -4.776 1.00 0.83 H new ATOM 0 HE2 LYS A 16 1.457 -6.061 -6.222 1.00 1.35 H new ATOM 0 HE3 LYS A 16 -0.178 -6.639 -6.471 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.562 -4.972 -5.002 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -0.319 -6.230 -3.888 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 0.936 -5.134 -4.219 1.00 1.39 H new ATOM 268 N LEU A 17 3.596 -11.865 -2.697 1.00 0.30 N ATOM 269 CA LEU A 17 4.339 -13.119 -2.692 1.00 0.27 C ATOM 270 C LEU A 17 3.425 -14.316 -2.448 1.00 0.31 C ATOM 271 O LEU A 17 3.517 -15.323 -3.149 1.00 0.32 O ATOM 272 CB LEU A 17 5.433 -13.074 -1.628 1.00 0.25 C ATOM 273 CG LEU A 17 6.546 -12.070 -1.904 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.453 -11.945 -0.699 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.340 -12.487 -3.127 1.00 0.25 C ATOM 0 H LEU A 17 3.883 -11.207 -1.973 1.00 0.30 H new ATOM 0 HA LEU A 17 4.791 -13.240 -3.676 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.977 -12.836 -0.667 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.872 -14.067 -1.535 1.00 0.25 H new ATOM 0 HG LEU A 17 6.097 -11.096 -2.100 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.243 -11.225 -0.911 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.873 -11.605 0.159 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.897 -12.915 -0.476 1.00 0.29 H new ATOM 0 HD21 LEU A 17 8.131 -11.761 -3.312 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.781 -13.469 -2.957 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.679 -12.531 -3.992 1.00 0.25 H new ATOM 287 N SER A 18 2.539 -14.203 -1.466 1.00 0.37 N ATOM 288 CA SER A 18 1.626 -15.293 -1.137 1.00 0.44 C ATOM 289 C SER A 18 0.626 -15.493 -2.272 1.00 0.47 C ATOM 290 O SER A 18 0.170 -16.608 -2.523 1.00 0.51 O ATOM 291 CB SER A 18 0.897 -15.019 0.185 1.00 0.54 C ATOM 292 OG SER A 18 0.107 -16.130 0.573 1.00 1.26 O ATOM 0 H SER A 18 2.433 -13.371 -0.885 1.00 0.37 H new ATOM 0 HA SER A 18 2.207 -16.207 -1.013 1.00 0.44 H new ATOM 0 HB2 SER A 18 1.625 -14.796 0.965 1.00 0.54 H new ATOM 0 HB3 SER A 18 0.264 -14.138 0.079 1.00 0.54 H new ATOM 0 HG SER A 18 -0.346 -15.930 1.419 1.00 1.26 H new ATOM 298 N GLN A 19 0.315 -14.408 -2.974 1.00 0.48 N ATOM 299 CA GLN A 19 -0.558 -14.465 -4.139 1.00 0.53 C ATOM 300 C GLN A 19 0.137 -15.223 -5.268 1.00 0.48 C ATOM 301 O GLN A 19 -0.508 -15.868 -6.094 1.00 0.55 O ATOM 302 CB GLN A 19 -0.909 -13.042 -4.581 1.00 0.59 C ATOM 303 CG GLN A 19 -1.814 -12.956 -5.799 1.00 0.71 C ATOM 304 CD GLN A 19 -1.986 -11.528 -6.271 1.00 1.06 C ATOM 305 OE1 GLN A 19 -1.216 -11.044 -7.099 1.00 1.72 O ATOM 306 NE2 GLN A 19 -2.981 -10.836 -5.735 1.00 1.65 N ATOM 0 H GLN A 19 0.658 -13.473 -2.753 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.478 -14.992 -3.884 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.392 -12.528 -3.750 1.00 0.59 H new ATOM 0 HB3 GLN A 19 0.015 -12.505 -4.794 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.396 -13.558 -6.606 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.789 -13.379 -5.558 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -3.597 -11.275 -5.051 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -3.130 -9.864 -6.006 1.00 1.65 H new ATOM 315 N LYS A 20 1.464 -15.149 -5.277 1.00 0.41 N ATOM 316 CA LYS A 20 2.278 -15.856 -6.258 1.00 0.40 C ATOM 317 C LYS A 20 2.558 -17.286 -5.791 1.00 0.44 C ATOM 318 O LYS A 20 3.200 -18.070 -6.491 1.00 0.48 O ATOM 319 CB LYS A 20 3.598 -15.111 -6.480 1.00 0.36 C ATOM 320 CG LYS A 20 3.428 -13.681 -6.980 1.00 0.68 C ATOM 321 CD LYS A 20 3.017 -13.631 -8.444 1.00 0.61 C ATOM 322 CE LYS A 20 2.669 -12.214 -8.879 1.00 1.06 C ATOM 323 NZ LYS A 20 1.458 -11.701 -8.184 1.00 1.87 N ATOM 0 H LYS A 20 2.003 -14.600 -4.607 1.00 0.41 H new ATOM 0 HA LYS A 20 1.729 -15.898 -7.199 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.155 -15.093 -5.543 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.200 -15.667 -7.199 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.676 -13.173 -6.376 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.364 -13.138 -6.848 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.828 -14.014 -9.064 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.158 -14.283 -8.604 1.00 0.61 H new ATOM 0 HE2 LYS A 20 3.512 -11.554 -8.674 1.00 1.06 H new ATOM 0 HE3 LYS A 20 2.504 -12.195 -9.956 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 1.097 -10.866 -8.687 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 0.726 -12.440 -8.170 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 1.703 -11.438 -7.208 1.00 1.87 H new ATOM 337 N GLY A 21 2.079 -17.615 -4.597 1.00 0.48 N ATOM 338 CA GLY A 21 2.224 -18.961 -4.080 1.00 0.54 C ATOM 339 C GLY A 21 3.456 -19.155 -3.211 1.00 0.53 C ATOM 340 O GLY A 21 3.777 -20.283 -2.840 1.00 0.67 O ATOM 0 H GLY A 21 1.591 -16.970 -3.976 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.337 -19.214 -3.499 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.267 -19.659 -4.916 1.00 0.54 H new ATOM 344 N TYR A 22 4.151 -18.074 -2.873 1.00 0.43 N ATOM 345 CA TYR A 22 5.345 -18.185 -2.037 1.00 0.42 C ATOM 346 C TYR A 22 5.034 -17.756 -0.609 1.00 0.43 C ATOM 347 O TYR A 22 4.250 -16.832 -0.387 1.00 0.46 O ATOM 348 CB TYR A 22 6.495 -17.340 -2.603 1.00 0.40 C ATOM 349 CG TYR A 22 6.833 -17.663 -4.044 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.976 -18.979 -4.476 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.990 -16.649 -4.977 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.268 -19.267 -5.795 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.278 -16.930 -6.297 1.00 0.57 C ATOM 354 CZ TYR A 22 7.417 -18.238 -6.700 1.00 0.69 C ATOM 355 OH TYR A 22 7.693 -18.522 -8.018 1.00 0.81 O ATOM 0 H TYR A 22 3.915 -17.124 -3.159 1.00 0.43 H new ATOM 0 HA TYR A 22 5.658 -19.229 -2.034 1.00 0.42 H new ATOM 0 HB2 TYR A 22 6.231 -16.285 -2.528 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.382 -17.491 -1.988 1.00 0.40 H new ATOM 0 HD1 TYR A 22 6.857 -19.787 -3.769 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.885 -15.620 -4.665 1.00 0.47 H new ATOM 0 HE1 TYR A 22 7.379 -20.292 -6.115 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.394 -16.127 -7.010 1.00 0.57 H new ATOM 0 HH TYR A 22 7.767 -17.686 -8.524 1.00 0.81 H new ATOM 365 N SER A 23 5.633 -18.437 0.354 1.00 0.45 N ATOM 366 CA SER A 23 5.383 -18.158 1.758 1.00 0.49 C ATOM 367 C SER A 23 6.436 -17.211 2.318 1.00 0.43 C ATOM 368 O SER A 23 7.639 -17.457 2.196 1.00 0.44 O ATOM 369 CB SER A 23 5.372 -19.458 2.566 1.00 0.59 C ATOM 370 OG SER A 23 5.161 -19.204 3.945 1.00 1.41 O ATOM 0 H SER A 23 6.299 -19.191 0.187 1.00 0.45 H new ATOM 0 HA SER A 23 4.407 -17.680 1.838 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.588 -20.116 2.191 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.319 -19.981 2.431 1.00 0.59 H new ATOM 0 HG SER A 23 5.157 -20.052 4.437 1.00 1.41 H new ATOM 376 N TRP A 24 5.976 -16.138 2.949 1.00 0.43 N ATOM 377 CA TRP A 24 6.871 -15.158 3.553 1.00 0.41 C ATOM 378 C TRP A 24 7.566 -15.761 4.775 1.00 0.47 C ATOM 379 O TRP A 24 8.659 -15.333 5.159 1.00 0.53 O ATOM 380 CB TRP A 24 6.085 -13.893 3.935 1.00 0.44 C ATOM 381 CG TRP A 24 6.910 -12.846 4.626 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.915 -12.565 5.963 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.845 -11.942 4.022 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.800 -11.552 6.226 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.383 -11.149 5.054 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.285 -11.724 2.713 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.332 -10.160 4.820 1.00 0.51 C ATOM 388 CZ3 TRP A 24 9.228 -10.740 2.481 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.744 -9.970 3.529 1.00 0.48 C ATOM 0 H TRP A 24 4.985 -15.924 3.056 1.00 0.43 H new ATOM 0 HA TRP A 24 7.637 -14.880 2.830 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.651 -13.462 3.033 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.256 -14.175 4.585 1.00 0.44 H new ATOM 0 HD1 TRP A 24 6.310 -13.067 6.704 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.994 -11.161 7.148 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.895 -12.314 1.897 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.729 -9.563 5.628 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.572 -10.563 1.473 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.482 -9.211 3.315 1.00 0.48 H new ATOM 400 N SER A 25 6.945 -16.778 5.363 1.00 0.54 N ATOM 401 CA SER A 25 7.507 -17.453 6.527 1.00 0.63 C ATOM 402 C SER A 25 8.808 -18.170 6.173 1.00 0.63 C ATOM 403 O SER A 25 9.643 -18.418 7.038 1.00 0.75 O ATOM 404 CB SER A 25 6.497 -18.451 7.089 1.00 0.75 C ATOM 405 OG SER A 25 5.254 -17.818 7.340 1.00 1.20 O ATOM 0 H SER A 25 6.049 -17.154 5.051 1.00 0.54 H new ATOM 0 HA SER A 25 7.729 -16.700 7.283 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.358 -19.271 6.384 1.00 0.75 H new ATOM 0 HB3 SER A 25 6.882 -18.886 8.011 1.00 0.75 H new ATOM 0 HG SER A 25 4.619 -18.473 7.698 1.00 1.20 H new ATOM 411 N GLN A 26 8.984 -18.486 4.895 1.00 0.61 N ATOM 412 CA GLN A 26 10.178 -19.185 4.443 1.00 0.73 C ATOM 413 C GLN A 26 11.372 -18.234 4.386 1.00 0.79 C ATOM 414 O GLN A 26 12.520 -18.651 4.541 1.00 0.93 O ATOM 415 CB GLN A 26 9.938 -19.809 3.062 1.00 0.80 C ATOM 416 CG GLN A 26 11.104 -20.653 2.559 1.00 1.25 C ATOM 417 CD GLN A 26 10.937 -21.095 1.116 1.00 1.53 C ATOM 418 OE1 GLN A 26 11.400 -22.167 0.732 1.00 1.91 O ATOM 419 NE2 GLN A 26 10.293 -20.268 0.308 1.00 2.26 N ATOM 0 H GLN A 26 8.315 -18.269 4.156 1.00 0.61 H new ATOM 0 HA GLN A 26 10.400 -19.978 5.157 1.00 0.73 H new ATOM 0 HB2 GLN A 26 9.043 -20.430 3.104 1.00 0.80 H new ATOM 0 HB3 GLN A 26 9.740 -19.014 2.343 1.00 0.80 H new ATOM 0 HG2 GLN A 26 12.027 -20.081 2.654 1.00 1.25 H new ATOM 0 HG3 GLN A 26 11.208 -21.533 3.193 1.00 1.25 H new ATOM 0 HE21 GLN A 26 9.924 -19.388 0.668 1.00 2.26 H new ATOM 0 HE22 GLN A 26 10.165 -20.511 -0.674 1.00 2.26 H new ATOM 644 N GLU A 42 -4.340 2.471 13.683 1.00 1.02 N ATOM 645 CA GLU A 42 -4.480 2.971 12.325 1.00 0.87 C ATOM 646 C GLU A 42 -3.723 2.065 11.362 1.00 0.73 C ATOM 647 O GLU A 42 -3.989 2.056 10.164 1.00 0.63 O ATOM 648 CB GLU A 42 -3.950 4.402 12.221 1.00 1.05 C ATOM 649 CG GLU A 42 -4.561 5.197 11.081 1.00 1.53 C ATOM 650 CD GLU A 42 -6.031 5.488 11.310 1.00 2.12 C ATOM 651 OE1 GLU A 42 -6.348 6.251 12.249 1.00 2.42 O ATOM 652 OE2 GLU A 42 -6.874 4.970 10.551 1.00 2.82 O ATOM 0 HA GLU A 42 -5.538 2.974 12.062 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -4.144 4.921 13.159 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -2.868 4.371 12.092 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -4.020 6.136 10.964 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -4.443 4.643 10.150 1.00 1.53 H new ATOM 659 N SER A 43 -2.777 1.303 11.906 1.00 0.79 N ATOM 660 CA SER A 43 -1.972 0.376 11.114 1.00 0.75 C ATOM 661 C SER A 43 -2.856 -0.619 10.360 1.00 0.67 C ATOM 662 O SER A 43 -2.607 -0.917 9.193 1.00 0.62 O ATOM 663 CB SER A 43 -0.996 -0.370 12.024 1.00 0.94 C ATOM 664 OG SER A 43 -0.374 0.525 12.931 1.00 1.14 O ATOM 0 H SER A 43 -2.548 1.310 12.900 1.00 0.79 H new ATOM 0 HA SER A 43 -1.412 0.952 10.378 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.526 -1.146 12.577 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.238 -0.870 11.421 1.00 0.94 H new ATOM 0 HG SER A 43 -0.016 0.023 13.692 1.00 1.14 H new ATOM 670 N GLU A 44 -3.901 -1.107 11.022 1.00 0.72 N ATOM 671 CA GLU A 44 -4.834 -2.045 10.398 1.00 0.73 C ATOM 672 C GLU A 44 -5.648 -1.352 9.306 1.00 0.61 C ATOM 673 O GLU A 44 -6.197 -2.001 8.414 1.00 0.66 O ATOM 674 CB GLU A 44 -5.778 -2.645 11.443 1.00 0.85 C ATOM 675 CG GLU A 44 -5.101 -3.589 12.426 1.00 1.32 C ATOM 676 CD GLU A 44 -4.556 -4.836 11.761 1.00 1.96 C ATOM 677 OE1 GLU A 44 -5.336 -5.541 11.083 1.00 1.90 O ATOM 678 OE2 GLU A 44 -3.351 -5.119 11.916 1.00 2.98 O ATOM 0 H GLU A 44 -4.124 -0.870 11.989 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.250 -2.847 9.947 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.248 -1.834 12.000 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.575 -3.183 10.930 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.287 -3.064 12.925 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -5.815 -3.877 13.197 1.00 1.32 H new ATOM 685 N ALA A 45 -5.708 -0.030 9.376 1.00 0.53 N ATOM 686 CA ALA A 45 -6.471 0.752 8.423 1.00 0.45 C ATOM 687 C ALA A 45 -5.641 1.051 7.184 1.00 0.39 C ATOM 688 O ALA A 45 -6.105 0.863 6.067 1.00 0.39 O ATOM 689 CB ALA A 45 -6.950 2.038 9.065 1.00 0.48 C ATOM 0 H ALA A 45 -5.233 0.523 10.089 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.340 0.170 8.117 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.522 2.616 8.339 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.583 1.804 9.921 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -6.091 2.621 9.397 1.00 0.48 H new ATOM 695 N VAL A 46 -4.410 1.513 7.384 1.00 0.36 N ATOM 696 CA VAL A 46 -3.503 1.782 6.270 1.00 0.32 C ATOM 697 C VAL A 46 -3.158 0.493 5.530 1.00 0.34 C ATOM 698 O VAL A 46 -3.056 0.474 4.303 1.00 0.35 O ATOM 699 CB VAL A 46 -2.216 2.499 6.733 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.764 2.002 8.091 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.112 2.312 5.712 1.00 0.34 C ATOM 0 H VAL A 46 -4.017 1.709 8.305 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.024 2.452 5.585 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.441 3.562 6.823 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.856 2.527 8.387 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.547 2.189 8.826 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.563 0.932 8.039 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.211 2.823 6.052 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.903 1.249 5.593 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.427 2.729 4.755 1.00 0.34 H new ATOM 711 N LYS A 47 -2.996 -0.578 6.291 1.00 0.41 N ATOM 712 CA LYS A 47 -2.818 -1.919 5.740 1.00 0.50 C ATOM 713 C LYS A 47 -3.908 -2.207 4.707 1.00 0.51 C ATOM 714 O LYS A 47 -3.660 -2.802 3.657 1.00 0.59 O ATOM 715 CB LYS A 47 -2.893 -2.930 6.890 1.00 0.63 C ATOM 716 CG LYS A 47 -2.722 -4.384 6.492 1.00 0.84 C ATOM 717 CD LYS A 47 -3.017 -5.288 7.678 1.00 1.45 C ATOM 718 CE LYS A 47 -2.733 -6.749 7.380 1.00 1.93 C ATOM 719 NZ LYS A 47 -3.493 -7.250 6.204 1.00 2.14 N ATOM 0 H LYS A 47 -2.984 -0.545 7.310 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.850 -1.996 5.245 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.126 -2.679 7.622 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.857 -2.818 7.387 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.392 -4.624 5.666 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -1.705 -4.555 6.138 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -2.416 -4.971 8.531 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -4.062 -5.176 7.965 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -1.666 -6.879 7.201 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -2.985 -7.350 8.254 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.876 -8.194 6.415 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -4.275 -6.598 5.993 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -2.860 -7.309 5.381 1.00 2.14 H new ATOM 733 N GLN A 48 -5.114 -1.758 5.024 1.00 0.47 N ATOM 734 CA GLN A 48 -6.262 -1.891 4.139 1.00 0.52 C ATOM 735 C GLN A 48 -6.247 -0.799 3.069 1.00 0.48 C ATOM 736 O GLN A 48 -6.579 -1.043 1.909 1.00 0.54 O ATOM 737 CB GLN A 48 -7.542 -1.801 4.971 1.00 0.55 C ATOM 738 CG GLN A 48 -8.824 -1.834 4.161 1.00 0.85 C ATOM 739 CD GLN A 48 -10.040 -1.602 5.031 1.00 1.50 C ATOM 740 OE1 GLN A 48 -10.642 -2.545 5.542 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.396 -0.342 5.222 1.00 2.02 N ATOM 0 H GLN A 48 -5.324 -1.290 5.905 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.219 -2.856 3.634 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.556 -2.626 5.683 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.518 -0.879 5.552 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -8.783 -1.072 3.382 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.913 -2.798 3.660 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -9.868 