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 75 THR OG1 : rot 3:sc= 0.987 USER MOD Set 1.2: A 78 THR OG1 : rot -140:sc= 1.55 USER MOD Single : A 4 SER OG : rot -31:sc= 0.237 USER MOD Single : A 5 ASN : amide:sc= 0.625 K(o=0.62,f=-4.4!) USER MOD Single : A 14 SER OG : rot -88:sc= 1.27 USER MOD Single : A 15 TYR OH : rot 30:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 169:sc=-0.00561 (180deg=-0.113) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=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= -5.23! K(o=-5.2!,f=-0.87) USER MOD Single : A 43 SER OG : rot 166:sc= 0.737 USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.14) USER MOD Single : A 48 GLN : amide:sc= -0.0809 K(o=-0.081,f=-0.63) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 77:sc= 0.838 USER MOD Single : A 69 THR OG1 : rot -101:sc= 1.26 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.0068) USER MOD Single : A 73 HIS : no HE2:sc= 0.716 K(o=0.72,f=-5.6!) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.866 K(o=-0.87,f=-0.042) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0.264 K(o=0.26,f=-0.45) USER MOD Single : A 88 ASN : amide:sc= 0.28 X(o=0.28,f=0) USER MOD Single : A 96 ASN : amide:sc= -1.1 K(o=-1.1,f=-0.0072) USER MOD Single : A 105 SER OG : rot 74:sc= 1.25 USER MOD Single : A 111 CYS SG : rot 77:sc= -5.23! USER MOD Single : A 114 SER OG : rot -82:sc= 1.27 USER MOD Single : A 117 LYS NZ :NH3+ -169:sc= -0.0173 (180deg=-0.182) USER MOD Single : A 119 MET CE :methyl -169:sc= -3.83! (180deg=-4.29!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 124 SER OG : rot 84:sc= 0.0188 USER MOD Single : A 130 MET CE :methyl -109:sc= -3.11! (180deg=-5.87!) USER MOD Single : A 132 THR OG1 : rot 81:sc= 1.31 USER MOD Single : A 133 TYR OH : rot 74:sc= 0.897 USER MOD Single : A 135 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 137 HIS : no HD1:sc= 0.612 K(o=0.61,f=-3.1!) USER MOD Single : A 143 GLN : amide:sc= -0.999 K(o=-1,f=-2.2) USER MOD Single : A 145 ASN : amide:sc= 1.2 K(o=1.2,f=-0.0074) USER MOD Single : A 150 THR OG1 : rot -164:sc= 1.23 USER MOD Single : A 157 ASN : amide:sc= -0.0645 X(o=-0.065,f=-0.16) USER MOD Single : A 158 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 163 SER OG : rot 73:sc= 1.28 USER MOD Single : A 165 LYS NZ :NH3+ 172:sc=-0.000807 (180deg=-0.0695) USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 5.084 -0.173 13.479 1.00 0.88 N ATOM 49 CA SER A 4 3.738 -0.046 12.915 1.00 0.77 C ATOM 50 C SER A 4 3.798 0.242 11.414 1.00 0.62 C ATOM 51 O SER A 4 2.903 -0.137 10.659 1.00 0.64 O ATOM 52 CB SER A 4 2.953 1.049 13.648 1.00 1.02 C ATOM 53 OG SER A 4 3.728 2.229 13.782 1.00 1.34 O ATOM 0 HA SER A 4 3.219 -0.995 13.053 1.00 0.77 H new ATOM 0 HB2 SER A 4 2.037 1.272 13.101 1.00 1.02 H new ATOM 0 HB3 SER A 4 2.657 0.691 14.634 1.00 1.02 H new ATOM 0 HG SER A 4 4.676 1.991 13.858 1.00 1.34 H new ATOM 59 N ASN A 5 4.877 0.886 10.983 1.00 0.59 N ATOM 60 CA ASN A 5 5.081 1.171 9.568 1.00 0.55 C ATOM 61 C ASN A 5 5.713 -0.031 8.877 1.00 0.43 C ATOM 62 O ASN A 5 5.468 -0.289 7.699 1.00 0.44 O ATOM 63 CB ASN A 5 5.960 2.416 9.387 1.00 0.65 C ATOM 64 CG ASN A 5 5.198 3.705 9.661 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.004 3.803 9.386 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.881 4.704 10.206 1.00 0.67 N ATOM 0 H ASN A 5 5.623 1.220 11.593 1.00 0.59 H new ATOM 0 HA ASN A 5 4.111 1.369 9.111 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.817 2.354 10.057 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.352 2.437 8.370 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.416 5.588 10.410 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.871 4.587 10.421 1.00 0.67 H new ATOM 73 N ARG A 6 6.513 -0.777 9.630 1.00 0.41 N ATOM 74 CA ARG A 6 7.143 -1.986 9.122 1.00 0.41 C ATOM 75 C ARG A 6 6.089 -3.054 8.824 1.00 0.37 C ATOM 76 O ARG A 6 6.270 -3.881 7.928 1.00 0.38 O ATOM 77 CB ARG A 6 8.170 -2.508 10.131 1.00 0.54 C ATOM 78 CG ARG A 6 8.818 -3.821 9.721 1.00 0.65 C ATOM 79 CD ARG A 6 9.964 -4.196 10.644 1.00 0.83 C ATOM 80 NE ARG A 6 11.074 -3.252 10.548 1.00 1.50 N ATOM 81 CZ ARG A 6 12.356 -3.605 10.627 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.689 -4.873 10.835 1.00 2.16 N ATOM 83 NH2 ARG A 6 13.301 -2.684 10.508 1.00 3.18 N ATOM 0 H ARG A 6 6.741 -0.562 10.601 1.00 0.41 H new ATOM 0 HA ARG A 6 7.659 -1.748 8.192 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.948 -1.756 10.266 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.682 -2.640 11.097 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.070 -4.614 9.729 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.186 -3.741 8.698 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.605 -4.230 11.673 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.317 -5.197 10.396 1.00 0.83 H new ATOM 0 HE ARG A 6 10.855 -2.265 10.413 1.00 1.50 H new ATOM 0 HH11 ARG A 6 11.962 -5.581 10.935 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.672 -5.139 10.895 1.00 2.16 H new ATOM 0 HH21 ARG A 6 13.046 -1.708 10.356 1.00 3.18 H new ATOM 0 HH22 ARG A 6 14.284 -2.951 10.568 1.00 3.18 H new ATOM 97 N GLU A 7 4.986 -3.020 9.570 1.00 0.36 N ATOM 98 CA GLU A 7 3.875 -3.941 9.339 1.00 0.37 C ATOM 99 C GLU A 7 3.332 -3.762 7.932 1.00 0.29 C ATOM 100 O GLU A 7 3.077 -4.731 7.219 1.00 0.29 O ATOM 101 CB GLU A 7 2.739 -3.689 10.330 1.00 0.46 C ATOM 102 CG GLU A 7 3.104 -3.904 11.784 1.00 0.60 C ATOM 103 CD GLU A 7 1.912 -3.692 12.688 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.017 -4.555 12.694 1.00 1.58 O ATOM 105 OE2 GLU A 7 1.845 -2.643 13.366 1.00 2.00 O ATOM 0 H GLU A 7 4.838 -2.366 10.338 1.00 0.36 H new ATOM 0 HA GLU A 7 4.253 -4.955 9.472 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.388 -2.664 10.206 1.00 0.46 H new ATOM 0 HB3 GLU A 7 1.905 -4.344 10.079 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.490 -4.915 11.918 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.903 -3.218 12.066 1.00 0.60 H new ATOM 112 N LEU A 8 3.191 -2.505 7.540 1.00 0.27 N ATOM 113 CA LEU A 8 2.604 -2.148 6.259 1.00 0.28 C ATOM 114 C LEU A 8 3.505 -2.595 5.126 1.00 0.28 C ATOM 115 O LEU A 8 3.069 -2.765 3.994 1.00 0.39 O ATOM 116 CB LEU A 8 2.392 -0.637 6.199 1.00 0.31 C ATOM 117 CG LEU A 8 1.661 -0.055 7.401 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.557 1.451 7.278 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.285 -0.682 7.532 1.00 0.35 C ATOM 0 H LEU A 8 3.480 -1.704 8.101 1.00 0.27 H new ATOM 0 HA LEU A 8 1.642 -2.650 6.154 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.363 -0.150 6.109 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.830 -0.397 5.296 1.00 0.31 H new ATOM 0 HG LEU A 8 2.230 -0.284 8.302 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.032 1.851 8.145 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.557 1.882 7.228 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.007 1.705 6.372 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.228 -0.257 8.395 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.294 -0.480 6.631 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.387 -1.759 7.664 1.00 0.35 H new ATOM 131 N VAL A 9 4.769 -2.771 5.450 1.00 0.26 N ATOM 132 CA VAL A 9 5.730 -3.290 4.509 1.00 0.28 C ATOM 133 C VAL A 9 5.657 -4.813 4.465 1.00 0.29 C ATOM 134 O VAL A 9 5.178 -5.387 3.493 1.00 0.31 O ATOM 135 CB VAL A 9 7.152 -2.853 4.892 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.174 -3.495 3.976 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.267 -1.341 4.851 1.00 0.31 C ATOM 0 H VAL A 9 5.155 -2.558 6.370 1.00 0.26 H new ATOM 0 HA VAL A 9 5.492 -2.890 3.523 1.00 0.28 H new ATOM 0 HB VAL A 9 7.355 -3.186 5.910 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.174 -3.172 4.264 1.00 0.38 H new ATOM 0 HG12 VAL A 9 8.105 -4.580 4.057 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.979 -3.195 2.946 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.280 -1.046 5.125 1.00 0.31 H new ATOM 0 HG22 VAL A 9 7.045 -0.986 3.845 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.559 -0.903 5.554 1.00 0.31 H new ATOM 147 N VAL A 10 6.105 -5.451 5.541 1.00 0.30 N ATOM 148 CA VAL A 10 6.229 -6.905 5.592 1.00 0.32 C ATOM 149 C VAL A 10 4.925 -7.606 5.229 1.00 0.35 C ATOM 150 O VAL A 10 4.912 -8.494 4.374 1.00 0.36 O ATOM 151 CB VAL A 10 6.686 -7.371 6.989 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.704 -8.888 7.075 1.00 0.42 C ATOM 153 CG2 VAL A 10 8.059 -6.809 7.312 1.00 0.38 C ATOM 0 H VAL A 10 6.391 -4.979 6.399 1.00 0.30 H new ATOM 0 HA VAL A 10 6.982 -7.178 4.852 1.00 0.32 H new ATOM 0 HB VAL A 10 5.972 -6.996 7.722 1.00 0.37 H new ATOM 0 HG11 VAL A 10 7.030 -9.192 8.070 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.703 -9.275 6.887 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.393 -9.287 6.330 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.367 -7.147 8.301 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.778 -7.156 6.570 1.00 0.38 H new ATOM 0 HG23 VAL A 10 8.019 -5.720 7.297 1.00 0.38 H new ATOM 163 N ASP A 11 3.832 -7.197 5.861 1.00 0.39 N ATOM 164 CA ASP A 11 2.553 -7.880 5.682 1.00 0.46 C ATOM 165 C ASP A 11 2.022 -7.677 4.266 1.00 0.44 C ATOM 166 O ASP A 11 1.287 -8.512 3.741 1.00 0.50 O ATOM 167 CB ASP A 11 1.522 -7.379 6.699 1.00 0.55 C ATOM 168 CG ASP A 11 0.386 -8.361 6.904 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.552 -8.361 6.080 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.423 -9.138 7.879 1.00 0.92 O ATOM 0 H ASP A 11 3.803 -6.401 6.498 1.00 0.39 H new ATOM 0 HA ASP A 11 2.720 -8.945 5.845 1.00 0.46 H new ATOM 0 HB2 ASP A 11 2.016 -7.196 7.653 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.117 -6.425 6.361 1.00 0.55 H new ATOM 175 N PHE A 12 2.412 -6.576 3.643 1.00 0.41 N ATOM 176 CA PHE A 12 1.955 -6.268 2.295 1.00 0.42 C ATOM 177 C PHE A 12 2.835 -6.965 1.261 1.00 0.37 C ATOM 178 O PHE A 12 2.341 -7.471 0.251 1.00 0.41 O ATOM 179 CB PHE A 12 1.957 -4.754 2.056 1.00 0.44 C ATOM 180 CG PHE A 12 1.179 -4.333 0.843 1.00 0.48 C ATOM 181 CD1 PHE A 12 -0.186 -4.112 0.929 1.00 0.62 C ATOM 182 CD2 PHE A 12 1.809 -4.156 -0.380 1.00 0.46 C ATOM 183 CE1 PHE A 12 -0.910 -3.723 -0.180 1.00 0.68 C ATOM 184 CE2 PHE A 12 1.087 -3.767 -1.493 1.00 0.51 C ATOM 185 CZ PHE A 12 -0.273 -3.551 -1.393 1.00 0.60 C ATOM 0 H PHE A 12 3.042 -5.882 4.047 1.00 0.41 H new ATOM 0 HA PHE A 12 0.934 -6.634 2.189 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.543 -4.256 2.933 1.00 0.44 H new ATOM 0 HB3 PHE A 12 2.987 -4.413 1.952 1.00 0.44 H new ATOM 0 HD1 PHE A 12 -0.690 -4.246 1.875 1.00 0.62 H new ATOM 0 HD2 PHE A 12 2.873 -4.323 -0.464 1.00 0.46 H new ATOM 0 HE1 PHE A 12 -1.974 -3.553 -0.099 1.00 0.68 H new ATOM 0 HE2 PHE A 12 1.587 -3.632 -2.441 1.00 0.51 H new ATOM 0 HZ PHE A 12 -0.838 -3.248 -2.262 1.00 0.60 H new ATOM 195 N LEU A 13 4.139 -7.003 1.519 1.00 0.33 N ATOM 196 CA LEU A 13 5.072 -7.641 0.602 1.00 0.32 C ATOM 197 C LEU A 13 4.830 -9.145 0.573 1.00 0.33 C ATOM 198 O LEU A 13 4.776 -9.756 -0.495 1.00 0.35 O ATOM 199 CB LEU A 13 6.521 -7.347 1.004 1.00 0.32 C ATOM 200 CG LEU A 13 6.869 -5.866 1.176 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.365 -5.690 1.368 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.384 -5.045 -0.006 1.00 0.38 C ATOM 0 H LEU A 13 4.570 -6.601 2.352 1.00 0.33 H new ATOM 0 HA LEU A 13 4.905 -7.234 -0.395 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.732 -7.863 1.941 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.183 -7.773 0.250 1.00 0.32 H new ATOM 0 HG LEU A 13 6.357 -5.503 2.068 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.594 -4.631 1.489 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.684 -6.234 2.257 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.892 -6.078 0.496 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.646 -3.998 0.146 1.00 0.38 H new ATOM 0 HD22 LEU A 13 6.855 -5.408 -0.919 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.302 -5.139 -0.095 1.00 0.38 H new ATOM 214 N SER A 14 4.661 -9.730 1.755 1.00 0.34 N ATOM 215 CA SER A 14 4.376 -11.151 1.871 1.00 0.38 C ATOM 216 C SER A 14 3.016 -11.481 1.259 1.00 0.39 C ATOM 217 O SER A 14 2.814 -12.569 0.720 1.00 0.41 O ATOM 218 CB SER A 14 4.425 -11.578 3.337 1.00 0.45 C ATOM 219 OG SER A 14 3.581 -10.766 4.134 1.00 1.14 O ATOM 0 H SER A 14 4.717 -9.238 2.647 1.00 0.34 H new ATOM 0 HA SER A 14 5.137 -11.704 1.321 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.120 -12.621 3.425 1.00 0.45 H new ATOM 0 HB3 SER A 14 5.449 -11.513 3.704 1.00 0.45 H new ATOM 0 HG SER A 14 4.076 -9.975 4.434 1.00 1.14 H new ATOM 225 N TYR A 15 2.095 -10.523 1.332 1.00 0.42 N ATOM 226 CA TYR A 15 0.774 -10.671 0.732 1.00 0.47 C ATOM 227 C TYR A 15 0.891 -10.862 -0.777 1.00 0.45 C ATOM 228 O TYR A 15 0.262 -11.750 -1.351 1.00 0.52 O ATOM 229 CB TYR A 15 -0.096 -9.448 1.053 1.00 0.55 C ATOM 230 CG TYR A 15 -1.340 -9.328 0.201 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.397 -10.220 0.340 1.00 0.79 C ATOM 232 CD2 TYR A 15 -1.454 -8.317 -0.745 1.00 0.78 C ATOM 233 CE1 TYR A 15 -3.529 -10.107 -0.443 1.00 0.96 C ATOM 234 CE2 TYR A 15 -2.584 -8.197 -1.528 1.00 0.94 C ATOM 235 CZ TYR A 15 -3.618 -9.094 -1.375 1.00 1.02 C ATOM 236 OH TYR A 15 -4.745 -8.976 -2.157 1.00 1.20 O ATOM 0 H TYR A 15 2.242 -9.631 1.804 1.00 0.42 H new ATOM 0 HA TYR A 15 0.298 -11.556 1.154 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.391 -9.492 2.101 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.504 -8.547 0.928 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.332 -11.013 1.071 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -0.645 -7.613 -0.870 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.341 -10.809 -0.326 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -2.657 -7.404 -2.257 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.522 -9.312 -1.664 1.00 1.20 H new ATOM 246 N LYS A 16 1.718 -10.040 -1.414 1.00 0.40 N ATOM 247 CA LYS A 16 1.898 -10.122 -2.856 1.00 0.41 C ATOM 248 C LYS A 16 2.602 -11.417 -3.239 1.00 0.35 C ATOM 249 O LYS A 16 2.262 -12.041 -4.240 1.00 0.39 O ATOM 250 CB LYS A 16 2.670 -8.909 -3.383 1.00 0.49 C ATOM 251 CG LYS A 16 1.884 -7.608 -3.306 1.00 0.90 C ATOM 252 CD LYS A 16 0.551 -7.722 -4.032 1.00 0.83 C ATOM 253 CE LYS A 16 -0.206 -6.404 -4.034 1.00 1.35 C ATOM 254 NZ LYS A 16 0.475 -5.372 -4.859 1.00 1.39 N ATOM 0 H LYS A 16 2.270 -9.314 -0.957 1.00 0.40 H new ATOM 0 HA LYS A 16 0.911 -10.120 -3.319 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.593 -8.801 -2.814 1.00 0.49 H new ATOM 0 HB3 LYS A 16 2.954 -9.092 -4.419 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.711 -7.347 -2.262 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.471 -6.800 -3.743 1.00 0.90 H new ATOM 0 HD2 LYS A 16 0.723 -8.044 -5.059 1.00 0.83 H new ATOM 0 HD3 LYS A 16 -0.058 -8.490 -3.555 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -1.214 -6.566 -4.415 1.00 1.35 H new ATOM 0 HE3 LYS A 16 -0.306 -6.042 -3.011 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.158 -4.557 -4.987 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 1.345 -5.063 -4.380 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 0.715 -5.773 -5.788 1.00 1.39 H new ATOM 268 N LEU A 17 3.576 -11.823 -2.435 1.00 0.30 N ATOM 269 CA LEU A 17 4.269 -13.087 -2.650 1.00 0.27 C ATOM 270 C LEU A 17 3.323 -14.271 -2.481 1.00 0.31 C ATOM 271 O LEU A 17 3.380 -15.233 -3.246 1.00 0.32 O ATOM 272 CB LEU A 17 5.447 -13.210 -1.686 1.00 0.25 C ATOM 273 CG LEU A 17 6.584 -12.234 -1.951 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.626 -12.327 -0.854 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.208 -12.518 -3.304 1.00 0.25 C ATOM 0 H LEU A 17 3.905 -11.295 -1.627 1.00 0.30 H new ATOM 0 HA LEU A 17 4.642 -13.099 -3.674 1.00 0.27 H new ATOM 0 HB2 LEU A 17 5.085 -13.059 -0.669 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.838 -14.226 -1.738 1.00 0.25 H new ATOM 0 HG LEU A 17 6.184 -11.220 -1.958 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.433 -11.623 -1.058 1.00 0.29 H new ATOM 0 HD12 LEU A 17 7.167 -12.086 0.105 1.00 0.29 H new ATOM 0 HD13 LEU A 17 8.028 -13.339 -0.819 1.00 0.29 H new ATOM 0 HD21 LEU A 17 8.021 -11.814 -3.485 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.599 -13.535 -3.318 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.453 -12.409 -4.083 1.00 0.25 H new ATOM 287 N SER A 18 2.449 -14.190 -1.485 1.00 0.37 N ATOM 288 CA SER A 18 1.457 -15.232 -1.250 1.00 0.44 C ATOM 289 C SER A 18 0.502 -15.314 -2.441 1.00 0.47 C ATOM 290 O SER A 18 0.063 -16.398 -2.830 1.00 0.51 O ATOM 291 CB SER A 18 0.686 -14.949 0.050 1.00 0.54 C ATOM 292 OG SER A 18 -0.207 -16.005 0.365 1.00 1.26 O ATOM 0 H SER A 18 2.407 -13.412 -0.826 1.00 0.37 H new ATOM 0 HA SER A 18 1.963 -16.192 -1.142 1.00 0.44 H new ATOM 0 HB2 SER A 18 1.391 -14.811 0.870 1.00 0.54 H new ATOM 0 HB3 SER A 18 0.129 -14.018 -0.052 1.00 0.54 H new ATOM 0 HG SER A 18 -0.681 -15.796 1.197 1.00 1.26 H new ATOM 298 N GLN A 19 0.220 -14.157 -3.036 1.00 0.48 N ATOM 299 CA GLN A 19 -0.605 -14.070 -4.235 1.00 0.53 C ATOM 300 C GLN A 19 0.072 -14.783 -5.404 1.00 0.48 C ATOM 301 O GLN A 19 -0.591 -15.341 -6.281 1.00 0.55 O ATOM 302 CB GLN A 19 -0.850 -12.595 -4.572 1.00 0.59 C ATOM 303 CG GLN A 19 -1.453 -12.346 -5.947 1.00 0.71 C ATOM 304 CD GLN A 19 -1.616 -10.865 -6.240 1.00 1.06 C ATOM 305 OE1 GLN A 19 -1.843 -10.066 -5.334 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.476 -10.478 -7.501 1.00 1.65 N ATOM 0 H GLN A 19 0.557 -13.255 -2.700 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.561 -14.561 -4.052 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.512 -12.170 -3.818 1.00 0.59 H new ATOM 0 HB3 GLN A 19 0.097 -12.059 -4.503 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -0.817 -12.798 -6.708 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.424 -12.837 -6.011 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -1.288 -11.168 -8.228 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -1.556 -9.490 -7.743 1.00 1.65 H new ATOM 315 N LYS A 20 1.398 -14.776 -5.394 1.00 0.41 N ATOM 316 CA LYS A 20 2.184 -15.393 -6.457 