USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=30 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 48 GLN : amide:sc= -0.488 X(o=-1,f=-1) USER MOD Set 1.2: A 158 ASN : amide:sc= -0.531 K(o=-1,f=-5.2!) USER MOD Set 2.1: A 73 HIS : no HD1:sc= 0.493 K(o=1,f=-1.8) USER MOD Set 2.2: A 75 THR OG1 : rot -26:sc= 0.538 USER MOD Set 3.1: A 23 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 25 SER OG : rot 180:sc= 0.0441 USER MOD Set 4.1: A 5 ASN : amide:sc= 1.35 K(o=1.3,f=-6.3!) USER MOD Set 4.2: A 135 ASN : amide:sc= 0 K(o=1.3,f=0.7) USER MOD Single : A 4 SER OG : rot -25:sc= 0.317 USER MOD Single : A 14 SER OG : rot 160:sc= -0.804 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 156:sc= -0.61 (180deg=-1.35!) USER MOD Single : A 22 TYR OH : rot 165:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -5.61! K(o=-5.6!,f=-1) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 0.607 (180deg=0.35) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot -84:sc= 1.19 USER MOD Single : A 69 THR OG1 : rot -78:sc= 0.334 USER MOD Single : A 70 SER OG : rot 75:sc= 1.24 USER MOD Single : A 71 GLN : amide:sc= -1.29! K(o=-1.3!,f=-0.011) USER MOD Single : A 78 THR OG1 : rot 71:sc= 1.14 USER MOD Single : A 80 TYR OH : rot -137:sc= 1.12 USER MOD Single : A 81 GLN : amide:sc= -6.12! K(o=-6.1!,f=-1.1) USER MOD Single : A 82 SER OG : rot 180:sc= 0.00375 USER MOD Single : A 85 GLN : amide:sc= -1.42! K(o=-1.4!,f=-0.038) USER MOD Single : A 88 ASN : amide:sc=-0.000153 X(o=-0.00015,f=-0.00015) USER MOD Single : A 96 ASN : amide:sc= -2.15! C(o=-2.1!,f=-8.4!) USER MOD Single : A 105 SER OG : rot -109:sc= 1.4 USER MOD Single : A 111 CYS SG : rot -78:sc= -0.371 USER MOD Single : A 114 SER OG : rot 83:sc= -0.596 USER MOD Single : A 117 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.117) USER MOD Single : A 119 MET CE :methyl -156:sc= -4.29! (180deg=-5.48!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 171:sc= -3.32! (180deg=-3.74!) USER MOD Single : A 132 THR OG1 : rot 86:sc= 1.29 USER MOD Single : A 133 TYR OH : rot -58:sc= -1.7 USER MOD Single : A 137 HIS : no HD1:sc= -0.131 X(o=-0.13,f=-0.057) USER MOD Single : A 143 GLN : amide:sc= -0.0388 K(o=-0.039,f=-0.54) USER MOD Single : A 145 ASN : amide:sc= 0.837 K(o=0.84,f=-0.0051) USER MOD Single : A 150 THR OG1 : rot 178:sc= 1.27 USER MOD Single : A 157 ASN : amide:sc= -0.392 X(o=-0.39,f=-0.07) USER MOD Single : A 163 SER OG : rot -42:sc= 0.125 USER MOD Single : A 165 LYS NZ :NH3+ -167:sc= -0.0149 (180deg=-0.192) USER MOD Single : A 167 GLN : amide:sc= 0.177 X(o=0.18,f=-0.054) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 4.519 -0.669 12.987 1.00 0.88 N ATOM 49 CA SER A 4 3.385 -0.731 12.076 1.00 0.77 C ATOM 50 C SER A 4 3.831 -0.427 10.648 1.00 0.62 C ATOM 51 O SER A 4 3.444 -1.124 9.712 1.00 0.64 O ATOM 52 CB SER A 4 2.302 0.251 12.523 1.00 1.02 C ATOM 53 OG SER A 4 2.865 1.509 12.850 1.00 1.34 O ATOM 0 HA SER A 4 2.971 -1.739 12.096 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.566 0.373 11.729 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.774 -0.152 13.388 1.00 1.02 H new ATOM 0 HG SER A 4 3.804 1.391 13.103 1.00 1.34 H new ATOM 59 N ASN A 5 4.669 0.598 10.497 1.00 0.59 N ATOM 60 CA ASN A 5 5.211 0.961 9.185 1.00 0.55 C ATOM 61 C ASN A 5 5.963 -0.213 8.559 1.00 0.43 C ATOM 62 O ASN A 5 5.886 -0.433 7.352 1.00 0.44 O ATOM 63 CB ASN A 5 6.135 2.185 9.284 1.00 0.65 C ATOM 64 CG ASN A 5 5.366 3.491 9.433 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.220 3.600 8.999 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.997 4.500 10.023 1.00 0.67 N ATOM 0 H ASN A 5 4.987 1.191 11.263 1.00 0.59 H new ATOM 0 HA ASN A 5 4.368 1.217 8.544 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.804 2.062 10.136 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.761 2.236 8.393 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.531 5.401 10.128 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.947 4.373 10.371 1.00 0.67 H new ATOM 73 N ARG A 6 6.678 -0.972 9.385 1.00 0.41 N ATOM 74 CA ARG A 6 7.403 -2.143 8.905 1.00 0.41 C ATOM 75 C ARG A 6 6.424 -3.216 8.436 1.00 0.37 C ATOM 76 O ARG A 6 6.618 -3.832 7.386 1.00 0.38 O ATOM 77 CB ARG A 6 8.295 -2.717 10.011 1.00 0.54 C ATOM 78 CG ARG A 6 9.227 -3.820 9.528 1.00 0.65 C ATOM 79 CD ARG A 6 9.825 -4.607 10.686 1.00 0.83 C ATOM 80 NE ARG A 6 8.817 -5.411 11.377 1.00 1.50 N ATOM 81 CZ ARG A 6 9.042 -6.130 12.476 1.00 2.14 C ATOM 82 NH1 ARG A 6 10.237 -6.147 13.051 1.00 2.16 N ATOM 83 NH2 ARG A 6 8.056 -6.843 12.997 1.00 3.18 N ATOM 0 H ARG A 6 6.770 -0.798 10.386 1.00 0.41 H new ATOM 0 HA ARG A 6 8.029 -1.834 8.068 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.890 -1.912 10.441 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.664 -3.109 10.809 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.679 -4.498 8.874 1.00 0.65 H new ATOM 0 HG3 ARG A 6 10.029 -3.383 8.934 1.00 0.65 H new ATOM 0 HD2 ARG A 6 10.615 -5.258 10.313 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.287 -3.918 11.393 1.00 0.83 H new ATOM 0 HE ARG A 6 7.874 -5.422 10.989 1.00 1.50 H new ATOM 0 HH11 ARG A 6 11.003 -5.604 12.652 1.00 2.16 H new ATOM 0 HH12 ARG A 6 10.390 -6.703 13.892 1.00 2.16 H new ATOM 0 HH21 ARG A 6 7.136 -6.838 12.557 1.00 3.18 H new ATOM 0 HH22 ARG A 6 8.217 -7.397 13.838 1.00 3.18 H new ATOM 97 N GLU A 7 5.364 -3.417 9.211 1.00 0.36 N ATOM 98 CA GLU A 7 4.380 -4.452 8.916 1.00 0.37 C ATOM 99 C GLU A 7 3.611 -4.129 7.647 1.00 0.29 C ATOM 100 O GLU A 7 3.239 -5.028 6.897 1.00 0.29 O ATOM 101 CB GLU A 7 3.406 -4.621 10.082 1.00 0.46 C ATOM 102 CG GLU A 7 4.088 -5.008 11.384 1.00 0.60 C ATOM 103 CD GLU A 7 5.020 -6.191 11.218 1.00 1.39 C ATOM 104 OE1 GLU A 7 4.527 -7.335 11.186 1.00 1.58 O ATOM 105 OE2 GLU A 7 6.243 -5.981 11.121 1.00 2.00 O ATOM 0 H GLU A 7 5.164 -2.875 10.051 1.00 0.36 H new ATOM 0 HA GLU A 7 4.920 -5.387 8.767 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.861 -3.689 10.229 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.671 -5.383 9.825 1.00 0.46 H new ATOM 0 HG2 GLU A 7 4.651 -4.155 11.763 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.331 -5.247 12.131 1.00 0.60 H new ATOM 112 N LEU A 8 3.386 -2.845 7.405 1.00 0.27 N ATOM 113 CA LEU A 8 2.693 -2.404 6.203 1.00 0.28 C ATOM 114 C LEU A 8 3.469 -2.824 4.972 1.00 0.28 C ATOM 115 O LEU A 8 2.893 -3.129 3.936 1.00 0.39 O ATOM 116 CB LEU A 8 2.518 -0.887 6.215 1.00 0.31 C ATOM 117 CG LEU A 8 1.770 -0.343 7.422 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.716 1.173 7.371 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.375 -0.936 7.486 1.00 0.35 C ATOM 0 H LEU A 8 3.674 -2.089 8.027 1.00 0.27 H new ATOM 0 HA LEU A 8 1.708 -2.870 6.180 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.503 -0.421 6.175 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.987 -0.589 5.311 1.00 0.31 H new ATOM 0 HG LEU A 8 2.304 -0.631 8.327 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.177 1.547 8.242 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.730 1.573 7.372 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.202 1.488 6.463 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.150 -0.538 8.355 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.173 -0.676 6.580 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.444 -2.021 7.569 1.00 0.35 H new ATOM 131 N VAL A 9 4.785 -2.837 5.106 1.00 0.26 N ATOM 132 CA VAL A 9 5.659 -3.313 4.056 1.00 0.28 C ATOM 133 C VAL A 9 5.642 -4.837 4.011 1.00 0.29 C ATOM 134 O VAL A 9 5.234 -5.431 3.017 1.00 0.31 O ATOM 135 CB VAL A 9 7.099 -2.829 4.285 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.015 -3.345 3.192 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.141 -1.312 4.360 1.00 0.31 C ATOM 0 H VAL A 9 5.272 -2.518 5.944 1.00 0.26 H new ATOM 0 HA VAL A 9 5.298 -2.914 3.108 1.00 0.28 H new ATOM 0 HB VAL A 9 7.453 -3.227 5.236 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.030 -2.992 3.371 1.00 0.38 H new ATOM 0 HG12 VAL A 9 8.004 -4.435 3.193 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.669 -2.980 2.225 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.168 -0.984 4.523 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.769 -0.891 3.426 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.516 -0.971 5.186 1.00 0.31 H new ATOM 147 N VAL A 10 6.077 -5.454 5.108 1.00 0.30 N ATOM 148 CA VAL A 10 6.183 -6.907 5.210 1.00 0.32 C ATOM 149 C VAL A 10 4.901 -7.607 4.773 1.00 0.35 C ATOM 150 O VAL A 10 4.927 -8.458 3.884 1.00 0.36 O ATOM 151 CB VAL A 10 6.526 -7.330 6.655 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.443 -8.839 6.813 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.911 -6.832 7.036 1.00 0.38 C ATOM 0 H VAL A 10 6.366 -4.959 5.952 1.00 0.30 H new ATOM 0 HA VAL A 10 6.985 -7.211 4.538 1.00 0.32 H new ATOM 0 HB VAL A 10 5.795 -6.878 7.325 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.689 -9.111 7.839 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.432 -9.174 6.581 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.148 -9.315 6.132 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.139 -7.137 8.057 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.650 -7.256 6.356 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.938 -5.744 6.968 1.00 0.38 H new ATOM 163 N ASP A 11 3.783 -7.234 5.384 1.00 0.39 N ATOM 164 CA ASP A 11 2.512 -7.906 5.128 1.00 0.46 C ATOM 165 C ASP A 11 2.032 -7.632 3.704 1.00 0.44 C ATOM 166 O ASP A 11 1.267 -8.409 3.132 1.00 0.50 O ATOM 167 CB ASP A 11 1.448 -7.456 6.136 1.00 0.55 C ATOM 168 CG ASP A 11 0.276 -8.414 6.201 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.686 -8.242 5.425 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.313 -9.351 7.027 1.00 0.92 O ATOM 0 H ASP A 11 3.729 -6.471 6.059 1.00 0.39 H new ATOM 0 HA ASP A 11 2.670 -8.978 5.242 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.900 -7.371 7.124 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.089 -6.464 5.863 1.00 0.55 H new ATOM 175 N PHE A 12 2.493 -6.531 3.130 1.00 0.41 N ATOM 176 CA PHE A 12 2.142 -6.189 1.758 1.00 0.42 C ATOM 177 C PHE A 12 2.935 -7.066 0.797 1.00 0.37 C ATOM 178 O PHE A 12 2.390 -7.586 -0.179 1.00 0.41 O ATOM 179 CB PHE A 12 2.431 -4.706 1.475 1.00 0.44 C ATOM 180 CG PHE A 12 1.711 -4.155 0.274 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.228 -4.342 -0.998 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.519 -3.457 0.412 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.573 -3.844 -2.109 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.139 -2.956 -0.696 1.00 0.68 C ATOM 185 CZ PHE A 12 0.370 -3.127 -1.934 1.00 0.60 C ATOM 0 H PHE A 12 3.109 -5.861 3.590 1.00 0.41 H new ATOM 0 HA PHE A 12 1.075 -6.362 1.615 1.00 0.42 H new ATOM 0 HB2 PHE A 12 2.154 -4.120 2.351 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.504 -4.577 1.332 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.154 -4.883 -1.123 1.00 0.46 H new ATOM 0 HD2 PHE A 12 0.101 -3.304 1.396 1.00 0.62 H new ATOM 0 HE1 PHE A 12 1.977 -4.002 -3.098 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.069 -2.423 -0.569 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.143 -2.715 -2.791 1.00 0.60 H new ATOM 195 N LEU A 13 4.219 -7.244 1.095 1.00 0.33 N ATOM 196 CA LEU A 13 5.095 -8.036 0.249 1.00 0.32 C ATOM 197 C LEU A 13 4.686 -9.501 0.303 1.00 0.33 C ATOM 198 O LEU A 13 4.630 -10.180 -0.722 1.00 0.35 O ATOM 199 CB LEU A 13 6.556 -7.884 0.692 1.00 0.32 C ATOM 200 CG LEU A 13 7.031 -6.443 0.912 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.529 -6.404 1.162 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.665 -5.563 -0.270 1.00 0.38 C ATOM 0 H LEU A 13 4.673 -6.848 1.918 1.00 0.33 H new ATOM 0 HA LEU A 13 5.004 -7.676 -0.776 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.696 -8.440 1.619 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.196 -8.349 -0.059 1.00 0.32 H new ATOM 0 HG LEU A 13 6.524 -6.053 1.795 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.846 -5.372 1.316 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.765 -6.992 2.049 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.053 -6.820 0.301 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.013 -4.546 -0.088 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.136 -5.952 -1.173 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.583 -5.558 -0.399 1.00 0.38 H new ATOM 214 N SER A 14 4.378 -9.972 1.506 1.00 0.34 N ATOM 215 CA SER A 14 3.969 -11.352 1.707 1.00 0.38 C ATOM 216 C SER A 14 2.661 -11.644 0.975 1.00 0.39 C ATOM 217 O SER A 14 2.482 -12.723 0.411 1.00 0.41 O ATOM 218 CB SER A 14 3.820 -11.641 3.200 1.00 0.45 C ATOM 219 OG SER A 14 2.938 -10.720 3.816 1.00 1.14 O ATOM 0 H SER A 14 4.405 -9.413 2.359 1.00 0.34 H new ATOM 0 HA SER A 14 4.739 -12.004 1.295 1.00 0.38 H new ATOM 0 HB2 SER A 14 3.447 -12.655 3.341 1.00 0.45 H new ATOM 0 HB3 SER A 14 4.796 -11.591 3.682 1.00 0.45 H new ATOM 0 HG SER A 14 2.609 -11.096 4.659 1.00 1.14 H new ATOM 225 N TYR A 15 1.764 -10.664 0.962 1.00 0.42 N ATOM 226 CA TYR A 15 0.467 -10.824 0.317 1.00 0.47 C ATOM 227 C TYR A 15 0.642 -10.931 -1.194 1.00 0.45 C ATOM 228 O TYR A 15 -0.109 -11.637 -1.871 1.00 0.52 O ATOM 229 CB TYR A 15 -0.453 -9.647 0.668 1.00 0.55 C ATOM 230 CG TYR A 15 -1.908 -9.866 0.304 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.680 -10.817 0.962 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.509 -9.119 -0.703 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.007 -11.017 0.625 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.834 -9.313 -1.044 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.582 -10.272 -0.353 1.00 1.02 C ATOM 236 OH TYR A 15 -5.899 -10.457 -0.714 1.00 1.20 O ATOM 0 H TYR A 15 1.912 -9.750 1.391 1.00 0.42 H new ATOM 0 HA TYR A 15 0.006 -11.742 0.681 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.383 -9.452 1.738 1.00 0.55 H new ATOM 0 HB3 TYR A 15 -0.093 -8.754 0.157 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.237 -11.409 1.749 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.930 -8.374 -1.228 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.587 -11.768 1.141 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -4.286 -8.732 -1.834 1.00 0.94 H new ATOM 0 HH TYR A 15 -6.133 -9.831 -1.431 1.00 1.20 H new ATOM 246 N LYS A 16 1.653 -10.244 -1.713 1.00 0.40 N ATOM 247 CA LYS A 16 1.946 -10.274 -3.137 1.00 0.41 C ATOM 248 C LYS A 16 2.659 -11.565 -3.512 1.00 0.35 C ATOM 249 O LYS A 16 2.288 -12.226 -4.481 1.00 0.39 O ATOM 250 CB LYS A 16 2.788 -9.063 -3.539 1.00 0.49 C ATOM 251 CG LYS A 16 2.011 -7.756 -3.537 1.00 0.90 C ATOM 252 CD LYS A 16 0.850 -7.807 -4.517 1.00 0.83 C ATOM 253 CE LYS A 16 0.113 -6.481 -4.593 1.00 1.35 C ATOM 254 NZ LYS A 16 -1.022 -6.543 -5.549 1.00 1.39 N ATOM 0 H LYS A 16 2.284 -9.659 -1.166 1.00 0.40 H new ATOM 0 HA LYS A 16 1.002 -10.233 -3.680 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.633 -8.975 -2.856 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.199 -9.231 -4.535 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.635 -7.554 -2.534 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.676 -6.934 -3.799 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.222 -8.073 -5.507 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.156 -8.591 -4.216 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -0.257 -6.212 -3.604 1.00 1.35 H new ATOM 0 HE3 LYS A 16 0.805 -5.696 -4.898 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -1.503 -5.622 -5.577 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -0.665 -6.775 -6.498 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -1.694 -7.276 -5.243 1.00 1.39 H new ATOM 268 N LEU A 17 3.675 -11.926 -2.734 1.00 0.30 N ATOM 269 CA LEU A 17 4.392 -13.179 -2.938 1.00 0.27 C ATOM 270 C LEU A 17 3.439 -14.364 -2.869 1.00 0.31 C ATOM 271 O LEU A 17 3.502 -15.268 -3.701 1.00 0.32 O ATOM 272 CB LEU A 17 5.491 -13.339 -1.887 1.00 0.25 C ATOM 273 CG LEU A 17 6.633 -12.337 -1.996 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.563 -12.472 -0.811 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.395 -12.544 -3.286 1.00 0.25 C ATOM 0 H LEU A 17 4.021 -11.366 -1.954 1.00 0.30 H new ATOM 0 HA LEU A 17 4.845 -13.152 -3.929 1.00 0.27 H new ATOM 0 HB2 LEU A 17 5.043 -13.251 -0.897 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.902 -14.346 -1.962 1.00 0.25 H new ATOM 0 HG LEU A 17 6.213 -11.331 -1.998 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.375 -11.750 -0.901 1.00 0.29 H new ATOM 0 HD12 LEU A 17 7.010 -12.283 0.109 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.976 -13.481 -0.785 1.00 0.29 H new ATOM 0 HD21 LEU A 17 8.208 -11.820 -3.349 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.806 -13.553 -3.308 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.722 -12.408 -4.132 1.00 0.25 H new ATOM 287 N SER A 18 2.544 -14.339 -1.890 1.00 0.37 N ATOM 288 CA SER A 18 1.578 -15.415 -1.708 1.00 0.44 C ATOM 289 C SER A 18 0.648 -15.502 -2.918 1.00 0.47 C ATOM 290 O SER A 18 0.205 -16.584 -3.297 1.00 0.51 O ATOM 291 CB SER A 18 0.772 -15.193 -0.417 1.00 0.54 C ATOM 292 OG SER A 18 -0.114 -16.272 -0.165 1.00 1.26 O ATOM 0 H SER A 18 2.467 -13.584 -1.209 1.00 0.37 H new ATOM 0 HA SER A 18 2.115 -16.359 -1.620 1.00 0.44 H new ATOM 0 HB2 SER A 18 1.455 -15.078 0.424 1.00 0.54 H new ATOM 0 HB3 SER A 18 0.205 -14.266 -0.496 1.00 0.54 H new ATOM 0 HG SER A 18 -0.610 -16.101 0.663 1.00 1.26 H new ATOM 298 N GLN A 19 0.388 -14.357 -3.544 1.00 0.48 N ATOM 299 CA GLN A 19 -0.482 -14.298 -4.712 1.00 0.53 C ATOM 300 C GLN A 19 0.274 -14.776 -5.955 1.00 0.48 C ATOM 301 O GLN A 19 -0.317 -15.076 -6.994 1.00 0.55 O ATOM 302 CB GLN A 19 -0.979 -12.862 -4.907 1.00 0.59 C ATOM 303 CG GLN A 19 -2.109 -12.717 -5.912 1.00 0.71 C ATOM 304 CD GLN A 19 -2.503 -11.269 -6.122 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.360 -10.736 -5.418 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.882 -10.618 -7.094 1.00 1.65 N ATOM 0 H GLN A 19 0.770 -13.455 -3.259 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.340 -14.953 -4.558 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.313 -12.473 -3.945 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.142 -12.242 -5.228 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.804 -13.151 -6.864 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.975 -13.282 -5.567 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -1.177 -11.094 -7.657 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -2.109 -9.641 -7.280 1.00 1.65 H new ATOM 315 N LYS A 20 1.592 -14.836 -5.829 1.00 0.41 N ATOM 316 CA LYS A 20 2.460 -15.290 -6.906 1.00 0.40 C ATOM 317 C LYS A 20 2.910 -16.732 -6.676 1.00 0.44 C ATOM 318 O LYS A 20 3.785 -17.238 -7.379 1.00 0.48 O ATOM 319 CB LYS A 20 3.681 -14.375 -7.005 1.00 0.36 C ATOM 320 CG LYS A 20 3.344 -12.945 -7.399 1.00 0.68 C ATOM 321 CD LYS A 20 2.914 -12.853 -8.856 1.00 0.61 C ATOM 322 CE LYS A 20 2.485 -11.442 -9.236 1.00 1.06 C ATOM 323 NZ LYS A 20 3.609 -10.473 -9.158 1.00 1.87 N ATOM 0 H LYS A 20 2.089 -14.572 -4.978 1.00 0.41 H new ATOM 0 HA LYS A 20 1.898 -15.252 -7.839 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.196 -14.366 -6.044 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.376 -14.789 -7.735 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.546 -12.569 -6.759 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.212 -12.307 -7.234 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.737 -13.167 -9.498 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.090 -13.543 -9.035 1.00 0.61 H new ATOM 0 HE2 LYS A 20 2.082 -11.447 -10.249 1.00 1.06 H new ATOM 0 HE3 LYS A 20 1.682 -11.118 -8.575 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 3.414 -9.664 -9.781 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 3.712 -10.139 -8.179 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 4.489 -10.937 -9.460 1.00 1.87 H new ATOM 337 N GLY A 21 2.317 -17.386 -5.686 1.00 0.48 N ATOM 338 CA GLY A 21 2.632 -18.779 -5.425 1.00 0.54 C ATOM 339 C GLY A 21 3.871 -18.966 -4.565 1.00 0.53 C ATOM 340 O GLY A 21 4.452 -20.052 -4.539 1.00 0.67 O ATOM 0 H GLY A 21 1.624 -16.978 -5.059 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.782 -19.250 -4.932 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.776 -19.295 -6.374 1.00 0.54 H new ATOM 344 N TYR A 22 4.293 -17.915 -3.873 1.00 0.43 N ATOM 345 CA TYR A 22 5.427 -18.015 -2.958 1.00 0.42 C ATOM 346 C TYR A 22 4.941 -17.902 -1.519 1.00 0.43 C ATOM 347 O TYR A 22 3.964 -17.209 -1.245 1.00 0.46 O ATOM 348 CB TYR A 22 6.457 -16.908 -3.220 1.00 0.40 C ATOM 349 CG TYR A 22 6.971 -16.840 -4.643 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.274 -17.990 -5.365 1.00 0.65 C ATOM 351 CD2 TYR A 22 7.154 -15.612 -5.264 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.746 -17.913 -6.663 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.626 -15.528 -6.559 1.00 0.57 C ATOM 354 CZ TYR A 22 7.919 -16.679 -7.254 1.00 0.69 C ATOM 355 OH TYR A 22 8.392 -16.595 -8.542 1.00 0.81 O ATOM 0 H TYR A 22 3.871 -16.988 -3.926 1.00 0.43 H new ATOM 0 HA TYR A 22 5.902 -18.982 -3.123 1.00 0.42 H new ATOM 0 HB2 TYR A 22 6.010 -15.947 -2.964 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.304 -17.054 -2.550 1.00 0.40 H new ATOM 0 HD1 TYR A 22 7.139 -18.958 -4.905 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.923 -14.706 -4.724 1.00 0.47 H new ATOM 0 HE1 TYR A 22 7.978 -18.814 -7.211 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.765 -14.563 -7.024 1.00 0.57 H new ATOM 0 HH TYR A 22 8.236 -15.692 -8.890 1.00 0.81 H new ATOM 365 N SER A 23 5.616 -18.576 -0.604 1.00 0.45 N ATOM 366 CA SER A 23 5.267 -18.488 0.804 1.00 0.49 C ATOM 367 C SER A 23 6.276 -17.613 1.548 1.00 0.43 C ATOM 368 O SER A 23 7.482 -17.863 1.504 1.00 0.44 O ATOM 369 CB SER A 23 5.207 -19.883 1.432 1.00 0.59 C ATOM 370 OG SER A 23 4.729 -19.824 2.768 1.00 1.41 O ATOM 0 H SER A 23 6.406 -19.188 -0.809 1.00 0.45 H new ATOM 0 HA SER A 23 4.281 -18.031 0.886 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.556 -20.525 0.838 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.199 -20.334 1.417 1.00 0.59 H new ATOM 0 HG SER A 23 4.699 -20.728 3.145 1.00 1.41 H new ATOM 376 N TRP A 24 5.774 -16.599 2.242 1.00 0.43 N ATOM 377 CA TRP A 24 6.629 -15.664 2.968 1.00 0.41 C ATOM 378 C TRP A 24 7.325 -16.367 4.126 1.00 0.47 C ATOM 379 O TRP A 24 8.524 -16.194 4.341 1.00 0.53 O ATOM 380 CB TRP A 24 5.804 -14.475 3.485 1.00 0.44 C ATOM 381 CG TRP A 24 6.577 -13.527 4.360 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.512 -13.434 5.725 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.526 -12.536 3.939 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.361 -12.454 6.172 1.00 0.57 N ATOM 385 CE2 TRP A 24 7.994 -11.887 5.097 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.028 -12.135 2.697 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.936 -10.861 5.050 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.963 -11.117 2.651 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.409 -10.490 3.820 1.00 0.48 C ATOM 0 H TRP A 24 4.776 -16.402 2.318 1.00 0.43 H new ATOM 0 HA TRP A 24 7.389 -15.289 2.283 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.407 -13.924 2.633 1.00 0.44 H new ATOM 0 HB3 TRP A 24 4.950 -14.855 4.045 1.00 0.44 H new ATOM 0 HD1 TRP A 24 5.884 -14.044 6.357 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.499 -12.190 7.147 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.691 -12.612 1.789 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.280 -10.376 5.951 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.356 -10.800 1.696 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.140 -9.698 3.750 1.00 0.48 H new ATOM 400 N SER A 25 6.577 -17.194 4.841 1.00 0.54 N ATOM 401 CA SER A 25 7.108 -17.906 5.995 1.00 0.63 C ATOM 402 C SER A 25 8.101 -18.995 5.578 1.00 0.63 C ATOM 403 O SER A 25 8.791 -19.575 6.418 1.00 0.75 O ATOM 404 CB SER A 25 5.951 -18.503 6.797 1.00 0.75 C ATOM 405 OG SER A 25 4.967 -19.050 5.931 1.00 1.20 O ATOM 0 H SER A 25 5.596 -17.389 4.642 1.00 0.54 H new ATOM 0 HA SER A 25 7.654 -17.199 6.619 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.327 -19.279 7.464 1.00 0.75 H new ATOM 0 HB3 SER A 25 5.502 -17.733 7.425 1.00 0.75 H new ATOM 0 HG SER A 25 4.236 -19.428 6.464 1.00 1.20 H new ATOM 411 N GLN A 26 8.183 -19.260 4.279 1.00 0.61 N ATOM 412 CA GLN A 26 9.081 -20.281 3.766 1.00 0.73 C ATOM 413 C GLN A 26 10.419 -19.673 3.337 1.00 0.79 C ATOM 414 O GLN A 26 11.435 -20.365 3.291 1.00 0.93 O ATOM 415 CB GLN A 26 8.421 -21.014 2.586 1.00 0.80 C ATOM 416 CG GLN A 26 9.191 -22.236 2.082 1.00 1.25 C ATOM 417 CD GLN A 26 9.115 -23.435 3.021 1.00 1.53 C ATOM 418 OE1 GLN A 26 9.167 -24.581 2.577 1.00 1.91 O ATOM 419 NE2 GLN A 26 8.988 -23.189 4.318 1.00 2.26 N ATOM 0 H GLN A 26 7.637 -18.780 3.564 1.00 0.61 H new ATOM 0 HA GLN A 26 9.280 -20.997 4.564 1.00 0.73 H new ATOM 0 HB2 GLN A 26 7.421 -21.329 2.885 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.300 -20.312 1.761 1.00 0.80 H new ATOM 0 HG2 GLN A 26 8.800 -22.524 1.106 1.00 1.25 H new ATOM 0 HG3 GLN A 26 10.236 -21.963 1.939 1.00 1.25 H new ATOM 0 HE21 GLN A 26 8.948 -22.226 4.653 1.00 2.26 H new ATOM 0 HE22 GLN A 26 8.930 -23.962 4.981 1.00 2.26 H new ATOM 644 N GLU A 42 -4.830 0.487 13.433 1.00 1.02 N ATOM 645 CA GLU A 42 -4.596 1.448 12.369 1.00 0.87 C ATOM 646 C GLU A 42 -3.763 0.832 11.258 1.00 0.73 C ATOM 647 O GLU A 42 -3.853 1.251 10.109 1.00 0.63 O ATOM 648 CB GLU A 42 -3.902 2.699 12.912 1.00 1.05 C ATOM 649 CG GLU A 42 -4.819 3.620 13.706 1.00 1.53 C ATOM 650 CD GLU A 42 -5.423 2.954 14.924 1.00 2.12 C ATOM 651 OE1 GLU A 42 -4.698 2.759 15.920 1.00 2.82 O ATOM 652 OE2 GLU A 42 -6.627 2.628 14.889 1.00 2.42 O ATOM 0 