0.410 4.779 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -11.198 -0.123 5.813 1.00 2.02 H new ATOM 750 N ALA A 49 -5.849 0.402 3.473 1.00 0.42 N ATOM 751 CA ALA A 49 -5.816 1.558 2.590 1.00 0.40 C ATOM 752 C ALA A 49 -4.949 1.301 1.369 1.00 0.39 C ATOM 753 O ALA A 49 -5.356 1.579 0.245 1.00 0.42 O ATOM 754 CB ALA A 49 -5.310 2.775 3.341 1.00 0.36 C ATOM 0 H ALA A 49 -5.540 0.600 4.425 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.833 1.744 2.246 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.290 3.634 2.670 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.972 2.986 4.181 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.304 2.581 3.713 1.00 0.36 H new ATOM 760 N LEU A 50 -3.759 0.761 1.595 1.00 0.38 N ATOM 761 CA LEU A 50 -2.841 0.459 0.500 1.00 0.39 C ATOM 762 C LEU A 50 -3.420 -0.611 -0.421 1.00 0.46 C ATOM 763 O LEU A 50 -3.140 -0.623 -1.619 1.00 0.49 O ATOM 764 CB LEU A 50 -1.467 0.028 1.028 1.00 0.39 C ATOM 765 CG LEU A 50 -0.464 1.167 1.255 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.203 1.918 -0.043 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.956 2.120 2.330 1.00 0.29 C ATOM 0 H LEU A 50 -3.406 0.523 2.522 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.709 1.373 -0.078 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.608 -0.502 1.970 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.032 -0.682 0.324 1.00 0.39 H new ATOM 0 HG LEU A 50 0.473 0.727 1.595 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.511 2.722 0.139 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.205 1.231 -0.785 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.137 2.339 -0.414 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.226 2.918 2.471 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.910 2.551 2.026 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.085 1.577 3.266 1.00 0.29 H new ATOM 779 N ARG A 51 -4.241 -1.492 0.137 1.00 0.52 N ATOM 780 CA ARG A 51 -4.923 -2.507 -0.656 1.00 0.61 C ATOM 781 C ARG A 51 -5.919 -1.855 -1.609 1.00 0.62 C ATOM 782 O ARG A 51 -6.023 -2.236 -2.778 1.00 0.69 O ATOM 783 CB ARG A 51 -5.655 -3.502 0.246 1.00 0.67 C ATOM 784 CG ARG A 51 -4.742 -4.466 0.979 1.00 0.98 C ATOM 785 CD ARG A 51 -5.539 -5.359 1.913 1.00 1.49 C ATOM 786 NE ARG A 51 -4.763 -6.499 2.394 1.00 2.00 N ATOM 787 CZ ARG A 51 -5.302 -7.547 3.013 1.00 2.89 C ATOM 788 NH1 ARG A 51 -6.589 -7.536 3.339 1.00 3.39 N ATOM 789 NH2 ARG A 51 -4.551 -8.593 3.334 1.00 3.74 N ATOM 0 H ARG A 51 -4.451 -1.524 1.135 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.170 -3.044 -1.233 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -6.242 -2.948 0.978 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.358 -4.074 -0.359 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -4.199 -5.078 0.259 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -3.999 -3.908 1.548 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -5.884 -4.773 2.765 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -6.427 -5.721 1.395 1.00 1.49 H new ATOM 0 HE ARG A 51 -3.754 -6.492 2.248 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -7.165 -6.724 3.115 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -7.002 -8.339 3.813 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -3.557 -8.596 3.106 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -4.968 -9.394 3.808 1.00 3.74 H new ATOM 803 N GLU A 52 -6.648 -0.869 -1.104 1.00 0.59 N ATOM 804 CA GLU A 52 -7.608 -0.134 -1.919 1.00 0.62 C ATOM 805 C GLU A 52 -6.878 0.788 -2.890 1.00 0.59 C ATOM 806 O GLU A 52 -7.255 0.915 -4.057 1.00 0.65 O ATOM 807 CB GLU A 52 -8.554 0.684 -1.036 1.00 0.66 C ATOM 808 CG GLU A 52 -9.390 -0.157 -0.085 1.00 0.92 C ATOM 809 CD GLU A 52 -10.211 -1.201 -0.810 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.286 -0.854 -1.344 1.00 1.45 O ATOM 811 OE2 GLU A 52 -9.785 -2.374 -0.845 1.00 1.88 O ATOM 0 H GLU A 52 -6.593 -0.559 -0.134 1.00 0.59 H new ATOM 0 HA GLU A 52 -8.197 -0.855 -2.486 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.968 1.397 -0.456 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.221 1.264 -1.674 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.734 -0.649 0.633 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -10.054 0.494 0.483 1.00 0.92 H new ATOM 818 N ALA A 53 -5.819 1.413 -2.397 1.00 0.52 N ATOM 819 CA ALA A 53 -5.029 2.345 -3.180 1.00 0.49 C ATOM 820 C ALA A 53 -4.334 1.643 -4.338 1.00 0.52 C ATOM 821 O ALA A 53 -4.270 2.177 -5.446 1.00 0.53 O ATOM 822 CB ALA A 53 -4.011 3.018 -2.280 1.00 0.43 C ATOM 0 H ALA A 53 -5.485 1.287 -1.442 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.694 3.097 -3.604 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.415 3.719 -2.865 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.527 3.556 -1.485 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.357 2.264 -1.842 1.00 0.43 H new ATOM 828 N GLY A 54 -3.824 0.446 -4.070 1.00 0.57 N ATOM 829 CA GLY A 54 -3.128 -0.324 -5.084 1.00 0.64 C ATOM 830 C GLY A 54 -3.988 -0.608 -6.297 1.00 0.74 C ATOM 831 O GLY A 54 -3.476 -0.764 -7.403 1.00 0.82 O ATOM 0 H GLY A 54 -3.881 -0.008 -3.159 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -2.235 0.218 -5.396 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.794 -1.267 -4.652 1.00 0.64 H new ATOM 835 N ASP A 55 -5.297 -0.664 -6.096 1.00 0.79 N ATOM 836 CA ASP A 55 -6.219 -0.903 -7.198 1.00 0.92 C ATOM 837 C ASP A 55 -6.462 0.382 -7.976 1.00 0.88 C ATOM 838 O ASP A 55 -6.389 0.396 -9.204 1.00 0.97 O ATOM 839 CB ASP A 55 -7.549 -1.465 -6.693 1.00 1.04 C ATOM 840 CG ASP A 55 -8.567 -1.619 -7.808 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.415 -2.537 -8.639 1.00 1.34 O ATOM 842 OD2 ASP A 55 -9.524 -0.821 -7.863 1.00 1.29 O ATOM 0 H ASP A 55 -5.743 -0.548 -5.186 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.764 -1.640 -7.859 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -7.377 -2.434 -6.224 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.952 -0.805 -5.924 1.00 1.04 H new ATOM 847 N GLU A 56 -6.723 1.461 -7.246 1.00 0.79 N ATOM 848 CA GLU A 56 -7.022 2.751 -7.857 1.00 0.83 C ATOM 849 C GLU A 56 -5.824 3.259 -8.660 1.00 0.78 C ATOM 850 O GLU A 56 -5.970 3.689 -9.804 1.00 0.85 O ATOM 851 CB GLU A 56 -7.409 3.770 -6.777 1.00 0.83 C ATOM 852 CG GLU A 56 -7.850 5.121 -7.321 1.00 0.94 C ATOM 853 CD GLU A 56 -9.162 5.054 -8.076 1.00 1.27 C ATOM 854 OE1 GLU A 56 -10.220 4.899 -7.429 1.00 1.38 O ATOM 855 OE2 GLU A 56 -9.139 5.128 -9.322 1.00 2.06 O ATOM 0 H GLU A 56 -6.733 1.467 -6.226 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.862 2.623 -8.539 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -8.215 3.354 -6.173 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.558 3.919 -6.113 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.948 5.825 -6.495 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -7.076 5.511 -7.982 1.00 0.94 H new ATOM 862 N PHE A 57 -4.634 3.174 -8.070 1.00 0.72 N ATOM 863 CA PHE A 57 -3.428 3.672 -8.721 1.00 0.76 C ATOM 864 C PHE A 57 -3.116 2.848 -9.970 1.00 0.82 C ATOM 865 O PHE A 57 -2.753 3.396 -11.009 1.00 0.90 O ATOM 866 CB PHE A 57 -2.234 3.645 -7.758 1.00 0.77 C ATOM 867 CG PHE A 57 -1.001 4.319 -8.302 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.798 5.681 -8.131 1.00 1.07 C ATOM 869 CD2 PHE A 57 -0.040 3.584 -8.980 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.338 6.296 -8.625 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.097 4.193 -9.476 1.00 1.25 C ATOM 872 CZ PHE A 57 1.264 5.574 -9.318 1.00 1.34 C ATOM 0 H PHE A 57 -4.481 2.767 -7.147 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.607 4.706 -9.017 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.520 4.130 -6.825 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.995 2.609 -7.519 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -1.536 6.268 -7.605 1.00 1.07 H new ATOM 0 HD2 PHE A 57 -0.182 2.523 -9.122 1.00 1.05 H new ATOM 0 HE1 PHE A 57 0.492 7.352 -8.461 1.00 1.26 H new ATOM 0 HE2 PHE A 57 1.851 3.608 -9.982 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.125 6.067 -9.744 1.00 1.34 H new ATOM 882 N GLU A 58 -3.294 1.535 -9.874 1.00 0.83 N ATOM 883 CA GLU A 58 -2.969 0.638 -10.980 1.00 0.95 C ATOM 884 C GLU A 58 -3.991 0.785 -12.108 1.00 0.99 C ATOM 885 O GLU A 58 -3.695 0.517 -13.268 1.00 1.08 O ATOM 886 CB GLU A 58 -2.930 -0.815 -10.485 1.00 1.05 C ATOM 887 CG GLU A 58 -2.448 -1.821 -11.524 1.00 1.35 C ATOM 888 CD GLU A 58 -2.459 -3.240 -10.997 1.00 1.27 C ATOM 889 OE1 GLU A 58 -1.614 -3.571 -10.140 1.00 1.45 O ATOM 890 OE2 GLU A 58 -3.321 -4.034 -11.431 1.00 1.61 O ATOM 0 H GLU A 58 -3.660 1.068 -9.045 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.986 0.906 -11.368 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -2.279 -0.872 -9.613 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.929 -1.101 -10.156 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -3.082 -1.759 -12.408 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -1.437 -1.560 -11.838 1.00 1.35 H new ATOM 897 N LEU A 59 -5.194 1.214 -11.761 1.00 0.98 N ATOM 898 CA LEU A 59 -6.247 1.405 -12.744 1.00 1.10 C ATOM 899 C LEU A 59 -6.057 2.749 -13.457 1.00 1.10 C ATOM 900 O LEU A 59 -6.514 2.948 -14.583 1.00 1.24 O ATOM 901 CB LEU A 59 -7.612 1.336 -12.040 1.00 1.19 C ATOM 902 CG LEU A 59 -8.812 0.879 -12.890 1.00 1.36 C ATOM 903 CD1 LEU A 59 -9.250 1.955 -13.868 1.00 1.59 C ATOM 904 CD2 LEU A 59 -8.480 -0.408 -13.627 1.00 1.56 C ATOM 0 H LEU A 59 -5.465 1.437 -10.803 1.00 0.98 H new ATOM 0 HA LEU A 59 -6.203 0.618 -13.497 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.521 0.660 -11.190 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.837 2.324 -11.639 1.00 1.19 H new ATOM 0 HG LEU A 59 -9.645 0.693 -12.212 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -10.099 1.595 -14.449 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -9.541 2.850 -13.318 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.425 2.194 -14.540 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -9.338 -0.718 -14.223 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -7.624 -0.242 -14.282 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -8.239 -1.189 -12.905 1.00 1.56 H new ATOM 916 N ARG A 60 -5.345 3.661 -12.810 1.00 1.00 N ATOM 917 CA ARG A 60 -5.158 5.002 -13.356 1.00 1.06 C ATOM 918 C ARG A 60 -3.795 5.155 -14.030 1.00 1.00 C ATOM 919 O ARG A 60 -3.695 5.742 -15.107 1.00 1.07 O ATOM 920 CB ARG A 60 -5.327 6.069 -12.265 1.00 1.10 C ATOM 921 CG ARG A 60 -6.765 6.264 -11.779 1.00 1.19 C ATOM 922 CD ARG A 60 -7.685 6.794 -12.876 1.00 1.31 C ATOM 923 NE ARG A 60 -7.953 5.804 -13.922 1.00 1.81 N ATOM 924 CZ ARG A 60 -9.037 5.817 -14.698 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.959 6.761 -14.543 1.00 2.15 N ATOM 926 NH2 ARG A 60 -9.197 4.885 -15.631 1.00 3.21 N ATOM 0 H ARG A 60 -4.889 3.501 -11.912 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.928 5.147 -14.114 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.703 5.800 -11.413 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -4.954 7.020 -12.645 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.153 5.314 -11.411 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -6.770 6.958 -10.938 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -8.629 7.110 -12.431 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.234 7.678 -13.326 1.00 1.31 H new ATOM 0 HE ARG A 60 -7.270 5.060 -14.065 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.839 7.479 -13.828 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.787 6.768 -15.139 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -8.491 4.160 -15.754 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -10.026 4.895 -16.225 1.00 3.21 H new ATOM 940 N TYR A 61 -2.754 4.623 -13.408 1.00 0.91 N ATOM 941 CA TYR A 61 -1.403 4.750 -13.940 1.00 0.90 C ATOM 942 C TYR A 61 -0.720 3.388 -13.992 1.00 0.84 C ATOM 943 O TYR A 61 0.339 3.183 -13.392 1.00 0.83 O ATOM 944 CB TYR A 61 -0.571 5.724 -13.096 1.00 0.96 C ATOM 945 CG TYR A 61 -1.130 7.132 -13.044 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.245 7.894 -14.198 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.543 7.695 -11.842 1.00 1.04 C ATOM 948 CE1 TYR A 61 -1.757 9.177 -14.158 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.055 8.978 -11.794 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.150 9.717 -12.943 1.00 1.27 C ATOM 951 OH TYR A 61 -2.675 10.989 -12.908 1.00 1.41 O ATOM 0 H TYR A 61 -2.817 4.099 -12.535 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.476 5.147 -14.952 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.498 5.336 -12.080 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.442 5.761 -13.497 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -0.929 7.477 -15.143 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.463 7.121 -10.931 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -1.850 9.754 -15.066 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -2.379 9.397 -10.853 1.00 1.14 H new ATOM 0 HH TYR A 61 -2.903 11.223 -11.984 1.00 1.41 H new ATOM 961 N ARG A 62 -1.337 2.454 -14.705 1.00 0.86 N ATOM 962 CA ARG A 62 -0.790 1.108 -14.845 1.00 0.85 C ATOM 963 C ARG A 62 0.525 1.138 -15.614 1.00 0.87 C ATOM 964 O ARG A 62 1.479 0.446 -15.260 1.00 0.85 O ATOM 965 CB ARG A 62 -1.785 0.201 -15.569 1.00 0.95 C ATOM 966 CG ARG A 62 -1.318 -1.238 -15.715 1.00 1.04 C ATOM 967 CD ARG A 62 -2.330 -2.079 -16.477 1.00 1.23 C ATOM 968 NE ARG A 62 -1.967 -3.491 -16.491 1.00 1.73 N ATOM 969 CZ ARG A 62 -2.834 -4.477 -16.276 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.096 -4.198 -15.968 1.00 2.24 N ATOM 971 NH2 ARG A 62 -2.434 -5.740 -16.344 1.00 3.02 N ATOM 0 H ARG A 62 -2.218 2.603 -15.197 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.606 0.713 -13.846 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.731 0.212 -15.028 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.980 0.611 -16.560 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.360 -1.260 -16.235 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -1.154 -1.670 -14.728 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -3.314 -1.962 -16.023 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.407 -1.714 -17.501 1.00 1.23 H new ATOM 0 HE ARG A 62 -0.994 -3.737 -16.676 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -4.401 -3.227 -15.896 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -4.760 -4.955 -15.803 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -1.461 -5.956 -16.561 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -3.099 -6.495 -16.179 1.00 3.02 H new ATOM 985 N ARG A 63 0.565 1.962 -16.656 1.00 0.94 N ATOM 986 CA ARG A 63 1.741 2.072 -17.509 1.00 1.01 C ATOM 987 C ARG A 63 2.913 2.641 -16.718 1.00 0.95 C ATOM 988 O ARG A 63 4.072 2.339 -16.999 1.00 0.99 O ATOM 989 CB ARG A 63 1.431 2.954 -18.724 1.00 1.16 C ATOM 990 CG ARG A 63 2.514 2.937 -19.797 1.00 1.70 C ATOM 991 CD ARG A 63 2.094 3.725 -21.029 1.00 2.14 C ATOM 992 NE ARG A 63 0.765 3.335 -21.499 1.00 2.71 N ATOM 993 CZ ARG A 63 0.197 3.804 -22.608 1.00 3.58 C ATOM 994 NH1 ARG A 63 0.865 4.624 -23.410 1.00 3.92 N ATOM 995 NH2 ARG A 63 -1.036 3.435 -22.922 1.00 4.52 N ATOM 0 H ARG A 63 -0.209 2.567 -16.930 1.00 0.94 H new ATOM 0 HA ARG A 63 2.015 1.078 -17.864 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.490 2.627 -19.167 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.284 3.980 -18.387 1.00 1.16 H new ATOM 0 HG2 ARG A 63 3.435 3.357 -19.392 1.00 1.70 H new ATOM 0 HG3 ARG A 63 2.731 1.907 -20.080 1.00 1.70 H new ATOM 0 HD2 ARG A 63 2.099 4.790 -20.798 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.821 3.568 -21.826 1.00 2.14 H new ATOM 0 HE ARG A 63 0.240 2.661 -20.942 1.00 2.71 H new ATOM 0 HH11 ARG A 63 1.820 4.899 -23.178 1.00 3.92 H new ATOM 0 HH12 ARG A 63 0.424 4.980 -24.258 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -1.547 2.794 -22.315 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -1.475 3.792 -23.771 1.00 4.52 H new ATOM 1009 N ALA A 64 2.603 3.458 -15.717 1.00 0.90 N ATOM 1010 CA ALA A 64 3.625 3.990 -14.835 1.00 0.89 C ATOM 1011 C ALA A 64 4.178 2.881 -13.953 1.00 0.75 C ATOM 1012 O ALA A 64 5.387 2.758 -13.784 1.00 0.73 O ATOM 1013 CB ALA A 64 3.069 5.119 -13.985 1.00 