1.00 0.40 C ATOM 317 C LYS A 20 2.382 -16.883 -6.193 1.00 0.44 C ATOM 318 O LYS A 20 2.963 -17.595 -7.009 1.00 0.48 O ATOM 319 CB LYS A 20 3.549 -14.708 -6.570 1.00 0.36 C ATOM 320 CG LYS A 20 3.471 -13.199 -6.731 1.00 0.68 C ATOM 321 CD LYS A 20 2.891 -12.792 -8.075 1.00 0.61 C ATOM 322 CE LYS A 20 2.652 -11.292 -8.142 1.00 1.06 C ATOM 323 NZ LYS A 20 2.155 -10.870 -9.475 1.00 1.87 N ATOM 0 H LYS A 20 1.956 -14.347 -4.656 1.00 0.41 H new ATOM 0 HA LYS A 20 1.639 -15.273 -7.393 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.135 -14.938 -5.680 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.085 -15.127 -7.422 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.858 -12.782 -5.932 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.468 -12.772 -6.624 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.572 -13.090 -8.872 1.00 0.61 H new ATOM 0 HD3 LYS A 20 1.952 -13.320 -8.243 1.00 0.61 H new ATOM 0 HE2 LYS A 20 1.930 -11.005 -7.378 1.00 1.06 H new ATOM 0 HE3 LYS A 20 3.580 -10.766 -7.917 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 2.005 -9.841 -9.480 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 2.855 -11.121 -10.202 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 1.256 -11.352 -9.679 1.00 1.87 H new ATOM 337 N GLY A 21 1.901 -17.347 -5.047 1.00 0.48 N ATOM 338 CA GLY A 21 2.038 -18.749 -4.700 1.00 0.54 C ATOM 339 C GLY A 21 3.318 -19.045 -3.937 1.00 0.53 C ATOM 340 O GLY A 21 3.694 -20.204 -3.772 1.00 0.67 O ATOM 0 H GLY A 21 1.418 -16.778 -4.351 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.183 -19.055 -4.098 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.017 -19.348 -5.611 1.00 0.54 H new ATOM 344 N TYR A 22 3.994 -18.005 -3.468 1.00 0.43 N ATOM 345 CA TYR A 22 5.227 -18.186 -2.711 1.00 0.42 C ATOM 346 C TYR A 22 4.944 -18.054 -1.220 1.00 0.43 C ATOM 347 O TYR A 22 4.035 -17.327 -0.819 1.00 0.46 O ATOM 348 CB TYR A 22 6.287 -17.162 -3.137 1.00 0.40 C ATOM 349 CG TYR A 22 6.620 -17.184 -4.616 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.564 -18.362 -5.357 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.986 -16.017 -5.274 1.00 0.47 C ATOM 352 CE1 TYR A 22 6.867 -18.370 -6.706 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.288 -16.019 -6.622 1.00 0.57 C ATOM 354 CZ TYR A 22 7.226 -17.196 -7.333 1.00 0.69 C ATOM 355 OH TYR A 22 7.528 -17.199 -8.676 1.00 0.81 O ATOM 0 H TYR A 22 3.713 -17.033 -3.597 1.00 0.43 H new ATOM 0 HA TYR A 22 5.614 -19.184 -2.918 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.939 -16.164 -2.870 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.199 -17.344 -2.569 1.00 0.40 H new ATOM 0 HD1 TYR A 22 6.280 -19.283 -4.870 1.00 0.65 H new ATOM 0 HD2 TYR A 22 7.035 -15.090 -4.721 1.00 0.47 H new ATOM 0 HE1 TYR A 22 6.823 -19.292 -7.266 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.571 -15.101 -7.116 1.00 0.57 H new ATOM 0 HH TYR A 22 7.760 -16.290 -8.961 1.00 0.81 H new ATOM 365 N SER A 23 5.713 -18.756 -0.401 1.00 0.45 N ATOM 366 CA SER A 23 5.507 -18.728 1.039 1.00 0.49 C ATOM 367 C SER A 23 6.558 -17.847 1.710 1.00 0.43 C ATOM 368 O SER A 23 7.756 -18.117 1.617 1.00 0.44 O ATOM 369 CB SER A 23 5.565 -20.148 1.612 1.00 0.59 C ATOM 370 OG SER A 23 5.142 -20.176 2.966 1.00 1.41 O ATOM 0 H SER A 23 6.483 -19.350 -0.708 1.00 0.45 H new ATOM 0 HA SER A 23 4.521 -18.309 1.239 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.933 -20.808 1.018 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.583 -20.530 1.539 1.00 0.59 H new ATOM 0 HG SER A 23 5.188 -21.095 3.304 1.00 1.41 H new ATOM 376 N TRP A 24 6.102 -16.803 2.390 1.00 0.43 N ATOM 377 CA TRP A 24 6.993 -15.871 3.078 1.00 0.41 C ATOM 378 C TRP A 24 7.815 -16.597 4.143 1.00 0.47 C ATOM 379 O TRP A 24 8.986 -16.281 4.364 1.00 0.53 O ATOM 380 CB TRP A 24 6.172 -14.732 3.708 1.00 0.44 C ATOM 381 CG TRP A 24 6.971 -13.788 4.562 1.00 0.46 C ATOM 382 CD1 TRP A 24 7.012 -13.759 5.929 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.834 -12.732 4.112 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.846 -12.756 6.353 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.362 -12.112 5.261 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.212 -12.251 2.855 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.246 -11.037 5.188 1.00 0.51 C ATOM 388 CZ3 TRP A 24 9.090 -11.186 2.785 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.599 -10.589 3.946 1.00 0.48 C ATOM 0 H TRP A 24 5.112 -16.577 2.481 1.00 0.43 H new ATOM 0 HA TRP A 24 7.685 -15.445 2.352 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.692 -14.164 2.912 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.377 -15.166 4.314 1.00 0.44 H new ATOM 0 HD1 TRP A 24 6.468 -14.428 6.579 1.00 0.55 H new ATOM 0 HE1 TRP A 24 8.049 -12.527 7.326 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.825 -12.704 1.954 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.638 -10.574 6.082 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.389 -10.807 1.819 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.284 -9.758 3.858 1.00 0.48 H new ATOM 400 N SER A 25 7.206 -17.596 4.770 1.00 0.54 N ATOM 401 CA SER A 25 7.870 -18.372 5.812 1.00 0.63 C ATOM 402 C SER A 25 9.022 -19.208 5.248 1.00 0.63 C ATOM 403 O SER A 25 9.837 -19.740 5.998 1.00 0.75 O ATOM 404 CB SER A 25 6.853 -19.279 6.502 1.00 0.75 C ATOM 405 OG SER A 25 5.721 -18.536 6.927 1.00 1.20 O ATOM 0 H SER A 25 6.249 -17.889 4.574 1.00 0.54 H new ATOM 0 HA SER A 25 8.293 -17.675 6.535 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.540 -20.068 5.818 1.00 0.75 H new ATOM 0 HB3 SER A 25 7.317 -19.766 7.360 1.00 0.75 H new ATOM 0 HG SER A 25 5.081 -19.136 7.365 1.00 1.20 H new ATOM 411 N GLN A 26 9.094 -19.323 3.927 1.00 0.61 N ATOM 412 CA GLN A 26 10.153 -20.091 3.292 1.00 0.73 C ATOM 413 C GLN A 26 11.367 -19.205 3.005 1.00 0.79 C ATOM 414 O GLN A 26 12.493 -19.693 2.903 1.00 0.93 O ATOM 415 CB GLN A 26 9.637 -20.728 1.989 1.00 0.80 C ATOM 416 CG GLN A 26 10.610 -21.714 1.347 1.00 1.25 C ATOM 417 CD GLN A 26 10.683 -23.052 2.072 1.00 1.53 C ATOM 418 OE1 GLN A 26 10.961 -24.083 1.458 1.00 1.91 O ATOM 419 NE2 GLN A 26 10.434 -23.057 3.374 1.00 2.26 N ATOM 0 H GLN A 26 8.433 -18.895 3.279 1.00 0.61 H new ATOM 0 HA GLN A 26 10.461 -20.883 3.974 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.699 -21.243 2.196 1.00 0.80 H new ATOM 0 HB3 GLN A 26 9.415 -19.936 1.274 1.00 0.80 H new ATOM 0 HG2 GLN A 26 10.312 -21.886 0.313 1.00 1.25 H new ATOM 0 HG3 GLN A 26 11.604 -21.268 1.322 1.00 1.25 H new ATOM 0 HE21 GLN A 26 10.207 -22.186 3.853 1.00 2.26 H new ATOM 0 HE22 GLN A 26 10.470 -23.932 3.897 1.00 2.26 H new ATOM 644 N GLU A 42 -3.412 0.595 14.177 1.00 1.02 N ATOM 645 CA GLU A 42 -3.854 1.455 13.084 1.00 0.87 C ATOM 646 C GLU A 42 -3.430 0.845 11.755 1.00 0.73 C ATOM 647 O GLU A 42 -3.913 1.225 10.689 1.00 0.63 O ATOM 648 CB GLU A 42 -3.247 2.852 13.224 1.00 1.05 C ATOM 649 CG GLU A 42 -3.593 3.551 14.528 1.00 1.53 C ATOM 650 CD GLU A 42 -2.847 4.858 14.697 1.00 2.12 C ATOM 651 OE1 GLU A 42 -1.718 4.837 15.229 1.00 2.82 O ATOM 652 OE2 GLU A 42 -3.382 5.913 14.294 1.00 2.42 O ATOM 0 HA GLU A 42 -4.940 1.540 13.120 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -2.163 2.775 13.142 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -3.587 3.469 12.392 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -4.666 3.741 14.562 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -3.359 2.892 15.364 1.00 1.53 H new ATOM 659 N SER A 43 -2.522 -0.117 11.845 1.00 0.79 N ATOM 660 CA SER A 43 -1.887 -0.716 10.680 1.00 0.75 C ATOM 661 C SER A 43 -2.890 -1.420 9.764 1.00 0.67 C ATOM 662 O SER A 43 -2.738 -1.389 8.544 1.00 0.62 O ATOM 663 CB SER A 43 -0.817 -1.698 11.149 1.00 0.94 C ATOM 664 OG SER A 43 -0.170 -1.204 12.312 1.00 1.14 O ATOM 0 H SER A 43 -2.204 -0.506 12.733 1.00 0.79 H new ATOM 0 HA SER A 43 -1.436 0.083 10.092 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.270 -2.666 11.361 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.085 -1.855 10.356 1.00 0.94 H new ATOM 0 HG SER A 43 0.349 -1.924 12.729 1.00 1.14 H new ATOM 670 N GLU A 44 -3.922 -2.031 10.339 1.00 0.72 N ATOM 671 CA GLU A 44 -4.897 -2.772 9.539 1.00 0.73 C ATOM 672 C GLU A 44 -5.653 -1.842 8.599 1.00 0.61 C ATOM 673 O GLU A 44 -6.039 -2.238 7.498 1.00 0.66 O ATOM 674 CB GLU A 44 -5.899 -3.520 10.423 1.00 0.85 C ATOM 675 CG GLU A 44 -5.289 -4.633 11.258 1.00 1.32 C ATOM 676 CD GLU A 44 -6.349 -5.484 11.926 1.00 1.96 C ATOM 677 OE1 GLU A 44 -6.814 -5.115 13.026 1.00 2.98 O ATOM 678 OE2 GLU A 44 -6.735 -6.520 11.345 1.00 1.90 O ATOM 0 H GLU A 44 -4.105 -2.030 11.342 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.337 -3.500 8.952 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.382 -2.805 11.089 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.679 -3.943 9.790 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.665 -5.262 10.624 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -4.638 -4.201 12.018 1.00 1.32 H new ATOM 685 N ALA A 45 -5.855 -0.606 9.032 1.00 0.53 N ATOM 686 CA ALA A 45 -6.593 0.370 8.248 1.00 0.45 C ATOM 687 C ALA A 45 -5.788 0.804 7.034 1.00 0.39 C ATOM 688 O ALA A 45 -6.260 0.728 5.903 1.00 0.39 O ATOM 689 CB ALA A 45 -6.951 1.571 9.106 1.00 0.48 C ATOM 0 H ALA A 45 -5.515 -0.255 9.928 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.514 -0.095 7.897 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.504 2.295 8.507 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.568 1.248 9.945 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -6.039 2.033 9.483 1.00 0.48 H new ATOM 695 N VAL A 46 -4.564 1.243 7.278 1.00 0.36 N ATOM 696 CA VAL A 46 -3.684 1.682 6.209 1.00 0.32 C ATOM 697 C VAL A 46 -3.297 0.523 5.293 1.00 0.34 C ATOM 698 O VAL A 46 -3.252 0.679 4.077 1.00 0.35 O ATOM 699 CB VAL A 46 -2.422 2.380 6.760 1.00 0.33 C ATOM 700 CG1 VAL A 46 -2.013 1.801 8.102 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.281 2.271 5.765 1.00 0.34 C ATOM 0 H VAL A 46 -4.157 1.305 8.211 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.240 2.411 5.619 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.659 3.433 6.909 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -1.121 2.314 8.463 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.824 1.935 8.818 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.800 0.738 7.990 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.398 2.768 6.168 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.055 1.220 5.584 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.569 2.747 4.828 1.00 0.34 H new ATOM 711 N LYS A 47 -3.030 -0.638 5.872 1.00 0.41 N ATOM 712 CA LYS A 47 -2.689 -1.814 5.078 1.00 0.50 C ATOM 713 C LYS A 47 -3.831 -2.148 4.118 1.00 0.51 C ATOM 714 O LYS A 47 -3.608 -2.585 2.988 1.00 0.59 O ATOM 715 CB LYS A 47 -2.404 -3.020 5.975 1.00 0.63 C ATOM 716 CG LYS A 47 -1.673 -4.138 5.255 1.00 0.84 C ATOM 717 CD LYS A 47 -1.626 -5.407 6.085 1.00 1.45 C ATOM 718 CE LYS A 47 -2.976 -6.107 6.115 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.911 -7.399 6.843 1.00 2.14 N ATOM 0 H LYS A 47 -3.042 -0.793 6.880 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.788 -1.586 4.508 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -1.810 -2.697 6.830 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.346 -3.404 6.368 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -2.167 -4.343 4.305 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -0.657 -3.818 5.023 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -0.874 -6.082 5.676 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -1.318 -5.166 7.102 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -3.711 -5.458 6.591 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -3.318 -6.281 5.095 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.832 -7.878 6.784 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.179 -8.002 6.415 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -2.675 -7.224 7.841 1.00 2.14 H new ATOM 733 N GLN A 48 -5.056 -1.925 4.582 1.00 0.47 N ATOM 734 CA GLN A 48 -6.236 -2.119 3.754 1.00 0.52 C ATOM 735 C GLN A 48 -6.337 -0.994 2.730 1.00 0.48 C ATOM 736 O GLN A 48 -6.710 -1.213 1.576 1.00 0.54 O ATOM 737 CB GLN A 48 -7.492 -2.163 4.634 1.00 0.55 C ATOM 738 CG GLN A 48 -8.785 -2.352 3.858 1.00 0.85 C ATOM 739 CD GLN A 48 -8.790 -3.614 3.018 1.00 1.50 C ATOM 740 OE1 GLN A 48 -8.176 -4.622 3.374 1.00 2.23 O ATOM 741 NE2 GLN A 48 -9.490 -3.567 1.898 1.00 2.02 N ATOM 0 H GLN A 48 -5.256 -1.609 5.531 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.153 -3.068 3.224 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.390 -2.975 5.354 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.555 -1.237 5.205 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.621 -2.383 4.557 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.943 -1.490 3.210 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -9.984 -2.712 1.641 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -9.537 -4.385 1.291 1.00 2.02 H new ATOM 750 N ALA A 49 -5.976 0.207 3.162 1.00 0.42 N ATOM 751 CA ALA A 49 -5.974 1.370 2.294 1.00 0.40 C ATOM 752 C ALA A 49 -5.005 1.178 1.134 1.00 0.39 C ATOM 753 O ALA A 49 -5.323 1.505 -0.005 1.00 0.42 O ATOM 754 CB ALA A 49 -5.611 2.610 3.092 1.00 0.36 C ATOM 0 H ALA A 49 -5.679 0.399 4.119 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.974 1.497 1.879 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.611 3.479 2.434 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.341 2.757 3.888 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.620 2.485 3.527 1.00 0.36 H new ATOM 760 N LEU A 50 -3.826 0.633 1.429 1.00 0.38 N ATOM 761 CA LEU A 50 -2.821 0.373 0.398 1.00 0.39 C ATOM 762 C LEU A 50 -3.291 -0.699 -0.579 1.00 0.46 C ATOM 763 O LEU A 50 -2.914 -0.683 -1.749 1.00 0.49 O ATOM 764 CB LEU A 50 -1.475 -0.039 1.006 1.00 0.39 C ATOM 765 CG LEU A 50 -0.479 1.102 1.248 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.217 1.871 -0.040 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.974 2.039 2.335 1.00 0.29 C ATOM 0 H LEU A 50 -3.543 0.363 2.371 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.683 1.308 -0.144 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.664 -0.540 1.956 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.008 -0.771 0.347 1.00 0.39 H new ATOM 0 HG LEU A 50 0.459 0.660 1.584 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.492 2.676 0.154 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.197 1.196 -0.789 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.152 2.293 -0.409 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.248 2.838 2.485 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.930 2.469 2.037 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.100 1.484 3.264 1.00 0.29 H new ATOM 779 N ARG A 51 -4.115 -1.626 -0.101 1.00 0.52 N ATOM 780 CA ARG A 51 -4.666 -2.664 -0.966 1.00 0.61 C ATOM 781 C ARG A 51 -5.565 -2.019 -2.014 1.00 0.62 C ATOM 782 O ARG A 51 -5.422 -2.265 -3.213 1.00 0.69 O ATOM 783 CB ARG A 51 -5.465 -3.691 -0.154 1.00 0.67 C ATOM 784 CG ARG A 51 -5.211 -5.139 -0.561 1.00 0.98 C ATOM 785 CD ARG A 51 -5.429 -5.372 -2.051 1.00 1.49 C ATOM 786 NE ARG A 51 -6.826 -5.197 -2.459 1.00 2.00 N ATOM 787 CZ ARG A 51 -7.225 -5.139 -3.733 1.00 2.89 C ATOM 788 NH1 ARG A 51 -6.327 -5.187 -4.711 1.00 3.39 N ATOM 789 NH2 ARG A 51 -8.515 -5.022 -4.030 1.00 3.74 N ATOM 0 H ARG A 51 -4.414 -1.680 0.873 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.843 -3.186 -1.454 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -5.221 -3.573 0.902 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.528 -3.476 -0.261 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -4.189 -5.413 -0.299 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -5.872 -5.794 0.007 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -4.802 -4.683 -2.617 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -5.105 -6.381 -2.307 1.00 1.49 H new ATOM 0 HE ARG A 51 -7.534 -5.115 -1.729 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -5.335 -5.268 -4.489 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -6.630 -5.143 -5.684 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -9.208 -4.976 -3.283 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -8.812 -4.978 -5.005 1.00 3.74 H new ATOM 803 N GLU A 52 -6.471 -1.167 -1.548 1.00 0.59 N ATOM 804 CA GLU A 52 -7.365 -0.442 -2.440 1.00 0.62 C ATOM 805 C GLU A 52 -6.573 0.541 -3.293 1.00 0.59 C ATOM 806 O GLU A 52 -6.893 0.771 -4.461 1.00 0.65 O ATOM 807 CB GLU A 52 -8.432 0.308 -1.638 1.00 0.66 C ATOM 808 CG GLU A 52 -9.337 -0.597 -0.815 1.00 0.92 C ATOM 809 CD GLU A 52 -10.066 -1.620 -1.661 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.123 -1.284 -2.229 1.00 1.45 O ATOM 811 OE2 GLU A 52 -9.584 -2.768 -1.759 1.00 1.88 O ATOM 0 H GLU A 52 -6.605 -0.962 -0.558 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.859 -1.163 -3.092 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.940 1.016 -0.971 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.046 0.891 -2.325 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.741 -1.113 -0.062 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -10.066 0.013 -0.281 1.00 0.92 H new ATOM 818 N ALA A 53 -5.533 1.105 -2.696 1.00 0.52 N ATOM 819 CA ALA A 53 -4.676 2.066 -3.366 1.00 0.49 C ATOM 820 C ALA A 53 -3.944 1.429 -4.538 1.00 0.52 C ATOM 821 O ALA A 53 -3.942 1.975 -5.638 1.00 0.53 O ATOM 822 CB ALA A 53 -3.683 2.643 -2.377 1.00 0.43 C ATOM 0 H ALA A 53 -5.261 0.908 -1.733 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.301 2.868 -3.760 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.042 3.364 -2.884 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.221 3.140 -1.570 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.072 1.840 -1.965 1.00 0.43 H new ATOM 828 N GLY A 54 -3.325 0.276 -4.294 1.00 0.57 N ATOM 829 CA GLY A 54 -2.602 -0.424 -5.344 1.00 0.64 C ATOM 830 C GLY A 54 -3.486 -0.726 -6.533 1.00 0.74 C ATOM 831 O GLY A 54 -3.065 -0.603 -7.683 1.00 0.82 O ATOM 0 H GLY A 54 -3.311 -0.187 -3.385 