HA GLU A 42 -5.564 1.735 11.959 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -3.071 2.394 13.548 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -3.477 3.257 12.078 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -4.256 4.498 14.022 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -5.621 3.972 13.057 1.00 1.53 H new ATOM 659 N SER A 43 -2.962 -0.172 11.601 1.00 0.79 N ATOM 660 CA SER A 43 -2.161 -0.882 10.609 1.00 0.75 C ATOM 661 C SER A 43 -3.069 -1.532 9.571 1.00 0.67 C ATOM 662 O SER A 43 -2.807 -1.454 8.373 1.00 0.62 O ATOM 663 CB SER A 43 -1.288 -1.942 11.279 1.00 0.94 C ATOM 664 OG SER A 43 -0.600 -1.402 12.395 1.00 1.14 O ATOM 0 H SER A 43 -2.850 -0.512 12.556 1.00 0.79 H new ATOM 0 HA SER A 43 -1.510 -0.162 10.112 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.908 -2.779 11.600 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.570 -2.335 10.559 1.00 0.94 H new ATOM 0 HG SER A 43 -0.049 -2.099 12.808 1.00 1.14 H new ATOM 670 N GLU A 44 -4.148 -2.149 10.039 1.00 0.72 N ATOM 671 CA GLU A 44 -5.139 -2.750 9.150 1.00 0.73 C ATOM 672 C GLU A 44 -5.855 -1.682 8.334 1.00 0.61 C ATOM 673 O GLU A 44 -6.368 -1.956 7.248 1.00 0.66 O ATOM 674 CB GLU A 44 -6.153 -3.565 9.956 1.00 0.85 C ATOM 675 CG GLU A 44 -5.684 -4.974 10.269 1.00 1.32 C ATOM 676 CD GLU A 44 -5.652 -5.849 9.034 1.00 1.96 C ATOM 677 OE1 GLU A 44 -4.652 -5.806 8.290 1.00 2.98 O ATOM 678 OE2 GLU A 44 -6.635 -6.581 8.796 1.00 1.90 O ATOM 0 H GLU A 44 -4.360 -2.247 11.032 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.618 -3.416 8.462 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.365 -3.045 10.890 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -7.089 -3.617 9.401 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.689 -4.935 10.711 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -6.346 -5.420 11.012 1.00 1.32 H new ATOM 685 N ALA A 45 -5.862 -0.463 8.854 1.00 0.53 N ATOM 686 CA ALA A 45 -6.511 0.650 8.188 1.00 0.45 C ATOM 687 C ALA A 45 -5.677 1.123 7.006 1.00 0.39 C ATOM 688 O ALA A 45 -6.177 1.229 5.891 1.00 0.39 O ATOM 689 CB ALA A 45 -6.746 1.784 9.168 1.00 0.48 C ATOM 0 H ALA A 45 -5.421 -0.222 9.742 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.477 0.316 7.810 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.234 2.613 8.655 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.382 1.436 9.982 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.791 2.119 9.572 1.00 0.48 H new ATOM 695 N VAL A 46 -4.402 1.401 7.249 1.00 0.36 N ATOM 696 CA VAL A 46 -3.496 1.797 6.179 1.00 0.32 C ATOM 697 C VAL A 46 -3.283 0.646 5.202 1.00 0.34 C ATOM 698 O VAL A 46 -3.217 0.849 3.992 1.00 0.35 O ATOM 699 CB VAL A 46 -2.143 2.315 6.722 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.770 1.625 8.017 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.047 2.126 5.692 1.00 0.34 C ATOM 0 H VAL A 46 -3.974 1.360 8.174 1.00 0.36 H new ATOM 0 HA VAL A 46 -3.965 2.625 5.647 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.253 3.380 6.926 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.815 2.011 8.373 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.539 1.815 8.765 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.687 0.552 7.847 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.103 2.496 6.093 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.950 1.067 5.455 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.299 2.679 4.787 1.00 0.34 H new ATOM 711 N LYS A 47 -3.191 -0.562 5.736 1.00 0.41 N ATOM 712 CA LYS A 47 -3.157 -1.765 4.912 1.00 0.50 C ATOM 713 C LYS A 47 -4.355 -1.782 3.960 1.00 0.51 C ATOM 714 O LYS A 47 -4.227 -2.120 2.783 1.00 0.59 O ATOM 715 CB LYS A 47 -3.178 -3.005 5.811 1.00 0.63 C ATOM 716 CG LYS A 47 -3.331 -4.316 5.063 1.00 0.84 C ATOM 717 CD LYS A 47 -2.081 -4.691 4.291 1.00 1.45 C ATOM 718 CE LYS A 47 -2.298 -5.984 3.523 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.771 -7.080 4.411 1.00 2.14 N ATOM 0 H LYS A 47 -3.138 -0.738 6.739 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.241 -1.770 4.320 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.255 -3.036 6.389 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.997 -2.909 6.524 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.569 -5.110 5.771 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -4.172 -4.242 4.373 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.819 -3.890 3.600 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -1.243 -4.806 4.978 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -3.027 -5.818 2.730 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -1.366 -6.282 3.042 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -2.843 -7.962 3.865 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.096 -7.210 5.192 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -3.705 -6.835 4.797 1.00 2.14 H new ATOM 733 N GLN A 48 -5.512 -1.390 4.483 1.00 0.47 N ATOM 734 CA GLN A 48 -6.730 -1.287 3.688 1.00 0.52 C ATOM 735 C GLN A 48 -6.611 -0.140 2.694 1.00 0.48 C ATOM 736 O GLN A 48 -7.006 -0.264 1.532 1.00 0.54 O ATOM 737 CB GLN A 48 -7.933 -1.056 4.609 1.00 0.55 C ATOM 738 CG GLN A 48 -9.230 -0.753 3.879 1.00 0.85 C ATOM 739 CD GLN A 48 -10.353 -0.390 4.830 1.00 1.50 C ATOM 740 OE1 GLN A 48 -10.115 0.138 5.916 1.00 2.23 O ATOM 741 NE2 GLN A 48 -11.583 -0.660 4.429 1.00 2.02 N ATOM 0 H GLN A 48 -5.632 -1.136 5.464 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.873 -2.217 3.138 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -8.077 -1.941 5.229 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.707 -0.229 5.282 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.068 0.068 3.181 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.523 -1.621 3.288 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -11.739 -1.098 3.521 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -12.376 -0.430 5.027 1.00 2.02 H new ATOM 750 N ALA A 49 -6.053 0.966 3.170 1.00 0.42 N ATOM 751 CA ALA A 49 -5.861 2.156 2.362 1.00 0.40 C ATOM 752 C ALA A 49 -5.016 1.851 1.136 1.00 0.39 C ATOM 753 O ALA A 49 -5.414 2.141 0.011 1.00 0.42 O ATOM 754 CB ALA A 49 -5.209 3.243 3.197 1.00 0.36 C ATOM 0 H ALA A 49 -5.721 1.060 4.130 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.835 2.504 2.019 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.067 4.135 2.586 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.849 3.483 4.046 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.242 2.893 3.559 1.00 0.36 H new ATOM 760 N LEU A 50 -3.856 1.243 1.362 1.00 0.38 N ATOM 761 CA LEU A 50 -2.941 0.906 0.274 1.00 0.39 C ATOM 762 C LEU A 50 -3.551 -0.133 -0.656 1.00 0.46 C ATOM 763 O LEU A 50 -3.270 -0.146 -1.851 1.00 0.49 O ATOM 764 CB LEU A 50 -1.598 0.392 0.809 1.00 0.39 C ATOM 765 CG LEU A 50 -0.550 1.465 1.125 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.258 2.308 -0.106 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.996 2.347 2.278 1.00 0.29 C ATOM 0 H LEU A 50 -3.526 0.973 2.289 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.764 1.823 -0.288 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.786 -0.183 1.716 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.176 -0.296 0.076 1.00 0.39 H new ATOM 0 HG LEU A 50 0.367 0.957 1.425 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.488 3.064 0.139 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.121 1.669 -0.903 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.174 2.797 -0.438 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.232 3.098 2.478 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.931 2.842 2.017 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.145 1.735 3.168 1.00 0.29 H new ATOM 779 N ARG A 51 -4.395 -0.992 -0.105 1.00 0.52 N ATOM 780 CA ARG A 51 -5.033 -2.036 -0.892 1.00 0.61 C ATOM 781 C ARG A 51 -6.017 -1.431 -1.888 1.00 0.62 C ATOM 782 O ARG A 51 -6.038 -1.807 -3.062 1.00 0.69 O ATOM 783 CB ARG A 51 -5.742 -3.035 0.021 1.00 0.67 C ATOM 784 CG ARG A 51 -6.281 -4.245 -0.715 1.00 0.98 C ATOM 785 CD ARG A 51 -6.925 -5.234 0.237 1.00 1.49 C ATOM 786 NE ARG A 51 -7.405 -6.420 -0.461 1.00 2.00 N ATOM 787 CZ ARG A 51 -8.277 -7.283 0.053 1.00 2.89 C ATOM 788 NH1 ARG A 51 -8.769 -7.090 1.272 1.00 3.39 N ATOM 789 NH2 ARG A 51 -8.649 -8.341 -0.654 1.00 3.74 N ATOM 0 H ARG A 51 -4.654 -0.987 0.882 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.261 -2.566 -1.451 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -5.047 -3.368 0.792 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.565 -2.532 0.529 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -7.012 -3.925 -1.457 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -5.471 -4.734 -1.256 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -6.204 -5.528 1.000 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -7.757 -4.754 0.753 1.00 1.49 H new ATOM 0 HE ARG A 51 -7.051 -6.599 -1.401 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -8.478 -6.278 1.817 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -9.438 -7.754 1.663 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -8.267 -8.490 -1.588 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -9.317 -9.006 -0.264 1.00 3.74 H new ATOM 803 N GLU A 52 -6.820 -0.479 -1.422 1.00 0.59 N ATOM 804 CA GLU A 52 -7.764 0.205 -2.299 1.00 0.62 C ATOM 805 C GLU A 52 -7.023 1.158 -3.228 1.00 0.59 C ATOM 806 O GLU A 52 -7.370 1.305 -4.402 1.00 0.65 O ATOM 807 CB GLU A 52 -8.808 0.981 -1.490 1.00 0.66 C ATOM 808 CG GLU A 52 -9.690 0.108 -0.611 1.00 0.92 C ATOM 809 CD GLU A 52 -10.354 -1.012 -1.381 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.214 -0.723 -2.240 1.00 1.45 O ATOM 811 OE2 GLU A 52 -10.015 -2.188 -1.128 1.00 1.88 O ATOM 0 H GLU A 52 -6.836 -0.166 -0.451 1.00 0.59 H new ATOM 0 HA GLU A 52 -8.279 -0.551 -2.891 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.296 1.710 -0.862 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.441 1.542 -2.178 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -9.089 -0.316 0.193 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -10.456 0.727 -0.144 1.00 0.92 H new ATOM 818 N ALA A 53 -5.993 1.797 -2.692 1.00 0.52 N ATOM 819 CA ALA A 53 -5.189 2.738 -3.450 1.00 0.49 C ATOM 820 C ALA A 53 -4.461 2.043 -4.590 1.00 0.52 C ATOM 821 O ALA A 53 -4.401 2.560 -5.706 1.00 0.53 O ATOM 822 CB ALA A 53 -4.194 3.418 -2.528 1.00 0.43 C ATOM 0 H ALA A 53 -5.694 1.677 -1.724 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.851 3.488 -3.884 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.592 4.124 -3.100 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.731 3.951 -1.743 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.544 2.668 -2.078 1.00 0.43 H new ATOM 828 N GLY A 54 -3.919 0.865 -4.301 1.00 0.57 N ATOM 829 CA GLY A 54 -3.184 0.105 -5.296 1.00 0.64 C ATOM 830 C GLY A 54 -4.035 -0.271 -6.491 1.00 0.74 C ATOM 831 O GLY A 54 -3.520 -0.480 -7.586 1.00 0.82 O ATOM 0 H GLY A 54 -3.977 0.419 -3.386 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -2.328 0.689 -5.634 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.790 -0.801 -4.836 1.00 0.64 H new ATOM 835 N ASP A 55 -5.340 -0.347 -6.285 1.00 0.79 N ATOM 836 CA ASP A 55 -6.256 -0.687 -7.366 1.00 0.92 C ATOM 837 C ASP A 55 -6.521 0.541 -8.227 1.00 0.88 C ATOM 838 O ASP A 55 -6.562 0.457 -9.453 1.00 0.97 O ATOM 839 CB ASP A 55 -7.571 -1.238 -6.810 1.00 1.04 C ATOM 840 CG ASP A 55 -8.497 -1.744 -7.899 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.214 -2.810 -8.485 1.00 1.34 O ATOM 842 OD2 ASP A 55 -9.502 -1.058 -8.191 1.00 1.29 O ATOM 0 H ASP A 55 -5.789 -0.179 -5.385 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.795 -1.461 -7.980 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -7.356 -2.050 -6.115 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -8.077 -0.457 -6.242 1.00 1.04 H new ATOM 847 N GLU A 56 -6.660 1.685 -7.568 1.00 0.79 N ATOM 848 CA GLU A 56 -6.939 2.943 -8.250 1.00 0.83 C ATOM 849 C GLU A 56 -5.698 3.452 -8.988 1.00 0.78 C ATOM 850 O GLU A 56 -5.763 3.786 -10.171 1.00 0.85 O ATOM 851 CB GLU A 56 -7.425 3.987 -7.233 1.00 0.83 C ATOM 852 CG GLU A 56 -7.758 5.345 -7.837 1.00 0.94 C ATOM 853 CD GLU A 56 -8.927 5.294 -8.794 1.00 1.27 C ATOM 854 OE1 GLU A 56 -10.062 5.059 -8.338 1.00 1.38 O ATOM 855 OE2 GLU A 56 -8.713 5.455 -10.015 1.00 2.06 O ATOM 0 H GLU A 56 -6.583 1.767 -6.554 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.722 2.773 -8.989 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -8.310 3.600 -6.728 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.657 4.120 -6.471 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.982 6.048 -7.035 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -6.883 5.728 -8.361 1.00 0.94 H new ATOM 862 N PHE A 57 -4.560 3.479 -8.296 1.00 0.72 N ATOM 863 CA PHE A 57 -3.339 4.045 -8.861 1.00 0.76 C ATOM 864 C PHE A 57 -2.856 3.213 -10.046 1.00 0.82 C ATOM 