0.94 C ATOM 0 H ALA A 64 1.654 3.763 -15.500 1.00 0.90 H new ATOM 0 HA ALA A 64 4.434 4.393 -15.444 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.853 5.502 -13.332 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.712 5.920 -14.632 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.243 4.746 -13.380 1.00 0.94 H new ATOM 1019 N PHE A 65 3.281 2.063 -13.415 1.00 0.69 N ATOM 1020 CA PHE A 65 3.669 0.945 -12.563 1.00 0.61 C ATOM 1021 C PHE A 65 4.617 0.002 -13.301 1.00 0.59 C ATOM 1022 O PHE A 65 5.688 -0.336 -12.795 1.00 0.59 O ATOM 1023 CB PHE A 65 2.430 0.173 -12.086 1.00 0.62 C ATOM 1024 CG PHE A 65 2.754 -0.991 -11.189 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.030 -0.794 -9.845 1.00 0.60 C ATOM 1026 CD2 PHE A 65 2.780 -2.280 -11.692 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.325 -1.862 -9.020 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.075 -3.351 -10.871 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.357 -3.137 -9.531 1.00 0.66 C ATOM 0 H PHE A 65 2.275 2.154 -13.555 1.00 0.69 H new ATOM 0 HA PHE A 65 4.188 1.351 -11.694 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.768 0.857 -11.555 1.00 0.62 H new ATOM 0 HB3 PHE A 65 1.882 -0.190 -12.955 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.014 0.206 -9.438 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.567 -2.450 -12.737 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.531 -1.695 -7.973 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.086 -4.353 -11.273 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.601 -3.971 -8.890 1.00 0.66 H new ATOM 1039 N SER A 66 4.231 -0.399 -14.503 1.00 0.64 N ATOM 1040 CA SER A 66 5.020 -1.342 -15.285 1.00 0.68 C ATOM 1041 C SER A 66 6.356 -0.734 -15.712 1.00 0.66 C ATOM 1042 O SER A 66 7.376 -1.423 -15.753 1.00 0.68 O ATOM 1043 CB SER A 66 4.211 -1.802 -16.500 1.00 0.83 C ATOM 1044 OG SER A 66 3.453 -0.730 -17.032 1.00 1.20 O ATOM 0 H SER A 66 3.374 -0.086 -14.960 1.00 0.64 H new ATOM 0 HA SER A 66 5.248 -2.207 -14.662 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.883 -2.193 -17.264 1.00 0.83 H new ATOM 0 HB3 SER A 66 3.546 -2.617 -16.213 1.00 0.83 H new ATOM 0 HG SER A 66 3.966 0.102 -16.958 1.00 1.20 H new ATOM 1050 N ASP A 67 6.355 0.558 -16.006 1.00 0.68 N ATOM 1051 CA ASP A 67 7.576 1.237 -16.429 1.00 0.73 C ATOM 1052 C ASP A 67 8.532 1.422 -15.253 1.00 0.65 C ATOM 1053 O ASP A 67 9.725 1.122 -15.352 1.00 0.66 O ATOM 1054 CB ASP A 67 7.252 2.595 -17.059 1.00 0.89 C ATOM 1055 CG ASP A 67 8.463 3.231 -17.711 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.907 2.725 -18.766 1.00 1.41 O ATOM 1057 OD2 ASP A 67 8.974 4.237 -17.182 1.00 2.06 O ATOM 0 H ASP A 67 5.530 1.156 -15.961 1.00 0.68 H new ATOM 0 HA ASP A 67 8.063 0.611 -17.177 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.466 2.469 -17.803 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.861 3.264 -16.293 1.00 0.89 H new ATOM 1062 N LEU A 68 7.999 1.886 -14.127 1.00 0.63 N ATOM 1063 CA LEU A 68 8.817 2.194 -12.964 1.00 0.66 C ATOM 1064 C LEU A 68 9.341 0.926 -12.290 1.00 0.57 C ATOM 1065 O LEU A 68 10.418 0.941 -11.700 1.00 0.63 O ATOM 1066 CB LEU A 68 8.031 3.050 -11.968 1.00 0.75 C ATOM 1067 CG LEU A 68 7.615 4.434 -12.487 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.802 5.181 -11.442 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.836 5.249 -12.887 1.00 1.07 C ATOM 0 H LEU A 68 7.002 2.057 -13.997 1.00 0.63 H new ATOM 0 HA LEU A 68 9.681 2.762 -13.309 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.134 2.505 -11.672 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.635 3.182 -11.070 1.00 0.75 H new ATOM 0 HG LEU A 68 6.992 4.289 -13.369 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.519 6.159 -11.832 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.904 4.611 -11.204 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.400 5.310 -10.540 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.518 6.226 -13.252 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.486 5.379 -12.022 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.380 4.727 -13.674 1.00 1.07 H new ATOM 1081 N THR A 69 8.598 -0.174 -12.386 1.00 0.49 N ATOM 1082 CA THR A 69 9.066 -1.443 -11.829 1.00 0.49 C ATOM 1083 C THR A 69 10.266 -1.968 -12.610 1.00 0.46 C ATOM 1084 O THR A 69 11.151 -2.614 -12.051 1.00 0.51 O ATOM 1085 CB THR A 69 7.959 -2.516 -11.808 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.241 -2.515 -13.049 1.00 0.71 O ATOM 1087 CG2 THR A 69 6.998 -2.281 -10.655 1.00 0.63 C ATOM 0 H THR A 69 7.684 -0.215 -12.836 1.00 0.49 H new ATOM 0 HA THR A 69 9.360 -1.241 -10.799 1.00 0.49 H new ATOM 0 HB THR A 69 8.433 -3.488 -11.671 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.482 -1.898 -12.987 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.226 -3.051 -10.662 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.544 -2.322 -9.712 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.533 -1.301 -10.763 1.00 0.63 H new ATOM 1095 N SER A 70 10.303 -1.668 -13.902 1.00 0.46 N ATOM 1096 CA SER A 70 11.420 -2.071 -14.738 1.00 0.49 C ATOM 1097 C SER A 70 12.628 -1.176 -14.454 1.00 0.48 C ATOM 1098 O SER A 70 13.777 -1.588 -14.615 1.00 0.53 O ATOM 1099 CB SER A 70 11.032 -2.008 -16.222 1.00 0.57 C ATOM 1100 OG SER A 70 12.021 -2.614 -17.035 1.00 1.31 O ATOM 0 H SER A 70 9.573 -1.148 -14.390 1.00 0.46 H new ATOM 0 HA SER A 70 11.685 -3.102 -14.504 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.076 -2.510 -16.372 1.00 0.57 H new ATOM 0 HB3 SER A 70 10.897 -0.969 -16.522 1.00 0.57 H new ATOM 0 HG SER A 70 11.749 -2.562 -17.975 1.00 1.31 H new ATOM 1106 N GLN A 71 12.353 0.044 -14.006 1.00 0.49 N ATOM 1107 CA GLN A 71 13.400 0.995 -13.651 1.00 0.53 C ATOM 1108 C GLN A 71 13.938 0.695 -12.252 1.00 0.46 C ATOM 1109 O GLN A 71 15.103 0.953 -11.946 1.00 0.53 O ATOM 1110 CB GLN A 71 12.841 2.420 -13.716 1.00 0.63 C ATOM 1111 CG GLN A 71 13.816 3.497 -13.272 1.00 0.69 C ATOM 1112 CD GLN A 71 13.227 4.892 -13.389 1.00 0.83 C ATOM 1113 OE1 GLN A 71 13.363 5.546 -14.421 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.562 5.356 -12.341 1.00 0.82 N ATOM 0 H GLN A 71 11.405 0.400 -13.879 1.00 0.49 H new ATOM 0 HA GLN A 71 14.223 0.903 -14.360 1.00 0.53 H new ATOM 0 HB2 GLN A 71 12.529 2.629 -14.739 1.00 0.63 H new ATOM 0 HB3 GLN A 71 11.948 2.476 -13.093 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.109 3.314 -12.238 1.00 0.69 H new ATOM 0 HG3 GLN A 71 14.721 3.436 -13.876 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.470 4.784 -11.501 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.142 6.285 -12.374 1.00 0.82 H new ATOM 1123 N LEU A 72 13.083 0.130 -11.416 1.00 0.39 N ATOM 1124 CA LEU A 72 13.443 -0.194 -10.042 1.00 0.33 C ATOM 1125 C LEU A 72 13.804 -1.671 -9.926 1.00 0.34 C ATOM 1126 O LEU A 72 13.795 -2.228 -8.832 1.00 0.37 O ATOM 1127 CB LEU A 72 12.274 0.126 -9.097 1.00 0.37 C ATOM 1128 CG LEU A 72 12.632 0.915 -7.831 1.00 0.46 C ATOM 1129 CD1 LEU A 72 11.402 1.094 -6.957 1.00 0.96 C ATOM 1130 CD2 LEU A 72 13.745 0.237 -7.048 1.00 0.92 C ATOM 0 H LEU A 72 12.125 -0.116 -11.666 1.00 0.39 H new ATOM 0 HA LEU A 72 14.306 0.408 -9.760 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.526 0.690 -9.654 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.807 -0.812 -8.797 1.00 0.37 H new ATOM 0 HG LEU A 72 12.994 1.896 -8.139 1.00 0.46 H new ATOM 0 HD11 LEU A 72 11.670 1.655 -6.062 1.00 0.96 H new ATOM 0 HD12 LEU A 72 10.638 1.638 -7.512 1.00 0.96 H new ATOM 0 HD13 LEU A 72 11.015 0.117 -6.670 1.00 0.96 H new ATOM 0 HD21 LEU A 72 13.973 0.823 -6.158 1.00 0.92 H new ATOM 0 HD22 LEU A 72 13.425 -0.762 -6.753 1.00 0.92 H new ATOM 0 HD23 LEU A 72 14.636 0.163 -7.672 1.00 0.92 H new ATOM 1142 N HIS A 73 14.125 -2.301 -11.055 1.00 0.41 N ATOM 1143 CA HIS A 73 14.431 -3.730 -11.063 1.00 0.46 C ATOM 1144 C HIS A 73 15.568 -4.033 -10.084 1.00 0.41 C ATOM 1145 O HIS A 73 16.650 -3.449 -10.167 1.00 0.45 O ATOM 1146 CB HIS A 73 14.771 -4.224 -12.482 1.00 0.60 C ATOM 1147 CG HIS A 73 16.113 -3.804 -13.007 1.00 1.34 C ATOM 1148 ND1 HIS A 73 17.216 -4.627 -12.974 1.00 2.07 N ATOM 1149 CD2 HIS A 73 16.521 -2.660 -13.603 1.00 2.33 C ATOM 1150 CE1 HIS A 73 18.240 -4.010 -13.525 1.00 2.86 C ATOM 1151 NE2 HIS A 73 17.848 -2.815 -13.917 1.00 3.01 N ATOM 0 H HIS A 73 14.180 -1.849 -11.968 1.00 0.41 H new ATOM 0 HA HIS A 73 13.542 -4.271 -10.738 1.00 0.46 H new ATOM 0 HB2 HIS A 73 14.721 -5.313 -12.491 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.003 -3.864 -13.167 1.00 0.60 H new ATOM 0 HD2 HIS A 73 15.915 -1.787 -13.796 1.00 2.33 H new ATOM 0 HE1 HIS A 73 19.235 -4.416 -13.637 1.00 2.86 H new ATOM 0 HE2 HIS A 73 18.434 -2.119 -14.378 1.00 3.01 H new ATOM 1160 N ILE A 74 15.308 -4.931 -9.149 1.00 0.37 N ATOM 1161 CA ILE A 74 16.245 -5.197 -8.075 1.00 0.36 C ATOM 1162 C ILE A 74 17.409 -6.071 -8.551 1.00 0.45 C ATOM 1163 O ILE A 74 17.237 -7.248 -8.870 1.00 0.61 O ATOM 1164 CB ILE A 74 15.531 -5.848 -6.861 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.540 -6.146 -5.753 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.780 -7.112 -7.263 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.909 -6.646 -4.479 1.00 0.34 C ATOM 0 H ILE A 74 14.454 -5.488 -9.113 1.00 0.37 H new ATOM 0 HA ILE A 74 16.656 -4.239 -7.756 1.00 0.36 H new ATOM 0 HB ILE A 74 14.794 -5.138 -6.484 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.252 -6.889 -6.112 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.107 -5.241 -5.537 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.293 -7.540 -6.387 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.028 -6.866 -8.012 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.482 -7.836 -7.678 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.686 -6.836 -3.738 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.218 -5.895 -4.096 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.366 -7.569 -4.680 1.00 0.34 H new ATOM 1179 N THR A 75 18.583 -5.469 -8.669 1.00 0.61 N ATOM 1180 CA THR A 75 19.788 -6.211 -8.991 1.00 0.73 C ATOM 1181 C THR A 75 20.407 -6.789 -7.721 1.00 0.58 C ATOM 1182 O THR A 75 20.241 -6.223 -6.638 1.00 0.57 O ATOM 1183 CB THR A 75 20.809 -5.312 -9.715 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.785 -3.992 -9.153 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.508 -5.241 -11.201 1.00 1.56 C ATOM 0 H THR A 75 18.725 -4.466 -8.546 1.00 0.61 H new ATOM 0 HA THR A 75 19.516 -7.029 -9.658 1.00 0.73 H new ATOM 0 HB THR A 75 21.800 -5.745 -9.582 1.00 1.02 H new ATOM 0 HG1 THR A 75 21.438 -3.427 -9.617 1.00 1.38 H new ATOM 0 HG21 THR A 75 21.242 -4.601 -11.691 1.00 1.56 H new ATOM 0 HG22 THR A 75 20.556 -6.242 -11.630 1.00 1.56 H new ATOM 0 HG23 THR A 75 19.510 -4.829 -11.351 1.00 1.56 H new ATOM 1193 N PRO A 76 21.107 -7.928 -7.828 1.00 0.66 N ATOM 1194 CA PRO A 76 21.716 -8.593 -6.672 1.00 0.73 C ATOM 1195 C PRO A 76 22.705 -7.692 -5.934 1.00 0.72 C ATOM 1196 O PRO A 76 23.760 -7.341 -6.469 1.00 0.81 O ATOM 1197 CB PRO A 76 22.438 -9.800 -7.280 1.00 0.93 C ATOM 1198 CG PRO A 76 21.782 -10.020 -8.599 1.00 1.06 C ATOM 1199 CD PRO A 76 21.360 -8.661 -9.079 1.00 0.90 C ATOM 0 HA PRO A 76 20.969 -8.864 -5.926 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.504 -9.604 -7.398 1.00 0.93 H new ATOM 0 HB3 PRO A 76 22.344 -10.678 -6.641 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.469 -10.488 -9.304 1.00 1.06 H new ATOM 0 HG3 PRO A 76 20.923 -10.684 -8.502 1.00 1.06 H new ATOM 0 HD2 PRO A 76 22.138 -8.184 -9.675 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.468 -8.713 -9.703 1.00 0.90 H new ATOM 1207 N GLY A 77 22.346 -7.307 -4.714 1.00 0.86 N ATOM 1208 CA GLY A 77 23.216 -6.473 -3.909 1.00 1.10 C ATOM 1209 C GLY A 77 23.003 -4.993 -4.164 1.00 1.00 C ATOM 1210 O GLY A 77 23.946 -4.204 -4.088 1.00 1.32 O ATOM 0 H GLY A 77 21.464 -7.559 -4.268 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.043 -6.685 -2.854 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.255 -6.729 -4.119 1.00 1.10 H new ATOM 1214 N THR A 78 21.764 -4.620 -4.457 1.00 0.85 N ATOM 1215 CA THR A 78 21.411 -3.235 -4.742 1.00 0.82 C ATOM 1216 C THR A 78 21.718 -2.320 -3.559 1.00 0.85 C ATOM 1217 O THR A 78 22.393 -1.298 -3.717 1.00 1.52 O ATOM 1218 CB THR A 78 19.916 -3.130 -5.076 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.310 -4.424 -4.961 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.707 -2.582 -6.478 1.00 1.15 C ATOM 0 H THR A 78 20.977 -5.267 -4.504 1.00 0.85 H new ATOM 0 HA THR A 78 22.011 -2.915 -5.594 1.00 0.82 H new ATOM 0 HB THR A 78 19.450 -2.441 -4.371 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.577 -4.979 -5.723 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.639 -2.518 -6.688 1.00 1.15 H new ATOM 0 HG22 THR A 78 20.151 -1.589 -6.551 1.00 1.15 H new ATOM 0 HG23 THR A 78 20.180 -3.245 -7.202 1.00 1.15 H new ATOM 1228 N ALA A 79 21.208 -2.701 -2.384 1.00 0.68 N ATOM 1229 CA ALA A 79 21.325 -1.908 -1.156 1.00 0.73 C ATOM 1230 C ALA A 79 20.395 -0.695 -1.191 1.00 0.62 C ATOM 1231 O ALA A 79 19.977 -0.250 -2.266 1.00 0.56 O ATOM 1232 CB ALA A 79 22.767 -1.479 -0.901 1.00 0.85 C ATOM 0 H ALA A 79 20.698 -3.575 -2.257 1.00 0.68 H new ATOM 0 HA ALA A 79 21.018 -2.546 -0.327 1.00 0.73 H new ATOM 0 HB1 ALA A 79 22.815 -0.893 0.017 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.397 -2.363 -0.801 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.120 -0.874 -1.736 1.00 0.85 H new ATOM 1238 N TYR A 80 20.069 -0.167 -0.013 1.00 0.63 N ATOM 1239 CA TYR A 80 19.169 0.980 0.099 1.00 0.58 C ATOM 1240 C TYR A 80 19.697 2.175 -0.691 1.00 0.50 C ATOM 1241 O TYR A 80 18.918 2.964 -1.214 1.00 0.46 O ATOM 1242 CB TYR A 80 18.949 1.376 1.569 1.00 0.67 C ATOM 1243 CG TYR A 80 18.115 2.632 1.740 1.00 0.80 C ATOM 1244 CD1 TYR A 80 16.763 2.650 1.408 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.685 3.808 2.217 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.007 3.801 1.548 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.936 4.962 2.355 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.599 4.953 2.021 1.00 1.58 C ATOM 1249 OH TYR A 80 15.857 6.106 2.152 1.00 2.03 O ATOM 0 H TYR A 80 20.416 -0.516 0.880 1.00 0.63 H new ATOM 0 HA TYR A 80 18.210 0.680 -0.325 1.00 0.58 H new ATOM 0 HB2 TYR A 80 18.461 0.552 2.090 1.00 0.67 H new ATOM 0 HB3 TYR A 80 19.918 1.525 2.046 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.296 1.750 1.035 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.731 3.820 2.484 1.00 1.14 H new ATOM 0 HE1 TYR A 80 14.959 3.797 1.288 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.397 5.867 2.723 1.00 1.55 H new ATOM 0 HH TYR A 80 16.277 6.825 1.636 1.00 2.03 H new ATOM 1259 N GLN A 81 21.017 2.289 -0.793 1.00 0.56 N ATOM 1260 CA GLN A 81 21.631 3.395 -1.518 1.00 0.59 C ATOM 1261 C GLN A 81 21.152 3.433 -2.969 1.00 0.54 C ATOM 1262 O GLN A 81 20.842 4.496 -3.499 1.00 0.63 O ATOM 1263 CB GLN A 81 23.158 3.282 -1.465 1.00 0.72 C ATOM 1264 CG GLN A 81 23.883 4.430 -2.158 1.00 0.84 C ATOM 1265 CD GLN A 81 23.503 5.788 -1.597 1.00 1.40 C ATOM 1266 OE1 GLN A 81 22.568 6.430 -2.072 1.00 2.01 O ATOM 1267 NE2 GLN A 81 24.215 6.231 -0.575 1.00 2.18 N ATOM 0 H GLN A 81 21.680 1.631 -0.384 1.00 0.56 H new ATOM 0 HA GLN A 81 21.329 4.325 -1.037 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.474 3.241 -0.423 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.460 2.342 -1.927 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.959 4.288 -2.057 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.657 4.406 -3.224 1.00 0.84 H new ATOM 0 HE21 GLN A 81 24.984 5.670 -0.208 1.00 2.18 H new ATOM 0 HE22 GLN A 81 23.996 7.134 -0.154 1.00 2.18 H new ATOM 1276 N SER A 82 21.073 2.271 -3.602 1.00 0.48 N ATOM 1277 CA SER A 82 20.626 2.193 -4.985 1.00 0.47 C ATOM 1278 C SER A 82 19.103 2.246 -5.057 1.00 0.40 C ATOM 1279 O SER A 82 18.533 2.822 -5.982 1.00 0.42 O ATOM 1280 CB SER A 82 21.144 0.912 -5.634 1.00 0.55 C ATOM 1281 OG SER A 82 22.543 0.778 -5.438 1.00 1.17 O ATOM 0 H SER A 82 21.312 1.373 -3.182 1.00 0.48 H new ATOM 0 HA SER A 82 21.027 3.048 -5.529 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.629 0.050 -5.210 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.921 0.924 -6.701 1.00 0.55 H new ATOM 0 HG SER A 82 22.717 0.043 -4.813 