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.754 0.181 -5.666 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.197 -1.355 -4.947 1.00 0.64 H new ATOM 835 N ASP A 55 -4.725 -1.094 -6.247 1.00 0.79 N ATOM 836 CA ASP A 55 -5.708 -1.364 -7.290 1.00 0.92 C ATOM 837 C ASP A 55 -6.026 -0.092 -8.066 1.00 0.88 C ATOM 838 O ASP A 55 -6.048 -0.091 -9.298 1.00 0.97 O ATOM 839 CB ASP A 55 -6.988 -1.933 -6.674 1.00 1.04 C ATOM 840 CG ASP A 55 -8.104 -2.068 -7.686 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.135 -3.085 -8.410 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.958 -1.160 -7.755 1.00 1.29 O ATOM 0 H ASP A 55 -5.077 -1.214 -5.297 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.288 -2.097 -7.978 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -6.776 -2.910 -6.239 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.315 -1.286 -5.860 1.00 1.04 H new ATOM 847 N GLU A 56 -6.243 0.990 -7.329 1.00 0.79 N ATOM 848 CA GLU A 56 -6.573 2.283 -7.917 1.00 0.83 C ATOM 849 C GLU A 56 -5.397 2.814 -8.739 1.00 0.78 C ATOM 850 O GLU A 56 -5.581 3.437 -9.788 1.00 0.85 O ATOM 851 CB GLU A 56 -6.941 3.276 -6.802 1.00 0.83 C ATOM 852 CG GLU A 56 -7.372 4.648 -7.297 1.00 0.94 C ATOM 853 CD GLU A 56 -8.647 4.607 -8.108 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.716 4.341 -7.523 1.00 1.38 O ATOM 855 OE2 GLU A 56 -8.582 4.821 -9.338 1.00 2.06 O ATOM 0 H GLU A 56 -6.196 0.997 -6.310 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.426 2.163 -8.584 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.747 2.850 -6.204 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.083 3.395 -6.141 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.512 5.310 -6.442 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -6.575 5.077 -7.904 1.00 0.94 H new ATOM 862 N PHE A 57 -4.186 2.547 -8.264 1.00 0.72 N ATOM 863 CA PHE A 57 -2.983 3.012 -8.938 1.00 0.76 C ATOM 864 C PHE A 57 -2.759 2.248 -10.236 1.00 0.82 C ATOM 865 O PHE A 57 -2.510 2.848 -11.278 1.00 0.90 O ATOM 866 CB PHE A 57 -1.755 2.876 -8.025 1.00 0.77 C ATOM 867 CG PHE A 57 -0.485 3.396 -8.643 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.176 4.748 -8.602 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.409 2.528 -9.252 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.998 5.221 -9.155 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.582 2.998 -9.809 1.00 1.25 C ATOM 872 CZ PHE A 57 1.846 4.365 -9.810 1.00 1.34 C ATOM 0 H PHE A 57 -4.013 2.010 -7.414 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.122 4.067 -9.176 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -1.943 3.412 -7.095 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.620 1.826 -7.766 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.861 5.438 -8.132 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.185 1.472 -9.291 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.249 6.268 -9.071 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.291 2.308 -10.242 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.714 4.749 -10.324 1.00 1.34 H new ATOM 882 N GLU A 58 -2.871 0.927 -10.181 1.00 0.83 N ATOM 883 CA GLU A 58 -2.559 0.094 -11.337 1.00 0.95 C ATOM 884 C GLU A 58 -3.639 0.213 -12.409 1.00 0.99 C ATOM 885 O GLU A 58 -3.352 0.131 -13.602 1.00 1.08 O ATOM 886 CB GLU A 58 -2.393 -1.372 -10.914 1.00 1.05 C ATOM 887 CG GLU A 58 -1.989 -2.300 -12.053 1.00 1.35 C ATOM 888 CD GLU A 58 -1.833 -3.738 -11.610 1.00 1.27 C ATOM 889 OE1 GLU A 58 -2.842 -4.472 -11.588 1.00 1.61 O ATOM 890 OE2 GLU A 58 -0.706 -4.138 -11.255 1.00 1.45 O ATOM 0 H GLU A 58 -3.173 0.411 -9.355 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.619 0.448 -11.760 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.641 -1.430 -10.127 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.331 -1.725 -10.486 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.739 -2.247 -12.842 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -1.049 -1.953 -12.483 1.00 1.35 H new ATOM 897 N LEU A 59 -4.879 0.423 -11.989 1.00 0.98 N ATOM 898 CA LEU A 59 -5.987 0.491 -12.927 1.00 1.10 C ATOM 899 C LEU A 59 -5.970 1.802 -13.711 1.00 1.10 C ATOM 900 O LEU A 59 -6.408 1.852 -14.858 1.00 1.24 O ATOM 901 CB LEU A 59 -7.318 0.335 -12.190 1.00 1.19 C ATOM 902 CG LEU A 59 -8.551 0.241 -13.087 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.456 -0.970 -14.001 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.810 0.172 -12.243 1.00 1.56 C ATOM 0 H LEU A 59 -5.140 0.548 -11.011 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.875 -0.329 -13.637 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.269 -0.561 -11.571 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.443 1.182 -11.515 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.597 1.135 -13.708 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.343 -1.020 -14.632 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.569 -0.884 -14.628 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.388 -1.876 -13.399 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.681 0.105 -12.894 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.769 -0.707 -11.600 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.885 1.068 -11.627 1.00 1.56 H new ATOM 916 N ARG A 60 -5.464 2.861 -13.093 1.00 1.00 N ATOM 917 CA ARG A 60 -5.434 4.169 -13.743 1.00 1.06 C ATOM 918 C ARG A 60 -4.047 4.493 -14.294 1.00 1.00 C ATOM 919 O ARG A 60 -3.916 4.950 -15.429 1.00 1.07 O ATOM 920 CB ARG A 60 -5.889 5.275 -12.780 1.00 1.10 C ATOM 921 CG ARG A 60 -7.393 5.309 -12.529 1.00 1.19 C ATOM 922 CD ARG A 60 -8.181 5.612 -13.801 1.00 1.31 C ATOM 923 NE ARG A 60 -7.800 6.892 -14.402 1.00 1.81 N ATOM 924 CZ ARG A 60 -8.509 7.515 -15.347 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.642 6.987 -15.790 1.00 2.15 N ATOM 926 NH2 ARG A 60 -8.076 8.664 -15.854 1.00 3.21 N ATOM 0 H ARG A 60 -5.072 2.844 -12.152 1.00 1.00 H new ATOM 0 HA ARG A 60 -6.130 4.125 -14.581 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -5.376 5.144 -11.827 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.577 6.240 -13.180 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.714 4.349 -12.124 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.617 6.064 -11.776 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -8.020 4.812 -14.524 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -9.246 5.625 -13.571 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.940 7.335 -14.079 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.975 6.102 -15.409 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.180 7.466 -16.512 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -7.202 9.071 -15.522 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -8.618 9.139 -16.576 1.00 3.21 H new ATOM 940 N TYR A 61 -3.016 4.240 -13.502 1.00 0.91 N ATOM 941 CA TYR A 61 -1.652 4.600 -13.875 1.00 0.90 C ATOM 942 C TYR A 61 -0.856 3.344 -14.225 1.00 0.84 C ATOM 943 O TYR A 61 0.287 3.175 -13.791 1.00 0.83 O ATOM 944 CB TYR A 61 -0.956 5.349 -12.728 1.00 0.96 C ATOM 945 CG TYR A 61 -1.728 6.541 -12.183 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.996 7.657 -12.973 1.00 1.27 C ATOM 947 CD2 TYR A 61 -2.175 6.553 -10.865 1.00 1.04 C ATOM 948 CE1 TYR A 61 -2.687 8.743 -12.462 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.866 7.635 -10.353 1.00 1.14 C ATOM 950 CZ TYR A 61 -3.119 8.723 -11.152 1.00 1.27 C ATOM 951 OH TYR A 61 -3.803 9.802 -10.635 1.00 1.41 O ATOM 0 H TYR A 61 -3.096 3.785 -12.593 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.696 5.255 -14.745 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.774 4.648 -11.913 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.018 5.693 -13.076 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -1.660 7.675 -13.999 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.978 5.701 -10.231 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -2.887 9.601 -13.086 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -3.206 7.625 -9.328 1.00 1.14 H new ATOM 0 HH TYR A 61 -4.035 9.624 -9.700 1.00 1.41 H new ATOM 961 N ARG A 62 -1.464 2.469 -15.020 1.00 0.86 N ATOM 962 CA ARG A 62 -0.842 1.200 -15.391 1.00 0.85 C ATOM 963 C ARG A 62 0.464 1.435 -16.147 1.00 0.87 C ATOM 964 O ARG A 62 1.454 0.734 -15.931 1.00 0.85 O ATOM 965 CB ARG A 62 -1.794 0.374 -16.259 1.00 0.95 C ATOM 966 CG ARG A 62 -1.461 -1.110 -16.300 1.00 1.04 C ATOM 967 CD ARG A 62 -2.294 -1.837 -17.346 1.00 1.23 C ATOM 968 NE ARG A 62 -3.697 -1.422 -17.318 1.00 1.73 N ATOM 969 CZ ARG A 62 -4.729 -2.258 -17.414 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.530 -3.569 -17.474 1.00 2.24 N ATOM 971 NH2 ARG A 62 -5.965 -1.777 -17.435 1.00 3.02 N ATOM 0 H ARG A 62 -2.390 2.615 -15.422 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.624 0.653 -14.474 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.810 0.498 -15.885 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.778 0.768 -17.275 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.402 -1.241 -16.521 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -1.639 -1.552 -15.320 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -1.880 -1.646 -18.336 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.231 -2.912 -17.176 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.898 -0.427 -17.218 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -3.581 -3.943 -17.447 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -5.326 -4.203 -17.547 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -6.122 -0.771 -17.378 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -6.759 -2.413 -17.508 1.00 3.02 H new ATOM 985 N ARG A 63 0.456 2.433 -17.027 1.00 0.94 N ATOM 986 CA ARG A 63 1.643 2.784 -17.803 1.00 1.01 C ATOM 987 C ARG A 63 2.786 3.193 -16.884 1.00 0.95 C ATOM 988 O ARG A 63 3.934 2.799 -17.096 1.00 0.99 O ATOM 989 CB ARG A 63 1.338 3.921 -18.784 1.00 1.16 C ATOM 990 CG ARG A 63 0.448 3.515 -19.947 1.00 1.70 C ATOM 991 CD ARG A 63 0.029 4.722 -20.773 1.00 2.14 C ATOM 992 NE ARG A 63 1.173 5.499 -21.255 1.00 2.71 N ATOM 993 CZ ARG A 63 1.106 6.795 -21.569 1.00 3.58 C ATOM 994 NH1 ARG A 63 -0.031 7.462 -21.406 1.00 3.92 N ATOM 995 NH2 ARG A 63 2.178 7.430 -22.022 1.00 4.52 N ATOM 0 H ARG A 63 -0.360 3.014 -17.221 1.00 0.94 H new ATOM 0 HA ARG A 63 1.942 1.902 -18.369 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.859 4.736 -18.241 1.00 1.16 H new ATOM 0 HB3 ARG A 63 2.278 4.309 -19.178 1.00 1.16 H new ATOM 0 HG2 ARG A 63 0.977 2.804 -20.581 1.00 1.70 H new ATOM 0 HG3 ARG A 63 -0.438 3.006 -19.568 1.00 1.70 H new ATOM 0 HD2 ARG A 63 -0.563 4.387 -21.625 1.00 2.14 H new ATOM 0 HD3 ARG A 63 -0.614 5.364 -20.171 1.00 2.14 H new ATOM 0 HE ARG A 63 2.070 5.024 -21.356 1.00 2.71 H new ATOM 0 HH11 ARG A 63 -0.855 6.984 -21.040 1.00 3.92 H new ATOM 0 HH12 ARG A 63 -0.080 8.452 -21.646 1.00 3.92 H new ATOM 0 HH21 ARG A 63 3.059 6.928 -22.132 1.00 4.52 H new ATOM 0 HH22 ARG A 63 2.121 8.420 -22.260 1.00 4.52 H new ATOM 1009 N ALA A 64 2.464 3.976 -15.860 1.00 0.90 N ATOM 1010 CA ALA A 64 3.461 4.428 -14.903 1.00 0.89 C ATOM 1011 C ALA A 64 4.018 3.251 -14.119 1.00 0.75 C ATOM 1012 O ALA A 64 5.231 3.102 -13.986 1.00 0.73 O ATOM 1013 CB ALA A 64 2.865 5.461 -13.962 1.00 0.94 C ATOM 0 H ALA A 64 1.518 4.310 -15.673 1.00 0.90 H new ATOM 0 HA ALA A 64 4.279 4.894 -15.452 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.625 5.788 -13.253 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.513 6.317 -14.537 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.029 5.020 -13.420 1.00 0.94 H new ATOM 1019 N PHE A 65 3.123 2.406 -13.623 1.00 0.69 N ATOM 1020 CA PHE A 65 3.519 1.243 -12.835 1.00 0.61 C ATOM 1021 C PHE A 65 4.432 0.322 -13.641 1.00 0.59 C ATOM 1022 O PHE A 65 5.507 -0.058 -13.179 1.00 0.59 O ATOM 1023 CB PHE A 65 2.284 0.469 -12.353 1.00 0.62 C ATOM 1024 CG PHE A 65 2.614 -0.664 -11.419 1.00 0.59 C ATOM 1025 CD1 PHE A 65 2.929 -0.420 -10.092 1.00 0.60 C ATOM 1026 CD2 PHE A 65 2.605 -1.974 -11.872 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.229 -1.462 -9.234 1.00 0.64 C ATOM 1028 CE2 PHE A 65 2.904 -3.019 -11.018 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.231 -2.751 -9.690 1.00 0.66 C ATOM 0 H PHE A 65 2.116 2.504 -13.752 1.00 0.69 H new ATOM 0 HA PHE A 65 4.070 1.601 -11.966 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.606 1.159 -11.850 1.00 0.62 H new ATOM 0 HB3 PHE A 65 1.752 0.073 -13.218 1.00 0.62 H new ATOM 0 HD1 PHE A 65 2.940 0.595 -9.724 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.362 -2.181 -12.904 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.463 -1.257 -8.200 1.00 0.64 H new ATOM 0 HE2 PHE A 65 2.884 -4.037 -11.378 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.486 -3.560 -9.022 1.00 0.66 H new ATOM 1039 N SER A 66 4.009 -0.016 -14.853 1.00 0.64 N ATOM 1040 CA SER A 66 4.766 -0.930 -15.705 1.00 0.68 C ATOM 1041 C SER A 66 6.116 -0.332 -16.110 1.00 0.66 C ATOM 1042 O SER A 66 7.079 -1.057 -16.359 1.00 0.68 O ATOM 1043 CB SER A 66 3.949 -1.276 -16.952 1.00 0.83 C ATOM 1044 OG SER A 66 2.664 -1.759 -16.594 1.00 1.20 O ATOM 0 H SER A 66 3.144 0.329 -15.270 1.00 0.64 H new ATOM 0 HA SER A 66 4.962 -1.838 -15.135 1.00 0.68 H new ATOM 0 HB2 SER A 66 3.848 -0.393 -17.583 1.00 0.83 H new ATOM 0 HB3 SER A 66 4.475 -2.029 -17.540 1.00 0.83 H new ATOM 0 HG SER A 66 2.095 -1.007 -16.327 1.00 1.20 H new ATOM 1050 N ASP A 67 6.182 0.990 -16.161 1.00 0.68 N ATOM 1051 CA ASP A 67 7.409 1.681 -16.553 1.00 0.73 C ATOM 1052 C ASP A 67 8.371 1.806 -15.370 1.00 0.65 C ATOM 1053 O ASP A 67 9.537 1.410 -15.461 1.00 0.66 O ATOM 1054 CB ASP A 67 7.081 3.069 -17.114 1.00 0.89 C ATOM 1055 CG ASP A 67 8.300 3.804 -17.635 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.037 4.392 -16.815 1.00 2.06 O ATOM 1057 OD2 ASP A 67 8.540 3.777 -18.858 1.00 1.41 O ATOM 0 H ASP A 67 5.403 1.609 -15.937 1.00 0.68 H new ATOM 0 HA ASP A 67 7.897 1.090 -17.328 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.354 2.966 -17.920 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.609 3.667 -16.334 1.00 0.89 H new ATOM 1062 N LEU A 68 7.867 2.324 -14.253 1.00 0.63 N ATOM 1063 CA LEU A 68 8.695 2.608 -13.084 1.00 0.66 C ATOM 1064 C LEU A 68 9.254 1.333 -12.457 1.00 0.57 C ATOM 1065 O LEU A 68 10.326 1.353 -11.848 1.00 0.63 O ATOM 1066 CB LEU A 68 7.888 3.390 -12.044 1.00 0.75 C ATOM 1067 CG LEU A 68 7.447 4.792 -12.475 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.578 5.434 -11.405 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.657 5.665 -12.761 1.00 1.07 C ATOM 0 H LEU A 68 6.881 2.557 -14.133 1.00 0.63 H new ATOM 0 HA LEU A 68 9.539 3.210 -13.420 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.001 2.811 -11.787 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.485 3.478 -11.136 1.00 0.75 H new ATOM 0 HG LEU A 68 6.859 4.699 -13.388 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.275 6.429 -11.731 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.692 4.821 -11.240 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.143 5.512 -10.476 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.326 6.658 -13.066 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.267 5.747 -11.862 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.247 5.218 -13.561 1.00 1.07 H new ATOM 1081 N THR A 69 8.541 0.223 -12.619 1.00 0.49 N ATOM 1082 CA THR A 69 8.980 -1.055 -12.065 1.00 0.49 C ATOM 1083 C THR A 69 10.263 -1.547 -12.728 1.00 0.46 C ATOM 1084 O THR A 69 10.969 -2.391 -12.179 1.00 0.51 O ATOM 1085 CB THR A 69 7.891 -2.136 -12.196 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.255 -2.035 -13.476 1.00 0.71 O ATOM 1087 CG2 THR A 69 6.855 -2.003 -11.093 1.00 0.63 C ATOM 0 H THR A 69 7.658 0.181 -13.128 1.00 0.49 H new ATOM 0 HA THR A 69 9.176 -0.879 -11.007 1.00 0.49 H new ATOM 0 HB THR A 69 8.366 -3.112 -12.103 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.398 -1.570 -13.380 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.098 -2.778 -11.209 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.340 -2.112 -10.123 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.382 -1.023 -11.154 1.00 0.63 H new ATOM 1095 N SER A 70 10.573 -1.013 -13.899 1.00 0.46 N ATOM 1096 CA SER A 70 11.790 -1.396 -14.596 1.00 0.49 C ATOM 1097 C SER A 70 12.952 -0.513 -14.146 1.00 0.48 C ATOM 1098 O SER A 70 14.112 -0.923 -14.196 1.00 0.53 O ATOM 1099 CB SER A 70 11.599 -1.316 -16.113 1.00 0.57 C ATOM 1100 OG SER A 70 12.695 -1.897 -16.801 1.00 1.31 O ATOM 0 H SER A 70 10.004 -0.319 -14.383 1.00 0.46 H new ATOM 0 HA SER A 70 12.023 -2.431 -14.345 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.678 -1.828 -16.393 1.00 0.57 H new ATOM 0 HB3 SER A 70 11.489 -0.274 -16.414 1.00 0.57 H new ATOM 0 HG SER A 70 12.546 -1.833 -17.767 1.00 1.31 H new ATOM 1106 N GLN A 71 12.637 0.691 -13.682 1.00 0.49 N ATOM 1107 CA GLN A 71 13.656 1.592 -13.159 1.00 0.53 C ATOM 1108 C GLN A 71 14.054 1.163 -11.754 1.00 0.46 C ATOM 1109 O GLN A 71 15.211 1.279 -11.356 1.00 0.53 O ATOM 1110 CB GLN A 71 13.148 3.035 -13.138 1.00 0.63 C ATOM 1111 CG GLN A 71 14.173 4.035 -12.625 1.00 0.69 C ATOM 1112 CD GLN A 71 13.627 5.446 -12.512 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.363 6.419 -12.673 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.338 5.573 -12.227 1.00 0.82 N ATOM 0 H GLN A 71 11.688 1.064 -13.657 1.00 0.49 H new ATOM 0 HA GLN A 71 14.527 1.543 -13.813 1.00 0.53 H new ATOM 0 HB2 GLN A 71 12.848 3.320 -14.146 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.257 3.088 -12.513 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.529 3.711 -11.647 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.034 4.038 -13.293 1.00 0.69 H new ATOM 0 HE21 GLN A 71 11.759 4.743 -12.101 1.00 0.82 H new ATOM 0 HE22 GLN A 71 11.925 6.501 -12.134 1.00 0.82 H new ATOM 1123 N LEU A 72 13.081 0.654 -11.012 1.00 0.39 N ATOM 1124 CA LEU A 72 13.321 0.190 -9.654 1.00 0.33 C ATOM 1125 C LEU A 72 13.560 -1.317 -9.656 1.00 0.34 C ATOM 1126 O LEU A 72 13.644 -1.943 -8.604 1.00 0.37 O ATOM 1127 CB LEU A 72 12.131 0.551 -8.749 1.00 0.37 C ATOM 1128 CG LEU A 72 12.341 0.306 -7.253 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.577 