865 O PHE A 57 -2.466 3.755 -11.079 1.00 0.90 O ATOM 866 CB PHE A 57 -2.234 4.143 -7.797 1.00 0.77 C ATOM 867 CG PHE A 57 -1.040 4.948 -8.241 1.00 0.94 C ATOM 868 CD1 PHE A 57 0.011 4.350 -8.925 1.00 1.05 C ATOM 869 CD2 PHE A 57 -0.972 6.309 -7.981 1.00 1.07 C ATOM 870 CE1 PHE A 57 1.101 5.094 -9.337 1.00 1.25 C ATOM 871 CE2 PHE A 57 0.116 7.055 -8.391 1.00 1.26 C ATOM 872 CZ PHE A 57 1.153 6.448 -9.071 1.00 1.34 C ATOM 0 H PHE A 57 -4.459 3.117 -7.348 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.569 5.051 -9.212 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.649 4.591 -6.894 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.906 3.138 -7.532 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.024 3.292 -9.137 1.00 1.05 H new ATOM 0 HD2 PHE A 57 -1.780 6.792 -7.451 1.00 1.07 H new ATOM 0 HE1 PHE A 57 1.912 4.616 -9.867 1.00 1.25 H new ATOM 0 HE2 PHE A 57 0.155 8.113 -8.180 1.00 1.26 H new ATOM 0 HZ PHE A 57 2.003 7.031 -9.394 1.00 1.34 H new ATOM 882 N GLU A 58 -2.916 1.892 -9.906 1.00 0.83 N ATOM 883 CA GLU A 58 -2.406 0.989 -10.935 1.00 0.95 C ATOM 884 C GLU A 58 -3.345 0.949 -12.141 1.00 0.99 C ATOM 885 O GLU A 58 -2.964 0.507 -13.221 1.00 1.08 O ATOM 886 CB GLU A 58 -2.219 -0.424 -10.358 1.00 1.05 C ATOM 887 CG GLU A 58 -1.647 -1.432 -11.346 1.00 1.35 C ATOM 888 CD GLU A 58 -1.492 -2.811 -10.745 1.00 1.27 C ATOM 889 OE1 GLU A 58 -2.491 -3.559 -10.697 1.00 1.61 O ATOM 890 OE2 GLU A 58 -0.374 -3.156 -10.308 1.00 1.45 O ATOM 0 H GLU A 58 -3.312 1.423 -9.092 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.439 1.365 -11.269 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.559 -0.366 -9.492 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.182 -0.789 -10.001 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.299 -1.491 -12.218 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -0.676 -1.081 -11.697 1.00 1.35 H new ATOM 897 N LEU A 59 -4.571 1.408 -11.956 1.00 0.98 N ATOM 898 CA LEU A 59 -5.541 1.433 -13.039 1.00 1.10 C ATOM 899 C LEU A 59 -5.434 2.734 -13.830 1.00 1.10 C ATOM 900 O LEU A 59 -5.818 2.799 -14.999 1.00 1.24 O ATOM 901 CB LEU A 59 -6.953 1.272 -12.474 1.00 1.19 C ATOM 902 CG LEU A 59 -8.065 1.133 -13.514 1.00 1.36 C ATOM 903 CD1 LEU A 59 -7.838 -0.094 -14.382 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.418 1.060 -12.828 1.00 1.56 C ATOM 0 H LEU A 59 -4.919 1.768 -11.067 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.330 0.605 -13.715 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -6.970 0.393 -11.830 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.174 2.133 -11.844 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.049 2.012 -14.159 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -8.640 -0.174 -15.115 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -6.882 -0.003 -14.898 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -7.828 -0.986 -13.756 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.202 0.961 -13.579 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.442 0.197 -12.162 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.582 1.969 -12.250 1.00 1.56 H new ATOM 916 N ARG A 60 -4.905 3.764 -13.189 1.00 1.00 N ATOM 917 CA ARG A 60 -4.798 5.080 -13.813 1.00 1.06 C ATOM 918 C ARG A 60 -3.388 5.348 -14.328 1.00 1.00 C ATOM 919 O ARG A 60 -3.205 5.878 -15.424 1.00 1.07 O ATOM 920 CB ARG A 60 -5.208 6.185 -12.832 1.00 1.10 C ATOM 921 CG ARG A 60 -6.710 6.303 -12.616 1.00 1.19 C ATOM 922 CD ARG A 60 -7.445 6.550 -13.926 1.00 1.31 C ATOM 923 NE ARG A 60 -6.883 7.680 -14.670 1.00 1.81 N ATOM 924 CZ ARG A 60 -7.005 7.840 -15.988 1.00 2.26 C ATOM 925 NH1 ARG A 60 -7.592 6.905 -16.724 1.00 2.15 N ATOM 926 NH2 ARG A 60 -6.512 8.927 -16.572 1.00 3.21 N ATOM 0 H ARG A 60 -4.542 3.718 -12.237 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.479 5.086 -14.664 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.728 5.999 -11.871 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -4.829 7.139 -13.198 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.085 5.390 -12.154 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -6.916 7.119 -11.923 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -7.398 5.652 -14.542 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -8.498 6.741 -13.720 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.367 8.388 -14.148 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -7.952 6.059 -16.282 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -7.683 7.032 -17.732 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -6.041 9.638 -16.012 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -6.605 9.051 -17.580 1.00 3.21 H new ATOM 940 N TYR A 61 -2.394 4.977 -13.540 1.00 0.91 N ATOM 941 CA TYR A 61 -1.007 5.268 -13.870 1.00 0.90 C ATOM 942 C TYR A 61 -0.257 3.983 -14.192 1.00 0.84 C ATOM 943 O TYR A 61 0.928 3.858 -13.897 1.00 0.83 O ATOM 944 CB TYR A 61 -0.318 5.991 -12.701 1.00 0.96 C ATOM 945 CG TYR A 61 -0.961 7.309 -12.309 1.00 1.05 C ATOM 946 CD1 TYR A 61 -2.082 7.343 -11.486 1.00 1.04 C ATOM 947 CD2 TYR A 61 -0.441 8.519 -12.755 1.00 1.27 C ATOM 948 CE1 TYR A 61 -2.667 8.543 -11.121 1.00 1.14 C ATOM 949 CE2 TYR A 61 -1.020 9.722 -12.391 1.00 1.38 C ATOM 950 CZ TYR A 61 -2.131 9.727 -11.576 1.00 1.27 C ATOM 951 OH TYR A 61 -2.708 10.922 -11.212 1.00 1.41 O ATOM 0 H TYR A 61 -2.521 4.471 -12.663 1.00 0.91 H new ATOM 0 HA TYR A 61 -0.993 5.916 -14.746 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.314 5.331 -11.834 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.723 6.174 -12.967 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -2.503 6.416 -11.125 1.00 1.04 H new ATOM 0 HD2 TYR A 61 0.428 8.520 -13.396 1.00 1.27 H new ATOM 0 HE1 TYR A 61 -3.539 8.551 -10.483 1.00 1.14 H new ATOM 0 HE2 TYR A 61 -0.603 10.653 -12.744 1.00 1.38 H new ATOM 0 HH TYR A 61 -2.209 11.663 -11.616 1.00 1.41 H new ATOM 961 N ARG A 62 -0.945 3.036 -14.824 1.00 0.86 N ATOM 962 CA ARG A 62 -0.356 1.732 -15.123 1.00 0.85 C ATOM 963 C ARG A 62 0.824 1.872 -16.081 1.00 0.87 C ATOM 964 O ARG A 62 1.814 1.146 -15.975 1.00 0.85 O ATOM 965 CB ARG A 62 -1.408 0.791 -15.716 1.00 0.95 C ATOM 966 CG ARG A 62 -0.938 -0.648 -15.866 1.00 1.04 C ATOM 967 CD ARG A 62 -2.096 -1.579 -16.192 1.00 1.23 C ATOM 968 NE ARG A 62 -3.107 -1.585 -15.131 1.00 1.73 N ATOM 969 CZ ARG A 62 -4.290 -2.190 -15.224 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.649 -2.793 -16.353 1.00 2.24 N ATOM 971 NH2 ARG A 62 -5.123 -2.183 -14.190 1.00 3.02 N ATOM 0 H ARG A 62 -1.909 3.146 -15.139 1.00 0.86 H new ATOM 0 HA ARG A 62 0.010 1.306 -14.188 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.295 0.808 -15.082 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.708 1.168 -16.694 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.188 -0.707 -16.655 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.456 -0.973 -14.944 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -2.557 -1.271 -17.131 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -1.718 -2.591 -16.339 1.00 1.23 H new ATOM 0 HE ARG A 62 -2.890 -1.093 -14.264 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -4.017 -2.794 -17.154 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -5.556 -3.255 -16.418 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -4.857 -1.714 -13.324 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -6.029 -2.646 -14.262 1.00 3.02 H new ATOM 985 N ARG A 63 0.723 2.818 -17.003 1.00 0.94 N ATOM 986 CA ARG A 63 1.789 3.053 -17.968 1.00 1.01 C ATOM 987 C ARG A 63 3.009 3.663 -17.281 1.00 0.95 C ATOM 988 O ARG A 63 4.146 3.412 -17.676 1.00 0.99 O ATOM 989 CB ARG A 63 1.292 3.953 -19.103 1.00 1.16 C ATOM 990 CG ARG A 63 0.253 3.279 -19.990 1.00 1.70 C ATOM 991 CD ARG A 63 -0.252 4.206 -21.082 1.00 2.14 C ATOM 992 NE ARG A 63 -1.135 5.248 -20.564 1.00 2.71 N ATOM 993 CZ ARG A 63 -1.140 6.506 -21.001 1.00 3.58 C ATOM 994 NH1 ARG A 63 -0.252 6.900 -21.905 1.00 3.92 N ATOM 995 NH2 ARG A 63 -2.032 7.368 -20.530 1.00 4.52 N ATOM 0 H ARG A 63 -0.083 3.434 -17.104 1.00 0.94 H new ATOM 0 HA ARG A 63 2.087 2.097 -18.398 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.864 4.861 -18.678 1.00 1.16 H new ATOM 0 HB3 ARG A 63 2.141 4.258 -19.715 1.00 1.16 H new ATOM 0 HG2 ARG A 63 0.687 2.388 -20.443 1.00 1.70 H new ATOM 0 HG3 ARG A 63 -0.586 2.949 -19.378 1.00 1.70 H new ATOM 0 HD2 ARG A 63 0.598 4.670 -21.583 1.00 2.14 H new ATOM 0 HD3 ARG A 63 -0.785 3.622 -21.833 1.00 2.14 H new ATOM 0 HE ARG A 63 -1.788 4.997 -19.822 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.436 6.239 -22.266 1.00 3.92 H new ATOM 0 HH12 ARG A 63 -0.257 7.864 -22.239 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -2.714 7.067 -19.833 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -2.036 8.332 -20.864 1.00 4.52 H new ATOM 1009 N ALA A 64 2.763 4.442 -16.238 1.00 0.90 N ATOM 1010 CA ALA A 64 3.839 5.032 -15.458 1.00 0.89 C ATOM 1011 C ALA A 64 4.426 4.002 -14.501 1.00 0.75 C ATOM 1012 O ALA A 64 5.643 3.899 -14.349 1.00 0.73 O ATOM 1013 CB ALA A 64 3.333 6.242 -14.691 1.00 0.94 C ATOM 0 H ALA A 64 1.826 4.680 -15.912 1.00 0.90 H new ATOM 0 HA ALA A 64 4.625 5.358 -16.139 1.00 0.89 H new ATOM 0 HB1 ALA A 64 4.150 6.673 -14.112 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.954 6.985 -15.393 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.532 5.937 -14.018 1.00 0.94 H new ATOM 1019 N PHE A 65 3.544 3.236 -13.870 1.00 0.69 N ATOM 1020 CA PHE A 65 3.939 2.210 -12.910 1.00 0.61 C ATOM 1021 C PHE A 65 4.865 1.181 -13.552 1.00 0.59 C ATOM 1022 O PHE A 65 5.945 0.903 -13.033 1.00 0.59 O ATOM 1023 CB PHE A 65 2.699 1.513 -12.336 1.00 0.62 C ATOM 1024 CG PHE A 65 3.012 0.508 -11.262 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.318 0.926 -9.978 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.004 -0.849 -11.539 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.611 0.007 -8.989 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.296 -1.771 -10.554 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.600 -1.343 -9.278 1.00 0.66 C ATOM 0 H PHE A 65 2.536 3.308 -14.008 1.00 0.69 H new ATOM 0 HA PHE A 65 4.481 2.699 -12.101 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.025 2.267 -11.930 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.167 1.013 -13.145 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.328 1.981 -9.747 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.767 -1.189 -12.536 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.848 0.344 -7.991 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.287 -2.827 -10.782 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.829 -2.063 -8.506 1.00 0.66 H new ATOM 1039 N SER A 66 4.444 0.639 -14.692 1.00 0.64 N ATOM 1040 CA SER A 66 5.210 -0.391 -15.387 1.00 0.68 C ATOM 1041 C SER A 66 6.592 0.121 -15.792 1.00 0.66 C ATOM 1042 O SER A 66 7.570 -0.628 -15.798 1.00 0.68 O ATOM 1043 CB SER A 66 4.436 -0.877 -16.615 1.00 0.83 C ATOM 1044 OG SER A 66 3.958 0.216 -17.383 1.00 1.20 O ATOM 0 H SER A 66 3.573 0.898 -15.155 1.00 0.64 H new ATOM 0 HA SER A 66 5.356 -1.227 -14.703 1.00 0.68 H new ATOM 0 HB2 SER A 66 5.081 -1.504 -17.231 1.00 0.83 H new ATOM 0 HB3 SER A 66 3.597 -1.497 -16.298 1.00 0.83 H new ATOM 0 HG SER A 66 3.107 0.529 -17.012 1.00 1.20 H new ATOM 1050 N ASP A 67 6.671 1.404 -16.119 1.00 0.68 N ATOM 1051 CA ASP A 67 7.942 2.015 -16.485 1.00 0.73 C ATOM 1052 C ASP A 67 8.827 2.200 -15.253 1.00 0.65 C ATOM 1053 O ASP A 67 10.016 1.882 -15.279 1.00 0.66 O ATOM 1054 CB ASP A 67 7.717 3.359 -17.185 1.00 0.89 C ATOM 1055 CG ASP A 67 9.016 4.064 -17.515 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.712 3.621 -18.448 1.00 1.41 O ATOM 1057 OD2 ASP A 67 9.355 5.058 -16.835 1.00 2.06 O ATOM 0 H ASP A 67 5.874 2.040 -16.138 1.00 0.68 H new ATOM 0 HA ASP A 67 8.451 1.346 -17.179 1.00 0.73 H new ATOM 0 HB2 ASP A 67 7.152 3.197 -18.103 1.00 0.89 H new ATOM 0 HB3 ASP A 67 7.111 4.001 -16.546 1.00 0.89 H new ATOM 1062 N LEU A 68 8.233 2.684 -14.165 1.00 0.63 N ATOM 1063 CA LEU A 68 8.973 2.917 -12.931 1.00 0.66 C ATOM 1064 C LEU A 68 9.470 1.605 -12.324 1.00 0.57 C ATOM 1065 O LEU A 68 10.576 1.549 -11.784 1.00 0.63 O ATOM 1066 CB LEU A 68 8.113 3.686 -11.918 1.00 0.75 C ATOM 1067 CG LEU A 68 7.788 5.136 -12.301 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.949 5.803 -11.222 1.00 1.64 C ATOM 1069 CD2 LEU A 68 9.065 5.928 -12.540 1.00 1.07 C ATOM 0 H LEU A 68 7.242 2.922 -14.114 1.00 0.63 H new ATOM 0 HA LEU A 68 9.844 3.524 -13.178 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.177 3.146 -11.777 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.627 3.688 -10.957 1.00 0.75 H new ATOM 0 HG LEU A 68 7.212 5.120 -13.226 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.730 6.830 -11.514 1.00 1.64 H new ATOM 0 HD12 LEU A 68 6.015 5.255 -11.096 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.499 5.803 -10.281 