1.00 1.17 H new ATOM 1287 N PHE A 83 18.453 1.654 -4.060 1.00 0.36 N ATOM 1288 CA PHE A 83 16.997 1.631 -3.992 1.00 0.33 C ATOM 1289 C PHE A 83 16.447 3.047 -3.819 1.00 0.31 C ATOM 1290 O PHE A 83 15.433 3.413 -4.419 1.00 0.32 O ATOM 1291 CB PHE A 83 16.551 0.725 -2.829 1.00 0.35 C ATOM 1292 CG PHE A 83 15.060 0.592 -2.670 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.328 -0.232 -3.511 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.394 1.281 -1.667 1.00 0.32 C ATOM 1295 CE1 PHE A 83 12.961 -0.362 -3.356 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.029 1.154 -1.510 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.311 0.331 -2.356 1.00 0.38 C ATOM 0 H PHE A 83 18.916 1.181 -3.284 1.00 0.36 H new ATOM 0 HA PHE A 83 16.600 1.230 -4.925 1.00 0.33 H new ATOM 0 HB2 PHE A 83 16.977 -0.268 -2.976 1.00 0.35 H new ATOM 0 HB3 PHE A 83 16.968 1.117 -1.901 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.831 -0.778 -4.295 1.00 0.38 H new ATOM 0 HD2 PHE A 83 14.950 1.924 -1.001 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.401 -1.006 -4.018 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.522 1.698 -0.726 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.243 0.230 -2.235 1.00 0.38 H new ATOM 1307 N GLU A 84 17.145 3.850 -3.026 1.00 0.34 N ATOM 1308 CA GLU A 84 16.714 5.208 -2.737 1.00 0.39 C ATOM 1309 C GLU A 84 16.841 6.094 -3.968 1.00 0.37 C ATOM 1310 O GLU A 84 16.050 7.006 -4.155 1.00 0.40 O ATOM 1311 CB GLU A 84 17.533 5.797 -1.584 1.00 0.51 C ATOM 1312 CG GLU A 84 17.114 7.207 -1.203 1.00 0.64 C ATOM 1313 CD GLU A 84 17.984 7.794 -0.117 1.00 0.90 C ATOM 1314 OE1 GLU A 84 19.164 8.093 -0.389 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.496 7.949 1.021 1.00 0.95 O ATOM 0 H GLU A 84 18.017 3.580 -2.570 1.00 0.34 H new ATOM 0 HA GLU A 84 15.665 5.171 -2.444 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.437 5.150 -0.712 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.587 5.802 -1.863 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.158 7.846 -2.085 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.077 7.197 -0.868 1.00 0.64 H new ATOM 1322 N GLN A 85 17.817 5.802 -4.818 1.00 0.37 N ATOM 1323 CA GLN A 85 18.059 6.607 -6.016 1.00 0.42 C ATOM 1324 C GLN A 85 16.815 6.667 -6.896 1.00 0.38 C ATOM 1325 O GLN A 85 16.579 7.655 -7.591 1.00 0.46 O ATOM 1326 CB GLN A 85 19.241 6.043 -6.810 1.00 0.50 C ATOM 1327 CG GLN A 85 20.574 6.161 -6.087 1.00 0.61 C ATOM 1328 CD GLN A 85 21.685 5.376 -6.756 1.00 1.44 C ATOM 1329 OE1 GLN A 85 21.697 5.199 -7.974 1.00 1.90 O ATOM 1330 NE2 GLN A 85 22.623 4.890 -5.958 1.00 2.16 N ATOM 0 H GLN A 85 18.455 5.015 -4.703 1.00 0.37 H new ATOM 0 HA GLN A 85 18.300 7.621 -5.697 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.050 4.993 -7.033 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.308 6.564 -7.765 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.860 7.211 -6.034 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.457 5.811 -5.061 1.00 0.61 H new ATOM 0 HE21 GLN A 85 22.576 5.060 -4.953 1.00 2.16 H new ATOM 0 HE22 GLN A 85 23.393 4.346 -6.348 1.00 2.16 H new ATOM 1339 N VAL A 86 16.014 5.614 -6.840 1.00 0.31 N ATOM 1340 CA VAL A 86 14.780 5.551 -7.601 1.00 0.31 C ATOM 1341 C VAL A 86 13.639 6.156 -6.800 1.00 0.29 C ATOM 1342 O VAL A 86 12.955 7.075 -7.251 1.00 0.32 O ATOM 1343 CB VAL A 86 14.412 4.098 -7.943 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.183 4.057 -8.833 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.583 3.384 -8.595 1.00 0.36 C ATOM 0 H VAL A 86 16.200 4.788 -6.271 1.00 0.31 H new ATOM 0 HA VAL A 86 14.935 6.111 -8.523 1.00 0.31 H new ATOM 0 HB VAL A 86 14.177 3.575 -7.016 1.00 0.33 H new ATOM 0 HG11 VAL A 86 12.936 3.021 -9.065 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.344 4.523 -8.316 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.385 4.598 -9.757 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.299 2.358 -8.828 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.859 3.902 -9.514 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.432 3.379 -7.912 1.00 0.36 H new ATOM 1355 N VAL A 87 13.443 5.628 -5.599 1.00 0.28 N ATOM 1356 CA VAL A 87 12.319 6.011 -4.759 1.00 0.32 C ATOM 1357 C VAL A 87 12.429 7.456 -4.269 1.00 0.35 C ATOM 1358 O VAL A 87 11.462 8.029 -3.769 1.00 0.37 O ATOM 1359 CB VAL A 87 12.175 5.058 -3.563 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.142 3.622 -4.054 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.297 5.259 -2.562 1.00 0.41 C ATOM 0 H VAL A 87 14.055 4.926 -5.183 1.00 0.28 H new ATOM 0 HA VAL A 87 11.426 5.939 -5.379 1.00 0.32 H new ATOM 0 HB VAL A 87 11.238 5.281 -3.052 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.040 2.949 -3.203 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.295 3.487 -4.727 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.067 3.398 -4.585 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.167 4.570 -1.727 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.255 5.067 -3.046 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.276 6.284 -2.193 1.00 0.41 H new ATOM 1371 N ASN A 88 13.607 8.042 -4.425 1.00 0.38 N ATOM 1372 CA ASN A 88 13.810 9.458 -4.121 1.00 0.47 C ATOM 1373 C ASN A 88 12.962 10.311 -5.050 1.00 0.44 C ATOM 1374 O ASN A 88 12.467 11.369 -4.665 1.00 0.45 O ATOM 1375 CB ASN A 88 15.287 9.838 -4.282 1.00 0.61 C ATOM 1376 CG ASN A 88 15.553 11.313 -4.029 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.925 11.935 -3.172 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.484 11.883 -4.780 1.00 0.97 N ATOM 0 H ASN A 88 14.441 7.561 -4.761 1.00 0.38 H new ATOM 0 HA ASN A 88 13.512 9.636 -3.088 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.886 9.243 -3.593 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.614 9.583 -5.290 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.702 12.872 -4.658 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.982 11.333 -5.480 1.00 0.97 H new ATOM 1385 N GLU A 89 12.756 9.818 -6.266 1.00 0.42 N ATOM 1386 CA GLU A 89 12.008 10.557 -7.270 1.00 0.45 C ATOM 1387 C GLU A 89 10.531 10.608 -6.906 1.00 0.38 C ATOM 1388 O GLU A 89 9.772 11.387 -7.468 1.00 0.43 O ATOM 1389 CB GLU A 89 12.195 9.934 -8.654 1.00 0.54 C ATOM 1390 CG GLU A 89 13.645 9.878 -9.104 1.00 0.65 C ATOM 1391 CD GLU A 89 13.795 9.358 -10.517 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.463 8.176 -10.760 1.00 2.04 O ATOM 1393 OE2 GLU A 89 14.248 10.123 -11.393 1.00 1.28 O ATOM 0 H GLU A 89 13.098 8.909 -6.578 1.00 0.42 H new ATOM 0 HA GLU A 89 12.393 11.576 -7.299 1.00 0.45 H new ATOM 0 HB2 GLU A 89 11.786 8.924 -8.647 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.619 10.506 -9.382 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.081 10.875 -9.039 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.208 9.239 -8.424 1.00 0.65 H new ATOM 1400 N LEU A 90 10.130 9.777 -5.953 1.00 0.31 N ATOM 1401 CA LEU A 90 8.765 9.800 -5.455 1.00 0.27 C ATOM 1402 C LEU A 90 8.576 11.002 -4.542 1.00 0.25 C ATOM 1403 O LEU A 90 7.577 11.714 -4.624 1.00 0.26 O ATOM 1404 CB LEU A 90 8.452 8.517 -4.685 1.00 0.26 C ATOM 1405 CG LEU A 90 8.747 7.216 -5.424 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.511 6.032 -4.507 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.894 7.094 -6.671 1.00 0.37 C ATOM 0 H LEU A 90 10.731 9.081 -5.511 1.00 0.31 H new ATOM 0 HA LEU A 90 8.085 9.872 -6.304 1.00 0.27 H new ATOM 0 HB2 LEU A 90 9.022 8.524 -3.756 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.397 8.527 -4.411 1.00 0.26 H new ATOM 0 HG LEU A 90 9.793 7.226 -5.730 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.724 5.108 -5.044 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.167 6.107 -3.639 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.472 6.029 -4.177 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.124 6.158 -7.179 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.840 7.107 -6.394 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.104 7.930 -7.338 1.00 0.37 H new ATOM 1419 N PHE A 91 9.562 11.228 -3.685 1.00 0.27 N ATOM 1420 CA PHE A 91 9.509 12.311 -2.713 1.00 0.29 C ATOM 1421 C PHE A 91 9.883 13.635 -3.369 1.00 0.33 C ATOM 1422 O PHE A 91 9.227 14.656 -3.155 1.00 0.33 O ATOM 1423 CB PHE A 91 10.465 12.022 -1.547 1.00 0.35 C ATOM 1424 CG PHE A 91 10.182 12.823 -0.306 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.681 14.107 -0.174 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.418 12.295 0.726 1.00 0.37 C ATOM 1427 CE1 PHE A 91 10.429 14.851 0.963 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.163 13.036 1.864 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.648 14.289 1.994 1.00 0.50 C ATOM 0 H PHE A 91 10.415 10.670 -3.644 1.00 0.27 H new ATOM 0 HA PHE A 91 8.490 12.382 -2.332 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.411 10.961 -1.302 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.486 12.223 -1.871 1.00 0.35 H new ATOM 0 HD1 PHE A 91 11.275 14.533 -0.969 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.019 11.295 0.638 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.825 15.851 1.061 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.569 12.608 2.658 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.438 14.860 2.886 1.00 0.50 H new ATOM 1439 N ARG A 92 10.923 13.601 -4.195 1.00 0.39 N ATOM 1440 CA ARG A 92 11.480 14.813 -4.782 1.00 0.49 C ATOM 1441 C ARG A 92 10.546 15.398 -5.844 1.00 0.51 C ATOM 1442 O ARG A 92 10.647 16.571 -6.194 1.00 0.62 O ATOM 1443 CB ARG A 92 12.855 14.515 -5.389 1.00 0.56 C ATOM 1444 CG ARG A 92 13.654 15.760 -5.735 1.00 1.24 C ATOM 1445 CD ARG A 92 14.049 16.529 -4.481 1.00 1.54 C ATOM 1446 NE ARG A 92 14.978 15.764 -3.646 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.898 15.674 -2.317 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.912 16.276 -1.660 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.807 14.972 -1.647 1.00 3.95 N ATOM 0 H ARG A 92 11.399 12.743 -4.474 1.00 0.39 H new ATOM 0 HA ARG A 92 11.590 15.554 -3.991 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.429 13.910 -4.687 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.722 13.917 -6.291 1.00 0.56 H new ATOM 0 HG2 ARG A 92 14.550 15.478 -6.289 1.00 1.24 H new ATOM 0 HG3 ARG A 92 13.065 16.403 -6.388 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.510 17.475 -4.765 1.00 1.54 H new ATOM 0 HD3 ARG A 92 13.155 16.769 -3.905 1.00 1.54 H new ATOM 0 HE ARG A 92 15.737 15.267 -4.112 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.210 16.811 -2.172 1.00 3.13 H new ATOM 0 HH12 ARG A 92 13.857 16.203 -0.644 1.00 3.13 H new ATOM 0 HH21 ARG A 92 16.562 14.505 -2.149 1.00 3.95 H new ATOM 0 HH22 ARG A 92 15.749 14.901 -0.631 1.00 3.95 H new ATOM 1463 N ASP A 93 9.626 14.578 -6.336 1.00 0.46 N ATOM 1464 CA ASP A 93 8.679 15.013 -7.363 1.00 0.53 C ATOM 1465 C ASP A 93 7.448 15.654 -6.718 1.00 0.50 C ATOM 1466 O ASP A 93 6.441 15.915 -7.381 1.00 0.60 O ATOM 1467 CB ASP A 93 8.264 13.817 -8.241 1.00 0.62 C ATOM 1468 CG ASP A 93 7.432 14.211 -9.448 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.974 14.874 -10.362 1.00 1.14 O ATOM 1470 OD2 ASP A 93 6.225 13.890 -9.477 1.00 1.11 O ATOM 0 H ASP A 93 9.513 13.608 -6.043 1.00 0.46 H new ATOM 0 HA ASP A 93 9.164 15.758 -7.993 1.00 0.53 H new ATOM 0 HB2 ASP A 93 9.160 13.298 -8.581 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.698 13.110 -7.634 1.00 0.62 H new ATOM 1475 N GLY A 94 7.530 15.928 -5.420 1.00 0.45 N ATOM 1476 CA GLY A 94 6.395 16.518 -4.739 1.00 0.47 C ATOM 1477 C GLY A 94 5.498 15.476 -4.107 1.00 0.39 C ATOM 1478 O GLY A 94 4.280 15.630 -4.135 1.00 0.42 O ATOM 0 H GLY A 94 8.348 15.755 -4.836 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.752 17.202 -3.969 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.816 17.110 -5.448 1.00 0.47 H new ATOM 1482 N VAL A 95 6.121 14.403 -3.593 1.00 0.32 N ATOM 1483 CA VAL A 95 5.436 13.225 -3.024 1.00 0.26 C ATOM 1484 C VAL A 95 3.979 13.473 -2.625 1.00 0.25 C ATOM 1485 O VAL A 95 3.682 14.216 -1.694 1.00 0.29 O ATOM 1486 CB VAL A 95 6.209 12.677 -1.798 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.472 13.776 -0.779 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.456 11.516 -1.158 1.00 0.33 C ATOM 0 H VAL A 95 7.138 14.326 -3.560 1.00 0.32 H new ATOM 0 HA VAL A 95 5.423 12.492 -3.830 1.00 0.26 H new ATOM 0 HB VAL A 95 7.173 12.307 -2.149 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.016 13.362 0.070 1.00 0.40 H new ATOM 0 HG12 VAL A 95 7.066 14.565 -1.240 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.523 14.189 -0.436 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.017 11.147 -0.299 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.474 11.856 -0.830 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.338 10.713 -1.886 1.00 0.33 H new ATOM 1498 N ASN A 96 3.077 12.871 -3.379 1.00 0.24 N ATOM 1499 CA ASN A 96 1.660 12.883 -3.045 1.00 0.29 C ATOM 1500 C ASN A 96 1.280 11.532 -2.449 1.00 0.23 C ATOM 1501 O ASN A 96 2.125 10.637 -2.362 1.00 0.21 O ATOM 1502 CB ASN A 96 0.804 13.179 -4.286 1.00 0.41 C ATOM 1503 CG ASN A 96 1.009 14.580 -4.839 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.865 14.809 -6.039 1.00 2.13 O ATOM 1505 ND2 ASN A 96 1.339 15.529 -3.978 1.00 2.00 N ATOM 0 H ASN A 96 3.301 12.363 -4.235 1.00 0.24 H new ATOM 0 HA ASN A 96 1.472 13.673 -2.318 1.00 0.29 H new ATOM 0 HB2 ASN A 96 1.039 12.451 -5.063 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.248 13.046 -4.033 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.482 16.485 -4.303 1.00 2.00 H new ATOM 0 HD22 ASN A 96 1.450 15.304 -2.989 1.00 2.00 H new ATOM 1512 N TRP A 97 0.022 11.371 -2.050 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.430 10.114 -1.451 1.00 0.24 C ATOM 1514 C TRP A 97 -0.276 8.947 -2.433 1.00 0.25 C ATOM 1515 O TRP A 97 -0.072 7.802 -2.022 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.886 10.220 -0.973 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.087 11.199 0.155 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.762 12.386 0.104 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.608 11.073 1.504 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.732 13.003 1.332 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.029 12.220 2.205 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.863 10.107 2.185 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.731 12.423 3.551 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.570 10.310 3.522 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.003 11.460 4.192 1.00 0.30 C ATOM 0 H TRP A 97 -0.700 12.088 -2.128 1.00 0.25 H new ATOM 0 HA TRP A 97 0.202 9.919 -0.585 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.514 10.515 -1.814 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.226 9.235 -0.652 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.249 12.782 -0.775 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.164 13.899 1.556 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.522 9.217 1.677 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.064 13.310 4.070 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.003 9.568 4.058 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.757 11.589 5.236 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.346 9.245 -3.730 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.196 8.213 -4.743 1.00 0.29 C ATOM 1538 C GLY A 98 1.223 7.681 -4.824 1.00 0.26 C ATOM 1539 O GLY A 98 1.444 6.550 -5.257 1.00 0.27 O ATOM 0 H GLY A 98 -0.504 10.184 -4.097 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.877 7.391 -4.523 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.486 8.616 -5.713 1.00 0.29 H new ATOM 1543 N ARG A 99 2.184 8.488 -4.387 1.00 0.26 N ATOM 1544 CA ARG A 99 3.587 8.083 -4.397 1.00 0.25 C ATOM 1545 C ARG A 99 3.825 7.006 -3.356 1.00 0.21 C ATOM 1546 O ARG A 99 4.641 6.111 -3.552 1.00 0.20 O ATOM 1547 CB ARG A 99 4.516 9.272 -4.131 1.00 0.30 C ATOM 1548 CG ARG A 99 4.631 10.247 -5.292 1.00 0.70 C ATOM 1549 CD ARG A 99 5.128 9.557 -6.553 1.00 1.40 C ATOM 1550 NE ARG A 99 5.420 10.512 -7.620 1.00 1.74 N ATOM 1551 CZ ARG A 99 6.031 10.193 -8.760 1.00 2.46 C ATOM 1552 NH1 ARG A 99 6.390 8.939 -8.999 1.00 3.06 N ATOM 1553 NH2 ARG A 99 6.286 