1.039 -6.758 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.118 0.745 -6.470 1.00 0.92 C ATOM 0 H LEU A 72 12.117 0.552 -11.328 1.00 0.39 H new ATOM 0 HA LEU A 72 14.210 0.683 -9.261 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.892 1.604 -8.897 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.263 -0.022 -9.075 1.00 0.37 H new ATOM 0 HG LEU A 72 12.490 -0.762 -7.097 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.709 0.852 -5.692 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.453 0.682 -7.300 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.457 2.109 -6.926 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.282 0.565 -5.408 1.00 0.92 H new ATOM 0 HD22 LEU A 72 10.943 1.808 -6.635 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.249 0.178 -6.804 1.00 0.92 H new ATOM 1142 N HIS A 73 13.680 -1.881 -10.856 1.00 0.41 N ATOM 1143 CA HIS A 73 13.906 -3.315 -11.023 1.00 0.46 C ATOM 1144 C HIS A 73 15.124 -3.766 -10.223 1.00 0.41 C ATOM 1145 O HIS A 73 16.247 -3.324 -10.484 1.00 0.45 O ATOM 1146 CB HIS A 73 14.086 -3.650 -12.509 1.00 0.60 C ATOM 1147 CG HIS A 73 14.399 -5.090 -12.781 1.00 1.34 C ATOM 1148 ND1 HIS A 73 13.753 -6.135 -12.161 1.00 2.07 N ATOM 1149 CD2 HIS A 73 15.302 -5.653 -13.617 1.00 2.33 C ATOM 1150 CE1 HIS A 73 14.240 -7.276 -12.604 1.00 2.86 C ATOM 1151 NE2 HIS A 73 15.181 -7.012 -13.487 1.00 3.01 N ATOM 0 H HIS A 73 13.624 -1.363 -11.733 1.00 0.41 H new ATOM 0 HA HIS A 73 13.035 -3.850 -10.645 1.00 0.46 H new ATOM 0 HB2 HIS A 73 13.175 -3.381 -13.043 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.888 -3.033 -12.914 1.00 0.60 H new ATOM 0 HD1 HIS A 73 13.012 -6.041 -11.466 1.00 2.07 H new ATOM 0 HD2 HIS A 73 15.989 -5.130 -14.265 1.00 2.33 H new ATOM 0 HE1 HIS A 73 13.922 -8.261 -12.296 1.00 2.86 H new ATOM 1160 N ILE A 74 14.894 -4.653 -9.265 1.00 0.37 N ATOM 1161 CA ILE A 74 15.931 -5.058 -8.337 1.00 0.36 C ATOM 1162 C ILE A 74 16.852 -6.109 -8.956 1.00 0.45 C ATOM 1163 O ILE A 74 16.399 -7.069 -9.588 1.00 0.61 O ATOM 1164 CB ILE A 74 15.318 -5.595 -7.019 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.417 -5.878 -5.993 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.489 -6.851 -7.269 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.887 -6.205 -4.618 1.00 0.34 C ATOM 0 H ILE A 74 13.993 -5.106 -9.113 1.00 0.37 H new ATOM 0 HA ILE A 74 16.527 -4.174 -8.109 1.00 0.36 H new ATOM 0 HB ILE A 74 14.656 -4.827 -6.620 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.027 -6.710 -6.346 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.071 -5.009 -5.924 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.072 -7.205 -6.326 1.00 0.35 H new ATOM 0 HG22 ILE A 74 13.679 -6.621 -7.961 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.123 -7.626 -7.699 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.721 -6.394 -3.942 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.301 -5.365 -4.245 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.256 -7.092 -4.673 1.00 0.34 H new ATOM 1179 N THR A 75 18.148 -5.895 -8.804 1.00 0.61 N ATOM 1180 CA THR A 75 19.143 -6.852 -9.244 1.00 0.73 C ATOM 1181 C THR A 75 20.089 -7.166 -8.087 1.00 0.58 C ATOM 1182 O THR A 75 20.119 -6.426 -7.104 1.00 0.57 O ATOM 1183 CB THR A 75 19.936 -6.318 -10.459 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.430 -4.996 -10.197 1.00 1.38 O ATOM 1185 CG2 THR A 75 19.064 -6.296 -11.706 1.00 1.56 C ATOM 0 H THR A 75 18.537 -5.056 -8.374 1.00 0.61 H new ATOM 0 HA THR A 75 18.635 -7.764 -9.558 1.00 0.73 H new ATOM 0 HB THR A 75 20.779 -6.988 -10.628 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.195 -4.734 -9.282 1.00 1.38 H new ATOM 0 HG21 THR A 75 19.643 -5.917 -12.548 1.00 1.56 H new ATOM 0 HG22 THR A 75 18.720 -7.306 -11.928 1.00 1.56 H new ATOM 0 HG23 THR A 75 18.203 -5.649 -11.537 1.00 1.56 H new ATOM 1193 N PRO A 76 20.850 -8.269 -8.161 1.00 0.66 N ATOM 1194 CA PRO A 76 21.779 -8.645 -7.096 1.00 0.73 C ATOM 1195 C PRO A 76 22.834 -7.567 -6.853 1.00 0.72 C ATOM 1196 O PRO A 76 23.767 -7.403 -7.643 1.00 0.81 O ATOM 1197 CB PRO A 76 22.433 -9.933 -7.608 1.00 0.93 C ATOM 1198 CG PRO A 76 21.525 -10.440 -8.676 1.00 1.06 C ATOM 1199 CD PRO A 76 20.864 -9.232 -9.274 1.00 0.90 C ATOM 0 HA PRO A 76 21.269 -8.774 -6.141 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.431 -9.738 -8.001 1.00 0.93 H new ATOM 0 HB3 PRO A 76 22.543 -10.663 -6.806 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.084 -10.992 -9.432 1.00 1.06 H new ATOM 0 HG3 PRO A 76 20.784 -11.125 -8.264 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.421 -8.850 -10.129 1.00 0.90 H new ATOM 0 HD3 PRO A 76 19.857 -9.457 -9.625 1.00 0.90 H new ATOM 1207 N GLY A 77 22.667 -6.824 -5.768 1.00 0.86 N ATOM 1208 CA GLY A 77 23.591 -5.757 -5.450 1.00 1.10 C ATOM 1209 C GLY A 77 22.912 -4.404 -5.379 1.00 1.00 C ATOM 1210 O GLY A 77 23.525 -3.421 -4.958 1.00 1.32 O ATOM 0 H GLY A 77 21.905 -6.943 -5.101 1.00 0.86 H new ATOM 0 HA2 GLY A 77 24.072 -5.969 -4.495 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.378 -5.726 -6.203 1.00 1.10 H new ATOM 1214 N THR A 78 21.647 -4.351 -5.785 1.00 0.85 N ATOM 1215 CA THR A 78 20.866 -3.123 -5.707 1.00 0.82 C ATOM 1216 C THR A 78 20.554 -2.785 -4.247 1.00 0.85 C ATOM 1217 O THR A 78 19.515 -3.171 -3.716 1.00 1.52 O ATOM 1218 CB THR A 78 19.548 -3.252 -6.502 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.825 -3.695 -7.840 1.00 1.52 O ATOM 1220 CG2 THR A 78 18.810 -1.921 -6.555 1.00 1.15 C ATOM 0 H THR A 78 21.141 -5.147 -6.172 1.00 0.85 H new ATOM 0 HA THR A 78 21.459 -2.321 -6.146 1.00 0.82 H new ATOM 0 HB THR A 78 18.917 -3.982 -5.994 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.246 -3.216 -8.470 1.00 1.52 H new ATOM 0 HG21 THR A 78 17.886 -2.040 -7.120 1.00 1.15 H new ATOM 0 HG22 THR A 78 18.576 -1.594 -5.542 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.439 -1.175 -7.041 1.00 1.15 H new ATOM 1228 N ALA A 79 21.490 -2.107 -3.597 1.00 0.68 N ATOM 1229 CA ALA A 79 21.361 -1.756 -2.189 1.00 0.73 C ATOM 1230 C ALA A 79 20.432 -0.561 -1.995 1.00 0.62 C ATOM 1231 O ALA A 79 19.985 0.047 -2.971 1.00 0.56 O ATOM 1232 CB ALA A 79 22.733 -1.456 -1.611 1.00 0.85 C ATOM 0 H ALA A 79 22.357 -1.786 -4.028 1.00 0.68 H new ATOM 0 HA ALA A 79 20.922 -2.604 -1.663 1.00 0.73 H new ATOM 0 HB1 ALA A 79 22.635 -1.194 -0.558 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.369 -2.336 -1.708 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.182 -0.623 -2.152 1.00 0.85 H new ATOM 1238 N TYR A 80 20.160 -0.212 -0.735 1.00 0.63 N ATOM 1239 CA TYR A 80 19.305 0.935 -0.422 1.00 0.58 C ATOM 1240 C TYR A 80 19.882 2.217 -1.014 1.00 0.50 C ATOM 1241 O TYR A 80 19.140 3.122 -1.382 1.00 0.46 O ATOM 1242 CB TYR A 80 19.122 1.096 1.093 1.00 0.67 C ATOM 1243 CG TYR A 80 18.168 2.212 1.483 1.00 0.80 C ATOM 1244 CD1 TYR A 80 16.796 2.072 1.313 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.640 3.405 2.025 1.00 1.14 C ATOM 1246 CE1 TYR A 80 15.924 3.083 1.671 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.773 4.417 2.388 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.417 4.253 2.208 1.00 1.58 C ATOM 1249 OH TYR A 80 15.549 5.256 2.576 1.00 2.03 O ATOM 0 H TYR A 80 20.518 -0.706 0.082 1.00 0.63 H new ATOM 0 HA TYR A 80 18.329 0.747 -0.869 1.00 0.58 H new ATOM 0 HB2 TYR A 80 18.755 0.157 1.507 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.094 1.287 1.548 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.404 1.157 0.894 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.702 3.541 2.164 1.00 1.14 H new ATOM 0 HE1 TYR A 80 14.861 2.957 1.531 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.157 5.334 2.811 1.00 1.55 H new ATOM 0 HH TYR A 80 16.057 6.012 2.938 1.00 2.03 H new ATOM 1259 N GLN A 81 21.205 2.283 -1.114 1.00 0.56 N ATOM 1260 CA GLN A 81 21.872 3.430 -1.718 1.00 0.59 C ATOM 1261 C GLN A 81 21.359 3.669 -3.139 1.00 0.54 C ATOM 1262 O GLN A 81 21.173 4.809 -3.558 1.00 0.63 O ATOM 1263 CB GLN A 81 23.388 3.216 -1.729 1.00 0.72 C ATOM 1264 CG GLN A 81 24.167 4.360 -2.367 1.00 0.84 C ATOM 1265 CD GLN A 81 23.980 5.686 -1.650 1.00 1.40 C ATOM 1266 OE1 GLN A 81 24.016 6.746 -2.272 1.00 2.01 O ATOM 1267 NE2 GLN A 81 23.791 5.641 -0.340 1.00 2.18 N ATOM 0 H GLN A 81 21.838 1.554 -0.784 1.00 0.56 H new ATOM 0 HA GLN A 81 21.646 4.313 -1.120 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.734 3.081 -0.704 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.611 2.294 -2.265 1.00 0.72 H new ATOM 0 HG2 GLN A 81 25.227 4.107 -2.378 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.854 4.469 -3.406 1.00 0.84 H new ATOM 0 HE21 GLN A 81 23.767 4.742 0.141 1.00 2.18 H new ATOM 0 HE22 GLN A 81 23.669 6.505 0.188 1.00 2.18 H new ATOM 1276 N SER A 82 21.114 2.587 -3.866 1.00 0.48 N ATOM 1277 CA SER A 82 20.588 2.679 -5.220 1.00 0.47 C ATOM 1278 C SER A 82 19.062 2.765 -5.187 1.00 0.40 C ATOM 1279 O SER A 82 18.448 3.505 -5.955 1.00 0.42 O ATOM 1280 CB SER A 82 21.032 1.459 -6.026 1.00 0.55 C ATOM 1281 OG SER A 82 22.412 1.195 -5.826 1.00 1.17 O ATOM 0 H SER A 82 21.272 1.634 -3.539 1.00 0.48 H new ATOM 0 HA SER A 82 20.976 3.580 -5.695 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.445 0.590 -5.731 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.840 1.628 -7.085 1.00 0.55 H new ATOM 0 HG SER A 82 22.674 0.409 -6.350 1.00 1.17 H new ATOM 1287 N PHE A 83 18.467 2.010 -4.268 1.00 0.36 N ATOM 1288 CA PHE A 83 17.016 1.958 -4.103 1.00 0.33 C ATOM 1289 C PHE A 83 16.455 3.339 -3.761 1.00 0.31 C ATOM 1290 O PHE A 83 15.406 3.739 -4.272 1.00 0.32 O ATOM 1291 CB PHE A 83 16.670 0.940 -2.998 1.00 0.35 C ATOM 1292 CG PHE A 83 15.197 0.715 -2.776 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.493 -0.185 -3.561 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.522 1.387 -1.769 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.146 -0.406 -3.346 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.176 1.171 -1.551 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.487 0.273 -2.341 1.00 0.38 C ATOM 0 H PHE A 83 18.978 1.416 -3.615 1.00 0.36 H new ATOM 0 HA PHE A 83 16.560 1.642 -5.042 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.134 -0.014 -3.246 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.115 1.277 -2.062 1.00 0.35 H new ATOM 0 HD1 PHE A 83 15.003 -0.719 -4.349 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.056 2.089 -1.146 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.609 -1.110 -3.964 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.663 1.704 -0.764 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.434 0.102 -2.173 1.00 0.38 H new ATOM 1307 N GLU A 84 17.174 4.074 -2.916 1.00 0.34 N ATOM 1308 CA GLU A 84 16.735 5.393 -2.478 1.00 0.39 C ATOM 1309 C GLU A 84 16.745 6.380 -3.638 1.00 0.37 C ATOM 1310 O GLU A 84 15.887 7.247 -3.717 1.00 0.40 O ATOM 1311 CB GLU A 84 17.623 5.916 -1.339 1.00 0.51 C ATOM 1312 CG GLU A 84 17.194 7.277 -0.808 1.00 0.64 C ATOM 1313 CD GLU A 84 18.097 7.791 0.293 1.00 0.90 C ATOM 1314 OE1 GLU A 84 19.160 8.370 -0.024 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.746 7.627 1.479 1.00 0.95 O ATOM 0 H GLU A 84 18.066 3.776 -2.521 1.00 0.34 H new ATOM 0 HA GLU A 84 15.714 5.297 -2.109 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.612 5.196 -0.521 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.652 5.981 -1.692 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.185 7.995 -1.628 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.173 7.209 -0.432 1.00 0.64 H new ATOM 1322 N GLN A 85 17.697 6.222 -4.552 1.00 0.37 N ATOM 1323 CA GLN A 85 17.837 7.142 -5.680 1.00 0.42 C ATOM 1324 C GLN A 85 16.578 7.139 -6.536 1.00 0.38 C ATOM 1325 O GLN A 85 16.183 8.165 -7.087 1.00 0.46 O ATOM 1326 CB GLN A 85 19.044 6.764 -6.539 1.00 0.50 C ATOM 1327 CG GLN A 85 20.370 6.805 -5.794 1.00 0.61 C ATOM 1328 CD GLN A 85 21.533 6.359 -6.652 1.00 1.44 C ATOM 1329 OE1 GLN A 85 21.545 6.571 -7.864 1.00 1.90 O ATOM 1330 NE2 GLN A 85 22.511 5.719 -6.034 1.00 2.16 N ATOM 0 H GLN A 85 18.383 5.467 -4.536 1.00 0.37 H new ATOM 0 HA GLN A 85 17.989 8.144 -5.278 1.00 0.42 H new ATOM 0 HB2 GLN A 85 18.894 5.761 -6.938 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.097 7.441 -7.392 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.552 7.820 -5.440 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.307 6.166 -4.913 1.00 0.61 H new ATOM 0 HE21 GLN A 85 22.463 5.564 -5.027 1.00 2.16 H new ATOM 0 HE22 GLN A 85 23.314 5.381 -6.564 1.00 2.16 H new ATOM 1339 N VAL A 86 15.944 5.981 -6.627 1.00 0.31 N ATOM 1340 CA VAL A 86 14.731 5.834 -7.405 1.00 0.31 C ATOM 1341 C VAL A 86 13.547 6.390 -6.636 1.00 0.29 C ATOM 1342 O VAL A 86 12.830 7.267 -7.115 1.00 0.32 O ATOM 1343 CB VAL A 86 14.459 4.357 -7.726 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.192 4.213 -8.549 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.646 3.736 -8.441 1.00 0.36 C ATOM 0 H VAL A 86 16.255 5.125 -6.167 1.00 0.31 H new ATOM 0 HA VAL A 86 14.865 6.385 -8.336 1.00 0.31 H new ATOM 0 HB VAL A 86 14.314 3.822 -6.787 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.017 3.159 -8.766 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.347 4.614 -7.989 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.301 4.763 -9.484 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.433 2.690 -8.659 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.830 4.271 -9.373 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.529 3.801 -7.805 1.00 0.36 H new ATOM 1355 N VAL A 87 13.357 5.875 -5.431 1.00 0.28 N ATOM 1356 CA VAL A 87 12.218 6.244 -4.611 1.00 0.32 C ATOM 1357 C VAL A 87 12.302 7.699 -4.139 1.00 0.35 C ATOM 1358 O VAL A 87 11.319 8.271 -3.670 1.00 0.37 O ATOM 1359 CB VAL A 87 12.081 5.298 -3.408 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.015 3.861 -3.891 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.227 5.482 -2.433 1.00 0.41 C ATOM 0 H VAL A 87 13.983 5.196 -4.999 1.00 0.28 H new ATOM 0 HA VAL A 87 11.329 6.149 -5.234 1.00 0.32 H new ATOM 0 HB VAL A 87 11.158 5.540 -2.881 1.00 0.38 H new ATOM 0 HG11 VAL A 87 11.918 3.193 -3.035 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.154 3.737 -4.547 1.00 0.38 H new ATOM 0 HG13 VAL A 87 12.926 3.619 -4.438 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.103 4.799 -1.592 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.170 5.270 -2.936 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.233 6.509 -2.068 1.00 0.41 H new ATOM 1371 N ASN A 88 13.479 8.293 -4.278 1.00 0.38 N ATOM 1372 CA ASN A 88 13.662 9.716 -4.005 1.00 0.47 C ATOM 1373 C ASN A 88 12.906 10.545 -5.033 1.00 0.44 C ATOM 1374 O ASN A 88 12.405 11.627 -4.731 1.00 0.45 O ATOM 1375 CB ASN A 88 15.153 10.084 -4.025 1.00 0.61 C ATOM 1376 CG ASN A 88 15.403 11.577 -3.892 1.00 0.78 C ATOM 1377 OD1 ASN A 88 15.478 12.108 -2.785 1.00 0.87 O ATOM 1378 ND2 ASN A 88 15.554 12.264 -5.016 1.00 0.97 N ATOM 0 H ASN A 88 14.326 7.811 -4.579 1.00 0.38 H new ATOM 0 HA ASN A 88 13.267 9.931 -3.012 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.660 9.563 -3.212 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.596 9.730 -4.956 1.00 0.61 H new ATOM 0 HD21 ASN A 88 15.739 13.266 -4.980 1.00 0.97 H new ATOM 0 HD22 ASN A 88 15.485 11.790 -5.917 1.00 0.97 H new ATOM 1385 N GLU A 89 12.790 10.010 -6.242 1.00 0.42 N ATOM 1386 CA GLU A 89 12.118 10.709 -7.325 1.00 0.45 C ATOM 1387 C GLU A 89 10.613 10.717 -7.109 1.00 0.38 C ATOM 1388 O GLU A 89 9.883 11.437 -7.782 1.00 0.43 O ATOM 1389 CB GLU A 89 12.469 10.077 -8.670 1.00 0.54 C ATOM 1390 CG GLU A 89 13.951 10.153 -8.985 1.00 0.65 C ATOM 1391 CD GLU A 89 14.476 11.573 -8.933 1.00 1.23 C ATOM 1392 OE1 GLU A 89 14.136 12.372 -9.831 1.00 1.28 O ATOM 1393 OE2 GLU A 89 15.226 11.900 -7.990 1.00 2.04 O ATOM 0 H GLU A 89 13.154 9.092 -6.495 1.00 0.42 H new ATOM 0 HA GLU A 89 12.464 11.743 -7.332 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.155 9.033 -8.669 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.908 10.578 -9.459 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.503 9.537 -8.275 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.132 9.737 -9.976 1.00 0.65 H new ATOM 1400 N LEU A 90 10.153 9.903 -6.170 1.00 0.31 N ATOM 1401 CA LEU A 90 8.760 9.929 -5.762 1.00 0.27 C ATOM 1402 C LEU A 90 8.522 11.138 -4.873 1.00 0.25 C ATOM 1403 O LEU A 90 7.482 11.786 -4.940 1.00 0.26 O ATOM 1404 CB LEU A 90 8.399 8.656 -4.996 1.00 0.26 C ATOM 1405 CG LEU A 90 8.706 7.345 -5.712 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.439 6.173 -4.786 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.882 7.217 -6.981 1.00 0.37 C ATOM 0 H LEU A 90 10.726 9.217 -5.678 1.00 0.31 H new ATOM 0 HA LEU A 90 8.133 9.990 -6.652 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.931 8.663 -4.045 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.334 8.682 -4.765 1.00 0.26 H new ATOM 0 HG LEU A 90 9.760 7.342 -5.992 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.661 5.241 -5.306 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.072 6.256 -3.903 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.392 6.179 -4.484 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.118 6.274 -7.475 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.822 7.240 -6.730 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.114 8.045 -7.651 1.00 0.37 H new ATOM 1419 N PHE A 91 9.520 11.442 -4.051 1.00 0.27 N ATOM 1420 CA PHE A 91 9.438 12.543 -3.105 1.00 0.29 C ATOM 1421 C PHE A 91 9.760 13.863 -3.806 1.00 0.33 C ATOM 1422 O PHE A 91 9.042 14.853 -3.653 1.00 0.33 O ATOM 1423 CB PHE A 91 10.418 12.307 -1.945 1.00 0.35 C ATOM 1424 CG PHE A 91 10.004 12.941 -0.646 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.134 14.309 -0.463 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.489 12.178 0.390 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.759 14.903 0.727 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.113 12.766 1.582 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.230 14.097 1.761 1.00 0.50 C ATOM 0 H PHE A 91 10.404 10.933 -4.023 1.00 0.27 H new ATOM 0 HA PHE A 91 8.424 12.596 -2.708 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.530 11.234 -1.792 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.397 12.693 -2.228 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.533 14.918 -1.260 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.380 11.111 0.264 1.00 0.37 H new ATOM 0 HE1 PHE A 91 9.869 15.968 0.865 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.721 12.152 2.380 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.920 14.547 2.693 1.00 0.50 H new ATOM 1439 N ARG A 92 10.823 13.850 -4.605 1.00 0.39 N ATOM 1440 CA ARG A 92 11.316 15.049 -5.276 1.00 0.49 C ATOM 1441 C ARG A 92 10.334 15.538 -6.342 1.00 0.51 C ATOM 1442 O ARG A 92 10.322 16.716 -6.700 1.00 0.62 O ATOM 1443 CB ARG A 92 12.689 14.758 -5.898 1.00 0.56 C ATOM 1444 CG ARG A 92 13.326 15.944 -6.614 1.00 1.24 C ATOM 1445 CD ARG A 92 13.492 17.142 -5.687 1.00 1.54 C ATOM 1446 NE ARG A 92 14.263 16.816 -4.488 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.266 17.560 -3.383 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.587 18.700 -3.344 1.00 3.13 N ATOM 1449 NH2 ARG A 92 14.958 17.168 -2.322 1.00 3.95 N ATOM 0 H ARG A 92 11.366 13.010 -4.805 1.00 0.39 H new ATOM 0 HA ARG A 92 11.414 15.844 -4.537 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.365 14.419 -5.113 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.586 13.936 -6.606 1.00 0.56 H new ATOM 0 HG2 ARG A 92 14.299 15.651 -7.007 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.710 16.227 -7.467 1.00 1.24 H new ATOM 0 HD2 ARG A 92 13.988 17.949 -6.226 1.00 1.54 H new ATOM 0 HD3 ARG A 92 12.509 17.511 -5.394 1.00 1.54 H new ATOM 0 HE ARG A 92 14.832 15.969 -4.498 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.061 19.009 -4.162 1.00 3.13 H new ATOM 0 HH12 ARG A 92 13.591 19.267 -2.496 1.00 3.13 H new ATOM 0 HH21 ARG A 92 15.488 16.297 -2.352 1.00 3.95 H new ATOM 0 HH22 ARG A 92 14.960 17.738 -1.476 1.00 3.95 H new ATOM 1463 N ASP A 93 9.492 14.634 -6.824 1.00 0.46 N ATOM 1464 CA ASP A 93 8.517 14.966 -7.862 1.00 0.53 C ATOM 1465 C ASP A 93 7.320 15.719 -7.275 1.00 0.50 C ATOM 1466 O ASP A 93 6.434 16.167 -8.005 1.00 0.60 O ATOM 1467 CB ASP A 93 8.047 13.684 -8.573 1.00 0.62 C ATOM 1468 CG ASP A 93 7.052 13.944 -9.687 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.471 14.429 -10.760 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.847 13.687 -9.487 1.00 1.11 O ATOM 0 H ASP A 93 9.462 13.663 -6.514 1.00 0.46 H new ATOM 0 HA ASP A 93 9.000 15.619 -8.588 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.914 13.166 -8.984 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.594 13.016 -7.840 1.00 0.62 H new ATOM 1475 N GLY A 94 7.308 15.895 -5.958 1.00 0.45 N ATOM 1476 CA GLY A 94 6.162 16.519 -5.323 1.00 0.47 C ATOM 1477 C GLY A 94 5.312 15.519 -4.564 1.00 0.39 C ATOM 1478 O GLY A 94 4.086 15.631 -4.571 1.00 0.42 O ATOM 0 H GLY A 94 8.060 15.621 -5.326 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.506 17.294 -4.638 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.552 17.010 -6.081 1.00 0.47 H new ATOM 1482 N VAL A 95 5.985 14.530 -3.954 1.00 0.32 N ATOM 1483 CA VAL A 95 5.357 13.386 -3.271 1.00 0.26 C ATOM 1484 C VAL A 95 3.928 13.643 -2.791 1.00 0.25 C ATOM 1485 O VAL A 95 3.679 14.442 -1.894 1.00 0.29 O ATOM 1486 CB VAL A 95 6.211 12.914 -2.067 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.501 14.062 -1.112 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.525 11.766 -1.336 1.00 0.33 C ATOM 0 H VAL A 95 7.004 14.502 -3.921 1.00 0.32 H new ATOM 0 HA VAL A 95 5.305 12.608 -4.033 1.00 0.26 H new ATOM 0 HB VAL A 95 7.164 12.554 -2.456 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.102 13.699 -0.278 1.00 0.40 H new ATOM 0 HG12 VAL A 95 7.047 14.844 -1.639 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.562 14.467 -0.734 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.142 11.450 -0.495 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.553 12.097 -0.970 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.389 10.929 -2.020 1.00 0.33 H new ATOM 1498 N ASN A 96 2.994 12.991 -3.452 1.00 0.24 N ATOM 1499 CA ASN A 96 1.611 12.943 -2.999 1.00 0.29 C ATOM 1500 C ASN A 96 1.283 11.529 -2.531 1.00 0.23 C ATOM 1501 O ASN A 96 2.143 10.646 -2.587 1.00 0.21 O ATOM 1502 CB ASN A 96 0.649 13.392 -4.105 1.00 0.41 C ATOM 1503 CG ASN A 96 0.364 14.884 -4.068 1.00 1.33 C ATOM 1504 OD1 ASN A 96 -0.715 15.327 -4.460 1.00 2.13 O ATOM 1505 ND2 ASN A 96 1.318 15.671 -3.594 1.00 2.00 N ATOM 0 H ASN A 96 3.167 12.479 -4.317 1.00 0.24 H new ATOM 0 HA ASN A 96 1.488 13.634 -2.165 1.00 0.29 H new ATOM 0 HB2 ASN A 96 1.071 13.131 -5.075 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.289 12.845 -4.008 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.170 16.679 -3.545 1.00 2.00 H new ATOM 0 HD22 ASN A 96 2.200 15.269 -3.278 1.00 2.00 H new ATOM 1512 N TRP A 97 0.053 11.303 -2.087 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.328 10.012 -1.516 1.00 0.24 C ATOM 1514 C TRP A 97 -0.227 8.887 -2.550 1.00 0.25 C ATOM 1515 O TRP A 97 -0.011 7.729 -2.192 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.741 10.076 -0.925 1.00 0.27 C ATOM 1517 CG TRP A 97 -1.870 11.089 0.180 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.459 12.320 0.099 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.385 10.969 1.528 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.373 12.965 1.308 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -1.721 12.160 2.199 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.704 9.974 2.235 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.400 12.382 3.535 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.385 10.197 3.563 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.734 11.393 4.200 1.00 0.30 C ATOM 0 H TRP A 97 -0.698 11.993 -2.110 1.00 0.25 H new ATOM 0 HA TRP A 97 0.374 9.788 -0.713 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.450 10.318 -1.717 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.014 9.092 -0.543 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -2.924 12.726 -0.787 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -2.738 13.896 1.509 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.431 9.047 1.753 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -1.668 13.304 4.028 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.142 9.435 4.117 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.471 11.537 5.238 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.345 9.233 -3.829 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.252 8.236 -4.884 1.00 0.29 C ATOM 1538 C GLY A 98 1.163 7.715 -5.063 1.00 0.26 C ATOM 1539 O GLY A 98 1.369 6.612 -5.574 1.00 0.27 O ATOM 0 H GLY A 98 -0.503 10.186 -4.155 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.917 7.403 -4.653 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.598 8.670 -5.822 1.00 0.29 H new ATOM 1543 N ARG A 99 2.139 8.503 -4.628 1.00 0.26 N ATOM 1544 CA ARG A 99 3.539 8.096 -4.708 1.00 0.25 C ATOM 1545 C ARG A 99 3.833 7.080 -3.617 1.00 0.21 C ATOM 1546 O ARG A 99 4.648 6.177 -3.795 1.00 0.20 O ATOM 1547 CB ARG A 99 4.478 9.299 -4.571 1.00 0.30 C ATOM 1548 CG ARG A 99 4.444 10.261 -5.751 1.00 0.70 C ATOM 1549 CD ARG A 99 4.875 9.590 -7.047 1.00 1.40 C ATOM 1550 NE ARG A 99 5.053 10.560 -8.127 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.875 10.288 -9.422 1.00 2.46 C ATOM 1552 NH1 ARG A 99 4.401 9.106 -9.804 1.00 3.06 N ATOM 1553 NH2 ARG A 99 5.138 11.215 -10.334 1.00 2.98 N ATOM 0 H ARG A 99 1.989 9.425 -4.217 1.00 0.26 H new ATOM 0 HA ARG A 99 3.712 7.648 -5.686 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.218 9.846 -3.665 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.498 8.936 -4.443 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.435 10.658 -5.866 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.098 11.108 -5.547 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.809 9.051 -6.885 1.00 1.40 H new ATOM 0 HD3 ARG A 99 4.128 8.852 -7.340 1.00 1.40 H new ATOM 0 HE ARG A 99 5.332 11.508 -7.874 1.00 1.74 H new ATOM 0 HH11 ARG A 99 4.170 8.399 -9.106 1.00 3.06 H new ATOM 0 HH12 ARG A 99 4.268 8.906 -10.795 1.00 3.06 H new ATOM 0 HH21 ARG A 99 5.475 12.133 -10.045 1.00 2.98 H new ATOM 0 HH22 ARG A 99 5.003 11.009 -11.324 1.00 2.98 H new ATOM 1567 N ILE A 100 3.142 7.233 -2.495 1.00 0.22 N ATOM 1568 CA ILE A 100 3.218 6.273 -1.408 1.00 0.21 C ATOM 1569 C ILE A 100 2.654 4.943 -1.877 1.00 0.20 C ATOM 1570 O ILE A 100 3.239 3.885 -1.647 1.00 0.19 O ATOM 1571 CB ILE A 100 2.430 6.769 -0.174 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.034 8.075 0.345 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.412 5.709 0.917 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.430 8.551 1.645 1.00 0.30 C ATOM 0 H ILE A 100 2.519 8.020 -2.316 1.00 0.22 H new ATOM 0 HA ILE A 100 4.262 6.154 -1.118 1.00 0.21 H new ATOM 0 HB ILE A 100 1.399 6.958 -0.472 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.107 7.939 0.482 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.904 8.850 -0.410 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.852 6.080 1.775 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.937 4.804 0.537 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.434 5.482 1.221 1.00 0.24 H new ATOM 0 HD11 ILE A 100 2.909 9.482 1.949 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.362 8.720 1.510 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.583 7.795 2.415 1.00 0.30 H new ATOM 1586 N VAL A 101 1.522 5.019 -2.562 1.00 0.21 N ATOM 1587 CA VAL A 101 0.898 3.853 -3.157 1.00 0.21 C ATOM 1588 C VAL A 101 1.875 3.155 -4.083 1.00 0.20 C ATOM 1589 O VAL A 101 2.095 1.947 -3.983 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.340 4.246 -3.969 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -0.989 3.017 -4.567 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.321 5.008 -3.106 1.00 0.26 C ATOM 0 H VAL A 101 1.014 5.889 -2.719 1.00 0.21 H new ATOM 0 HA VAL A 101 0.602 3.187 -2.346 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.029 4.899 -4.784 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.867 3.312 -5.141 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.279 2.513 -5.223 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.289 2.339 -3.768 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.194 5.279 -3.700 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.631 4.383 -2.269 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.846 5.912 -2.727 1.00 0.26 H new ATOM 1602 N ALA A 102 2.447 3.937 -4.987 1.00 0.19 N ATOM 1603 CA ALA A 102 3.418 3.434 -5.939 1.00 0.19 C ATOM 1604 C ALA A 102 4.567 2.739 -5.222 1.00 0.17 C ATOM 1605 O ALA A 102 4.930 1.621 -5.569 1.00 0.19 O ATOM 1606 CB ALA A 102 3.939 4.568 -6.804 1.00 0.21 C ATOM 0 H ALA A 102 2.250 4.934 -5.079 1.00 0.19 H new ATOM 0 HA ALA A 102 2.926 2.702 -6.580 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.667 4.178 -7.515 1.00 0.21 H new ATOM 0 HB2 ALA A 102 3.110 5.022 -7.346 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.414 5.319 -6.172 1.00 0.21 H new ATOM 1612 N PHE A 103 5.102 3.398 -4.200 1.00 0.16 N ATOM 1613 CA PHE A 103 6.221 2.864 -3.425 1.00 0.17 C ATOM 1614 C PHE A 103 5.900 1.472 -2.876 1.00 0.17 C ATOM 1615 O PHE A 103 6.683 0.533 -3.042 1.00 0.21 O ATOM 1616 CB PHE A 103 6.572 3.822 -2.277 1.00 0.17 C ATOM 1617 CG PHE A 103 7.678 3.328 -1.383 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.950 3.100 -1.889 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.446 3.088 -0.039 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.964 2.644 -1.070 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.458 2.632 0.783 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.722 2.421 0.268 1.00 0.26 C ATOM 0 H PHE A 103 4.776 4.312 -3.885 1.00 0.16 H new ATOM 0 HA PHE A 103 7.081 2.773 -4.089 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.861 4.785 -2.697 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.680 3.992 -1.674 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.149 3.281 -2.935 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.462 3.259 0.371 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.947 2.462 -1.478 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.261 2.441 1.828 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.519 2.082 0.913 1.00 0.26 H new ATOM 1632 N PHE A 104 4.736 1.336 -2.254 1.00 0.16 N ATOM 1633 CA PHE A 104 4.333 0.066 -1.661 1.00 0.18 C ATOM 1634 C PHE A 104 4.038 -0.970 -2.738 1.00 0.19 C ATOM 1635 O PHE A 104 4.340 -2.156 -2.578 1.00 0.23 O ATOM 1636 CB PHE A 104 3.109 0.255 -0.761 1.00 0.19 C ATOM 1637 CG PHE A 104 3.433 0.820 0.598 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.864 2.130 0.743 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.302 0.035 1.731 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.157 2.643 1.991 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.592 0.544 2.980 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.019 1.849 3.110 1.00 0.30 C ATOM 0 H PHE A 104 4.055 2.088 -2.147 1.00 0.16 H new ATOM 0 HA PHE A 104 5.162 -0.297 -1.053 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.402 0.917 -1.260 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.611 -0.706 -0.635 1.00 0.19 H new ATOM 0 HD1 PHE A 104 3.972 2.756 -0.130 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.969 -0.988 1.636 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.494 3.664 2.091 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.485 -0.079 3.856 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.245 2.249 4.087 1.00 0.30 H new ATOM 1652 N SER A 105 3.466 -0.516 -3.843 1.00 0.18 N ATOM 1653 CA SER A 105 3.148 -1.400 -4.952 1.00 0.21 C ATOM 1654 C SER A 105 4.425 -1.906 -5.619 1.00 0.21 C ATOM 1655 O SER A 105 4.485 -3.056 -6.062 1.00 0.23 O ATOM 1656 CB SER A 105 2.261 -0.677 -5.966 1.00 0.25 C ATOM 1657 OG SER A 105 1.078 -0.198 -5.346 1.00 1.04 O ATOM 0 H SER A 105 3.213 0.460 -3.995 1.00 0.18 H new ATOM 0 HA SER A 105 2.603 -2.261 -4.565 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.809 0.156 -6.407 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.002 -1.355 -6.779 1.00 0.25 H new ATOM 0 HG SER A 105 1.292 0.582 -4.793 1.00 1.04 H new ATOM 1663 N PHE A 106 5.449 -1.055 -5.671 1.00 0.20 N ATOM 1664 CA PHE A 106 6.731 -1.445 -6.241 1.00 0.21 C ATOM 1665 C PHE A 106 7.371 -2.519 -5.380 1.00 0.22 C ATOM 1666 O PHE A 106 7.780 -3.557 -5.886 1.00 0.24 O ATOM 1667 CB PHE A 106 7.691 -0.252 -6.359 1.00 0.23 C ATOM 1668 CG PHE A 106 7.236 0.839 -7.290 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.363 0.577 -8.336 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.693 2.135 -7.115 1.00 0.27 C ATOM 1671 CE1 PHE A 106 5.953 1.589 -9.184 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.288 3.148 -7.958 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.417 2.875 -8.993 1.00 0.33 C ATOM 0 H PHE A 106 5.413 -0.096 -5.326 1.00 0.20 H new ATOM 0 HA PHE A 106 6.542 -1.828 -7.244 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.839 0.175 -5.367 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.661 -0.617 -6.697 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.000 -0.428 -8.489 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.376 2.355 -6.307 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.271 1.374 -9.994 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.652 4.154 -7.809 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.098 3.668 -9.654 1.00 0.33 H new ATOM 1683 N GLY A 107 7.431 -2.268 -4.072 1.00 0.23 N ATOM 1684 CA GLY A 107 8.030 -3.218 -3.152 1.00 0.27 C ATOM 1685 C GLY A 107 7.403 -4.593 -3.256 1.00 0.32 C ATOM 1686 O GLY A 107 8.105 -5.604 -3.226 1.00 0.37 O ATOM 0 H GLY A 107 7.073 -1.419 -3.634 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.098 -3.292 -3.354 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.924 -2.849 -2.132 1.00 0.27 H new ATOM 1690 N GLY A 108 6.081 -4.627 -3.389 1.00 0.33 N ATOM 1691 CA GLY A 108 5.376 -5.888 -3.549 1.00 0.41 C ATOM 1692 C GLY A 108 5.812 -6.640 -4.790 1.00 0.42 C ATOM 1693 O GLY A 108 5.951 -7.859 -4.765 1.00 0.63 O ATOM 0 H GLY A 108 5.482 -3.801 -3.389 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.547 -6.511 -2.671 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.304 -5.698 -3.601 1.00 0.41 H new ATOM 1697 N ALA A 109 6.038 -5.907 -5.871 1.00 0.27 N ATOM 1698 CA ALA A 109 6.478 -6.504 -7.124 1.00 0.26 C ATOM 1699 C ALA A 109 7.950 -6.878 -7.049 1.00 0.23 C ATOM 1700 O ALA A 109 8.361 -7.923 -7.554 1.00 0.24 O ATOM 1701 CB ALA A 109 6.231 -5.542 -8.271 1.00 0.29 C ATOM 0 H ALA A 109 5.923 -4.894 -5.905 1.00 0.27 H new ATOM 0 HA ALA A 109 5.904 -7.414 -7.300 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.563 -5.996 -9.205 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.166 -5.318 -8.335 1.00 0.29 H new ATOM 0 HB3 ALA A 109 6.786 -4.620 -8.099 1.00 0.29 H new ATOM 1707 N LEU A 110 8.732 -6.021 -6.401 1.00 0.22 N ATOM 1708 CA LEU A 110 10.157 -6.249 -6.208 1.00 0.23 C ATOM 1709 C LEU A 110 10.390 -7.562 -5.490 1.00 0.21 C ATOM 1710 O LEU A 110 11.279 -8.336 -5.848 1.00 0.21 O ATOM 1711 CB LEU A 110 10.760 -5.110 -5.392 1.00 0.25 C ATOM 1712 CG LEU A 110 10.711 -3.745 -6.060 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.223 -2.679 -5.112 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.521 -3.759 -7.341 1.00 0.36 C ATOM 0 H LEU A 110 8.394 -5.148 -5.995 1.00 0.22 H new ATOM 0 HA LEU A 110 10.636 -6.290 -7.186 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.236 -5.050 -4.438 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.799 -5.352 -5.171 1.00 0.25 H new ATOM 0 HG LEU A 110 9.676 -3.512 -6.311 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.183 -1.706 -5.602 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.602 -2.660 -4.216 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.253 -2.903 -4.835 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.478 -2.776 -7.810 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.558 -4.007 -7.113 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.111 -4.504 -8.023 1.00 0.36 H new ATOM 1726 N CYS A 111 9.585 -7.802 -4.470 1.00 0.21 N ATOM 1727 CA CYS A 111 9.663 -9.030 -3.701 1.00 0.21 C ATOM 1728 C CYS A 111 9.428 -10.248 -4.586 1.00 0.21 C ATOM 1729 O CYS A 111 10.022 -11.301 -4.381 1.00 0.25 O ATOM 1730 CB CYS A 111 8.642 -8.996 -2.571 1.00 0.22 C ATOM 1731 SG CYS A 111 8.953 -7.704 -1.351 1.00 1.34 S ATOM 0 H CYS A 111 8.863 -7.155 -4.153 1.00 0.21 H new ATOM 0 HA CYS A 111 10.665 -9.109 -3.280 1.00 0.21 H new ATOM 0 HB2 CYS A 111 7.648 -8.851 -2.995 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.636 -9.964 -2.069 1.00 0.22 H new ATOM 0 HG CYS A 111 8.571 -6.556 -1.827 1.00 1.34 H new ATOM 1737 N VAL A 112 8.576 -10.090 -5.582 1.00 0.19 N ATOM 1738 CA VAL A 112 8.246 -11.184 -6.473 1.00 0.20 C ATOM 1739 C VAL A 112 9.368 -11.423 -7.474 1.00 0.22 C ATOM 1740 O VAL A 112 9.904 -12.529 -7.569 1.00 0.25 O ATOM 1741 CB VAL A 112 6.944 -10.896 -7.235 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.593 -12.058 -8.145 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.814 -10.619 -6.260 1.00 0.25 C ATOM 0 H VAL A 112 8.100 -9.213 -5.794 1.00 0.19 H new ATOM 0 HA VAL A 112 8.113 -12.076 -5.861 1.00 0.20 H new ATOM 0 HB VAL A 112 7.091 -10.011 -7.854 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.668 -11.837 -8.677 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.397 -12.213 -8.864 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.461 -12.961 -7.548 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.897 -10.416 -6.814 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.666 -11.488 -5.618 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.066 -9.754 -5.647 1.00 0.25 H new ATOM 1753 N GLU A 113 9.719 -10.373 -8.209 1.00 0.22 N ATOM 1754 CA GLU A 113 10.740 -10.463 -9.253 1.00 0.25 C ATOM 1755 C GLU A 113 12.092 -10.906 -8.692 1.00 0.25 C ATOM 1756 O GLU A 113 12.917 -11.465 -9.415 1.00 0.30 O ATOM 1757 CB GLU A 113 10.878 -9.127 -9.993 1.00 0.29 C ATOM 1758 CG GLU A 113 11.168 -7.943 -9.090 1.00 0.30 C ATOM 1759 CD GLU A 113 11.265 -6.640 -9.856 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.224 -6.152 -10.339 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.382 -6.094 -9.977 1.00 0.50 O ATOM 0 H GLU A 113 9.311 -9.444 -8.102 1.00 0.22 H new ATOM 0 HA GLU A 113 10.413 -11.225 -9.961 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.678 -9.213 -10.729 1.00 0.29 H new ATOM 0 HB3 GLU A 113 9.958 -8.933 -10.544 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.382 -7.862 -8.339 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.102 -8.117 -8.556 1.00 0.30 H new ATOM 1768 N SER A 114 12.317 -10.669 -7.406 1.00 0.23 N ATOM 1769 CA SER A 114 13.545 -11.110 -6.768 1.00 0.28 C ATOM 1770 C SER A 114 13.499 -12.613 -6.503 1.00 0.27 C ATOM 1771 O SER A 114 14.433 -13.339 -6.846 1.00 0.31 O ATOM 1772 CB SER A 114 13.794 -10.333 -5.472 1.00 0.33 C ATOM 1773 OG SER A 114 12.648 -10.329 -4.646 1.00 0.99 O ATOM 0 H SER A 114 11.669 -10.177 -6.790 1.00 0.23 H new ATOM 0 HA SER A 114 14.376 -10.908 -7.444 1.00 0.28 H new ATOM 0 HB2 SER A 114 14.631 -10.778 -4.934 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.077 -9.308 -5.709 1.00 0.33 H new ATOM 0 HG SER A 114 12.033 -9.627 -4.944 1.00 0.99 H new ATOM 1779 N VAL A 115 12.400 -13.081 -5.919 1.00 0.28 N ATOM 1780 CA VAL A 115 12.221 -14.504 -5.648 1.00 0.33 C ATOM 1781 C VAL A 115 12.225 -15.301 -6.947 1.00 0.37 C ATOM 1782 O VAL A 115 12.763 -16.408 -7.010 1.00 0.42 O ATOM 1783 CB VAL A 115 10.909 -14.770 -4.887 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.676 -16.262 -4.714 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.933 -14.081 -3.536 1.00 0.41 C ATOM 0 H VAL A 115 11.619 -12.495 -5.624 1.00 0.28 H new ATOM 0 HA VAL A 115 13.055 -14.824 -5.024 1.00 0.33 H new ATOM 0 HB VAL A 115 10.087 -14.362 -5.474 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.743 -16.424 -4.174 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.615 -16.737 -5.693 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.502 -16.696 -4.151 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.999 -14.278 -3.010 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.768 -14.462 -2.948 1.00 0.41 H new ATOM 0 HG23 VAL A 115 11.050 -13.007 -3.678 1.00 0.41 H new ATOM 1795 N ASP A 116 11.629 -14.719 -7.980 1.00 0.38 N ATOM 1796 CA ASP A 116 11.622 -15.311 -9.318 1.00 0.46 C ATOM 1797 C ASP A 116 13.046 -15.609 -9.791 1.00 0.47 C ATOM 1798 O ASP A 116 13.287 -16.597 -10.484 1.00 0.56 O ATOM 1799 CB ASP A 116 10.930 -14.360 -10.300 1.00 0.49 C ATOM 1800 CG ASP A 116 10.881 -14.893 -11.720 1.00 1.08 C ATOM 1801 OD1 ASP A 116 11.849 -14.670 -12.476 1.00 1.89 O ATOM 1802 OD2 ASP A 116 9.890 -15.561 -12.081 1.00 1.23 O ATOM 0 H ASP A 116 11.138 -13.827 -7.918 1.00 0.38 H new ATOM 0 HA ASP A 116 11.074 -16.252 -9.278 1.00 0.46 H new ATOM 0 HB2 ASP A 116 9.913 -14.170 -9.956 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.452 -13.403 -10.297 1.00 0.49 H new ATOM 1807 N LYS A 117 13.987 -14.764 -9.386 1.00 0.43 N ATOM 1808 CA LYS A 117 15.387 -14.922 -9.775 1.00 0.49 C ATOM 1809 C LYS A 117 16.189 -15.618 -8.676 1.00 0.47 C ATOM 1810 O LYS A 117 17.420 -15.550 -8.654 1.00 0.52 O ATOM 1811 CB LYS A 117 16.002 -13.555 -10.080 1.00 0.53 C ATOM 1812 CG LYS A 117 15.284 -12.805 -11.188 1.00 0.61 C ATOM 1813 CD LYS A 117 15.878 -11.425 -11.394 1.00 1.20 C ATOM 1814 CE LYS A 117 15.116 -10.654 -12.460 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.164 -11.334 -13.781 1.00 1.90 N ATOM 0 H LYS A 117 13.807 -13.959 -8.786 1.00 0.43 H new ATOM 0 HA LYS A 117 15.422 -15.544 -10.670 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.990 -12.949 -9.174 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.047 -13.689 -10.360 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.349 -13.373 -12.116 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.226 -12.715 -10.943 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.855 -10.872 -10.455 1.00 1.20 H new ATOM 0 HD3 LYS A 117 16.925 -11.516 -11.685 1.00 1.20 H new ATOM 0 HE2 LYS A 117 14.078 -10.537 -12.150 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.536 -9.652 -12.552 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.798 -10.694 -14.514 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.147 -11.590 -14.004 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 14.581 -12.194 -13.750 1.00 1.90 H new ATOM 1829 N GLU A 118 15.473 -16.279 -7.764 1.00 0.45 N ATOM 1830 CA GLU A 118 16.082 -17.032 -6.664 1.00 0.49 C ATOM 1831 C GLU A 118 16.788 -16.111 -5.673 1.00 0.45 C ATOM 1832 O GLU A 118 17.592 -16.560 -4.856 1.00 0.55 O ATOM 1833 CB GLU A 118 17.064 -18.084 -7.195 1.00 0.59 C ATOM 1834 CG GLU A 118 16.416 -19.148 -8.060 1.00 1.07 C ATOM 1835 CD GLU A 118 15.352 -19.932 -7.321 1.00 1.72 C ATOM 1836 OE1 GLU A 118 15.705 -20.746 -6.444 1.00 1.89 O ATOM 1837 OE2 GLU A 118 14.155 -19.740 -7.614 1.00 2.54 O ATOM 0 H GLU A 118 14.453 -16.308 -7.767 1.00 0.45 H new ATOM 0 HA GLU A 118 15.274 -17.540 -6.138 1.00 0.49 H new ATOM 0 HB2 GLU A 118 17.841 -17.583 -7.773 1.00 0.59 H new ATOM 0 HB3 GLU A 118 17.556 -18.566 -6.351 1.00 0.59 H new ATOM 0 HG2 GLU A 118 15.972 -18.677 -8.937 1.00 1.07 H new ATOM 0 HG3 GLU A 118 17.182 -19.834 -8.421 1.00 1.07 H new ATOM 1844 N MET A 119 16.461 -14.832 -5.725 1.00 0.35 N ATOM 1845 CA MET A 119 17.069 -13.853 -4.838 1.00 0.33 C ATOM 1846 C MET A 119 16.212 -13.694 -3.588 1.00 0.31 C ATOM 1847 O MET A 119 15.652 -12.629 -3.324 1.00 0.27 O ATOM 1848 CB MET A 119 17.243 -12.507 -5.551 1.00 0.34 C ATOM 1849 CG MET A 119 18.007 -12.613 -6.860 1.00 0.41 C ATOM 1850 SD MET A 119 18.320 -11.014 -7.634 1.00 0.47 S ATOM 1851 CE MET A 119 16.668 -10.335 -7.733 1.00 0.44 C ATOM 0 H MET A 119 15.776 -14.445 -6.374 1.00 0.35 H new ATOM 0 HA MET A 119 18.058 -14.206 -4.547 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.260 -12.078 -5.746 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.766 -11.818 -4.888 1.00 0.34 H new ATOM 0 HG2 MET A 119 18.958 -13.113 -6.678 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.444 -13.240 -7.552 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.678 -9.444 -8.361 1.00 0.44 H new ATOM 0 HE2 MET A 119 15.995 -11.076 -8.165 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.323 -10.071 -6.733 1.00 0.44 H new ATOM 1861 N GLN A 120 16.118 -14.775 -2.826 1.00 0.36 N ATOM 1862 CA GLN A 120 15.281 -14.824 -1.632 1.00 0.39 C ATOM 1863 C GLN A 120 15.893 -14.010 -0.498 1.00 0.41 C ATOM 1864 O GLN A 120 15.226 -13.692 0.483 1.00 0.47 O ATOM 1865 CB GLN A 120 15.090 -16.273 -1.177 1.00 0.49 C ATOM 1866 CG GLN A 120 14.395 -17.165 -2.199 1.00 0.53 C ATOM 1867 CD GLN A 120 14.421 -18.631 -1.798 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.478 -18.960 -0.612 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.352 -19.522 -2.776 1.00 0.70 N ATOM 0 H GLN A 120 16.619 -15.643 -3.017 1.00 0.36 H new ATOM 0 HA GLN A 120 14.313 -14.393 -1.886 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.065 -16.700 -0.943 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.510 -16.278 -0.254 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.361 -16.841 -2.317 1.00 0.53 H new ATOM 0 HG3 GLN A 120 14.878 -17.047 -3.169 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.306 -19.211 -3.747 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.345 -20.519 -2.558 1.00 0.70 H new ATOM 1878 N VAL A 121 17.168 -13.686 -0.624 1.00 0.39 N ATOM 1879 CA VAL A 121 17.822 -12.838 0.355 1.00 0.44 C ATOM 1880 C VAL A 121 17.507 -11.370 0.069 1.00 0.38 C ATOM 1881 O VAL A 121 17.509 -10.532 0.971 1.00 0.47 O ATOM 1882 CB VAL A 121 19.350 -13.064 0.375 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.974 -12.677 -0.956 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.997 -12.300 1.521 1.00 0.92 C ATOM 0 H VAL A 121 17.767 -13.995 -1.389 1.00 0.39 H new ATOM 0 HA VAL A 121 17.437 -13.104 1.339 1.00 0.44 H new ATOM 0 HB VAL A 121 19.531 -14.127 0.534 1.00 0.52 H new ATOM 0 HG11 VAL A 121 21.050 -12.845 -0.916 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.541 -13.284 -1.751 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.779 -11.624 -1.157 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.073 -12.475 1.514 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.802 -11.234 1.403 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.580 -12.643 2.468 1.00 0.92 H new ATOM 1894 N LEU A 122 17.198 -11.069 -1.188 1.00 0.30 N ATOM 1895 CA LEU A 122 16.903 -9.704 -1.587 1.00 0.27 C ATOM 1896 C LEU A 122 15.524 -9.276 -1.121 1.00 0.23 C ATOM 1897 O LEU A 122 15.353 -8.154 -0.658 1.00 0.23 O ATOM 1898 CB LEU A 122 17.031 -9.521 -3.097 1.00 0.28 C ATOM 1899 CG LEU A 122 18.396 -9.021 -3.562 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.489 -9.992 -3.165 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.391 -8.803 -5.059 1.00 0.41 C ATOM 0 H LEU A 122 17.146 -11.752 -1.944 1.00 0.30 H new ATOM 0 HA LEU A 122 17.642 -9.065 -1.103 1.00 0.27 H new ATOM 0 HB2 LEU A 122 16.822 -10.473 -3.584 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.268 -8.818 -3.431 1.00 0.28 H new ATOM 0 HG LEU A 122 18.600 -8.068 -3.073 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.453 -9.615 -3.507 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.505 -10.098 -2.080 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.297 -10.963 -3.622 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.370 -8.446 -5.378 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.165 -9.743 -5.563 1.00 0.41 H new ATOM 0 HD23 LEU A 122 17.634 -8.062 -5.316 1.00 0.41 H new ATOM 1913 N VAL A 123 14.549 -10.174 -1.224 1.00 0.23 N ATOM 1914 CA VAL A 123 13.183 -9.864 -0.811 1.00 0.25 C ATOM 1915 C VAL A 123 13.135 -9.455 0.661 1.00 0.27 C ATOM 1916 O VAL A 123 12.429 -8.517 1.039 1.00 0.31 O ATOM 1917 CB VAL A 123 12.219 -11.047 -1.070 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.716 -12.324 -0.419 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.825 -10.713 -0.576 1.00 0.31 C ATOM 0 H VAL A 123 14.678 -11.118 -1.588 1.00 0.23 H new ATOM 0 HA VAL A 123 12.850 -9.023 -1.419 1.00 0.25 H new ATOM 0 HB VAL A 123 12.183 -11.214 -2.147 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.014 -13.133 -0.622 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.694 -12.582 -0.824 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.797 -12.176 0.658 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.160 -11.556 -0.766 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.857 -10.510 0.495 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.454 -9.833 -1.101 1.00 0.31 H new ATOM 1929 N SER A 124 13.924 -10.138 1.476 1.00 0.29 N ATOM 1930 CA SER A 124 13.993 -9.849 2.899 1.00 0.35 C ATOM 1931 C SER A 124 14.627 -8.479 3.144 1.00 0.34 C ATOM 1932 O SER A 124 14.290 -7.789 4.108 1.00 0.44 O ATOM 1933 CB SER A 124 14.788 -10.945 3.606 1.00 0.43 C ATOM 1934 OG SER A 124 14.284 -12.227 3.265 1.00 1.32 O ATOM 0 H SER A 124 14.529 -10.901 1.173 1.00 0.29 H new ATOM 0 HA SER A 124 12.982 -9.826 3.305 1.00 0.35 H new ATOM 0 HB2 SER A 124 15.840 -10.876 3.328 1.00 0.43 H new ATOM 0 HB3 SER A 124 14.734 -10.802 4.685 1.00 0.43 H new ATOM 0 HG SER A 124 14.678 -12.518 2.416 1.00 1.32 H new ATOM 1940 N ARG A 125 15.530 -8.078 2.253 1.00 0.28 N ATOM 1941 CA ARG A 125 16.168 -6.772 2.360 1.00 0.31 C ATOM 1942 C ARG A 125 15.242 -5.692 1.814 1.00 0.24 C ATOM 1943 O ARG A 125 15.272 -4.552 2.272 1.00 0.24 O ATOM 1944 CB ARG A 125 17.503 -6.742 1.605 1.00 0.41 C ATOM 1945 CG ARG A 125 18.526 -7.761 2.102 1.00 0.91 C ATOM 1946 CD ARG A 125 19.872 -7.617 1.394 1.00 0.74 C ATOM 1947 NE ARG A 125 20.818 -8.663 1.784 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.501 -8.672 2.931 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.347 -7.691 3.818 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.346 -9.664 3.188 1.00 1.84 N ATOM 0 H ARG A 125 15.834 -8.635 1.455 1.00 0.28 H new ATOM 0 HA ARG A 125 16.368 -6.581 3.414 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.313 -6.921 0.547 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.932 -5.743 1.687 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.667 -7.638 3.176 1.00 0.91 H new ATOM 0 HG3 ARG A 125 18.140 -8.768 1.944 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.719 -7.652 0.315 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.298 -6.640 1.623 1.00 0.74 H new ATOM 0 HE ARG A 125 20.965 -9.437 1.136 1.00 1.01 H new ATOM 0 HH11 ARG A 125 20.703 -6.924 3.624 1.00 1.28 H new ATOM 0 HH12 ARG A 125 21.873 -7.706 4.692 1.00 1.28 H new ATOM 0 HH21 ARG A 125 22.471 -10.416 2.510 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.870 -9.674 4.063 1.00 1.84 H new ATOM 1964 N ILE A 126 14.416 -6.065 0.840 1.00 0.21 N ATOM 1965 CA ILE A 126 13.430 -5.156 0.268 1.00 0.19 C ATOM 1966 C ILE A 126 12.528 -4.601 1.359 1.00 0.19 C ATOM 1967 O ILE A 126 12.339 -3.391 1.460 1.00 0.19 O ATOM 1968 CB ILE A 126 12.579 -5.865 -0.807 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.442 -6.187 -2.024 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.384 -5.014 -1.209 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.724 -6.973 -3.093 1.00 0.23 C ATOM 0 H ILE A 126 14.412 -6.998 0.429 1.00 0.21 H new ATOM 0 HA ILE A 126 13.966 -4.334 -0.206 1.00 0.19 H new ATOM 0 HB ILE A 126 12.198 -6.795 -0.386 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.806 -5.255 -2.455 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.316 -6.751 -1.698 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.803 -5.538 -1.967 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.759 -4.829 -0.336 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.733 -4.064 -1.612 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.404 -7.162 -3.924 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.383 -7.922 -2.680 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.866 -6.403 -3.449 1.00 0.23 H new ATOM 1983 N ALA A 127 11.986 -5.494 2.179 1.00 0.22 N ATOM 1984 CA ALA A 127 11.151 -5.097 3.303 1.00 0.25 C ATOM 1985 C ALA A 127 11.885 -4.122 4.217 1.00 0.24 C ATOM 1986 O ALA A 127 11.294 -3.175 4.737 1.00 0.26 O ATOM 1987 CB ALA A 127 10.705 -6.320 4.083 1.00 0.30 C ATOM 0 H ALA A 127 12.112 -6.502 2.084 1.00 0.22 H new ATOM 0 HA ALA A 127 10.271 -4.589 2.909 1.00 0.25 H new ATOM 0 HB1 ALA A 127 10.081 -6.009 4.921 1.00 0.30 H new ATOM 0 HB2 ALA A 127 10.133 -6.980 3.430 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.580 -6.851 4.459 1.00 0.30 H new ATOM 1993 N ALA A 128 13.177 -4.351 4.393 1.00 0.22 N ATOM 1994 CA ALA A 128 13.995 -3.487 5.225 1.00 0.23 C ATOM 1995 C ALA A 128 14.139 -2.104 4.596 1.00 0.19 C ATOM 1996 O ALA A 128 13.962 -1.086 5.268 1.00 0.19 O ATOM 1997 CB ALA A 128 15.358 -4.114 5.452 1.00 0.27 C ATOM 0 H ALA A 128 13.681 -5.130 3.969 1.00 0.22 H new ATOM 0 HA ALA A 128 13.500 -3.369 6.189 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.962 -3.456 6.077 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.237 -5.077 5.949 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.855 -4.260 4.493 1.00 0.27 H new ATOM 2003 N TRP A 129 14.443 -2.074 3.302 1.00 0.17 N ATOM 2004 CA TRP A 129 14.604 -0.812 2.582 1.00 0.17 C ATOM 2005 C TRP A 129 13.283 -0.056 2.523 1.00 0.15 C ATOM 2006 O TRP A 129 13.252 1.170 2.662 1.00 0.18 O ATOM 2007 CB TRP A 129 15.132 -1.052 1.164 1.00 0.20 C ATOM 2008 CG TRP A 129 16.432 -1.793 1.129 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.445 -1.717 2.040 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.863 -2.719 0.126 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.477 -2.542 1.668 1.00 0.33 N ATOM 2012 CE2 TRP A 129 18.144 -3.167 0.496 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.288 -3.213 -1.046 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.861 -4.088 -0.266 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.998 -4.125 -1.801 1.00 0.47 C ATOM 2016 CH2 TRP A 129 18.273 -4.556 -1.408 1.00 0.50 C ATOM 0 H TRP