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.812 6.953 -12.810 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.667 5.930 -11.631 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.632 5.469 -13.350 1.00 1.07 H new ATOM 1081 N THR A 69 8.672 0.544 -12.425 1.00 0.49 N ATOM 1082 CA THR A 69 9.084 -0.760 -11.915 1.00 0.49 C ATOM 1083 C THR A 69 10.216 -1.345 -12.750 1.00 0.46 C ATOM 1084 O THR A 69 10.995 -2.165 -12.266 1.00 0.51 O ATOM 1085 CB THR A 69 7.913 -1.761 -11.864 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.193 -1.749 -13.102 1.00 0.71 O ATOM 1087 CG2 THR A 69 6.971 -1.441 -10.719 1.00 0.63 C ATOM 0 H THR A 69 7.745 0.561 -12.851 1.00 0.49 H new ATOM 0 HA THR A 69 9.436 -0.595 -10.897 1.00 0.49 H new ATOM 0 HB THR A 69 8.330 -2.755 -11.701 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.610 -0.962 -13.134 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.154 -2.163 -10.707 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.515 -1.492 -9.776 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.566 -0.438 -10.851 1.00 0.63 H new ATOM 1095 N SER A 70 10.320 -0.907 -13.998 1.00 0.46 N ATOM 1096 CA SER A 70 11.393 -1.363 -14.870 1.00 0.49 C ATOM 1097 C SER A 70 12.708 -0.677 -14.500 1.00 0.48 C ATOM 1098 O SER A 70 13.787 -1.255 -14.644 1.00 0.53 O ATOM 1099 CB SER A 70 11.038 -1.108 -16.338 1.00 0.57 C ATOM 1100 OG SER A 70 9.831 -1.769 -16.689 1.00 1.31 O ATOM 0 H SER A 70 9.678 -0.240 -14.427 1.00 0.46 H new ATOM 0 HA SER A 70 11.519 -2.437 -14.734 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.934 -0.037 -16.511 1.00 0.57 H new ATOM 0 HB3 SER A 70 11.848 -1.457 -16.978 1.00 0.57 H new ATOM 0 HG SER A 70 9.070 -1.287 -16.304 1.00 1.31 H new ATOM 1106 N GLN A 71 12.611 0.551 -14.002 1.00 0.49 N ATOM 1107 CA GLN A 71 13.783 1.282 -13.537 1.00 0.53 C ATOM 1108 C GLN A 71 14.172 0.820 -12.135 1.00 0.46 C ATOM 1109 O GLN A 71 15.350 0.780 -11.779 1.00 0.53 O ATOM 1110 CB GLN A 71 13.511 2.790 -13.536 1.00 0.63 C ATOM 1111 CG GLN A 71 14.673 3.617 -13.006 1.00 0.69 C ATOM 1112 CD GLN A 71 14.345 5.095 -12.889 1.00 0.83 C ATOM 1113 OE1 GLN A 71 15.221 5.949 -13.020 1.00 1.22 O ATOM 1114 NE2 GLN A 71 13.085 5.409 -12.634 1.00 0.82 N ATOM 0 H GLN A 71 11.732 1.061 -13.910 1.00 0.49 H new ATOM 0 HA GLN A 71 14.609 1.078 -14.219 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.282 3.110 -14.552 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.627 2.991 -12.931 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.966 3.237 -12.027 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.531 3.492 -13.666 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.387 4.673 -12.532 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.812 6.387 -12.540 1.00 0.82 H new ATOM 1123 N LEU A 72 13.171 0.453 -11.348 1.00 0.39 N ATOM 1124 CA LEU A 72 13.398 0.012 -9.977 1.00 0.33 C ATOM 1125 C LEU A 72 13.649 -1.494 -9.934 1.00 0.34 C ATOM 1126 O LEU A 72 13.786 -2.075 -8.857 1.00 0.37 O ATOM 1127 CB LEU A 72 12.201 0.387 -9.091 1.00 0.37 C ATOM 1128 CG LEU A 72 12.402 0.167 -7.589 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.625 0.920 -7.095 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.166 0.602 -6.821 1.00 0.92 C ATOM 0 H LEU A 72 12.192 0.451 -11.635 1.00 0.39 H new ATOM 0 HA LEU A 72 14.284 0.517 -9.592 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.961 1.437 -9.258 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.336 -0.193 -9.413 1.00 0.37 H new ATOM 0 HG LEU A 72 12.563 -0.897 -7.417 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.749 0.750 -6.026 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.509 0.565 -7.624 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.495 1.986 -7.280 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.324 0.439 -5.755 1.00 0.92 H new ATOM 0 HD22 LEU A 72 10.978 1.660 -7.003 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.307 0.019 -7.153 1.00 0.92 H new ATOM 1142 N HIS A 73 13.723 -2.105 -11.117 1.00 0.41 N ATOM 1143 CA HIS A 73 14.001 -3.537 -11.256 1.00 0.46 C ATOM 1144 C HIS A 73 15.153 -3.957 -10.346 1.00 0.41 C ATOM 1145 O HIS A 73 16.249 -3.393 -10.422 1.00 0.45 O ATOM 1146 CB HIS A 73 14.353 -3.850 -12.716 1.00 0.60 C ATOM 1147 CG HIS A 73 14.739 -5.278 -12.961 1.00 1.34 C ATOM 1148 ND1 HIS A 73 16.044 -5.717 -12.938 1.00 2.07 N ATOM 1149 CD2 HIS A 73 13.987 -6.363 -13.257 1.00 2.33 C ATOM 1150 CE1 HIS A 73 16.077 -7.004 -13.208 1.00 2.86 C ATOM 1151 NE2 HIS A 73 14.843 -7.426 -13.410 1.00 3.01 N ATOM 0 H HIS A 73 13.592 -1.622 -12.006 1.00 0.41 H new ATOM 0 HA HIS A 73 13.111 -4.095 -10.964 1.00 0.46 H new ATOM 0 HB2 HIS A 73 13.498 -3.603 -13.345 1.00 0.60 H new ATOM 0 HB3 HIS A 73 15.175 -3.205 -13.027 1.00 0.60 H new ATOM 0 HD2 HIS A 73 12.912 -6.389 -13.355 1.00 2.33 H new ATOM 0 HE1 HIS A 73 16.967 -7.614 -13.256 1.00 2.86 H new ATOM 0 HE2 HIS A 73 14.571 -8.381 -13.641 1.00 3.01 H new ATOM 1160 N ILE A 74 14.914 -4.942 -9.491 1.00 0.37 N ATOM 1161 CA ILE A 74 15.922 -5.351 -8.539 1.00 0.36 C ATOM 1162 C ILE A 74 16.837 -6.413 -9.157 1.00 0.45 C ATOM 1163 O ILE A 74 16.507 -7.596 -9.243 1.00 0.61 O ATOM 1164 CB ILE A 74 15.285 -5.841 -7.211 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.369 -6.206 -6.198 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.341 -7.015 -7.436 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.829 -6.472 -4.813 1.00 0.34 C ATOM 0 H ILE A 74 14.039 -5.464 -9.441 1.00 0.37 H new ATOM 0 HA ILE A 74 16.533 -4.483 -8.292 1.00 0.36 H new ATOM 0 HB ILE A 74 14.693 -5.019 -6.808 1.00 0.31 H new ATOM 0 HG12 ILE A 74 16.901 -7.090 -6.549 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.096 -5.396 -6.147 1.00 0.31 H new ATOM 0 HG21 ILE A 74 13.916 -7.328 -6.482 1.00 0.35 H new ATOM 0 HG22 ILE A 74 13.539 -6.713 -8.109 1.00 0.35 H new ATOM 0 HG23 ILE A 74 14.892 -7.845 -7.878 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.652 -6.725 -4.144 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.322 -5.581 -4.443 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.123 -7.302 -4.851 1.00 0.34 H new ATOM 1179 N THR A 75 17.976 -5.954 -9.641 1.00 0.61 N ATOM 1180 CA THR A 75 18.968 -6.825 -10.233 1.00 0.73 C ATOM 1181 C THR A 75 19.887 -7.366 -9.137 1.00 0.58 C ATOM 1182 O THR A 75 20.192 -6.643 -8.189 1.00 0.57 O ATOM 1183 CB THR A 75 19.782 -6.037 -11.280 1.00 1.02 C ATOM 1184 OG1 THR A 75 18.886 -5.247 -12.079 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.581 -6.962 -12.186 1.00 1.56 C ATOM 0 H THR A 75 18.237 -4.968 -9.634 1.00 0.61 H new ATOM 0 HA THR A 75 18.478 -7.664 -10.727 1.00 0.73 H new ATOM 0 HB THR A 75 20.486 -5.397 -10.748 1.00 1.02 H new ATOM 0 HG1 THR A 75 17.998 -5.661 -12.081 1.00 1.38 H new ATOM 0 HG21 THR A 75 21.140 -6.369 -12.909 1.00 1.56 H new ATOM 0 HG22 THR A 75 21.275 -7.550 -11.585 1.00 1.56 H new ATOM 0 HG23 THR A 75 19.901 -7.631 -12.714 1.00 1.56 H new ATOM 1193 N PRO A 76 20.298 -8.646 -9.222 1.00 0.66 N ATOM 1194 CA PRO A 76 21.195 -9.265 -8.237 1.00 0.73 C ATOM 1195 C PRO A 76 22.348 -8.350 -7.823 1.00 0.72 C ATOM 1196 O PRO A 76 23.249 -8.071 -8.615 1.00 0.81 O ATOM 1197 CB PRO A 76 21.723 -10.490 -8.981 1.00 0.93 C ATOM 1198 CG PRO A 76 20.616 -10.878 -9.900 1.00 1.06 C ATOM 1199 CD PRO A 76 19.900 -9.604 -10.273 1.00 0.90 C ATOM 0 HA PRO A 76 20.680 -9.494 -7.304 1.00 0.73 H new ATOM 0 HB2 PRO A 76 22.633 -10.256 -9.533 1.00 0.93 H new ATOM 0 HB3 PRO A 76 21.967 -11.298 -8.291 1.00 0.93 H new ATOM 0 HG2 PRO A 76 21.006 -11.377 -10.787 1.00 1.06 H new ATOM 0 HG3 PRO A 76 19.935 -11.577 -9.414 1.00 1.06 H new ATOM 0 HD2 PRO A 76 20.196 -9.256 -11.263 1.00 0.90 H new ATOM 0 HD3 PRO A 76 18.819 -9.746 -10.295 1.00 0.90 H new ATOM 1207 N GLY A 77 22.290 -7.858 -6.590 1.00 0.86 N ATOM 1208 CA GLY A 77 23.340 -6.995 -6.082 1.00 1.10 C ATOM 1209 C GLY A 77 22.855 -5.587 -5.780 1.00 1.00 C ATOM 1210 O GLY A 77 23.576 -4.801 -5.162 1.00 1.32 O ATOM 0 H GLY A 77 21.533 -8.042 -5.932 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.756 -7.433 -5.175 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.148 -6.947 -6.812 1.00 1.10 H new ATOM 1214 N THR A 78 21.642 -5.268 -6.222 1.00 0.85 N ATOM 1215 CA THR A 78 21.036 -3.960 -5.964 1.00 0.82 C ATOM 1216 C THR A 78 20.948 -3.685 -4.462 1.00 0.85 C ATOM 1217 O THR A 78 20.431 -4.506 -3.704 1.00 1.52 O ATOM 1218 CB THR A 78 19.622 -3.882 -6.582 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.699 -4.105 -7.996 1.00 1.52 O ATOM 1220 CG2 THR A 78 18.972 -2.532 -6.319 1.00 1.15 C ATOM 0 H THR A 78 21.054 -5.900 -6.765 1.00 0.85 H new ATOM 0 HA THR A 78 21.672 -3.205 -6.426 1.00 0.82 H new ATOM 0 HB THR A 78 19.009 -4.653 -6.114 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.919 -5.045 -8.168 1.00 1.52 H new ATOM 0 HG21 THR A 78 17.979 -2.513 -6.768 1.00 1.15 H new ATOM 0 HG22 THR A 78 18.888 -2.372 -5.244 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.583 -1.743 -6.756 1.00 1.15 H new ATOM 1228 N ALA A 79 21.488 -2.548 -4.038 1.00 0.68 N ATOM 1229 CA ALA A 79 21.483 -2.170 -2.630 1.00 0.73 C ATOM 1230 C ALA A 79 20.467 -1.060 -2.366 1.00 0.62 C ATOM 1231 O ALA A 79 19.749 -0.637 -3.276 1.00 0.56 O ATOM 1232 CB ALA A 79 22.872 -1.728 -2.204 1.00 0.85 C ATOM 0 H ALA A 79 21.937 -1.869 -4.653 1.00 0.68 H new ATOM 0 HA ALA A 79 21.193 -3.040 -2.042 1.00 0.73 H new ATOM 0 HB1 ALA A 79 22.858 -1.448 -1.151 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.576 -2.547 -2.352 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.181 -0.871 -2.803 1.00 0.85 H new ATOM 1238 N TYR A 80 20.414 -0.579 -1.124 1.00 0.63 N ATOM 1239 CA TYR A 80 19.467 0.471 -0.756 1.00 0.58 C ATOM 1240 C TYR A 80 19.797 1.774 -1.468 1.00 0.50 C ATOM 1241 O TYR A 80 18.901 2.535 -1.814 1.00 0.46 O ATOM 1242 CB TYR A 80 19.429 0.700 0.762 1.00 0.67 C ATOM 1243 CG TYR A 80 18.506 1.832 1.174 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.138 1.756 0.950 1.00 0.89 C ATOM 1245 CD2 TYR A 80 19.004 2.971 1.798 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.295 2.781 1.332 1.00 1.24 C ATOM 1247 CE2 TYR A 80 18.165 3.999 2.188 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.816 3.918 1.908 1.00 1.58 C ATOM 1249 OH TYR A 80 15.967 4.911 2.344 1.00 2.03 O ATOM 0 H TYR A 80 21.012 -0.898 -0.361 1.00 0.63 H new ATOM 0 HA TYR A 80 18.480 0.134 -1.072 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.108 -0.219 1.253 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.437 0.915 1.116 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.726 0.881 0.469 1.00 0.89 H new ATOM 0 HD2 TYR A 80 20.065 3.054 1.981 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.230 2.691 1.179 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.562 4.858 2.708 1.00 1.55 H new ATOM 0 HH TYR A 80 16.325 5.785 2.083 1.00 2.03 H new ATOM 1259 N GLN A 81 21.081 2.029 -1.690 1.00 0.56 N ATOM 1260 CA GLN A 81 21.501 3.221 -2.416 1.00 0.59 C ATOM 1261 C GLN A 81 20.831 3.264 -3.787 1.00 0.54 C ATOM 1262 O GLN A 81 20.307 4.298 -4.200 1.00 0.63 O ATOM 1263 CB GLN A 81 23.027 3.256 -2.560 1.00 0.72 C ATOM 1264 CG GLN A 81 23.556 4.416 -3.402 1.00 0.84 C ATOM 1265 CD GLN A 81 23.401 5.789 -2.753 1.00 1.40 C ATOM 1266 OE1 GLN A 81 24.211 6.683 -2.992 1.00 2.01 O ATOM 1267 NE2 GLN A 81 22.375 5.975 -1.934 1.00 2.18 N ATOM 0 H GLN A 81 21.846 1.430 -1.379 1.00 0.56 H new ATOM 0 HA GLN A 81 21.193 4.100 -1.850 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.472 3.312 -1.567 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.359 2.318 -3.006 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.612 4.244 -3.612 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.036 4.420 -4.360 1.00 0.84 H new ATOM 0 HE21 GLN A 81 21.720 5.214 -1.756 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.241 6.880 -1.482 1.00 2.18 H new ATOM 1276 N SER A 82 20.819 2.125 -4.464 1.00 0.48 N ATOM 1277 CA SER A 82 20.190 2.010 -5.766 1.00 0.47 C ATOM 1278 C SER A 82 18.679 2.201 -5.643 1.00 0.40 C ATOM 1279 O SER A 82 18.070 2.951 -6.407 1.00 0.42 O ATOM 1280 CB SER A 82 20.503 0.636 -6.357 1.00 0.55 C ATOM 1281 OG SER A 82 21.860 0.289 -6.127 1.00 1.17 O ATOM 0 H SER A 82 21.243 1.261 -4.126 1.00 0.48 H new ATOM 0 HA SER A 82 20.581 2.785 -6.425 1.00 0.47 H new ATOM 0 HB2 SER A 82 19.850 -0.114 -5.912 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.300 0.640 -7.428 1.00 0.55 H new ATOM 0 HG SER A 82 22.041 -0.594 -6.511 1.00 1.17 H new ATOM 1287 N PHE A 83 18.096 1.536 -4.653 1.00 0.36 N ATOM 1288 CA PHE A 83 16.660 1.601 -4.407 1.00 0.33 C ATOM 1289 C PHE A 83 16.225 3.031 -4.079 1.00 0.31 C ATOM 1290 O PHE A 83 15.210 3.514 -4.586 1.00 0.32 O ATOM 1291 CB PHE A 83 16.294 0.644 -3.256 1.00 0.35 C ATOM 1292 CG PHE A 83 14.829 0.603 -2.907 1.00 0.33 C ATOM 1293 CD1 PHE A 83 13.939 -0.128 -3.682 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.339 1.304 -1.817 1.00 0.32 C ATOM 1295 CE1 PHE A 83 12.593 -0.160 -3.374 1.00 0.41 