11.125 -9.664 1.00 2.98 N ATOM 0 H ARG A 99 2.018 9.426 -4.022 1.00 0.26 H new ATOM 0 HA ARG A 99 3.813 7.690 -5.388 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.156 9.810 -3.254 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.510 8.895 -3.888 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.659 10.702 -5.484 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.313 11.054 -5.025 1.00 0.70 H new ATOM 0 HD2 ARG A 99 6.026 8.984 -6.323 1.00 1.40 H new ATOM 0 HD3 ARG A 99 4.377 8.847 -6.898 1.00 1.40 H new ATOM 0 HE ARG A 99 5.139 11.483 -7.483 1.00 1.74 H new ATOM 0 HH11 ARG A 99 6.199 8.213 -8.308 1.00 3.06 H new ATOM 0 HH12 ARG A 99 6.858 8.700 -9.874 1.00 3.06 H new ATOM 0 HH21 ARG A 99 6.015 12.093 -9.489 1.00 2.98 H new ATOM 0 HH22 ARG A 99 6.754 10.876 -10.535 1.00 2.98 H new ATOM 1567 N ILE A 100 3.090 7.096 -2.258 1.00 0.22 N ATOM 1568 CA ILE A 100 3.157 6.095 -1.211 1.00 0.21 C ATOM 1569 C ILE A 100 2.583 4.784 -1.727 1.00 0.20 C ATOM 1570 O ILE A 100 3.152 3.713 -1.519 1.00 0.19 O ATOM 1571 CB ILE A 100 2.386 6.556 0.043 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.000 7.847 0.589 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.378 5.467 1.105 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.407 8.293 1.904 1.00 0.30 C ATOM 0 H ILE A 100 2.438 7.857 -2.071 1.00 0.22 H new ATOM 0 HA ILE A 100 4.200 5.951 -0.930 1.00 0.21 H new ATOM 0 HB ILE A 100 1.351 6.754 -0.237 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.073 7.704 0.715 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.868 8.641 -0.146 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.829 5.816 1.979 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.897 4.574 0.707 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.403 5.230 1.391 1.00 0.24 H new ATOM 0 HD11 ILE A 100 2.892 9.214 2.228 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.339 8.470 1.780 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.562 7.518 2.655 1.00 0.30 H new ATOM 1586 N VAL A 101 1.462 4.888 -2.426 1.00 0.21 N ATOM 1587 CA VAL A 101 0.839 3.740 -3.057 1.00 0.21 C ATOM 1588 C VAL A 101 1.815 3.072 -4.005 1.00 0.20 C ATOM 1589 O VAL A 101 2.049 1.863 -3.934 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.403 4.155 -3.854 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.087 2.936 -4.437 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.352 4.950 -2.984 1.00 0.26 C ATOM 0 H VAL A 101 0.963 5.766 -2.570 1.00 0.21 H new ATOM 0 HA VAL A 101 0.546 3.049 -2.267 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.091 4.795 -4.679 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.967 3.247 -5.000 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.397 2.414 -5.101 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.390 2.268 -3.631 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.227 5.236 -3.567 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.664 4.341 -2.135 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.849 5.847 -2.622 1.00 0.26 H new ATOM 1602 N ALA A 102 2.371 3.878 -4.899 1.00 0.19 N ATOM 1603 CA ALA A 102 3.342 3.404 -5.865 1.00 0.19 C ATOM 1604 C ALA A 102 4.527 2.755 -5.164 1.00 0.17 C ATOM 1605 O ALA A 102 4.952 1.668 -5.535 1.00 0.19 O ATOM 1606 CB ALA A 102 3.803 4.554 -6.743 1.00 0.21 C ATOM 0 H ALA A 102 2.161 4.873 -4.972 1.00 0.19 H new ATOM 0 HA ALA A 102 2.870 2.650 -6.494 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.533 4.190 -7.466 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.947 4.974 -7.271 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.261 5.325 -6.123 1.00 0.21 H new ATOM 1612 N PHE A 103 5.024 3.420 -4.125 1.00 0.16 N ATOM 1613 CA PHE A 103 6.171 2.933 -3.360 1.00 0.17 C ATOM 1614 C PHE A 103 5.919 1.526 -2.826 1.00 0.17 C ATOM 1615 O PHE A 103 6.766 0.640 -2.951 1.00 0.21 O ATOM 1616 CB PHE A 103 6.476 3.891 -2.198 1.00 0.17 C ATOM 1617 CG PHE A 103 7.636 3.458 -1.343 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.914 3.404 -1.870 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.449 3.102 -0.016 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.982 3.004 -1.095 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.514 2.700 0.765 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.783 2.652 0.223 1.00 0.26 C ATOM 0 H PHE A 103 4.647 4.306 -3.790 1.00 0.16 H new ATOM 0 HA PHE A 103 7.031 2.894 -4.028 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.684 4.882 -2.601 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.589 3.982 -1.571 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.077 3.679 -2.902 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.458 3.140 0.412 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.974 2.966 -1.520 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.355 2.424 1.797 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.619 2.339 0.831 1.00 0.26 H new ATOM 1632 N PHE A 104 4.744 1.323 -2.250 1.00 0.16 N ATOM 1633 CA PHE A 104 4.390 0.030 -1.681 1.00 0.18 C ATOM 1634 C PHE A 104 4.142 -0.994 -2.782 1.00 0.19 C ATOM 1635 O PHE A 104 4.521 -2.160 -2.659 1.00 0.23 O ATOM 1636 CB PHE A 104 3.152 0.157 -0.785 1.00 0.19 C ATOM 1637 CG PHE A 104 3.430 0.743 0.576 1.00 0.21 C ATOM 1638 CD1 PHE A 104 4.107 1.945 0.692 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.027 0.096 1.735 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.375 2.489 1.933 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.292 0.637 2.977 1.00 0.33 C ATOM 1642 CZ PHE A 104 3.921 1.811 3.096 1.00 0.30 C ATOM 0 H PHE A 104 4.019 2.036 -2.164 1.00 0.16 H new ATOM 0 HA PHE A 104 5.226 -0.314 -1.072 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.413 0.778 -1.291 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.706 -0.830 -0.659 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.430 2.464 -0.199 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.499 -0.843 1.665 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.922 3.416 2.018 1.00 0.27 H new ATOM 0 HE2 PHE A 104 2.987 0.104 3.866 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.083 2.242 4.073 1.00 0.30 H new ATOM 1652 N SER A 105 3.529 -0.545 -3.868 1.00 0.18 N ATOM 1653 CA SER A 105 3.227 -1.423 -4.986 1.00 0.21 C ATOM 1654 C SER A 105 4.507 -1.880 -5.689 1.00 0.21 C ATOM 1655 O SER A 105 4.574 -3.005 -6.187 1.00 0.23 O ATOM 1656 CB SER A 105 2.294 -0.718 -5.970 1.00 0.25 C ATOM 1657 OG SER A 105 1.086 -0.334 -5.330 1.00 1.04 O ATOM 0 H SER A 105 3.232 0.422 -3.997 1.00 0.18 H new ATOM 0 HA SER A 105 2.725 -2.310 -4.600 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.789 0.162 -6.381 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.073 -1.380 -6.807 1.00 0.25 H new ATOM 0 HG SER A 105 1.251 0.446 -4.760 1.00 1.04 H new ATOM 1663 N PHE A 106 5.524 -1.017 -5.714 1.00 0.20 N ATOM 1664 CA PHE A 106 6.801 -1.371 -6.323 1.00 0.21 C ATOM 1665 C PHE A 106 7.407 -2.557 -5.595 1.00 0.22 C ATOM 1666 O PHE A 106 7.770 -3.550 -6.218 1.00 0.24 O ATOM 1667 CB PHE A 106 7.791 -0.198 -6.304 1.00 0.23 C ATOM 1668 CG PHE A 106 7.382 0.976 -7.148 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.599 0.804 -8.279 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.790 2.257 -6.809 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.229 1.886 -9.052 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.423 3.341 -7.579 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.641 3.156 -8.700 1.00 0.33 C ATOM 0 H PHE A 106 5.487 -0.076 -5.322 1.00 0.20 H new ATOM 0 HA PHE A 106 6.608 -1.629 -7.364 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.918 0.137 -5.275 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.763 -0.554 -6.645 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.275 -0.188 -8.558 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.402 2.408 -5.932 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.618 1.740 -9.931 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.748 4.334 -7.304 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.351 4.004 -9.302 1.00 0.33 H new ATOM 1683 N GLY A 107 7.486 -2.457 -4.271 1.00 0.23 N ATOM 1684 CA GLY A 107 8.024 -3.544 -3.477 1.00 0.27 C ATOM 1685 C GLY A 107 7.247 -4.828 -3.680 1.00 0.32 C ATOM 1686 O GLY A 107 7.820 -5.914 -3.677 1.00 0.37 O ATOM 0 H GLY A 107 7.187 -1.642 -3.735 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.069 -3.706 -3.743 1.00 0.27 H new ATOM 0 HA3 GLY A 107 8.002 -3.269 -2.422 1.00 0.27 H new ATOM 1690 N GLY A 108 5.938 -4.692 -3.869 1.00 0.33 N ATOM 1691 CA GLY A 108 5.089 -5.840 -4.129 1.00 0.41 C ATOM 1692 C GLY A 108 5.486 -6.584 -5.390 1.00 0.42 C ATOM 1693 O GLY A 108 5.310 -7.794 -5.485 1.00 0.63 O ATOM 0 H GLY A 108 5.447 -3.798 -3.846 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.135 -6.521 -3.280 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.054 -5.510 -4.217 1.00 0.41 H new ATOM 1697 N ALA A 109 6.021 -5.861 -6.358 1.00 0.27 N ATOM 1698 CA ALA A 109 6.505 -6.472 -7.584 1.00 0.26 C ATOM 1699 C ALA A 109 7.959 -6.896 -7.425 1.00 0.23 C ATOM 1700 O ALA A 109 8.368 -7.957 -7.903 1.00 0.24 O ATOM 1701 CB ALA A 109 6.358 -5.500 -8.741 1.00 0.29 C ATOM 0 H ALA A 109 6.132 -4.848 -6.319 1.00 0.27 H new ATOM 0 HA ALA A 109 5.909 -7.360 -7.795 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.723 -5.966 -9.656 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.308 -5.235 -8.863 1.00 0.29 H new ATOM 0 HB3 ALA A 109 6.938 -4.600 -8.536 1.00 0.29 H new ATOM 1707 N LEU A 110 8.723 -6.060 -6.733 1.00 0.22 N ATOM 1708 CA LEU A 110 10.140 -6.294 -6.507 1.00 0.23 C ATOM 1709 C LEU A 110 10.372 -7.575 -5.730 1.00 0.21 C ATOM 1710 O LEU A 110 11.226 -8.381 -6.091 1.00 0.21 O ATOM 1711 CB LEU A 110 10.747 -5.119 -5.747 1.00 0.25 C ATOM 1712 CG LEU A 110 10.711 -3.791 -6.491 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.320 -2.693 -5.644 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.433 -3.917 -7.819 1.00 0.36 C ATOM 0 H LEU A 110 8.374 -5.199 -6.312 1.00 0.22 H new ATOM 0 HA LEU A 110 10.622 -6.392 -7.480 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.218 -5.004 -4.801 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.783 -5.357 -5.506 1.00 0.25 H new ATOM 0 HG LEU A 110 9.673 -3.526 -6.689 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.286 -1.751 -6.191 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.757 -2.595 -4.716 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.356 -2.943 -5.415 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.401 -2.962 -8.343 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.471 -4.200 -7.643 1.00 0.36 H new ATOM 0 HD23 LEU A 110 10.947 -4.680 -8.427 1.00 0.36 H new ATOM 1726 N CYS A 111 9.609 -7.760 -4.664 1.00 0.21 N ATOM 1727 CA CYS A 111 9.752 -8.935 -3.822 1.00 0.21 C ATOM 1728 C CYS A 111 9.546 -10.212 -4.630 1.00 0.21 C ATOM 1729 O CYS A 111 10.242 -11.206 -4.425 1.00 0.25 O ATOM 1730 CB CYS A 111 8.772 -8.876 -2.649 1.00 0.22 C ATOM 1731 SG CYS A 111 7.039 -8.728 -3.128 1.00 1.34 S ATOM 0 H CYS A 111 8.884 -7.110 -4.362 1.00 0.21 H new ATOM 0 HA CYS A 111 10.767 -8.947 -3.424 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.893 -9.775 -2.045 1.00 0.22 H new ATOM 0 HB3 CYS A 111 9.034 -8.029 -2.015 1.00 0.22 H new ATOM 0 HG CYS A 111 6.797 -7.510 -3.511 1.00 1.34 H new ATOM 1737 N VAL A 112 8.612 -10.167 -5.570 1.00 0.19 N ATOM 1738 CA VAL A 112 8.304 -11.321 -6.394 1.00 0.20 C ATOM 1739 C VAL A 112 9.423 -11.590 -7.389 1.00 0.22 C ATOM 1740 O VAL A 112 9.933 -12.711 -7.472 1.00 0.25 O ATOM 1741 CB VAL A 112 6.983 -11.128 -7.155 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.714 -12.321 -8.055 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.834 -10.926 -6.182 1.00 0.25 C ATOM 0 H VAL A 112 8.054 -9.339 -5.779 1.00 0.19 H new ATOM 0 HA VAL A 112 8.203 -12.176 -5.726 1.00 0.20 H new ATOM 0 HB VAL A 112 7.068 -10.237 -7.777 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.775 -12.170 -8.588 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.527 -12.425 -8.774 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.647 -13.225 -7.450 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.906 -10.791 -6.738 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.746 -11.800 -5.536 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.024 -10.042 -5.573 1.00 0.25 H new ATOM 1753 N GLU A 113 9.806 -10.563 -8.142 1.00 0.22 N ATOM 1754 CA GLU A 113 10.876 -10.711 -9.123 1.00 0.25 C ATOM 1755 C GLU A 113 12.178 -11.097 -8.431 1.00 0.25 C ATOM 1756 O GLU A 113 13.023 -11.767 -9.012 1.00 0.30 O ATOM 1757 CB GLU A 113 11.074 -9.438 -9.958 1.00 0.29 C ATOM 1758 CG GLU A 113 11.550 -8.230 -9.169 1.00 0.30 C ATOM 1759 CD GLU A 113 11.939 -7.072 -10.065 1.00 0.39 C ATOM 1760 OE1 GLU A 113 11.036 -6.415 -10.622 1.00 0.51 O ATOM 1761 OE2 GLU A 113 13.154 -6.827 -10.232 1.00 0.50 O ATOM 0 H GLU A 113 9.397 -9.630 -8.093 1.00 0.22 H new ATOM 0 HA GLU A 113 10.582 -11.507 -9.807 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.795 -9.646 -10.748 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.131 -9.189 -10.445 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.761 -7.910 -8.488 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.405 -8.514 -8.555 1.00 0.30 H new ATOM 1768 N SER A 114 12.316 -10.691 -7.175 1.00 0.23 N ATOM 1769 CA SER A 114 13.478 -11.041 -6.379 1.00 0.28 C ATOM 1770 C SER A 114 13.547 -12.553 -6.210 1.00 0.27 C ATOM 1771 O SER A 114 14.614 -13.152 -6.309 1.00 0.31 O ATOM 1772 CB SER A 114 13.417 -10.349 -5.012 1.00 0.33 C ATOM 1773 OG SER A 114 14.656 -10.441 -4.328 1.00 0.99 O ATOM 0 H SER A 114 11.631 -10.115 -6.686 1.00 0.23 H new ATOM 0 HA SER A 114 14.377 -10.701 -6.893 1.00 0.28 H new ATOM 0 HB2 SER A 114 13.151 -9.300 -5.145 1.00 0.33 H new ATOM 0 HB3 SER A 114 12.632 -10.803 -4.408 1.00 0.33 H new ATOM 0 HG SER A 114 14.803 -11.366 -4.040 1.00 0.99 H new ATOM 1779 N VAL A 115 12.394 -13.169 -5.989 1.00 0.28 N ATOM 1780 CA VAL A 115 12.318 -14.610 -5.825 1.00 0.33 C ATOM 1781 C VAL A 115 12.600 -15.308 -7.148 1.00 0.37 C ATOM 1782 O VAL A 115 13.388 -16.253 -7.206 1.00 0.42 O ATOM 1783 CB VAL A 115 10.933 -15.033 -5.303 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.859 -16.542 -5.134 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.629 -14.331 -3.992 1.00 0.41 C ATOM 0 H VAL A 115 11.497 -12.689 -5.919 1.00 0.28 H new ATOM 0 HA VAL A 115 13.071 -14.904 -5.094 1.00 0.33 H new ATOM 0 HB VAL A 115 10.182 -14.738 -6.036 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.872 -16.819 -4.764 1.00 0.45 H new ATOM 0 HG12 VAL A 115 11.035 -17.025 -6.095 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.617 -16.866 -4.421 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.647 -14.639 -3.634 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.385 -14.597 -3.253 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.637 -13.252 -4.147 1.00 0.41 H new ATOM 1795 N ASP A 116 11.961 -14.823 -8.206 1.00 0.38 N ATOM 1796 CA ASP A 116 12.149 -15.378 -9.547 1.00 0.46 C ATOM 1797 C ASP A 116 13.601 -15.255 -10.005 1.00 0.47 C ATOM 1798 O ASP A 116 14.082 -16.058 -10.799 1.00 0.56 O ATOM 1799 CB ASP A 116 11.227 -14.678 -10.552 1.00 0.49 C ATOM 1800 CG ASP A 116 11.511 -15.090 -11.983 1.00 1.08 C ATOM 1801 OD1 ASP A 116 11.250 -16.262 -12.334 1.00 1.23 O ATOM 1802 OD2 ASP A 116 11.987 -14.242 -12.767 1.00 1.89 O ATOM 0 H ASP A 116 11.305 -14.043 -8.164 1.00 0.38 H new ATOM 0 HA ASP A 116 11.894 -16.437 -9.502 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.189 -14.908 -10.310 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.345 -13.598 -10.458 1.00 0.49 H new ATOM 1807 N LYS A 117 14.298 -14.251 -9.495 1.00 0.43 N ATOM 1808 CA LYS A 117 15.703 -14.046 -9.831 1.00 0.49 C ATOM 1809 C LYS A 117 16.614 -14.770 -8.838 1.00 0.47 C ATOM 1810 O LYS A 117 17.809 -14.478 -8.748 1.00 0.52 O ATOM 1811 CB LYS A 117 16.023 -12.546 -9.880 1.00 0.53 C ATOM 1812 CG LYS A 117 15.296 -11.813 -11.002 1.00 0.61 C ATOM 1813 CD LYS A 117 15.447 -10.301 -10.887 1.00 1.20 C ATOM 1814 CE LYS A 117 14.664 -9.580 -11.978 1.00 1.32 C ATOM 1815 NZ LYS A 117 14.761 -8.102 -11.857 1.00 1.90 N ATOM 0 H LYS A 117 13.915 -13.564 -8.846 1.00 0.43 H new ATOM 0 HA LYS A 117 15.888 -14.470 -10.818 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.755 -12.093 -8.926 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.098 -12.414 -10.005 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.686 -12.144 -11.964 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.238 -12.075 -10.980 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.098 -9.972 -9.908 1.00 1.20 H new ATOM 0 HD3 LYS A 117 16.501 -10.033 -10.956 1.00 1.20 H new ATOM 0 HE2 LYS A 117 15.038 -9.888 -12.955 1.00 1.32 H new ATOM 0 HE3 LYS A 117 13.617 -9.879 -11.929 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.755 -7.675 -12.805 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 13.951 -7.744 -11.311 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.645 -7.851 -11.370 1.00 1.90 H new ATOM 1829 N GLU A 118 16.033 -15.721 -8.099 1.00 0.45 N ATOM 1830 CA GLU A 118 16.775 -16.575 -7.164 1.00 0.49 C ATOM 1831 C GLU A 118 17.381 -15.766 -6.024 1.00 0.45 C ATOM 1832 O GLU A 118 18.283 -16.230 -5.328 1.00 0.55 O ATOM 1833 CB GLU A 118 17.875 -17.365 -7.886 1.00 0.59 C ATOM 1834 CG GLU A 118 17.370 -18.549 -8.700 1.00 1.07 C ATOM 1835 CD GLU A 118 16.504 -18.150 -9.876 1.00 1.72 C ATOM 1836 OE1 GLU A 118 17.026 -17.496 -10.804 1.00 2.54 O ATOM 1837 OE2 GLU A 118 15.295 -18.461 -9.862 1.00 1.89 O ATOM 0 H GLU A 118 15.033 -15.921 -8.132 1.00 0.45 H new ATOM 0 HA GLU A 118 16.058 -17.279 -6.741 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.416 -16.689 -8.548 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.590 -17.727 -7.147 1.00 0.59 H new ATOM 0 HG2 GLU A 118 18.224 -19.119 -9.065 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.800 -19.211 -8.048 1.00 1.07 H new ATOM 1844 N MET A 119 16.856 -14.574 -5.814 1.00 0.35 N ATOM 1845 CA MET A 119 17.357 -13.687 -4.778 1.00 0.33 C ATOM 1846 C MET A 119 16.401 -13.691 -3.593 1.00 0.31 C ATOM 1847 O MET A 119 15.790 -12.673 -3.263 1.00 0.27 O ATOM 1848 CB MET A 119 17.520 -12.264 -5.320 1.00 0.34 C ATOM 1849 CG MET A 119 18.366 -12.183 -6.579 1.00 0.41 C ATOM 1850 SD MET A 119 18.493 -10.506 -7.230 1.00 0.47 S ATOM 1851 CE MET A 119 16.766 -10.042 -7.311 1.00 0.44 C ATOM 0 H MET A 119 16.076 -14.194 -6.351 1.00 0.35 H new ATOM 0 HA MET A 119 18.334 -14.044 -4.452 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.534 -11.849 -5.528 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.972 -11.640 -4.549 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.366 -12.561 -6.364 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.937 -12.832 -7.342 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.572 -9.524 -8.250 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.146 -10.937 -7.255 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.527 -9.382 -6.477 1.00 0.44 H new ATOM 1861 N GLN A 120 16.272 -14.847 -2.962 1.00 0.36 N ATOM 1862 CA GLN A 120 15.344 -15.024 -1.850 1.00 0.39 C ATOM 1863 C GLN A 120 15.854 -14.337 -0.586 1.00 0.41 C ATOM 1864 O GLN A 120 15.152 -14.272 0.421 1.00 0.47 O ATOM 1865 CB GLN A 120 15.107 -16.510 -1.578 1.00 0.49 C ATOM 1866 CG GLN A 120 14.381 -17.238 -2.704 1.00 0.53 C ATOM 1867 CD GLN A 120 14.129 -18.702 -2.387 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.000 -19.081 -1.223 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.043 -19.530 -3.418 1.00 0.70 N ATOM 0 H GLN A 120 16.802 -15.685 -3.202 1.00 0.36 H new ATOM 0 HA GLN A 120 14.399 -14.560 -2.133 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.068 -16.995 -1.406 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.528 -16.613 -0.660 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.429 -16.743 -2.897 1.00 0.53 H new ATOM 0 HG3 GLN A 120 14.970 -17.164 -3.618 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.156 -19.175 -4.368 1.00 0.70 H new ATOM 0 HE22 GLN A 120 13.864 -20.522 -3.262 1.00 0.70 H new ATOM 1878 N VAL A 121 17.078 -13.847 -0.631 1.00 0.39 N ATOM 1879 CA VAL A 121 17.608 -13.053 0.464 1.00 0.44 C ATOM 1880 C VAL A 121 17.316 -11.571 0.250 1.00 0.38 C ATOM 1881 O VAL A 121 17.117 -10.821 1.203 1.00 0.47 O ATOM 1882 CB VAL A 121 19.123 -13.265 0.645 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.405 -14.680 1.122 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.872 -12.974 -0.646 1.00 0.92 C ATOM 0 H VAL A 121 17.723 -13.983 -1.410 1.00 0.39 H new ATOM 0 HA VAL A 121 17.108 -13.389 1.372 1.00 0.44 H new ATOM 0 HB VAL A 121 19.477 -12.566 1.403 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.480 -14.815 1.245 1.00 0.98 H new ATOM 0 HG12 VAL A 121 18.906 -14.848 2.076 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.032 -15.393 0.387 1.00 0.98 H new ATOM 0 HG21 VAL A 121 20.939 -13.131 -0.491 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.517 -13.642 -1.431 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.697 -11.940 -0.943 1.00 0.92 H new ATOM 1894 N LEU A 122 17.247 -11.158 -1.010 1.00 0.30 N ATOM 1895 CA LEU A 122 17.016 -9.761 -1.336 1.00 0.27 C ATOM 1896 C LEU A 122 15.579 -9.357 -1.063 1.00 0.23 C ATOM 1897 O LEU A 122 15.302 -8.194 -0.779 1.00 0.23 O ATOM 1898 CB LEU A 122 17.372 -9.465 -2.788 1.00 0.28 C ATOM 1899 CG LEU A 122 18.811 -9.017 -3.026 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.787 -10.116 -2.655 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.990 -8.604 -4.471 1.00 0.41 C ATOM 0 H LEU A 122 17.348 -11.771 -1.819 1.00 0.30 H new ATOM 0 HA LEU A 122 17.668 -9.172 -0.691 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.184 -10.360 -3.381 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.701 -8.690 -3.159 1.00 0.28 H new ATOM 0 HG LEU A 122 19.019 -8.158 -2.388 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.806 -9.773 -2.833 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.668 -10.368 -1.601 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.590 -10.999 -3.263 1.00 0.39 H new ATOM 0 HD21 LEU A 122 20.020 -8.285 -4.633 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.765 -9.449 -5.122 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.315 -7.780 -4.700 1.00 0.41 H new ATOM 1913 N VAL A 123 14.668 -10.319 -1.135 1.00 0.23 N ATOM 1914 CA VAL A 123 13.264 -10.052 -0.862 1.00 0.25 C ATOM 1915 C VAL A 123 13.079 -9.539 0.567 1.00 0.27 C ATOM 1916 O VAL A 123 12.242 -8.674 0.827 1.00 0.31 O ATOM 1917 CB VAL A 123 12.390 -11.304 -1.100 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.838 -12.469 -0.238 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.932 -10.985 -0.846 1.00 0.31 C ATOM 0 H VAL A 123 14.876 -11.287 -1.379 1.00 0.23 H new ATOM 0 HA VAL A 123 12.937 -9.279 -1.558 1.00 0.25 H new ATOM 0 HB VAL A 123 12.510 -11.600 -2.142 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.201 -13.332 -0.432 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.872 -12.721 -0.475 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.764 -12.193 0.814 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.329 -11.877 -1.018 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.806 -10.655 0.185 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.610 -10.193 -1.522 1.00 0.31 H new ATOM 1929 N SER A 124 13.895 -10.051 1.478 1.00 0.29 N ATOM 1930 CA SER A 124 13.855 -9.618 2.868 1.00 0.35 C ATOM 1931 C SER A 124 14.449 -8.217 2.989 1.00 0.34 C ATOM 1932 O SER A 124 14.006 -7.404 3.802 1.00 0.44 O ATOM 1933 CB SER A 124 14.622 -10.609 3.755 1.00 0.43 C ATOM 1934 OG SER A 124 14.470 -10.299 5.130 1.00 1.32 O ATOM 0 H SER A 124 14.593 -10.767 1.279 1.00 0.29 H new ATOM 0 HA SER A 124 12.819 -9.590 3.204 1.00 0.35 H new ATOM 0 HB2 SER A 124 14.263 -11.621 3.567 1.00 0.43 H new ATOM 0 HB3 SER A 124 15.680 -10.592 3.492 1.00 0.43 H new ATOM 0 HG SER A 124 14.968 -10.948 5.669 1.00 1.32 H new ATOM 1940 N ARG A 125 15.435 -7.933 2.144 1.00 0.28 N ATOM 1941 CA ARG A 125 16.096 -6.635 2.148 1.00 0.31 C ATOM 1942 C ARG A 125 15.150 -5.566 1.620 1.00 0.24 C ATOM 1943 O ARG A 125 15.168 -4.429 2.081 1.00 0.24 O ATOM 1944 CB ARG A 125 17.370 -6.667 1.292 1.00 0.41 C ATOM 1945 CG ARG A 125 18.395 -7.709 1.733 1.00 0.91 C ATOM 1946 CD ARG A 125 19.628 -7.710 0.833 1.00 0.74 C ATOM 1947 NE ARG A 125 20.546 -8.797 1.159 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.806 -8.860 0.734 1.00 1.24 C ATOM 1949 NH1 ARG A 125 22.331 -7.847 0.051 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.551 -9.922 1.018 1.00 1.84 N ATOM 0 H ARG A 125 15.793 -8.586 1.447 1.00 0.28 H new ATOM 0 HA ARG A 125 16.374 -6.398 3.175 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.093 -6.862 0.256 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.836 -5.682 1.317 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.696 -7.510 2.761 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.936 -8.698 1.721 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.316 -7.799 -0.208 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.147 -6.757 0.930 1.00 0.74 H new ATOM 0 HE ARG A 125 20.201 -9.555 1.748 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.768 -7.020 -0.148 1.00 1.28 H new ATOM 0 HH12 ARG A 125 23.297 -7.897 -0.274 1.00 1.28 H new ATOM 0 HH21 ARG A 125 22.158 -10.690 1.562 1.00 1.84 H new ATOM 0 HH22 ARG A 125 23.516 -9.970 0.692 1.00 1.84 H new ATOM 1964 N ILE A 126 14.316 -5.951 0.661 1.00 0.21 N ATOM 1965 CA ILE A 126 13.329 -5.050 0.078 1.00 0.19 C ATOM 1966 C ILE A 126 12.433 -4.456 1.156 1.00 0.19 C ATOM 1967 O ILE A 126 12.279 -3.235 1.245 1.00 0.19 O ATOM 1968 CB ILE A 126 12.481 -5.792 -0.972 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.342 -6.104 -2.190 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.260 -4.979 -1.372 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.637 -6.912 -3.249 1.00 0.23 C ATOM 0 H ILE A 126 14.305 -6.892 0.267 1.00 0.21 H new ATOM 0 HA ILE A 126 13.860 -4.234 -0.412 1.00 0.19 H new ATOM 0 HB ILE A 126 12.122 -6.724 -0.535 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.684 -5.167 -2.630 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.230 -6.646 -1.865 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.683 -5.531 -2.114 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.641 -4.796 -0.494 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.580 -4.027 -1.795 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.317 -7.092 -4.082 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.319 -7.866 -2.828 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.765 -6.364 -3.604 1.00 0.23 H new ATOM 1983 N ALA A 127 11.854 -5.323 1.978 1.00 0.22 N ATOM 1984 CA ALA A 127 11.018 -4.885 3.085 1.00 0.25 C ATOM 1985 C ALA A 127 11.783 -3.943 4.007 1.00 0.24 C ATOM 1986 O ALA A 127 11.237 -2.954 4.494 1.00 0.26 O ATOM 1987 CB ALA A 127 10.505 -6.083 3.864 1.00 0.30 C ATOM 0 H ALA A 127 11.949 -6.335 1.897 1.00 0.22 H new ATOM 0 HA ALA A 127 10.167 -4.341 2.674 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.881 -5.740 4.689 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.916 -6.721 3.205 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.349 -6.649 4.258 1.00 0.30 H new ATOM 1993 N ALA A 128 13.055 -4.251 4.224 1.00 0.22 N ATOM 1994 CA ALA A 128 13.906 -3.441 5.080 1.00 0.23 C ATOM 1995 C ALA A 128 14.126 -2.055 4.480 1.00 0.19 C ATOM 1996 O ALA A 128 13.994 -1.041 5.173 1.00 0.19 O ATOM 1997 CB ALA A 128 15.235 -4.139 5.308 1.00 0.27 C ATOM 0 H ALA A 128 13.521 -5.061 3.815 1.00 0.22 H new ATOM 0 HA ALA A 128 13.405 -3.315 6.040 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.864 -3.523 5.951 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.062 -5.103 5.786 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.734 -4.293 4.351 1.00 0.27 H new ATOM 2003 N TRP A 129 14.444 -2.013 3.190 1.00 0.17 N ATOM 2004 CA TRP A 129 14.681 -0.746 2.503 1.00 0.17 C ATOM 2005 C TRP A 129 13.418 0.103 2.496 1.00 0.15 C ATOM 2006 O TRP A 129 13.468 1.309 2.756 1.00 0.18 O ATOM 2007 CB TRP A 129 15.144 -0.965 1.058 1.00 0.20 C ATOM 2008 CG TRP A 129 16.388 -1.786 0.930 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.406 -1.892 1.832 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.750 -2.606 -0.185 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.375 -2.737 1.349 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.995 -3.187 0.111 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.138 -2.908 -1.404 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.640 -4.052 -0.768 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.779 -3.765 -2.276 1.00 0.47 C ATOM 2016 CH2 TRP A 129 18.020 -4.328 -1.954 1.00 0.50 C ATOM 0 H TRP A 129 14.544 -2.839 2.600 1.00 0.17 H new ATOM 0 HA TRP A 129 15.470 -0.229 3.048 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.343 -1.451 0.501 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.313 0.006 0.592 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.444 -1.386 2.785 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.237 -2.989 1.833 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.181 -2.479 -1.660 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.596 -4.489 -0.522 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.316 -4.005 -3.222 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.497 -4.994 -2.658 1.00 0.50 H new ATOM 2027 N MET A 130 12.285 -0.533 2.214 1.00 0.16 N ATOM 2028 CA MET A 130 11.016 0.178 2.149 1.00 0.21 C ATOM 2029 C MET A 130 10.641 0.725 3.516 1.00 0.19 C ATOM 2030 O MET A 130 10.225 1.875 3.637 1.00 0.21 O ATOM 2031 CB MET A 130 9.897 -0.725 1.634 1.00 0.29 C ATOM 2032 CG MET A 130 10.021 -1.107 0.169 1.00 0.33 C ATOM 2033 SD MET A 130 8.644 -2.124 -0.388 1.00 0.71 S ATOM 2034 CE MET A 130 7.267 -1.059 0.033 1.00 0.29 C ATOM 0 H MET A 130 12.221 -1.534 2.028 1.00 0.16 H new ATOM 0 HA MET A 130 11.140 1.006 1.451 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.877 -1.635 2.233 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.942 -0.222 1.786 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.071 -0.203 -0.437 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.955 -1.647 0.014 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.342 -1.495 -0.344 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.205 -0.956 1.116 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.415 -0.077 -0.417 1.00 0.29 H new ATOM 2044 N ALA A 131 10.807 -0.101 4.544 1.00 0.18 N ATOM 2045 CA ALA A 131 10.504 0.305 5.908 1.00 0.20 C ATOM 2046 C ALA A 131 11.369 1.487 6.316 1.00 0.21 C ATOM 2047 O ALA A 131 10.900 2.420 6.960 1.00 0.23 O ATOM 2048 CB ALA A 131 10.706 -0.861 6.862 1.00 0.23 C ATOM 0 H ALA A 131 11.151 -1.057 4.456 1.00 0.18 H new ATOM 0 HA ALA A 131 9.460 0.613 5.956 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.476 -0.543 7.879 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.045 -1.681 6.580 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.742 -1.196 6.812 1.00 0.23 H new ATOM 2054 N THR A 132 12.629 1.445 5.911 1.00 0.22 N ATOM 2055 CA THR A 132 13.566 2.520 6.196 1.00 0.25 C ATOM 2056 C THR A 132 13.117 3.822 5.537 1.00 0.24 C ATOM 2057 O THR A 132 12.943 4.839 6.211 1.00 0.25 O ATOM 2058 CB THR A 132 14.981 2.151 5.711 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.391 0.918 6.317 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.981 3.245 6.058 1.00 0.37 C ATOM 0 H THR A 132 13.028 0.671 5.380 1.00 0.22 H new ATOM 0 HA THR A 132 13.589 2.664 7.276 1.00 0.25 H new ATOM 0 HB THR A 132 14.954 2.041 4.627 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.796 0.196 6.024 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.971 2.958 5.704 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.681 4.177 5.580 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.008 3.384 7.139 1.00 0.37 H new ATOM 2068 N TYR A 133 12.919 3.785 4.223 1.00 0.23 N ATOM 2069 CA TYR A 133 12.490 4.966 3.479 1.00 0.24 C ATOM 2070 C TYR A 133 11.170 5.500 4.035 1.00 0.21 C ATOM 2071 O TYR A 133 11.004 6.708 4.217 1.00 0.23 O ATOM 2072 CB TYR A 133 12.343 4.623 1.994 1.00 0.27 C ATOM 2073 CG TYR A 133 11.869 5.775 1.131 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.766 6.707 0.624 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.525 5.917 0.810 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.334 7.749 -0.175 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.087 6.951 0.010 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.993 7.865 -0.478 