A 129 14.583 -2.907 2.730 1.00 0.17 H new ATOM 0 HA TRP A 129 15.332 -0.209 3.125 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.388 -1.612 0.598 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.257 -0.092 0.664 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.436 -1.098 2.925 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.350 -2.669 2.181 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.306 -2.888 -1.356 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.844 -4.419 0.034 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.564 -4.513 -2.710 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.801 -5.272 -2.020 1.00 0.50 H new ATOM 2027 N MET A 130 12.197 -0.798 2.329 1.00 0.16 N ATOM 2028 CA MET A 130 10.858 -0.223 2.313 1.00 0.21 C ATOM 2029 C MET A 130 10.569 0.472 3.634 1.00 0.19 C ATOM 2030 O MET A 130 10.175 1.637 3.663 1.00 0.21 O ATOM 2031 CB MET A 130 9.813 -1.311 2.079 1.00 0.29 C ATOM 2032 CG MET A 130 9.708 -1.792 0.641 1.00 0.33 C ATOM 2033 SD MET A 130 8.600 -0.770 -0.342 1.00 0.71 S ATOM 2034 CE MET A 130 7.098 -0.909 0.627 1.00 0.29 C ATOM 0 H MET A 130 12.220 -1.807 2.180 1.00 0.16 H new ATOM 0 HA MET A 130 10.809 0.503 1.502 1.00 0.21 H new ATOM 0 HB2 MET A 130 10.047 -2.163 2.717 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.840 -0.935 2.394 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.699 -1.791 0.187 1.00 0.33 H new ATOM 0 HG3 MET A 130 9.354 -2.823 0.630 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.373 -1.520 0.089 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.325 -1.376 1.586 1.00 0.29 H new ATOM 0 HE3 MET A 130 6.681 0.084 0.797 1.00 0.29 H new ATOM 2044 N ALA A 131 10.795 -0.251 4.726 1.00 0.18 N ATOM 2045 CA ALA A 131 10.541 0.270 6.059 1.00 0.20 C ATOM 2046 C ALA A 131 11.418 1.478 6.341 1.00 0.21 C ATOM 2047 O ALA A 131 10.979 2.444 6.956 1.00 0.23 O ATOM 2048 CB ALA A 131 10.776 -0.813 7.100 1.00 0.23 C ATOM 0 H ALA A 131 11.156 -1.205 4.710 1.00 0.18 H new ATOM 0 HA ALA A 131 9.499 0.587 6.113 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.582 -0.410 8.094 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.105 -1.651 6.911 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.809 -1.155 7.042 1.00 0.23 H new ATOM 2054 N THR A 132 12.653 1.423 5.868 1.00 0.22 N ATOM 2055 CA THR A 132 13.595 2.513 6.062 1.00 0.25 C ATOM 2056 C THR A 132 13.108 3.785 5.364 1.00 0.24 C ATOM 2057 O THR A 132 12.953 4.825 6.002 1.00 0.25 O ATOM 2058 CB THR A 132 14.997 2.135 5.544 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.434 0.915 6.160 1.00 0.33 O ATOM 2060 CG2 THR A 132 16.000 3.238 5.842 1.00 0.37 C ATOM 0 H THR A 132 13.027 0.631 5.345 1.00 0.22 H new ATOM 0 HA THR A 132 13.661 2.703 7.133 1.00 0.25 H new ATOM 0 HB THR A 132 14.935 2.000 4.464 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.027 0.152 5.699 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.982 2.948 5.467 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.683 4.160 5.354 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.056 3.398 6.919 1.00 0.37 H new ATOM 2068 N TYR A 133 12.853 3.704 4.058 1.00 0.23 N ATOM 2069 CA TYR A 133 12.393 4.871 3.308 1.00 0.24 C ATOM 2070 C TYR A 133 11.074 5.387 3.868 1.00 0.21 C ATOM 2071 O TYR A 133 10.900 6.594 4.054 1.00 0.23 O ATOM 2072 CB TYR A 133 12.234 4.547 1.820 1.00 0.27 C ATOM 2073 CG TYR A 133 11.684 5.705 1.011 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.501 6.759 0.625 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.347 5.743 0.635 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.007 7.817 -0.111 1.00 0.50 C ATOM 2077 CE2 TYR A 133 9.843 6.798 -0.102 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.669 7.826 -0.475 1.00 0.51 C ATOM 2079 OH TYR A 133 10.179 8.886 -1.202 1.00 0.61 O ATOM 0 H TYR A 133 12.956 2.854 3.504 1.00 0.23 H new ATOM 0 HA TYR A 133 13.151 5.647 3.413 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.202 4.256 1.413 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.571 3.689 1.711 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.544 6.751 0.906 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.691 4.935 0.923 1.00 0.36 H new ATOM 0 HE1 TYR A 133 12.656 8.630 -0.401 1.00 0.50 H new ATOM 0 HE2 TYR A 133 8.800 6.812 -0.383 1.00 0.45 H new ATOM 0 HH TYR A 133 10.496 8.823 -2.127 1.00 0.61 H new ATOM 2089 N LEU A 134 10.161 4.466 4.149 1.00 0.20 N ATOM 2090 CA LEU A 134 8.853 4.816 4.681 1.00 0.20 C ATOM 2091 C LEU A 134 8.981 5.521 6.025 1.00 0.21 C ATOM 2092 O LEU A 134 8.428 6.595 6.220 1.00 0.24 O ATOM 2093 CB LEU A 134 7.990 3.559 4.815 1.00 0.20 C ATOM 2094 CG LEU A 134 6.724 3.707 5.661 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.793 4.743 5.061 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.017 2.368 5.792 1.00 0.26 C ATOM 0 H LEU A 134 10.305 3.465 4.016 1.00 0.20 H new ATOM 0 HA LEU A 134 8.371 5.504 3.987 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.701 3.232 3.816 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.601 2.766 5.246 1.00 0.20 H new ATOM 0 HG LEU A 134 7.014 4.047 6.655 1.00 0.22 H new ATOM 0 HD11 LEU A 134 4.900 4.831 5.679 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.301 5.707 5.017 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.509 4.437 4.054 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.118 2.489 6.397 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.742 2.003 4.802 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.683 1.650 6.271 1.00 0.26 H new ATOM 2108 N ASN A 135 9.736 4.933 6.935 1.00 0.24 N ATOM 2109 CA ASN A 135 9.835 5.455 8.292 1.00 0.29 C ATOM 2110 C ASN A 135 10.685 6.721 8.348 1.00 0.30 C ATOM 2111 O ASN A 135 10.372 7.654 9.085 1.00 0.33 O ATOM 2112 CB ASN A 135 10.418 4.393 9.224 1.00 0.37 C ATOM 2113 CG ASN A 135 10.405 4.817 10.681 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.506 5.531 11.126 1.00 1.17 O ATOM 2115 ND2 ASN A 135 11.404 4.380 11.433 1.00 1.46 N ATOM 0 H ASN A 135 10.290 4.094 6.762 1.00 0.24 H new ATOM 0 HA ASN A 135 8.828 5.713 8.621 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.850 3.469 9.114 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.443 4.175 8.923 1.00 0.37 H new ATOM 0 HD21 ASN A 135 11.448 4.633 12.420 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.129 3.790 11.025 1.00 1.46 H new ATOM 2122 N ASP A 136 11.752 6.765 7.564 1.00 0.32 N ATOM 2123 CA ASP A 136 12.683 7.887 7.632 1.00 0.37 C ATOM 2124 C ASP A 136 12.228 9.062 6.775 1.00 0.34 C ATOM 2125 O ASP A 136 12.084 10.176 7.271 1.00 0.36 O ATOM 2126 CB ASP A 136 14.093 7.467 7.208 1.00 0.46 C ATOM 2127 CG ASP A 136 15.072 8.620 7.290 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.667 8.817 8.370 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.240 9.344 6.286 1.00 2.07 O ATOM 0 H ASP A 136 11.995 6.048 6.881 1.00 0.32 H new ATOM 0 HA ASP A 136 12.701 8.207 8.674 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.437 6.652 7.845 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.067 7.084 6.188 1.00 0.46 H new ATOM 2134 N HIS A 137 12.004 8.821 5.491 1.00 0.33 N ATOM 2135 CA HIS A 137 11.735 9.916 4.556 1.00 0.35 C ATOM 2136 C HIS A 137 10.247 10.208 4.445 1.00 0.29 C ATOM 2137 O HIS A 137 9.827 11.364 4.455 1.00 0.32 O ATOM 2138 CB HIS A 137 12.281 9.610 3.154 1.00 0.45 C ATOM 2139 CG HIS A 137 13.773 9.490 3.072 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.606 10.574 2.929 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.576 8.399 3.072 1.00 1.53 C ATOM 2142 CE1 HIS A 137 15.854 10.157 2.839 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.868 8.840 2.921 1.00 1.34 N ATOM 0 H HIS A 137 12.002 7.891 5.072 1.00 0.33 H new ATOM 0 HA HIS A 137 12.244 10.791 4.959 1.00 0.35 H new ATOM 0 HB2 HIS A 137 11.836 8.680 2.801 1.00 0.45 H new ATOM 0 HB3 HIS A 137 11.956 10.397 2.473 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.259 7.372 3.172 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.721 10.789 2.718 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.698 8.249 2.879 1.00 1.34 H new ATOM 2152 N LEU A 138 9.457 9.155 4.352 1.00 0.26 N ATOM 2153 CA LEU A 138 8.053 9.279 3.998 1.00 0.25 C ATOM 2154 C LEU A 138 7.192 9.664 5.201 1.00 0.24 C ATOM 2155 O LEU A 138 6.300 10.504 5.089 1.00 0.25 O ATOM 2156 CB LEU A 138 7.579 7.957 3.400 1.00 0.23 C ATOM 2157 CG LEU A 138 6.244 8.004 2.671 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.313 8.986 1.514 1.00 0.26 C ATOM 2159 CD2 LEU A 138 5.876 6.615 2.179 1.00 0.22 C ATOM 0 H LEU A 138 9.765 8.197 4.518 1.00 0.26 H new ATOM 0 HA LEU A 138 7.947 10.080 3.266 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.339 7.600 2.705 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.509 7.221 4.201 1.00 0.23 H new ATOM 0 HG LEU A 138 5.471 8.344 3.360 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.352 9.011 1.000 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.547 9.980 1.894 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.090 8.672 0.816 1.00 0.26 H new ATOM 0 HD21 LEU A 138 4.919 6.655 1.658 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.646 6.255 1.497 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.798 5.937 3.029 1.00 0.22 H new ATOM 2171 N GLU A 139 7.474 9.046 6.343 1.00 0.26 N ATOM 2172 CA GLU A 139 6.714 9.269 7.575 1.00 0.29 C ATOM 2173 C GLU A 139 6.589 10.762 7.917 1.00 0.30 C ATOM 2174 O GLU A 139 5.483 11.224 8.182 1.00 0.30 O ATOM 2175 CB GLU A 139 7.357 8.498 8.733 1.00 0.36 C ATOM 2176 CG GLU A 139 6.363 7.892 9.717 1.00 0.52 C ATOM 2177 CD GLU A 139 5.645 8.923 10.563 1.00 1.00 C ATOM 2178 OE1 GLU A 139 6.291 9.515 11.453 1.00 1.74 O ATOM 2179 OE2 GLU A 139 4.428 9.119 10.365 1.00 1.46 O ATOM 0 H GLU A 139 8.236 8.375 6.444 1.00 0.26 H new ATOM 0 HA GLU A 139 5.703 8.896 7.413 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.975 7.700 8.323 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.022 9.170 9.275 1.00 0.36 H new ATOM 0 HG2 GLU A 139 5.626 7.310 9.164 1.00 0.52 H new ATOM 0 HG3 GLU A 139 6.890 7.199 10.373 1.00 0.52 H new ATOM 2186 N PRO A 140 7.697 11.547 7.919 1.00 0.33 N ATOM 2187 CA PRO A 140 7.624 12.992 8.179 1.00 0.36 C ATOM 2188 C PRO A 140 6.594 13.703 7.304 1.00 0.31 C ATOM 2189 O PRO A 140 5.907 14.610 7.767 1.00 0.36 O ATOM 2190 CB PRO A 140 9.034 13.489 7.856 1.00 0.42 C ATOM 2191 CG PRO A 140 9.905 12.312 8.112 1.00 0.42 C ATOM 2192 CD PRO A 140 9.095 11.106 7.713 1.00 0.35 C ATOM 0 HA PRO A 140 7.308 13.197 9.202 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.111 13.823 6.821 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.312 14.334 8.486 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.826 12.374 7.532 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.193 12.260 9.162 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.279 10.824 6.676 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.337 10.239 8.327 1.00 0.35 H new ATOM 2200 N TRP A 141 6.475 13.285 6.046 1.00 0.28 N ATOM 2201 CA TRP A 141 5.506 13.892 5.141 1.00 0.25 C ATOM 2202 C TRP A 141 4.104 13.380 5.461 1.00 0.22 C ATOM 2203 O TRP A 141 3.139 14.149 5.498 1.00 0.22 O ATOM 2204 CB TRP A 141 5.854 13.597 3.673 1.00 0.29 C ATOM 2205 CG TRP A 141 5.011 14.379 2.714 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.265 15.631 2.236 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.769 13.969 2.126 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.258 16.027 1.394 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.327 15.025 1.309 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.988 12.812 2.212 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 2.139 14.961 0.587 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.810 12.749 1.494 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.395 13.818 0.691 1.00 0.36 C ATOM 0 H TRP A 141 7.032 12.536 5.634 1.00 0.28 H new ATOM 0 HA TRP A 141 5.538 14.972 5.284 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.905 13.828 3.499 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.725 12.532 3.480 1.00 0.29 H new ATOM 0 HD1 TRP A 141 6.133 16.224 2.485 1.00 0.32 H new ATOM 0 HE1 TRP A 141 4.210 16.923 0.909 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.301 11.983 2.829 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.816 15.784 -0.033 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.199 11.860 1.553 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.468 13.739 0.142 1.00 0.36 H new ATOM 2224 N ILE A 142 4.009 12.080 5.705 1.00 0.20 N ATOM 2225 CA ILE A 142 2.744 11.440 6.046 1.00 0.19 C ATOM 2226 C ILE A 142 2.147 12.064 7.306 1.00 0.20 C ATOM 2227 O ILE A 142 1.037 12.601 7.277 1.00 0.20 O ATOM 2228 CB ILE A 142 2.947 9.922 6.264 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.347 9.245 4.953 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.692 9.274 6.828 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.700 7.786 5.116 1.00 0.23 C ATOM 0 H ILE A 142 4.803 11.441 5.673 1.00 0.20 H new ATOM 0 HA ILE A 142 2.054 11.592 5.216 1.00 0.19 H new ATOM 0 HB ILE A 142 3.750 9.792 6.989 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.527 9.336 4.241 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.200 9.772 4.526 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.866 8.207 6.970 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.445 9.732 7.786 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.865 9.417 6.133 1.00 0.25 H new ATOM 0 HD11 ILE A 142 3.974 7.368 4.148 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.540 7.690 5.804 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.841 7.246 5.514 1.00 0.23 H new ATOM 2243 N GLN A 143 2.905 12.000 8.396 1.00 0.25 N ATOM 2244 CA GLN A 143 2.466 12.499 9.693 1.00 0.30 C ATOM 2245 C GLN A 143 2.112 13.984 9.614 1.00 0.29 C ATOM 2246 O GLN A 143 1.120 14.422 10.197 1.00 0.31 O ATOM 2247 CB GLN A 143 3.573 12.246 10.733 1.00 0.40 C ATOM 2248 CG GLN A 143 3.198 12.570 12.178 1.00 0.51 C ATOM 2249 CD GLN A 143 3.241 14.055 12.492 1.00 0.95 C ATOM 2250 OE1 GLN A 143 4.032 14.803 11.916 1.00 1.51 O ATOM 2251 NE2 GLN A 143 2.393 14.493 13.407 1.00 1.60 N ATOM 0 H GLN A 143 3.843 11.600 8.404 1.00 0.25 H new ATOM 0 HA GLN A 143 1.564 11.968 9.997 1.00 0.30 H new ATOM 0 HB2 GLN A 143 3.868 11.198 10.678 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.447 12.838 10.460 1.00 0.40 H new ATOM 0 HG2 GLN A 143 2.196 12.192 12.379 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.877 12.044 12.849 1.00 0.51 H new ATOM 0 HE21 GLN A 143 1.753 13.842 13.862 1.00 1.60 H new ATOM 0 HE22 GLN A 143 2.379 15.482 13.658 1.00 1.60 H new ATOM 2260 N GLU A 144 2.914 14.741 8.871 1.00 0.29 N ATOM 2261 CA GLU A 144 2.714 16.183 8.742 1.00 0.33 C ATOM 2262 C GLU A 144 1.360 16.503 8.114 1.00 0.29 C ATOM 2263 O GLU A 144 0.712 17.481 8.483 1.00 0.35 O ATOM 2264 CB GLU A 144 3.833 16.805 7.904 1.00 0.41 C ATOM 2265 CG GLU A 144 3.729 18.314 7.764 1.00 0.64 C ATOM 2266 CD GLU A 144 4.874 18.898 6.971 1.00 1.09 C ATOM 2267 OE1 GLU A 144 5.985 19.018 7.530 1.00 1.25 O ATOM 2268 OE2 GLU A 144 4.674 19.234 5.788 1.00 1.75 O ATOM 0 H GLU A 144 3.711 14.380 8.347 1.00 0.29 H new ATOM 0 HA GLU A 144 2.736 16.610 9.745 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.793 16.557 8.356 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.823 16.356 6.911 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.787 18.567 7.277 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.708 18.768 8.755 1.00 0.64 H new ATOM 2275 N ASN A 145 0.929 15.671 7.177 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.350 15.884 6.504 1.00 0.28 C ATOM 2277 C ASN A 145 -1.479 15.174 7.244 1.00 0.30 C ATOM 2278 O ASN A 145 -2.560 14.963 6.694 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.292 15.408 5.044 1.00 0.32 C ATOM 2280 CG ASN A 145 0.516 16.339 4.151 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.023 17.286 3.578 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.809 16.078 4.015 1.00 0.33 N ATOM 0 H ASN A 145 1.441 14.846 6.865 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.551 16.955 6.509 1.00 0.28 H new ATOM 0 HB2 ASN A 145 0.144 14.410 5.009 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.306 15.326 4.653 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.389 16.670 3.421 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.223 15.285 4.504 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.225 14.806 8.493 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.261 14.214 9.318 1.00 0.30 C ATOM 2291 C GLY A 146 -1.942 12.790 9.720 1.00 0.30 C ATOM 2292 O GLY A 146 -2.344 12.335 10.789 1.00 0.41 O ATOM 0 H GLY A 146 -0.319 14.907 8.950 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.396 14.819 10.214 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.206 14.231 8.776 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.210 12.093 8.868 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.866 10.717 9.139 1.00 0.22 C ATOM 2298 C GLY A 147 -1.578 9.767 8.204 1.00 0.19 C ATOM 2299 O GLY A 147 -2.206 10.199 7.232 1.00 0.20 O ATOM 0 H GLY A 147 -0.846 12.459 7.988 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.211 10.585 9.040 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -1.124 10.474 10.170 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.483 8.474 8.487 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.153 7.462 7.681 1.00 0.21 C ATOM 2305 C TRP A 148 -3.662 7.670 7.661 1.00 0.23 C ATOM 2306 O TRP A 148 -4.331 7.282 6.705 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.831 6.058 8.192 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.438 5.601 7.869 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.549 5.270 8.755 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.121 5.424 6.562 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.679 4.883 8.077 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.441 4.971 6.731 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.371 5.599 5.263 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.275 4.691 5.653 