C ATOM 1296 CE2 PHE A 83 12.993 1.273 -1.506 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.131 0.513 -2.244 1.00 0.38 C ATOM 0 H PHE A 83 18.603 0.938 -4.000 1.00 0.36 H new ATOM 0 HA PHE A 83 16.132 1.295 -5.310 1.00 0.33 H new ATOM 0 HB2 PHE A 83 16.617 -0.362 -3.523 1.00 0.35 H new ATOM 0 HB3 PHE A 83 16.856 0.935 -2.368 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.304 -0.679 -4.537 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.016 1.881 -1.204 1.00 0.32 H new ATOM 0 HE1 PHE A 83 11.904 -0.702 -4.004 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.621 1.853 -0.675 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.094 0.434 -1.953 1.00 0.38 H new ATOM 1307 N GLU A 84 17.017 3.716 -3.261 1.00 0.34 N ATOM 1308 CA GLU A 84 16.661 5.047 -2.786 1.00 0.39 C ATOM 1309 C GLU A 84 16.729 6.069 -3.912 1.00 0.37 C ATOM 1310 O GLU A 84 15.850 6.911 -4.028 1.00 0.40 O ATOM 1311 CB GLU A 84 17.569 5.469 -1.622 1.00 0.51 C ATOM 1312 CG GLU A 84 17.206 6.821 -1.022 1.00 0.64 C ATOM 1313 CD GLU A 84 18.007 7.145 0.222 1.00 0.90 C ATOM 1314 OE1 GLU A 84 19.176 7.569 0.094 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.475 6.973 1.338 1.00 0.95 O ATOM 0 H GLU A 84 17.911 3.370 -2.913 1.00 0.34 H new ATOM 0 HA GLU A 84 15.633 5.008 -2.427 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.520 4.710 -0.841 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.601 5.502 -1.971 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.370 7.600 -1.767 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.144 6.832 -0.778 1.00 0.64 H new ATOM 1322 N GLN A 85 17.748 5.974 -4.763 1.00 0.37 N ATOM 1323 CA GLN A 85 17.917 6.929 -5.861 1.00 0.42 C ATOM 1324 C GLN A 85 16.691 6.946 -6.771 1.00 0.38 C ATOM 1325 O GLN A 85 16.394 7.954 -7.415 1.00 0.46 O ATOM 1326 CB GLN A 85 19.163 6.590 -6.682 1.00 0.50 C ATOM 1327 CG GLN A 85 20.474 6.816 -5.942 1.00 0.61 C ATOM 1328 CD GLN A 85 21.677 6.309 -6.717 1.00 1.44 C ATOM 1329 OE1 GLN A 85 22.778 6.846 -6.594 1.00 1.90 O ATOM 1330 NE2 GLN A 85 21.480 5.268 -7.517 1.00 2.16 N ATOM 0 H GLN A 85 18.466 5.251 -4.716 1.00 0.37 H new ATOM 0 HA GLN A 85 18.036 7.919 -5.421 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.108 5.546 -6.992 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.162 7.193 -7.590 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.596 7.881 -5.744 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.432 6.315 -4.975 1.00 0.61 H new ATOM 0 HE21 GLN A 85 20.552 4.851 -7.592 1.00 2.16 H new ATOM 0 HE22 GLN A 85 22.256 4.886 -8.057 1.00 2.16 H new ATOM 1339 N VAL A 86 15.980 5.830 -6.807 1.00 0.31 N ATOM 1340 CA VAL A 86 14.774 5.714 -7.603 1.00 0.31 C ATOM 1341 C VAL A 86 13.578 6.246 -6.827 1.00 0.29 C ATOM 1342 O VAL A 86 12.903 7.180 -7.262 1.00 0.32 O ATOM 1343 CB VAL A 86 14.502 4.249 -7.983 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.244 4.136 -8.827 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.694 3.653 -8.708 1.00 0.36 C ATOM 0 H VAL A 86 16.223 4.986 -6.288 1.00 0.31 H new ATOM 0 HA VAL A 86 14.920 6.299 -8.511 1.00 0.31 H new ATOM 0 HB VAL A 86 14.345 3.682 -7.065 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.071 3.091 -9.084 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.392 4.517 -8.263 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.365 4.719 -9.740 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.481 2.616 -8.968 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.889 4.222 -9.617 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.570 3.692 -8.061 1.00 0.36 H new ATOM 1355 N VAL A 87 13.331 5.648 -5.670 1.00 0.28 N ATOM 1356 CA VAL A 87 12.148 5.955 -4.882 1.00 0.32 C ATOM 1357 C VAL A 87 12.191 7.370 -4.307 1.00 0.35 C ATOM 1358 O VAL A 87 11.166 7.918 -3.914 1.00 0.37 O ATOM 1359 CB VAL A 87 11.958 4.935 -3.747 1.00 0.38 C ATOM 1360 CG1 VAL A 87 11.977 3.526 -4.309 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.017 5.102 -2.670 1.00 0.41 C ATOM 0 H VAL A 87 13.940 4.943 -5.255 1.00 0.28 H new ATOM 0 HA VAL A 87 11.297 5.894 -5.560 1.00 0.32 H new ATOM 0 HB VAL A 87 10.989 5.116 -3.282 1.00 0.38 H new ATOM 0 HG11 VAL A 87 11.842 2.809 -3.499 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.170 3.412 -5.033 1.00 0.38 H new ATOM 0 HG13 VAL A 87 12.933 3.343 -4.800 1.00 0.38 H new ATOM 0 HG21 VAL A 87 12.854 4.366 -1.883 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.005 4.955 -3.106 1.00 0.41 H new ATOM 0 HG23 VAL A 87 12.952 6.105 -2.248 1.00 0.41 H new ATOM 1371 N ASN A 88 13.377 7.961 -4.278 1.00 0.38 N ATOM 1372 CA ASN A 88 13.535 9.335 -3.810 1.00 0.47 C ATOM 1373 C ASN A 88 12.923 10.308 -4.813 1.00 0.44 C ATOM 1374 O ASN A 88 12.532 11.422 -4.459 1.00 0.45 O ATOM 1375 CB ASN A 88 15.017 9.655 -3.574 1.00 0.61 C ATOM 1376 CG ASN A 88 15.263 11.085 -3.129 1.00 0.78 C ATOM 1377 OD1 ASN A 88 15.132 11.411 -1.948 1.00 0.87 O ATOM 1378 ND2 ASN A 88 15.666 11.939 -4.058 1.00 0.97 N ATOM 0 H ASN A 88 14.245 7.513 -4.572 1.00 0.38 H new ATOM 0 HA ASN A 88 13.010 9.444 -2.861 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.412 8.975 -2.819 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.572 9.468 -4.493 1.00 0.61 H new ATOM 0 HD21 ASN A 88 15.880 12.904 -3.806 1.00 0.97 H new ATOM 0 HD22 ASN A 88 15.763 11.632 -5.026 1.00 0.97 H new ATOM 1385 N GLU A 89 12.802 9.867 -6.064 1.00 0.42 N ATOM 1386 CA GLU A 89 12.170 10.681 -7.091 1.00 0.45 C ATOM 1387 C GLU A 89 10.683 10.815 -6.813 1.00 0.38 C ATOM 1388 O GLU A 89 10.047 11.761 -7.262 1.00 0.43 O ATOM 1389 CB GLU A 89 12.384 10.098 -8.490 1.00 0.54 C ATOM 1390 CG GLU A 89 13.809 10.216 -8.998 1.00 0.65 C ATOM 1391 CD GLU A 89 13.936 9.804 -10.449 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.543 10.591 -11.334 1.00 1.28 O ATOM 1393 OE2 GLU A 89 14.426 8.685 -10.715 1.00 2.04 O ATOM 0 H GLU A 89 13.132 8.957 -6.386 1.00 0.42 H new ATOM 0 HA GLU A 89 12.638 11.665 -7.062 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.098 9.046 -8.481 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.717 10.603 -9.189 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.149 11.245 -8.883 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.463 9.594 -8.387 1.00 0.65 H new ATOM 1400 N LEU A 90 10.134 9.872 -6.053 1.00 0.31 N ATOM 1401 CA LEU A 90 8.730 9.921 -5.675 1.00 0.27 C ATOM 1402 C LEU A 90 8.489 11.113 -4.762 1.00 0.25 C ATOM 1403 O LEU A 90 7.487 11.816 -4.882 1.00 0.26 O ATOM 1404 CB LEU A 90 8.318 8.635 -4.958 1.00 0.26 C ATOM 1405 CG LEU A 90 8.587 7.342 -5.721 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.278 6.144 -4.842 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.766 7.290 -7.000 1.00 0.37 C ATOM 0 H LEU A 90 10.642 9.066 -5.688 1.00 0.31 H new ATOM 0 HA LEU A 90 8.130 10.023 -6.579 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.842 8.588 -4.003 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.252 8.690 -4.735 1.00 0.26 H new ATOM 0 HG LEU A 90 9.642 7.314 -5.994 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.473 5.226 -5.396 1.00 0.31 H new ATOM 0 HD12 LEU A 90 8.908 6.172 -3.953 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.230 6.172 -4.544 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.974 6.359 -7.528 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.705 7.339 -6.754 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.030 8.135 -7.636 1.00 0.37 H new ATOM 1419 N PHE A 91 9.434 11.336 -3.858 1.00 0.27 N ATOM 1420 CA PHE A 91 9.351 12.445 -2.923 1.00 0.29 C ATOM 1421 C PHE A 91 9.685 13.751 -3.636 1.00 0.33 C ATOM 1422 O PHE A 91 8.987 14.753 -3.481 1.00 0.33 O ATOM 1423 CB PHE A 91 10.312 12.225 -1.747 1.00 0.35 C ATOM 1424 CG PHE A 91 9.976 13.028 -0.520 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.293 14.375 -0.436 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.341 12.427 0.556 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.982 15.107 0.693 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.027 13.155 1.689 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.347 14.497 1.757 1.00 0.50 C ATOM 0 H PHE A 91 10.269 10.760 -3.754 1.00 0.27 H new ATOM 0 HA PHE A 91 8.334 12.502 -2.535 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.313 11.167 -1.486 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.323 12.476 -2.067 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.790 14.858 -1.264 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.089 11.378 0.509 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.235 16.156 0.744 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.532 12.675 2.520 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.101 15.068 2.640 1.00 0.50 H new ATOM 1439 N ARG A 92 10.737 13.718 -4.448 1.00 0.39 N ATOM 1440 CA ARG A 92 11.232 14.913 -5.122 1.00 0.49 C ATOM 1441 C ARG A 92 10.280 15.360 -6.236 1.00 0.51 C ATOM 1442 O ARG A 92 10.359 16.488 -6.722 1.00 0.62 O ATOM 1443 CB ARG A 92 12.629 14.647 -5.689 1.00 0.56 C ATOM 1444 CG ARG A 92 13.336 15.890 -6.214 1.00 1.24 C ATOM 1445 CD ARG A 92 13.619 16.886 -5.096 1.00 1.54 C ATOM 1446 NE ARG A 92 14.436 16.301 -4.035 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.707 16.906 -2.879 1.00 2.99 C ATOM 1448 NH1 ARG A 92 14.269 18.137 -2.643 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.434 16.280 -1.962 1.00 3.95 N ATOM 0 H ARG A 92 11.266 12.871 -4.656 1.00 0.39 H new ATOM 0 HA ARG A 92 11.288 15.720 -4.391 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.244 14.194 -4.912 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.549 13.920 -6.497 1.00 0.56 H new ATOM 0 HG2 ARG A 92 14.272 15.603 -6.692 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.720 16.365 -6.978 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.129 17.757 -5.507 1.00 1.54 H new ATOM 0 HD3 ARG A 92 12.676 17.237 -4.676 1.00 1.54 H new ATOM 0 HE ARG A 92 14.824 15.370 -4.189 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.720 18.627 -3.349 1.00 3.13 H new ATOM 0 HH12 ARG A 92 14.481 18.592 -1.755 1.00 3.13 H new ATOM 0 HH21 ARG A 92 15.783 15.339 -2.143 1.00 3.95 H new ATOM 0 HH22 ARG A 92 15.643 16.740 -1.076 1.00 3.95 H new ATOM 1463 N ASP A 93 9.371 14.477 -6.628 1.00 0.46 N ATOM 1464 CA ASP A 93 8.398 14.788 -7.676 1.00 0.53 C ATOM 1465 C ASP A 93 7.177 15.490 -7.078 1.00 0.50 C ATOM 1466 O ASP A 93 6.204 15.768 -7.774 1.00 0.60 O ATOM 1467 CB ASP A 93 7.967 13.501 -8.405 1.00 0.62 C ATOM 1468 CG ASP A 93 7.174 13.763 -9.671 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.790 14.068 -10.714 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.931 13.647 -9.637 1.00 1.11 O ATOM 0 H ASP A 93 9.284 13.538 -6.238 1.00 0.46 H new ATOM 0 HA ASP A 93 8.867 15.458 -8.397 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.854 12.919 -8.655 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.367 12.893 -7.728 1.00 0.62 H new ATOM 1475 N GLY A 94 7.235 15.793 -5.786 1.00 0.45 N ATOM 1476 CA GLY A 94 6.101 16.426 -5.141 1.00 0.47 C ATOM 1477 C GLY A 94 5.238 15.430 -4.396 1.00 0.39 C ATOM 1478 O GLY A 94 4.017 15.573 -4.385 1.00 0.42 O ATOM 0 H GLY A 94 8.036 15.614 -5.181 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.458 17.186 -4.446 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.498 16.938 -5.891 1.00 0.47 H new ATOM 1482 N VAL A 95 5.894 14.414 -3.818 1.00 0.32 N ATOM 1483 CA VAL A 95 5.244 13.276 -3.142 1.00 0.26 C ATOM 1484 C VAL A 95 3.814 13.555 -2.674 1.00 0.25 C ATOM 1485 O VAL A 95 3.567 14.388 -1.803 1.00 0.29 O ATOM 1486 CB VAL A 95 6.085 12.792 -1.937 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.394 13.938 -0.987 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.376 11.659 -1.205 1.00 0.33 C ATOM 0 H VAL A 95 6.912 14.357 -3.806 1.00 0.32 H new ATOM 0 HA VAL A 95 5.183 12.497 -3.902 1.00 0.26 H new ATOM 0 HB VAL A 95 7.032 12.412 -2.321 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.986 13.567 -0.150 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.956 14.708 -1.516 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.462 14.362 -0.613 1.00 0.40 H new ATOM 0 HG21 VAL A 95 5.985 11.334 -0.361 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.410 12.009 -0.842 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.226 10.823 -1.888 1.00 0.33 H new ATOM 1498 N ASN A 96 2.878 12.881 -3.315 1.00 0.24 N ATOM 1499 CA ASN A 96 1.485 12.893 -2.898 1.00 0.29 C ATOM 1500 C ASN A 96 1.122 11.517 -2.349 1.00 0.23 C ATOM 1501 O ASN A 96 1.976 10.626 -2.312 1.00 0.21 O ATOM 1502 CB ASN A 96 0.563 13.257 -4.071 1.00 0.41 C ATOM 1503 CG ASN A 96 0.505 12.175 -5.143 1.00 1.33 C ATOM 1504 OD1 ASN A 96 1.484 11.473 -5.392 1.00 2.13 O ATOM 1505 ND2 ASN A 96 -0.652 12.022 -5.775 1.00 2.00 N ATOM 0 H ASN A 96 3.060 12.309 -4.140 1.00 0.24 H new ATOM 0 HA ASN A 96 1.351 13.648 -2.123 1.00 0.29 H new ATOM 0 HB2 ASN A 96 -0.443 13.439 -3.692 1.00 0.41 H new ATOM 0 HB3 ASN A 96 0.908 