1.00 0.51 C ATOM 2079 OH TYR A 133 10.561 8.887 -1.287 1.00 0.61 O ATOM 0 H TYR A 133 13.049 2.951 3.651 1.00 0.23 H new ATOM 0 HA TYR A 133 13.247 5.743 3.589 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.304 4.274 1.617 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.641 3.795 1.892 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.816 6.616 0.858 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.810 5.204 1.194 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.042 8.468 -0.560 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.039 7.043 -0.232 1.00 0.45 H new ATOM 0 HH TYR A 133 10.822 8.704 -2.214 1.00 0.61 H new ATOM 2089 N LEU A 134 10.251 4.587 4.323 1.00 0.20 N ATOM 2090 CA LEU A 134 8.946 4.941 4.858 1.00 0.20 C ATOM 2091 C LEU A 134 9.071 5.584 6.239 1.00 0.21 C ATOM 2092 O LEU A 134 8.558 6.675 6.467 1.00 0.24 O ATOM 2093 CB LEU A 134 8.063 3.689 4.920 1.00 0.20 C ATOM 2094 CG LEU A 134 6.775 3.814 5.735 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.872 4.886 5.157 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.052 2.479 5.785 1.00 0.26 C ATOM 0 H LEU A 134 10.390 3.585 4.192 1.00 0.20 H new ATOM 0 HA LEU A 134 8.483 5.674 4.197 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.798 3.405 3.901 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.654 2.873 5.335 1.00 0.20 H new ATOM 0 HG LEU A 134 7.039 4.106 6.751 1.00 0.22 H new ATOM 0 HD11 LEU A 134 4.962 4.956 5.754 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.390 5.845 5.171 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.613 4.629 4.130 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.137 2.582 6.368 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.803 2.162 4.772 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.697 1.733 6.250 1.00 0.26 H new ATOM 2108 N ASN A 135 9.777 4.922 7.141 1.00 0.24 N ATOM 2109 CA ASN A 135 9.883 5.382 8.524 1.00 0.29 C ATOM 2110 C ASN A 135 10.715 6.658 8.639 1.00 0.30 C ATOM 2111 O ASN A 135 10.411 7.534 9.448 1.00 0.33 O ATOM 2112 CB ASN A 135 10.485 4.273 9.399 1.00 0.37 C ATOM 2113 CG ASN A 135 10.772 4.724 10.823 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.880 4.745 11.668 1.00 1.17 O ATOM 2115 ND2 ASN A 135 12.029 5.041 11.114 1.00 1.46 N ATOM 0 H ASN A 135 10.288 4.062 6.944 1.00 0.24 H new ATOM 0 HA ASN A 135 8.878 5.617 8.874 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.799 3.426 9.424 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.410 3.921 8.943 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.279 5.313 12.065 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.744 5.012 10.387 1.00 1.46 H new ATOM 2122 N ASP A 136 11.747 6.772 7.821 1.00 0.32 N ATOM 2123 CA ASP A 136 12.678 7.887 7.946 1.00 0.37 C ATOM 2124 C ASP A 136 12.258 9.088 7.102 1.00 0.34 C ATOM 2125 O ASP A 136 12.085 10.188 7.625 1.00 0.36 O ATOM 2126 CB ASP A 136 14.094 7.450 7.563 1.00 0.46 C ATOM 2127 CG ASP A 136 15.118 8.543 7.792 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.553 8.720 8.951 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.505 9.217 6.817 1.00 2.07 O ATOM 0 H ASP A 136 11.963 6.116 7.070 1.00 0.32 H new ATOM 0 HA ASP A 136 12.665 8.197 8.991 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.370 6.570 8.145 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.109 7.156 6.514 1.00 0.46 H new ATOM 2134 N HIS A 137 12.101 8.880 5.799 1.00 0.33 N ATOM 2135 CA HIS A 137 11.875 9.994 4.873 1.00 0.35 C ATOM 2136 C HIS A 137 10.395 10.276 4.638 1.00 0.29 C ATOM 2137 O HIS A 137 9.980 11.433 4.569 1.00 0.32 O ATOM 2138 CB HIS A 137 12.574 9.742 3.530 1.00 0.45 C ATOM 2139 CG HIS A 137 14.066 9.765 3.630 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.863 8.666 3.385 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.909 10.769 3.960 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.127 8.998 3.564 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.183 10.269 3.912 1.00 1.34 N ATOM 0 H HIS A 137 12.125 7.960 5.359 1.00 0.33 H new ATOM 0 HA HIS A 137 12.306 10.876 5.347 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.257 8.775 3.138 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.252 10.497 2.813 1.00 0.45 H new ATOM 0 HD1 HIS A 137 14.528 7.743 3.109 1.00 1.07 H new ATOM 0 HD2 HIS A 137 14.629 11.780 4.215 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.974 8.339 3.445 1.00 0.95 H new ATOM 2152 N LEU A 138 9.607 9.221 4.517 1.00 0.26 N ATOM 2153 CA LEU A 138 8.214 9.346 4.107 1.00 0.25 C ATOM 2154 C LEU A 138 7.316 9.759 5.275 1.00 0.24 C ATOM 2155 O LEU A 138 6.426 10.597 5.119 1.00 0.25 O ATOM 2156 CB LEU A 138 7.749 8.017 3.513 1.00 0.23 C ATOM 2157 CG LEU A 138 6.391 8.035 2.818 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.383 9.051 1.689 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.061 6.650 2.289 1.00 0.22 C ATOM 0 H LEU A 138 9.908 8.263 4.697 1.00 0.26 H new ATOM 0 HA LEU A 138 8.140 10.132 3.355 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.498 7.680 2.796 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.717 7.276 4.312 1.00 0.23 H new ATOM 0 HG LEU A 138 5.630 8.325 3.543 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.406 9.050 1.205 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.587 10.043 2.091 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.150 8.790 0.959 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.090 6.671 1.794 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.825 6.341 1.576 1.00 0.22 H new ATOM 0 HD23 LEU A 138 6.031 5.942 3.117 1.00 0.22 H new ATOM 2171 N GLU A 139 7.573 9.171 6.440 1.00 0.26 N ATOM 2172 CA GLU A 139 6.793 9.431 7.656 1.00 0.29 C ATOM 2173 C GLU A 139 6.625 10.936 7.943 1.00 0.30 C ATOM 2174 O GLU A 139 5.501 11.380 8.189 1.00 0.30 O ATOM 2175 CB GLU A 139 7.439 8.702 8.847 1.00 0.36 C ATOM 2176 CG GLU A 139 6.580 8.635 10.104 1.00 0.52 C ATOM 2177 CD GLU A 139 6.691 9.874 10.969 1.00 1.00 C ATOM 2178 OE1 GLU A 139 7.801 10.159 11.464 1.00 1.46 O ATOM 2179 OE2 GLU A 139 5.669 10.561 11.169 1.00 1.74 O ATOM 0 H GLU A 139 8.329 8.499 6.572 1.00 0.26 H new ATOM 0 HA GLU A 139 5.787 9.042 7.498 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.687 7.686 8.540 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.377 9.199 9.092 1.00 0.36 H new ATOM 0 HG2 GLU A 139 5.538 8.492 9.817 1.00 0.52 H new ATOM 0 HG3 GLU A 139 6.872 7.763 10.690 1.00 0.52 H new ATOM 2186 N PRO A 140 7.714 11.752 7.917 1.00 0.33 N ATOM 2187 CA PRO A 140 7.615 13.200 8.152 1.00 0.36 C ATOM 2188 C PRO A 140 6.566 13.882 7.276 1.00 0.31 C ATOM 2189 O PRO A 140 5.884 14.802 7.724 1.00 0.36 O ATOM 2190 CB PRO A 140 9.010 13.724 7.807 1.00 0.42 C ATOM 2191 CG PRO A 140 9.914 12.569 8.041 1.00 0.42 C ATOM 2192 CD PRO A 140 9.118 11.339 7.693 1.00 0.35 C ATOM 0 HA PRO A 140 7.303 13.409 9.175 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.061 14.064 6.773 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.281 14.573 8.435 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.808 12.642 7.422 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.246 12.538 9.079 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.285 11.033 6.660 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.392 10.493 8.324 1.00 0.35 H new ATOM 2200 N TRP A 141 6.431 13.433 6.031 1.00 0.28 N ATOM 2201 CA TRP A 141 5.447 14.016 5.129 1.00 0.25 C ATOM 2202 C TRP A 141 4.055 13.493 5.470 1.00 0.22 C ATOM 2203 O TRP A 141 3.085 14.251 5.519 1.00 0.22 O ATOM 2204 CB TRP A 141 5.781 13.707 3.660 1.00 0.29 C ATOM 2205 CG TRP A 141 4.880 14.427 2.702 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.067 15.675 2.180 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.639 13.950 2.166 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.017 16.004 1.359 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.129 14.961 1.332 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.911 12.766 2.310 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.924 14.825 0.648 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.717 12.632 1.630 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.232 13.656 0.810 1.00 0.36 C ATOM 0 H TRP A 141 6.984 12.676 5.629 1.00 0.28 H new ATOM 0 HA TRP A 141 5.470 15.098 5.258 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.816 13.986 3.460 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.702 12.633 3.491 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.917 16.310 2.383 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.915 16.883 0.851 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.276 11.970 2.942 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.549 15.614 0.013 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.147 11.720 1.733 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.293 13.521 0.294 1.00 0.36 H new ATOM 2224 N ILE A 142 3.978 12.194 5.729 1.00 0.20 N ATOM 2225 CA ILE A 142 2.718 11.535 6.042 1.00 0.19 C ATOM 2226 C ILE A 142 2.047 12.185 7.248 1.00 0.20 C ATOM 2227 O ILE A 142 0.941 12.718 7.142 1.00 0.20 O ATOM 2228 CB ILE A 142 2.948 10.032 6.322 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.450 9.328 5.062 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.675 9.367 6.824 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.843 7.891 5.295 1.00 0.23 C ATOM 0 H ILE A 142 4.785 11.570 5.728 1.00 0.20 H new ATOM 0 HA ILE A 142 2.062 11.642 5.178 1.00 0.19 H new ATOM 0 HB ILE A 142 3.705 9.946 7.101 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.672 9.365 4.300 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.308 9.872 4.668 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.866 8.311 7.013 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.353 9.848 7.748 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.892 9.465 6.072 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.190 7.452 4.359 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.643 7.848 6.034 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.981 7.333 5.660 1.00 0.23 H new ATOM 2243 N GLN A 143 2.736 12.166 8.382 1.00 0.25 N ATOM 2244 CA GLN A 143 2.178 12.666 9.631 1.00 0.30 C ATOM 2245 C GLN A 143 1.900 14.167 9.553 1.00 0.29 C ATOM 2246 O GLN A 143 0.948 14.661 10.158 1.00 0.31 O ATOM 2247 CB GLN A 143 3.135 12.363 10.785 1.00 0.40 C ATOM 2248 CG GLN A 143 2.532 12.577 12.167 1.00 0.51 C ATOM 2249 CD GLN A 143 1.297 11.725 12.403 1.00 0.95 C ATOM 2250 OE1 GLN A 143 1.400 10.583 12.851 1.00 1.51 O ATOM 2251 NE2 GLN A 143 0.123 12.271 12.127 1.00 1.60 N ATOM 0 H GLN A 143 3.688 11.807 8.462 1.00 0.25 H new ATOM 0 HA GLN A 143 1.229 12.160 9.808 1.00 0.30 H new ATOM 0 HB2 GLN A 143 3.470 11.329 10.703 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.019 12.993 10.685 1.00 0.40 H new ATOM 0 HG2 GLN A 143 3.280 12.345 12.926 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.272 13.629 12.287 1.00 0.51 H new ATOM 0 HE21 GLN A 143 0.076 13.220 11.757 1.00 1.60 H new ATOM 0 HE22 GLN A 143 -0.735 11.742 12.285 1.00 1.60 H new ATOM 2260 N GLU A 144 2.718 14.881 8.786 1.00 0.29 N ATOM 2261 CA GLU A 144 2.570 16.327 8.636 1.00 0.33 C ATOM 2262 C GLU A 144 1.231 16.679 7.985 1.00 0.29 C ATOM 2263 O GLU A 144 0.606 17.676 8.337 1.00 0.35 O ATOM 2264 CB GLU A 144 3.729 16.895 7.811 1.00 0.41 C ATOM 2265 CG GLU A 144 3.718 18.408 7.682 1.00 0.64 C ATOM 2266 CD GLU A 144 4.922 18.929 6.928 1.00 1.09 C ATOM 2267 OE1 GLU A 144 4.847 19.042 5.686 1.00 1.75 O ATOM 2268 OE2 GLU A 144 5.944 19.239 7.571 1.00 1.25 O ATOM 0 H GLU A 144 3.493 14.481 8.257 1.00 0.29 H new ATOM 0 HA GLU A 144 2.590 16.775 9.629 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.670 16.587 8.267 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.700 16.456 6.814 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.808 18.720 7.169 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.693 18.855 8.676 1.00 0.64 H new ATOM 2275 N ASN A 145 0.781 15.845 7.055 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.485 16.094 6.363 1.00 0.28 C ATOM 2277 C ASN A 145 -1.650 15.453 7.104 1.00 0.30 C ATOM 2278 O ASN A 145 -2.771 15.406 6.598 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.438 15.583 4.917 1.00 0.32 C ATOM 2280 CG ASN A 145 0.456 16.434 4.030 1.00 0.34 C ATOM 2281 OD1 ASN A 145 0.003 17.404 3.420 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.728 16.079 3.943 1.00 0.33 N ATOM 0 H ASN A 145 1.266 14.997 6.762 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.637 17.173 6.343 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.079 14.554 4.910 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.447 15.571 4.506 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.368 16.615 3.357 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.068 15.270 4.462 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.381 14.966 8.307 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.430 14.400 9.131 1.00 0.30 C ATOM 2291 C GLY A 146 -2.117 12.989 9.571 1.00 0.30 C ATOM 2292 O GLY A 146 -2.507 12.571 10.658 1.00 0.41 O ATOM 0 H GLY A 146 -0.452 14.953 8.728 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.577 15.028 10.010 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.368 14.405 8.575 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.394 12.261 8.737 1.00 0.24 N ATOM 2297 CA GLY A 147 -1.021 10.907 9.072 1.00 0.22 C ATOM 2298 C GLY A 147 -1.726 9.890 8.202 1.00 0.19 C ATOM 2299 O GLY A 147 -2.369 10.250 7.213 1.00 0.20 O ATOM 0 H GLY A 147 -1.058 12.586 7.830 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.057 10.791 8.963 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -1.258 10.715 10.118 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.606 8.622 8.566 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.228 7.544 7.811 1.00 0.21 C ATOM 2305 C TRP A 148 -3.746 7.673 7.785 1.00 0.23 C ATOM 2306 O TRP A 148 -4.379 7.338 6.788 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.842 6.181 8.384 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.421 5.795 8.112 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.574 5.597 9.027 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.165 5.561 6.826 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.735 5.235 8.390 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.509 5.210 7.039 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.320 5.609 5.515 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.372 4.906 5.991 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.539 5.309 4.476 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.873 4.960 4.721 1.00 0.24 C ATOM 0 H TRP A 148 -1.081 8.313 9.384 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.859 7.622 6.788 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -2.007 6.190 9.461 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.502 5.421 7.966 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.463 5.709 10.095 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.621 5.020 8.848 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.348 5.876 5.319 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.401 4.637 6.176 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.177 5.344 3.459 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.521 4.729 3.888 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.327 8.177 8.872 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.783 8.314 8.970 1.00 0.31 C ATOM 2329 C ASP A 149 -6.329 9.232 7.882 1.00 0.30 C ATOM 2330 O ASP A 149 -7.498 9.137 7.506 1.00 0.37 O ATOM 2331 CB ASP A 149 -6.202 8.830 10.351 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.475 10.090 10.758 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -4.328 9.992 11.240 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -6.046 11.185 10.581 1.00 1.96 O ATOM 0 H ASP A 149 -3.817 8.497 9.695 1.00 0.26 H new ATOM 0 HA ASP A 149 -6.208 7.320 8.828 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -7.275 9.021 10.351 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.016 8.054 11.094 1.00 0.40 H new ATOM 2339 N THR A 150 -5.483 10.115 7.378 1.00 0.27 N ATOM 2340 CA THR A 150 -5.839 10.946 6.244 1.00 0.29 C ATOM 2341 C THR A 150 -5.928 10.087 4.985 1.00 0.28 C ATOM 2342 O THR A 150 -6.956 10.057 4.306 1.00 0.33 