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.461 5.321 4.195 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.771 4.869 4.396 1.00 0.24 C ATOM 0 H TRP A 148 -0.947 8.101 9.271 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.780 7.564 6.662 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.970 6.034 9.273 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.543 5.353 7.763 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.454 5.307 9.830 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.553 4.579 8.506 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.381 5.944 5.099 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.287 4.345 5.805 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.094 5.455 3.188 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.395 4.657 3.540 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.193 8.295 8.710 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.627 8.589 8.791 1.00 0.31 C ATOM 2329 C ASP A 149 -6.085 9.442 7.612 1.00 0.30 C ATOM 2330 O ASP A 149 -7.256 9.413 7.232 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.970 9.295 10.108 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.931 8.357 11.295 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -4.821 8.063 11.789 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -7.007 7.928 11.757 1.00 1.96 O ATOM 0 H ASP A 149 -3.654 8.609 9.517 1.00 0.26 H new ATOM 0 HA ASP A 149 -6.155 7.636 8.755 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.268 10.113 10.272 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.963 9.738 10.031 1.00 0.40 H new ATOM 2339 N THR A 150 -5.159 10.197 7.037 1.00 0.27 N ATOM 2340 CA THR A 150 -5.442 10.987 5.852 1.00 0.29 C ATOM 2341 C THR A 150 -5.503 10.084 4.623 1.00 0.28 C ATOM 2342 O THR A 150 -6.434 10.158 3.822 1.00 0.33 O ATOM 2343 CB THR A 150 -4.350 12.051 5.637 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.113 12.761 6.858 1.00 0.38 O ATOM 2345 CG2 THR A 150 -4.753 13.029 4.547 1.00 0.37 C ATOM 0 H THR A 150 -4.200 10.277 7.376 1.00 0.27 H new ATOM 0 HA THR A 150 -6.403 11.481 5.995 1.00 0.29 H new ATOM 0 HB THR A 150 -3.436 11.544 5.327 1.00 0.33 H new ATOM 0 HG1 THR A 150 -3.621 13.587 6.666 1.00 0.38 H new ATOM 0 HG21 THR A 150 -3.965 13.771 4.414 1.00 0.37 H new ATOM 0 HG22 THR A 150 -4.905 12.490 3.612 1.00 0.37 H new ATOM 0 HG23 THR A 150 -5.678 13.530 4.831 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.505 9.220 4.498 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.401 8.322 3.358 1.00 0.25 C ATOM 2355 C PHE A 151 -5.568 7.335 3.330 1.00 0.26 C ATOM 2356 O PHE A 151 -6.178 7.113 2.284 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.069 7.566 3.404 1.00 0.25 C ATOM 2358 CG PHE A 151 -2.865 6.653 2.232 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -2.403 7.150 1.029 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -3.146 5.303 2.333 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.224 6.317 -0.054 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.969 4.464 1.255 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.508 4.970 0.058 1.00 0.34 C ATOM 0 H PHE A 151 -3.751 9.123 5.178 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.440 8.920 2.447 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.252 8.286 3.442 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.022 6.982 4.323 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -2.180 8.203 0.936 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -3.508 4.902 3.268 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -1.862 6.717 -0.990 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -3.191 3.411 1.347 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.369 4.315 -0.789 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.884 6.761 4.490 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.979 5.802 4.602 1.00 0.29 C ATOM 2375 C VAL A 152 -8.324 6.491 4.365 1.00 0.35 C ATOM 2376 O VAL A 152 -9.328 5.852 4.067 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.972 5.102 5.980 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -8.046 4.031 6.057 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.608 4.494 6.258 1.00 0.28 C ATOM 0 H VAL A 152 -5.395 6.945 5.366 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.834 5.041 3.835 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.187 5.855 6.739 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -8.017 3.556 7.038 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -9.025 4.485 5.903 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.869 3.282 5.286 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.619 4.005 7.232 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.372 3.761 5.487 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.852 5.279 6.255 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.329 7.806 4.490 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.505 8.598 4.172 1.00 0.46 C ATOM 2391 C GLU A 153 -9.645 8.763 2.656 1.00 0.51 C ATOM 2392 O GLU A 153 -10.693 8.460 2.082 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.413 9.966 4.855 1.00 0.52 C ATOM 2394 CG GLU A 153 -10.519 10.932 4.468 1.00 0.70 C ATOM 2395 CD GLU A 153 -10.396 12.266 5.172 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -9.536 13.077 4.775 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -11.160 12.512 6.130 1.00 1.42 O ATOM 0 H GLU A 153 -7.528 8.351 4.811 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.390 8.080 4.542 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.434 9.822 5.935 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -8.451 10.417 4.612 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -10.498 11.091 3.390 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.485 10.487 4.706 1.00 0.70 H new ATOM 2404 N LEU A 154 -8.569 9.212 2.015 1.00 0.50 N ATOM 2405 CA LEU A 154 -8.593 9.529 0.586 1.00 0.59 C ATOM 2406 C LEU A 154 -8.623 8.274 -0.290 1.00 0.68 C ATOM 2407 O LEU A 154 -9.214 8.282 -1.371 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.386 10.394 0.216 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.321 11.750 0.919 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.036 12.474 0.555 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.532 12.599 0.559 1.00 0.67 C ATOM 0 H LEU A 154 -7.666 9.366 2.463 1.00 0.50 H new ATOM 0 HA LEU A 154 -9.513 10.081 0.396 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -6.477 9.839 0.446 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -7.394 10.560 -0.861 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.330 11.580 1.996 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -6.005 13.438 1.063 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.180 11.873 0.863 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.000 12.631 -0.523 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.467 13.560 1.069 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.555 12.761 -0.519 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.442 12.085 0.868 1.00 0.67 H new ATOM 2444 N GLY A 156 -9.582 5.310 1.097 1.00 0.89 N ATOM 2445 CA GLY A 156 -10.449 4.391 1.802 1.00 1.02 C ATOM 2446 C GLY A 156 -11.898 4.594 1.425 1.00 1.11 C ATOM 2447 O GLY A 156 -12.192 5.157 0.370 1.00 1.68 O ATOM 0 HA2 GLY A 156 -10.154 3.366 1.577 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -10.329 4.529 2.877 1.00 1.02 H new ATOM 2451 N ASN A 157 -12.804 4.158 2.287 1.00 1.62 N ATOM 2452 CA ASN A 157 -14.233 4.240 1.994 1.00 2.05 C ATOM 2453 C ASN A 157 -14.746 5.669 2.138 1.00 2.33 C ATOM 2454 O ASN A 157 -15.806 6.007 1.619 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.044 3.301 2.901 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.894 3.615 4.380 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -14.006 3.089 5.050 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -15.763 4.466 4.906 1.00 4.60 N ATOM 0 H ASN A 157 -12.580 3.745 3.192 1.00 1.62 H new ATOM 0 HA ASN A 157 -14.366 3.924 0.959 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -16.097 3.364 2.628 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -14.730 2.273 2.721 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -15.708 4.704 5.896 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -16.486 4.883 4.320 1.00 4.60 H new ATOM 2465 N ASN A 158 -13.981 6.505 2.834 1.00 2.99 N ATOM 2466 CA ASN A 158 -14.381 7.890 3.081 1.00 4.03 C ATOM 2467 C ASN A 158 -14.494 8.665 1.773 1.00 4.18 C ATOM 2468 O ASN A 158 -15.580 9.105 1.391 1.00 4.81 O ATOM 2469 CB ASN A 158 -13.383 8.587 4.009 1.00 5.08 C ATOM 2470 CG ASN A 158 -13.330 7.963 5.387 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -12.555 7.041 5.632 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -14.150 8.464 6.298 1.00 6.76 N ATOM 0 H ASN A 158 -13.080 6.249 3.238 1.00 2.99 H new ATOM 0 HA ASN A 158 -15.358 7.871 3.564 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -12.390 8.551 3.560 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -13.653 9.639 4.101 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -14.154 8.084 7.245 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -14.778 9.230 6.053 1.00 6.76 H new ATOM 2479 N ALA A 159 -13.370 8.822 1.083 1.00 3.95 N ATOM 2480 CA ALA A 159 -13.350 9.549 -0.177 1.00 4.72 C ATOM 2481 C ALA A 159 -14.058 8.767 -1.273 1.00 4.66 C ATOM 2482 O ALA A 159 -14.688 9.354 -2.149 1.00 5.63 O ATOM 2483 CB ALA A 159 -11.924 9.863 -0.592 1.00 4.78 C ATOM 0 H ALA A 159 -12.464 8.456 1.375 1.00 3.95 H new ATOM 0 HA ALA A 159 -13.885 10.487 -0.028 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -11.931 10.407 -1.537 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -11.448 10.474 0.175 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -11.367 8.934 -0.713 1.00 4.78 H new ATOM 2489 N ALA A 160 -13.955 7.441 -1.217 1.00 3.75 N ATOM 2490 CA ALA A 160 -14.595 6.578 -2.208 1.00 4.08 C ATOM 2491 C ALA A 160 -16.100 6.814 -2.255 1.00 4.33 C ATOM 2492 O ALA A 160 -16.670 7.027 -3.326 1.00 5.11 O ATOM 2493 CB ALA A 160 -14.300 5.118 -1.915 1.00 3.59 C ATOM 0 H ALA A 160 -13.435 6.941 -0.496 1.00 3.75 H new ATOM 0 HA ALA A 160 -14.182 6.830 -3.185 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -14.785 4.491 -2.664 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -13.223 4.951 -1.945 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -14.680 4.861 -0.926 1.00 3.59 H new ATOM 2499 N ALA A 161 -16.735 6.792 -1.087 1.00 3.93 N ATOM 2500 CA ALA A 161 -18.167 7.046 -0.994 1.00 4.43 C ATOM 2501 C ALA A 161 -18.519 8.421 -1.553 1.00 5.54 C ATOM 2502 O ALA A 161 -19.511 8.575 -2.263 1.00 6.11 O ATOM 2503 CB ALA A 161 -18.638 6.924 0.446 1.00 4.39 C ATOM 0 H ALA A 161 -16.281 6.601 -0.194 1.00 3.93 H new ATOM 0 HA ALA A 161 -18.680 6.295 -1.594 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -19.710 7.117 0.496 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -18.433 5.918 0.812 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -18.110 7.650 1.064 1.00 4.39 H new ATOM 2509 N GLU A 162 -17.686 9.411 -1.253 1.00 5.98 N ATOM 2510 CA GLU A 162 -17.924 10.772 -1.712 1.00 7.23 C ATOM 2511 C GLU A 162 -17.698 10.879 -3.223 1.00 7.80 C ATOM 2512 O GLU A 162 -18.353 11.671 -3.903 1.00 8.75 O ATOM 2513 CB GLU A 162 -17.011 11.747 -0.965 1.00 7.72 C ATOM 2514 CG GLU A 162 -17.407 13.203 -1.133 1.00 7.99 C ATOM 2515 CD GLU A 162 -16.489 14.147 -0.391 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -16.534 14.166 0.858 1.00 9.09 O ATOM 2517 OE2 GLU A 162 -15.716 14.874 -1.048 1.00 9.03 O ATOM 0 H GLU A 162 -16.841 9.296 -0.694 1.00 5.98 H new ATOM 0 HA GLU A 162 -18.961 11.032 -1.503 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -17.018 11.498 0.096 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -15.988 11.615 -1.317 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -17.402 13.456 -2.193 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.428 13.341 -0.777 1.00 7.99 H new ATOM 2524 N SER A 163 -16.785 10.062 -3.741 1.00 7.39 N ATOM 2525 CA SER A 163 -16.478 10.054 -5.167 1.00 8.21 C ATOM 2526 C SER A 163 -17.698 9.632 -5.984 1.00 8.28 C ATOM 2527 O SER A 163 -18.079 10.308 -6.941 1.00 9.15 O ATOM 2528 CB SER A 163 -15.302 9.116 -5.459 1.00 8.03 C ATOM 2529 OG SER A 163 -14.134 9.521 -4.762 1.00 7.86 O ATOM 0 H SER A 163 -16.243 9.395 -3.192 1.00 7.39 H new ATOM 0 HA SER A 163 -16.201 11.068 -5.457 1.00 8.21 H new ATOM 0 HB2 SER A 163 -15.566 8.098 -5.171 1.00 8.03 H new ATOM 0 HB3 SER A 163 -15.102 9.102 -6.530 1.00 8.03 H new ATOM 0 HG SER A 163 -14.232 9.311 -3.810 1.00 7.86 H new ATOM 2535 N ARG A 164 -18.320 8.522 -5.596 1.00 7.47 N ATOM 2536 CA ARG A 164 -19.498 8.037 -6.305 1.00 7.60 C ATOM 2537 C ARG A 164 -20.741 8.825 -5.897 1.00 8.33 C ATOM 2538 O ARG A 164 -21.759 8.800 -6.585 1.00 8.87 O ATOM 2539 CB ARG A 164 -19.685 6.524 -6.096 1.00 6.69 C ATOM 2540 CG ARG A 164 -19.695 6.068 -4.644 1.00 6.19 C ATOM 2541 CD ARG A 164 -21.069 6.198 -4.016 1.00 5.74 C ATOM 2542 NE ARG A 164 -21.080 5.743 -2.629 1.00 5.66 N ATOM 2543 CZ ARG A 164 -22.050 6.030 -1.762 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -23.113 6.727 -2.155 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -21.969 5.603 -0.508 1.00 6.02 N ATOM 0 H ARG A 164 -18.032 7.948 -4.804 1.00 7.47 H new ATOM 0 HA ARG A 164 -19.345 8.199 -7.372 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -20.623 6.222 -6.562 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -18.886 5.999 -6.620 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -19.368 5.030 -4.588 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -18.979 6.659 -4.074 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -21.391 7.239 -4.059 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -21.788 5.618 -4.594 1.00 5.74 H new ATOM 0 HE ARG A 164 -20.299 5.172 -2.305 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -23.187 7.043 -3.122 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -23.854 6.945 -1.489 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -21.163 5.054 -0.207 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -22.712 5.823 0.155 1.00 6.02 H new ATOM 2559 N LYS A 165 -20.642 9.537 -4.780 1.00 8.52 N ATOM 2560 CA LYS A 165 -21.702 10.437 -4.341 1.00 9.41 C ATOM 2561 C LYS A 165 -21.824 11.611 -5.310 1.00 10.47 C ATOM 2562 O LYS A 165 -22.922 11.977 -5.735 1.00 11.24 O ATOM 2563 CB LYS A 165 -21.403 10.947 -2.929 1.00 9.61 C ATOM 2564 CG LYS A 165 -22.418 11.944 -2.399 1.00 9.69 C ATOM 2565 CD LYS A 165 -21.987 12.502 -1.052 1.00 10.12 C ATOM 2566 CE LYS A 165 -22.977 13.532 -0.528 1.00 10.34 C ATOM 2567 NZ LYS A 165 -24.300 12.929 -0.217 1.00 10.42 N ATOM 0 H LYS A 165 -19.833 9.508 -4.159 1.00 8.52 H new ATOM 0 HA LYS A 165 -22.647 9.893 -4.326 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -21.358 10.096 -2.250 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -20.417 11.412 -2.924 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -22.538 12.760 -3.112 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -23.390 11.461 -2.301 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -21.894 11.688 -0.333 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -21.002 12.959 -1.145 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -22.572 13.999 0.370 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -23.104 14.322 -1.269 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -24.898 13.632 0.262 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -24.760 12.626 -1.099 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -24.169 12.106 0.405 1.00 10.42 H new ATOM 2581 N GLY A 166 -20.679 12.187 -5.663 1.00 10.61 N ATOM 2582 CA GLY A 166 -20.656 13.290 -6.604 1.00 11.72 C ATOM 2583 C GLY A 166 -20.794 12.815 -8.035 1.00 12.02 C ATOM 2584 O GLY A 166 -21.078 13.603 -8.938 1.00 13.02 O ATOM 0 H GLY A 166 -19.763 11.907 -5.312 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -21.465 13.982 -6.372 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -19.723 13.842 -6.493 1.00 11.72 H new ATOM 2588 N GLN A 167 -20.602 11.518 -8.240 1.00 11.25 N ATOM 2589 CA GLN A 167 -20.740 10.922 -9.565 1.00 11.64 C ATOM 2590 C GLN A 167 -22.190 11.010 -10.028 1.00 12.01 C ATOM 2591 O GLN A 167 -22.476 10.995 -11.226 1.00 12.84 O ATOM 2592 CB GLN A 167 -20.273 9.462 -9.559 1.00 10.86 C ATOM 2593 CG GLN A 167 -20.251 8.828 -10.941 1.00 11.50 C ATOM 2594 CD GLN A 167 -19.922 7.352 -10.904 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -18.756 6.961 -10.970 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -20.947 6.526 -10.795 1.00 12.41 N ATOM 0 H GLN A 167 -20.350 10.857 -7.505 1.00 11.25 H new ATOM 0 HA GLN A 167 -20.110 11.477 -10.260 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -19.273 9.410 -9.128 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -20.930 8.881 -8.912 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -21.223 8.967 -11.415 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -19.517 9.344 -11.561 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -21.896 6.895 -10.743 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -20.789 5.519 -10.762 1.00 12.41 H new ATOM 2605 N GLU A 168 -23.102 11.124 -9.067 1.00 11.51 N ATOM 2606 CA GLU A 168 -24.516 11.307 -9.365 1.00 11.94 C ATOM 2607 C GLU A 168 -24.730 12.523 -10.259 1.00 13.03 C ATOM 2608 O GLU A 168 -25.471 12.458 -11.238 1.00 13.73 O ATOM 2609 CB GLU A 168 -25.316 11.460 -8.074 1.00 11.38 C ATOM 2610 CG GLU A 168 -25.534 10.150 -7.339 1.00 10.85 C ATOM 2611 CD GLU A 168 -26.314 9.157 -8.171 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -27.493 9.427 -8.481 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -25.751 8.097 -8.522 1.00 10.74 O ATOM 0 H GLU A 168 -22.884 11.092 -8.071 1.00 11.51 H new ATOM 0 HA GLU A 168 -24.867 10.422 -9.896 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -24.797 12.156 -7.415 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -26.285 11.903 -8.306 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -24.569 9.720 -7.071 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -26.067 10.341 -6.408 1.00 10.85 H new