O ATOM 2343 CB THR A 150 -4.789 12.052 6.032 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.612 12.795 7.246 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.205 12.991 4.913 1.00 0.37 C ATOM 0 H THR A 150 -4.542 10.274 7.739 1.00 0.27 H new ATOM 0 HA THR A 150 -6.805 11.410 6.444 1.00 0.29 H new ATOM 0 HB THR A 150 -3.848 11.579 5.752 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.834 13.737 7.089 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.446 13.763 4.784 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.311 12.428 3.986 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.157 13.458 5.165 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.848 9.363 4.711 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.736 8.550 3.508 1.00 0.25 C ATOM 2355 C PHE A 151 -5.790 7.444 3.483 1.00 0.26 C ATOM 2356 O PHE A 151 -6.399 7.178 2.446 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.332 7.942 3.418 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.140 7.046 2.231 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.166 7.563 0.949 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.934 5.688 2.400 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.991 6.743 -0.146 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.760 4.863 1.310 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.788 5.388 0.035 1.00 0.34 C ATOM 0 H PHE A 151 -4.028 9.324 5.316 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.907 9.195 2.646 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.599 8.747 3.377 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.132 7.375 4.327 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.325 8.621 0.803 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.909 5.271 3.396 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.013 7.159 -1.143 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.602 3.804 1.454 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.652 4.742 -0.820 1.00 0.34 H new ATOM 2373 N VAL A 152 -6.009 6.813 4.629 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.961 5.716 4.727 1.00 0.29 C ATOM 2375 C VAL A 152 -8.375 6.188 4.407 1.00 0.35 C ATOM 2376 O VAL A 152 -9.114 5.508 3.697 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.938 5.074 6.127 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.963 3.955 6.225 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.546 4.553 6.444 1.00 0.28 C ATOM 0 H VAL A 152 -5.539 7.043 5.505 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.661 4.967 3.995 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.200 5.837 6.860 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.929 3.516 7.222 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.959 4.357 6.039 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.737 3.189 5.484 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.544 4.102 7.436 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.260 3.805 5.704 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.834 5.378 6.419 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.732 7.362 4.915 1.00 0.37 N ATOM 2390 CA GLU A 153 -10.064 7.913 4.703 1.00 0.46 C ATOM 2391 C GLU A 153 -10.289 8.243 3.226 1.00 0.51 C ATOM 2392 O GLU A 153 -11.413 8.164 2.728 1.00 0.62 O ATOM 2393 CB GLU A 153 -10.261 9.164 5.560 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.701 9.651 5.608 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.864 10.896 6.452 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -11.769 10.795 7.693 1.00 1.42 O ATOM 2397 OE2 GLU A 153 -12.072 11.985 5.880 1.00 2.17 O ATOM 0 H GLU A 153 -8.117 7.950 5.477 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.796 7.162 5.000 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.923 8.955 6.575 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.629 9.963 5.172 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -12.046 9.855 4.594 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -12.336 8.860 6.007 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.210 8.588 2.524 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.291 8.918 1.098 1.00 0.59 C ATOM 2406 C LEU A 154 -9.769 7.716 0.285 1.00 0.68 C ATOM 2407 O LEU A 154 -10.396 7.871 -0.763 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.928 9.385 0.573 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.351 10.627 1.254 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -5.959 10.923 0.723 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.263 11.826 1.047 1.00 0.67 C ATOM 0 H LEU A 154 -8.271 8.647 2.917 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.013 9.727 0.986 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.216 8.567 0.684 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.019 9.586 -0.494 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.281 10.430 2.324 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.562 11.810 1.217 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.306 10.074 0.922 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.009 11.099 -0.352 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -7.834 12.699 1.539 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.366 12.025 -0.020 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.244 11.615 1.473 1.00 0.67 H new ATOM 2444 N GLY A 156 -11.425 5.196 1.998 1.00 0.89 N ATOM 2445 CA GLY A 156 -12.235 4.544 3.007 1.00 1.02 C ATOM 2446 C GLY A 156 -13.626 4.206 2.516 1.00 1.11 C ATOM 2447 O GLY A 156 -14.464 5.092 2.341 1.00 1.68 O ATOM 0 HA2 GLY A 156 -11.737 3.630 3.331 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -12.311 5.192 3.880 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.874 2.919 2.301 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.191 2.453 1.887 1.00 2.05 C ATOM 2453 C ASN A 157 -16.183 2.646 3.022 1.00 2.33 C ATOM 2454 O ASN A 157 -17.372 2.865 2.791 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.167 0.975 1.474 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.301 0.705 0.256 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -14.737 0.884 -0.882 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -13.086 0.231 0.486 1.00 4.60 N ATOM 0 H ASN A 157 -13.179 2.180 2.407 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.494 3.040 1.020 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -14.803 0.377 2.310 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -16.185 0.646 1.267 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -12.473 -0.001 -0.295 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -12.764 0.098 1.444 1.00 4.60 H new ATOM 2465 N ASN A 158 -15.681 2.580 4.251 1.00 2.99 N ATOM 2466 CA ASN A 158 -16.517 2.776 5.430 1.00 4.03 C ATOM 2467 C ASN A 158 -16.937 4.233 5.536 1.00 4.18 C ATOM 2468 O ASN A 158 -18.098 4.534 5.807 1.00 4.81 O ATOM 2469 CB ASN A 158 -15.788 2.352 6.707 1.00 5.08 C ATOM 2470 CG ASN A 158 -15.577 0.852 6.799 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -16.358 0.067 6.260 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -14.524 0.444 7.493 1.00 6.76 N ATOM 0 H ASN A 158 -14.700 2.392 4.456 1.00 2.99 H new ATOM 0 HA ASN A 158 -17.402 2.150 5.320 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -14.821 2.853 6.750 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -16.359 2.687 7.573 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -14.336 -0.553 7.596 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -13.901 1.127 7.924 1.00 6.76 H new ATOM 2479 N ALA A 159 -15.986 5.138 5.313 1.00 3.95 N ATOM 2480 CA ALA A 159 -16.278 6.565 5.284 1.00 4.72 C ATOM 2481 C ALA A 159 -17.310 6.866 4.206 1.00 4.66 C ATOM 2482 O ALA A 159 -18.268 7.605 4.435 1.00 5.63 O ATOM 2483 CB ALA A 159 -15.008 7.364 5.040 1.00 4.78 C ATOM 0 H ALA A 159 -15.006 4.905 5.150 1.00 3.95 H new ATOM 0 HA ALA A 159 -16.686 6.857 6.252 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -15.245 8.428 5.021 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -14.294 7.165 5.839 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -14.573 7.073 4.084 1.00 4.78 H new ATOM 2489 N ALA A 160 -17.111 6.270 3.036 1.00 3.75 N ATOM 2490 CA ALA A 160 -18.053 6.404 1.932 1.00 4.08 C ATOM 2491 C ALA A 160 -19.438 5.893 2.327 1.00 4.33 C ATOM 2492 O ALA A 160 -20.450 6.525 2.025 1.00 5.11 O ATOM 2493 CB ALA A 160 -17.539 5.665 0.706 1.00 3.59 C ATOM 0 H ALA A 160 -16.301 5.686 2.827 1.00 3.75 H new ATOM 0 HA ALA A 160 -18.143 7.463 1.688 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -18.253 5.774 -0.110 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -16.578 6.083 0.406 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -17.417 4.608 0.943 1.00 3.59 H new ATOM 2499 N ALA A 161 -19.473 4.755 3.011 1.00 3.93 N ATOM 2500 CA ALA A 161 -20.727 4.173 3.475 1.00 4.43 C ATOM 2501 C ALA A 161 -21.393 5.071 4.514 1.00 5.54 C ATOM 2502 O ALA A 161 -22.618 5.167 4.571 1.00 6.11 O ATOM 2503 CB ALA A 161 -20.488 2.783 4.045 1.00 4.39 C ATOM 0 H ALA A 161 -18.643 4.215 3.257 1.00 3.93 H new ATOM 0 HA ALA A 161 -21.399 4.088 2.621 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -21.434 2.362 4.387 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -20.063 2.141 3.273 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -19.795 2.848 4.884 1.00 4.39 H new ATOM 2509 N GLU A 162 -20.579 5.731 5.326 1.00 5.98 N ATOM 2510 CA GLU A 162 -21.081 6.662 6.324 1.00 7.23 C ATOM 2511 C GLU A 162 -21.692 7.886 5.648 1.00 7.80 C ATOM 2512 O GLU A 162 -22.819 8.275 5.947 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.954 7.092 7.263 1.00 7.72 C ATOM 2514 CG GLU A 162 -20.395 8.069 8.337 1.00 7.99 C ATOM 2515 CD GLU A 162 -19.230 8.628 9.120 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -18.597 9.593 8.648 1.00 9.09 O ATOM 2517 OE2 GLU A 162 -18.941 8.104 10.215 1.00 9.03 O ATOM 0 H GLU A 162 -19.563 5.637 5.312 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.853 6.160 6.907 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -19.533 6.207 7.740 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -19.157 7.547 6.675 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -20.946 8.889 7.875 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -21.082 7.569 9.020 1.00 7.99 H new ATOM 2524 N SER A 163 -20.948 8.474 4.718 1.00 7.39 N ATOM 2525 CA SER A 163 -21.406 9.654 3.993 1.00 8.21 C ATOM 2526 C SER A 163 -22.632 9.339 3.137 1.00 8.28 C ATOM 2527 O SER A 163 -23.364 10.237 2.720 1.00 9.15 O ATOM 2528 CB SER A 163 -20.274 10.189 3.114 1.00 8.03 C ATOM 2529 OG SER A 163 -19.107 10.432 3.882 1.00 7.86 O ATOM 0 H SER A 163 -20.019 8.150 4.447 1.00 7.39 H new ATOM 0 HA SER A 163 -21.693 10.413 4.721 1.00 8.21 H new ATOM 0 HB2 SER A 163 -20.051 9.471 2.324 1.00 8.03 H new ATOM 0 HB3 SER A 163 -20.592 11.111 2.627 1.00 8.03 H new ATOM 0 HG SER A 163 -18.689 9.578 4.121 1.00 7.86 H new ATOM 2535 N ARG A 164 -22.852 8.055 2.890 1.00 7.47 N ATOM 2536 CA ARG A 164 -23.992 7.594 2.108 1.00 7.60 C ATOM 2537 C ARG A 164 -25.315 7.950 2.790 1.00 8.33 C ATOM 2538 O ARG A 164 -26.342 8.105 2.124 1.00 8.87 O ATOM 2539 CB ARG A 164 -23.884 6.083 1.898 1.00 6.69 C ATOM 2540 CG ARG A 164 -25.060 5.463 1.164 1.00 6.19 C ATOM 2541 CD ARG A 164 -24.890 3.960 1.046 1.00 5.74 C ATOM 2542 NE ARG A 164 -24.654 3.340 2.349 1.00 5.66 N ATOM 2543 CZ ARG A 164 -24.087 2.146 2.512 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -23.738 1.423 1.456 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -23.869 1.674 3.734 1.00 6.02 N ATOM 0 H ARG A 164 -22.247 7.305 3.225 1.00 7.47 H new ATOM 0 HA ARG A 164 -23.979 8.097 1.141 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -22.972 5.871 1.341 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -23.783 5.600 2.870 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -25.985 5.688 1.694 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -25.147 5.903 0.170 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -25.782 3.527 0.593 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -24.055 3.739 0.381 1.00 5.74 H new ATOM 0 HE ARG A 164 -24.941 3.853 3.183 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -23.904 1.781 0.515 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -23.304 0.509 1.585 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -24.136 2.226 4.549 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -23.435 0.759 3.857 1.00 6.02 H new ATOM 2559 N LYS A 165 -25.286 8.108 4.114 1.00 8.52 N ATOM 2560 CA LYS A 165 -26.492 8.460 4.860 1.00 9.41 C ATOM 2561 C LYS A 165 -26.978 9.850 4.453 1.00 10.47 C ATOM 2562 O LYS A 165 -28.160 10.174 4.583 1.00 11.24 O ATOM 2563 CB LYS A 165 -26.248 8.408 6.375 1.00 9.61 C ATOM 2564 CG LYS A 165 -25.386 9.545 6.908 1.00 9.69 C ATOM 2565 CD LYS A 165 -25.221 9.472 8.419 1.00 10.12 C ATOM 2566 CE LYS A 165 -24.422 8.248 8.843 1.00 10.34 C ATOM 2567 NZ LYS A 165 -24.230 8.196 10.317 1.00 10.42 N ATOM 0 H LYS A 165 -24.449 7.999 4.686 1.00 8.52 H new ATOM 0 HA LYS A 165 -27.261 7.727 4.618 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -27.210 8.425 6.887 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -25.772 7.459 6.623 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -24.405 9.510 6.434 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -25.837 10.500 6.638 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -24.721 10.373 8.774 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -26.203 9.446 8.891 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -24.936 7.346 8.512 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -23.450 8.260 8.350 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -23.681 7.348 10.566 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -23.717 9.045 10.630 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -25.157 8.159 10.787 1.00 10.42 H new ATOM 2581 N GLY A 166 -26.055 10.669 3.960 1.00 10.61 N ATOM 2582 CA GLY A 166 -26.419 11.974 3.457 1.00 11.72 C ATOM 2583 C GLY A 166 -27.188 11.861 2.161 1.00 12.02 C ATOM 2584 O GLY A 166 -28.297 12.378 2.045 1.00 13.02 O ATOM 0 H GLY A 166 -25.061 10.449 3.901 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -27.023 12.497 4.198 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -25.520 12.570 3.300 1.00 11.72 H new ATOM 2588 N GLN A 167 -26.607 11.146 1.202 1.00 11.25 N ATOM 2589 CA GLN A 167 -27.238 10.917 -0.099 1.00 11.64 C ATOM 2590 C GLN A 167 -28.630 10.312 0.066 1.00 12.01 C ATOM 2591 O GLN A 167 -29.571 10.714 -0.611 1.00 12.84 O ATOM 2592 CB GLN A 167 -26.379 9.978 -0.955 1.00 10.86 C ATOM 2593 CG GLN A 167 -26.995 9.636 -2.306 1.00 11.50 C ATOM 2594 CD GLN A 167 -26.244 8.531 -3.018 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -25.658 7.653 -2.384 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -26.251 8.564 -4.339 1.00 12.41 N ATOM 0 H GLN A 167 -25.690 10.710 1.301 1.00 11.25 H new ATOM 0 HA GLN A 167 -27.328 11.883 -0.596 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -25.405 10.440 -1.117 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -26.206 9.055 -0.402 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -28.032 9.333 -2.163 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -27.006 10.527 -2.934 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -26.748 9.308 -4.828 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -25.759 7.845 -4.870 1.00 12.41 H new ATOM 2605 N GLU A 168 -28.743 9.351 0.977 1.00 11.51 N ATOM 2606 CA GLU A 168 -30.009 8.672 1.234 1.00 11.94 C ATOM 2607 C GLU A 168 -31.113 9.676 1.557 1.00 13.03 C ATOM 2608 O GLU A 168 -32.214 9.608 1.009 1.00 13.73 O ATOM 2609 CB GLU A 168 -29.842 7.684 2.393 1.00 11.38 C ATOM 2610 CG GLU A 168 -31.081 6.849 2.677 1.00 10.85 C ATOM 2611 CD GLU A 168 -31.443 5.934 1.526 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -30.851 4.843 1.421 1.00 10.74 O ATOM 2613 OE2 GLU A 168 -32.321 6.298 0.718 1.00 10.98 O ATOM 0 H GLU A 168 -27.968 9.023 1.553 1.00 11.51 H new ATOM 0 HA GLU A 168 -30.297 8.129 0.334 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -29.010 7.016 2.171 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -29.575 8.238 3.293 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -30.914 6.251 3.573 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -31.921 7.511 2.888 1.00 10.85 H new