14.188 -4.521 1.00 0.41 H new ATOM 0 HD21 ASN A 96 -0.750 11.304 -6.493 1.00 2.00 H new ATOM 0 HD22 ASN A 96 -1.443 12.622 -5.543 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.127 11.334 -1.928 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.574 10.035 -1.426 1.00 0.24 C ATOM 1514 C TRP A 97 -0.344 8.935 -2.466 1.00 0.25 C ATOM 1515 O TRP A 97 -0.007 7.804 -2.116 1.00 0.25 O ATOM 1516 CB TRP A 97 -2.055 10.069 -1.026 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.349 10.922 0.178 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -3.202 11.988 0.241 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.798 10.776 1.495 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -3.215 12.508 1.513 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.361 11.784 2.298 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.884 9.890 2.074 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -2.040 11.931 3.645 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.567 10.037 3.412 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.144 11.051 4.183 1.00 0.30 C ATOM 0 H TRP A 97 -0.843 12.061 -1.924 1.00 0.25 H new ATOM 0 HA TRP A 97 0.019 9.812 -0.539 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.639 10.437 -1.869 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.389 9.051 -0.827 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.781 12.367 -0.588 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.772 13.305 1.822 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.433 9.104 1.486 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.484 12.713 4.243 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.138 9.358 3.869 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.876 11.140 5.225 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.498 9.282 -3.744 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.329 8.313 -4.814 1.00 0.29 C ATOM 1538 C GLY A 98 1.088 7.777 -4.909 1.00 0.26 C ATOM 1539 O GLY A 98 1.300 6.622 -5.285 1.00 0.27 O ATOM 0 H GLY A 98 -0.738 10.223 -4.057 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.016 7.482 -4.656 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.601 8.776 -5.763 1.00 0.29 H new ATOM 1543 N ARG A 99 2.064 8.604 -4.554 1.00 0.26 N ATOM 1544 CA ARG A 99 3.465 8.190 -4.604 1.00 0.25 C ATOM 1545 C ARG A 99 3.750 7.170 -3.517 1.00 0.21 C ATOM 1546 O ARG A 99 4.566 6.268 -3.698 1.00 0.20 O ATOM 1547 CB ARG A 99 4.411 9.385 -4.454 1.00 0.30 C ATOM 1548 CG ARG A 99 4.399 10.346 -5.637 1.00 0.70 C ATOM 1549 CD ARG A 99 4.704 9.635 -6.951 1.00 1.40 C ATOM 1550 NE ARG A 99 4.859 10.581 -8.056 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.914 10.232 -9.344 1.00 2.46 C ATOM 1552 NH1 ARG A 99 4.731 8.968 -9.706 1.00 3.06 N ATOM 1553 NH2 ARG A 99 5.133 11.153 -10.273 1.00 2.98 N ATOM 0 H ARG A 99 1.915 9.560 -4.230 1.00 0.26 H new ATOM 0 HA ARG A 99 3.641 7.739 -5.581 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.143 9.935 -3.552 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.426 9.014 -4.312 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.424 10.828 -5.703 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.134 11.134 -5.472 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.616 9.048 -6.844 1.00 1.40 H new ATOM 0 HD3 ARG A 99 3.900 8.935 -7.181 1.00 1.40 H new ATOM 0 HE ARG A 99 4.930 11.573 -7.828 1.00 1.74 H new ATOM 0 HH11 ARG A 99 4.547 8.256 -8.999 1.00 3.06 H new ATOM 0 HH12 ARG A 99 4.774 8.708 -10.691 1.00 3.06 H new ATOM 0 HH21 ARG A 99 5.260 12.129 -10.004 1.00 2.98 H new ATOM 0 HH22 ARG A 99 5.175 10.886 -11.256 1.00 2.98 H new ATOM 1567 N ILE A 100 3.062 7.312 -2.392 1.00 0.22 N ATOM 1568 CA ILE A 100 3.172 6.357 -1.303 1.00 0.21 C ATOM 1569 C ILE A 100 2.585 5.022 -1.738 1.00 0.20 C ATOM 1570 O ILE A 100 3.154 3.962 -1.478 1.00 0.19 O ATOM 1571 CB ILE A 100 2.448 6.868 -0.039 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.124 8.144 0.473 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.423 5.798 1.041 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.606 8.614 1.814 1.00 0.30 C ATOM 0 H ILE A 100 2.420 8.084 -2.212 1.00 0.22 H new ATOM 0 HA ILE A 100 4.226 6.231 -1.057 1.00 0.21 H new ATOM 0 HB ILE A 100 1.416 7.101 -0.300 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.197 7.970 0.550 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.982 8.938 -0.260 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.908 6.182 1.922 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.899 4.918 0.669 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.444 5.527 1.308 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.132 9.522 2.110 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.539 8.822 1.739 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.773 7.838 2.561 1.00 0.30 H new ATOM 1586 N VAL A 101 1.452 5.095 -2.424 1.00 0.21 N ATOM 1587 CA VAL A 101 0.814 3.920 -2.992 1.00 0.21 C ATOM 1588 C VAL A 101 1.780 3.192 -3.909 1.00 0.20 C ATOM 1589 O VAL A 101 2.023 1.992 -3.761 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.430 4.310 -3.801 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.132 3.074 -4.325 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.366 5.148 -2.958 1.00 0.26 C ATOM 0 H VAL A 101 0.953 5.967 -2.601 1.00 0.21 H new ATOM 0 HA VAL A 101 0.519 3.271 -2.168 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.116 4.908 -4.657 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -2.012 3.370 -4.896 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.453 2.515 -4.969 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.437 2.446 -3.488 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.243 5.417 -3.546 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.677 4.577 -2.083 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.853 6.055 -2.637 1.00 0.26 H new ATOM 1602 N ALA A 102 2.330 3.942 -4.856 1.00 0.19 N ATOM 1603 CA ALA A 102 3.289 3.406 -5.803 1.00 0.19 C ATOM 1604 C ALA A 102 4.475 2.784 -5.080 1.00 0.17 C ATOM 1605 O ALA A 102 4.911 1.690 -5.424 1.00 0.19 O ATOM 1606 CB ALA A 102 3.753 4.503 -6.745 1.00 0.21 C ATOM 0 H ALA A 102 2.123 4.932 -4.986 1.00 0.19 H new ATOM 0 HA ALA A 102 2.803 2.623 -6.385 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.473 4.094 -7.454 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.897 4.903 -7.288 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.223 5.301 -6.170 1.00 0.21 H new ATOM 1612 N PHE A 103 4.963 3.480 -4.056 1.00 0.16 N ATOM 1613 CA PHE A 103 6.116 3.026 -3.279 1.00 0.17 C ATOM 1614 C PHE A 103 5.864 1.644 -2.681 1.00 0.17 C ATOM 1615 O PHE A 103 6.741 0.779 -2.698 1.00 0.21 O ATOM 1616 CB PHE A 103 6.436 4.038 -2.167 1.00 0.17 C ATOM 1617 CG PHE A 103 7.609 3.649 -1.305 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.903 3.797 -1.772 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.416 3.133 -0.031 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.982 3.438 -0.989 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.491 2.771 0.755 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.776 2.924 0.275 1.00 0.26 C ATOM 0 H PHE A 103 4.574 4.369 -3.742 1.00 0.16 H new ATOM 0 HA PHE A 103 6.972 2.953 -3.950 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.637 5.009 -2.620 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.557 4.157 -1.534 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.071 4.198 -2.761 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.412 3.013 0.350 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.987 3.559 -1.366 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.327 2.369 1.744 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.619 2.642 0.888 1.00 0.26 H new ATOM 1632 N PHE A 104 4.660 1.437 -2.171 1.00 0.16 N ATOM 1633 CA PHE A 104 4.299 0.160 -1.571 1.00 0.18 C ATOM 1634 C PHE A 104 4.100 -0.906 -2.642 1.00 0.19 C ATOM 1635 O PHE A 104 4.512 -2.055 -2.474 1.00 0.23 O ATOM 1636 CB PHE A 104 3.033 0.303 -0.724 1.00 0.19 C ATOM 1637 CG PHE A 104 3.285 0.812 0.669 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.778 2.090 0.887 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.028 0.003 1.764 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.008 2.548 2.169 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.256 0.458 3.047 1.00 0.33 C ATOM 1642 CZ PHE A 104 3.746 1.732 3.249 1.00 0.30 C ATOM 0 H PHE A 104 3.916 2.135 -2.160 1.00 0.16 H new ATOM 0 HA PHE A 104 5.118 -0.153 -0.924 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.345 0.981 -1.229 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.538 -0.666 -0.662 1.00 0.19 H new ATOM 0 HD1 PHE A 104 3.984 2.734 0.045 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.645 -0.995 1.612 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.393 3.545 2.326 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.051 -0.183 3.892 1.00 0.33 H new ATOM 0 HZ PHE A 104 3.924 2.090 4.252 1.00 0.30 H new ATOM 1652 N SER A 105 3.487 -0.515 -3.750 1.00 0.18 N ATOM 1653 CA SER A 105 3.222 -1.446 -4.834 1.00 0.21 C ATOM 1654 C SER A 105 4.524 -1.863 -5.524 1.00 0.21 C ATOM 1655 O SER A 105 4.602 -2.947 -6.105 1.00 0.23 O ATOM 1656 CB SER A 105 2.253 -0.827 -5.844 1.00 0.25 C ATOM 1657 OG SER A 105 1.817 -1.788 -6.790 1.00 1.04 O ATOM 0 H SER A 105 3.165 0.438 -3.921 1.00 0.18 H new ATOM 0 HA SER A 105 2.760 -2.339 -4.413 1.00 0.21 H new ATOM 0 HB2 SER A 105 1.392 -0.413 -5.319 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.740 0.000 -6.360 1.00 0.25 H new ATOM 0 HG SER A 105 2.224 -1.597 -7.661 1.00 1.04 H new ATOM 1663 N PHE A 106 5.543 -1.003 -5.456 1.00 0.20 N ATOM 1664 CA PHE A 106 6.848 -1.327 -6.020 1.00 0.21 C ATOM 1665 C PHE A 106 7.438 -2.534 -5.312 1.00 0.22 C ATOM 1666 O PHE A 106 7.799 -3.517 -5.954 1.00 0.24 O ATOM 1667 CB PHE A 106 7.824 -0.146 -5.914 1.00 0.23 C ATOM 1668 CG PHE A 106 7.517 1.009 -6.827 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.988 0.800 -8.090 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.772 2.309 -6.421 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.718 1.864 -8.929 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.503 3.376 -7.255 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.975 3.154 -8.510 1.00 0.33 C ATOM 0 H PHE A 106 5.487 -0.083 -5.018 1.00 0.20 H new ATOM 0 HA PHE A 106 6.700 -1.552 -7.076 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.827 0.213 -4.885 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.831 -0.504 -6.130 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.784 -0.207 -8.423 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.186 2.490 -5.440 1.00 0.27 H new ATOM 0 HE1 PHE A 106 6.306 1.687 -9.912 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.706 4.384 -6.925 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.763 3.988 -9.163 1.00 0.33 H new ATOM 1683 N GLY A 107 7.512 -2.464 -3.986 1.00 0.23 N ATOM 1684 CA GLY A 107 8.059 -3.565 -3.216 1.00 0.27 C ATOM 1685 C GLY A 107 7.286 -4.846 -3.433 1.00 0.32 C ATOM 1686 O GLY A 107 7.867 -5.932 -3.481 1.00 0.37 O ATOM 0 H GLY A 107 7.203 -1.665 -3.432 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.102 -3.719 -3.494 1.00 0.27 H new ATOM 0 HA3 GLY A 107 8.046 -3.309 -2.157 1.00 0.27 H new ATOM 1690 N GLY A 108 5.972 -4.714 -3.575 1.00 0.33 N ATOM 1691 CA GLY A 108 5.119 -5.856 -3.843 1.00 0.41 C ATOM 1692 C GLY A 108 5.496 -6.572 -5.126 1.00 0.42 C ATOM 1693 O GLY A 108 5.296 -7.776 -5.254 1.00 0.63 O ATOM 0 H GLY A 108 5.478 -3.824 -3.508 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.180 -6.555 -3.009 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.082 -5.525 -3.906 1.00 0.41 H new ATOM 1697 N ALA A 109 6.045 -5.831 -6.071 1.00 0.27 N ATOM 1698 CA ALA A 109 6.503 -6.405 -7.323 1.00 0.26 C ATOM 1699 C ALA A 109 7.958 -6.844 -7.213 1.00 0.23 C ATOM 1700 O ALA A 109 8.350 -7.883 -7.750 1.00 0.24 O ATOM 1701 CB ALA A 109 6.336 -5.395 -8.444 1.00 0.29 C ATOM 0 H ALA A 109 6.185 -4.824 -5.994 1.00 0.27 H new ATOM 0 HA ALA A 109 5.900 -7.285 -7.547 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.681 -5.831 -9.381 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.284 -5.124 -8.536 1.00 0.29 H new ATOM 0 HB3 ALA A 109 6.922 -4.504 -8.221 1.00 0.29 H new ATOM 1707 N LEU A 110 8.745 -6.046 -6.502 1.00 0.22 N ATOM 1708 CA LEU A 110 10.168 -6.298 -6.326 1.00 0.23 C ATOM 1709 C LEU A 110 10.415 -7.611 -5.604 1.00 0.21 C ATOM 1710 O LEU A 110 11.251 -8.412 -6.022 1.00 0.21 O ATOM 1711 CB LEU A 110 10.802 -5.158 -5.539 1.00 0.25 C ATOM 1712 CG LEU A 110 10.769 -3.804 -6.234 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.354 -2.739 -5.331 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.522 -3.870 -7.550 1.00 0.36 C ATOM 0 H LEU A 110 8.413 -5.205 -6.031 1.00 0.22 H new ATOM 0 HA LEU A 110 10.621 -6.363 -7.315 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.292 -5.070 -4.580 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.839 -5.416 -5.326 1.00 0.25 H new ATOM 0 HG LEU A 110 9.733 -3.541 -6.447 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.325 -1.775 -5.839 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.772 -2.682 -4.411 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.387 -2.992 -5.092 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.490 -2.895 -8.037 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.559 -4.149 -7.362 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.058 -4.614 -8.198 1.00 0.36 H new ATOM 1726 N CYS A 111 9.688 -7.825 -4.516 1.00 0.21 N ATOM 1727 CA CYS A 111 9.848 -9.028 -3.714 1.00 0.21 C ATOM 1728 C CYS A 111 9.662 -10.284 -4.561 1.00 0.21 C ATOM 1729 O CYS A 111 10.374 -11.277 -4.391 1.00 0.25 O ATOM 1730 CB CYS A 111 8.857 -9.020 -2.549 1.00 0.22 C ATOM 1731 SG CYS A 111 7.132 -8.820 -3.040 1.00 1.34 S ATOM 0 H CYS A 111 8.980 -7.178 -4.168 1.00 0.21 H new ATOM 0 HA CYS A 111 10.863 -9.039 -3.316 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.959 -9.953 -1.995 1.00 0.22 H new ATOM 0 HB3 CYS A 111 9.124 -8.213 -1.866 1.00 0.22 H new ATOM 0 HG CYS A 111 6.898 -7.569 -3.305 1.00 1.34 H new ATOM 1737 N VAL A 112 8.728 -10.216 -5.497 1.00 0.19 N ATOM 1738 CA VAL A 112 8.405 -11.351 -6.343 1.00 0.20 C ATOM 1739 C VAL A 112 9.558 -11.677 -7.278 1.00 0.22 C ATOM 1740 O VAL A 112 10.057 -12.807 -7.294 1.00 0.25 O ATOM 1741 CB VAL A 112 7.135 -11.074 -7.164 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.814 -12.251 -8.065 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.969 -10.774 -6.242 1.00 0.25 C ATOM 0 H VAL A 112 8.177 -9.379 -5.690 1.00 0.19 H new ATOM 0 HA VAL A 112 8.227 -12.208 -5.693 1.00 0.20 H new ATOM 0 HB VAL A 112 7.313 -10.202 -7.794 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.912 -12.035 -8.638 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.645 -12.423 -8.749 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.654 -13.141 -7.457 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.076 -10.580 -6.836 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.792 -11.629 -5.590 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.200 -9.897 -5.637 1.00 0.25 H new ATOM 1753 N GLU A 113 9.985 -10.682 -8.045 1.00 0.22 N ATOM 1754 CA GLU A 113 11.078 -10.868 -8.994 1.00 0.25 C ATOM 1755 C GLU A 113 12.377 -11.230 -8.271 1.00 0.25 C ATOM 1756 O GLU A 113 13.276 -11.828 -8.857 1.00 0.30 O ATOM 1757 CB GLU A 113 11.267 -9.627 -9.878 1.00 0.29 C ATOM 1758 CG GLU A 113 11.539 -8.342 -9.114 1.00 0.30 C ATOM 1759 CD GLU A 113 11.677 -7.140 -10.031 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.644 -6.660 -10.544 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.813 -6.680 -10.261 1.00 0.50 O ATOM 0 H GLU A 113 9.593 -9.740 -8.030 1.00 0.22 H new ATOM 0 HA GLU A 113 10.812 -11.701 -9.645 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.094 -9.808 -10.564 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.373 -9.490 -10.486 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.729 -8.165 -8.407 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.452 -8.456 -8.530 1.00 0.30 H new ATOM 1768 N SER A 114 12.457 -10.888 -6.991 1.00 0.23 N ATOM 1769 CA SER A 114 13.602 -11.261 -6.177 1.00 0.28 C ATOM 1770 C SER A 114 13.610 -12.764 -5.921 1.00 0.27 C ATOM 1771 O SER A 114 14.619 -13.433 -6.138 1.00 0.31 O ATOM 1772 CB SER A 114 13.591 -10.499 -4.853 1.00 0.33 C ATOM 1773 OG SER A 114 13.701 -9.108 -5.076 1.00 0.99 O ATOM 0 H SER A 114 11.742 -10.354 -6.497 1.00 0.23 H new ATOM 0 HA SER A 114 14.508 -10.997 -6.722 1.00 0.28 H new ATOM 0 HB2 SER A 114 12.670 -10.714 -4.312 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.415 -10.838 -4.226 1.00 0.33 H new ATOM 0 HG SER A 114 12.818 -8.740 -5.286 1.00 0.99 H new ATOM 1779 N VAL A 115 12.474 -13.298 -5.488 1.00 0.28 N ATOM 1780 CA VAL A 115 12.366 -14.717 -5.188 1.00 0.33 C ATOM 1781 C VAL A 115 12.503 -15.541 -6.462 1.00 0.37 C ATOM 1782 O VAL A 115 13.133 -16.599 -6.466 1.00 0.42 O ATOM 1783 CB VAL A 115 11.026 -15.040 -4.505 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.902 -16.531 -4.237 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.890 -14.251 -3.214 1.00 0.41 C ATOM 0 H VAL A 115 11.616 -12.768 -5.337 1.00 0.28 H new ATOM 0 HA VAL A 115 13.174 -14.974 -4.504 1.00 0.33 H new ATOM 0 HB VAL A 115 10.218 -14.750 -5.177 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.947 -16.736 -3.754 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.956 -17.076 -5.180 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.714 -16.852 -3.585 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.937 -14.489 -2.741 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.705 -14.513 -2.540 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.929 -13.184 -3.434 1.00 0.41 H new ATOM 1795 N ASP A 116 11.919 -15.031 -7.539 1.00 0.38 N ATOM 1796 CA ASP A 116 12.014 -15.669 -8.851 1.00 0.46 C ATOM 1797 C ASP A 116 13.471 -15.846 -9.271 1.00 0.47 C ATOM 1798 O ASP A 116 13.836 -16.856 -9.871 1.00 0.56 O ATOM 1799 CB ASP A 116 11.261 -14.833 -9.895 1.00 0.49 C ATOM 1800 CG ASP A 116 11.458 -15.335 -11.312 1.00 1.08 C ATOM 1801 OD1 ASP A 116 10.771 -16.301 -11.707 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.291 -14.755 -12.041 1.00 1.89 O ATOM 0 H ASP A 116 11.370 -14.171 -7.531 1.00 0.38 H new ATOM 0 HA ASP A 116 11.559 -16.657 -8.785 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.197 -14.839 -9.658 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.595 -13.797 -9.833 1.00 0.49 H new ATOM 1807 N LYS A 117 14.306 -14.875 -8.924 1.00 0.43 N ATOM 1808 CA LYS A 117 15.723 -14.917 -9.279 1.00 0.49 C ATOM 1809 C LYS A 117 16.554 -15.576 -8.178 1.00 0.47 C ATOM 1810 O LYS A 117 17.776 -15.426 -8.149 1.00 0.52 O ATOM 1811 CB LYS A 117 16.254 -13.505 -9.541 1.00 0.53 C ATOM 1812 CG LYS A 117 15.599 -12.804 -10.721 1.00 0.61 C ATOM 1813 CD LYS A 117 16.134 -11.391 -10.879 1.00 1.20 C ATOM 1814 CE LYS A 117 15.454 -10.655 -12.023 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.697 -11.313 -13.334 1.00 1.90 N ATOM 0 H LYS A 117 14.028 -14.047 -8.397 1.00 0.43 H new ATOM 0 HA LYS A 117 15.814 -15.513 -10.187 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.106 -12.901 -8.646 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.329 -13.559 -9.715 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.783 -13.371 -11.634 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.519 -12.774 -10.577 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.983 -10.839 -9.951 1.00 1.20 H new ATOM 0 HD3 LYS A 117 17.209 -11.427 -11.058 1.00 1.20 H new ATOM 0 HE2 LYS A 117 14.381 -10.606 -11.836 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.818 -9.628 -12.060 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 15.363 -10.694 -14.100 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.715 -11.490 -13.450 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.182 -12.216 -13.370 1.00 1.90 H new ATOM 1829 N GLU A 118 15.882 -16.292 -7.274 1.00 0.45 N ATOM 1830 CA GLU A 118 16.547 -17.014 -6.182 1.00 0.49 C ATOM 1831 C GLU A 118 17.223 -16.051 -5.207 1.00 0.45 C ATOM 1832 O GLU A 118 18.125 -16.435 -4.463 1.00 0.55 O ATOM 1833 CB GLU A 118 17.580 -18.006 -6.731 1.00 0.59 C ATOM 1834 CG GLU A 118 16.989 -19.081 -7.627 1.00 1.07 C ATOM 1835 CD GLU A 118 16.009 -19.976 -6.900 1.00 1.72 C ATOM 1836 OE1 GLU A 118 16.456 -20.864 -6.146 1.00 1.89 O ATOM 1837 OE2 GLU A 118 14.786 -19.802 -7.087 1.00 2.54 O ATOM 0 H GLU A 118 14.867 -16.389 -7.276 1.00 0.45 H new ATOM 0 HA GLU A 118 15.777 -17.566 -5.643 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.335 -17.455 -7.291 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.090 -18.484 -5.895 1.00 0.59 H new ATOM 0 HG2 GLU A 118 16.486 -18.608 -8.471 1.00 1.07 H new ATOM 0 HG3 GLU A 118 17.795 -19.690 -8.037 1.00 1.07 H new ATOM 1844 N MET A 119 16.771 -14.808 -5.196 1.00 0.35 N ATOM 1845 CA MET A 119 17.344 -13.794 -4.325 1.00 0.33 C ATOM 1846 C MET A 119 16.488 -13.647 -3.077 1.00 0.31 C ATOM 1847 O MET A 119 15.831 -12.625 -2.864 1.00 0.27 O ATOM 1848 CB MET A 119 17.462 -12.453 -5.054 1.00 0.34 C ATOM 1849 CG MET A 119 18.242 -12.534 -6.353 1.00 0.41 C ATOM 1850 SD MET A 119 18.449 -10.932 -7.153 1.00 0.47 S ATOM 1851 CE MET A 119 16.748 -10.390 -7.299 1.00 0.44 C ATOM 0 H MET A 119 16.006 -14.475 -5.783 1.00 0.35 H new ATOM 0 HA MET A 119 18.347 -14.108 -4.035 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.462 -12.074 -5.264 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.945 -11.732 -4.395 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.224 -12.964 -6.154 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.730 -13.211 -7.036 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.664 -9.670 -8.113 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.109 -11.248 -7.507 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.434 -9.922 -6.366 1.00 0.44 H new ATOM 1861 N GLN A 120 16.495 -14.685 -2.258 1.00 0.36 N ATOM 1862 CA GLN A 120 15.656 -14.740 -1.069 1.00 0.39 C ATOM 1863 C GLN A 120 16.210 -13.870 0.055 1.00 0.41 C ATOM 1864 O GLN A 120 15.520 -13.603 1.038 1.00 0.47 O ATOM 1865 CB GLN A 120 15.506 -16.184 -0.597 1.00 0.49 C ATOM 1866 CG GLN A 120 14.772 -17.075 -1.590 1.00 0.53 C ATOM 1867 CD GLN A 120 14.770 -18.532 -1.173 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.832 -18.849 0.018 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.676 -19.430 -2.144 1.00 0.70 N ATOM 0 H GLN A 120 17.079 -15.510 -2.396 1.00 0.36 H new ATOM 0 HA GLN A 120 14.676 -14.346 -1.337 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.495 -16.601 -0.409 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.971 -16.194 0.352 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.744 -16.729 -1.692 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.239 -16.982 -2.571 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.627 -19.126 -3.117 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.653 -20.424 -1.918 1.00 0.70 H new ATOM 1878 N VAL A 121 17.452 -13.433 -0.078 1.00 0.39 N ATOM 1879 CA VAL A 121 18.003 -12.477 0.868 1.00 0.44 C ATOM 1880 C VAL A 121 17.583 -11.063 0.484 1.00 0.38 C ATOM 1881 O VAL A 121 17.452 -10.182 1.335 1.00 0.47 O ATOM 1882 CB VAL A 121 19.541 -12.554 0.960 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.976 -13.904 1.505 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.183 -12.287 -0.390 1.00 0.92 C ATOM 0 H VAL A 121 18.090 -13.720 -0.821 1.00 0.39 H new ATOM 0 HA VAL A 121 17.604 -12.733 1.850 1.00 0.44 H new ATOM 0 HB VAL A 121 19.877 -11.780 1.649 1.00 0.52 H new ATOM 0 HG11 VAL A 121 21.064 -13.940 1.563 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.555 -14.047 2.500 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.622 -14.695 0.844 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.267 -12.348 -0.296 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.839 -13.030 -1.110 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.904 -11.291 -0.735 1.00 0.92 H new ATOM 1894 N LEU A 122 17.345 -10.858 -0.805 1.00 0.30 N ATOM 1895 CA LEU A 122 16.938 -9.554 -1.297 1.00 0.27 C ATOM 1896 C LEU A 122 15.482 -9.274 -0.968 1.00 0.23 C ATOM 1897 O LEU A 122 15.139 -8.158 -0.600 1.00 0.23 O ATOM 1898 CB LEU A 122 17.185 -9.414 -2.799 1.00 0.28 C ATOM 1899 CG LEU A 122 18.559 -8.858 -3.176 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.665 -9.786 -2.716 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.644 -8.636 -4.671 1.00 0.41 C ATOM 0 H LEU A 122 17.427 -11.577 -1.524 1.00 0.30 H new ATOM 0 HA LEU A 122 17.554 -8.813 -0.788 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.064 -10.392 -3.265 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.418 -8.764 -3.220 1.00 0.28 H new ATOM 0 HG LEU A 122 18.689 -7.901 -2.671 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.631 -9.367 -2.997 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.619 -9.898 -1.633 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.541 -10.761 -3.187 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.627 -8.240 -4.925 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.489 -9.583 -5.189 1.00 0.41 H new ATOM 0 HD23 LEU A 122 17.877 -7.925 -4.977 1.00 0.41 H new ATOM 1913 N VAL A 123 14.632 -10.293 -1.064 1.00 0.23 N ATOM 1914 CA VAL A 123 13.218 -10.124 -0.746 1.00 0.25 C ATOM 1915 C VAL A 123 13.042 -9.662 0.701 1.00 0.27 C ATOM 1916 O VAL A 123 12.151 -8.873 1.014 1.00 0.31 O ATOM 1917 CB VAL A 123 12.407 -11.418 -0.991 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.906 -12.566 -0.131 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.934 -11.167 -0.735 1.00 0.31 C ATOM 0 H VAL A 123 14.894 -11.234 -1.356 1.00 0.23 H new ATOM 0 HA VAL A 123 12.830 -9.358 -1.417 1.00 0.25 H new ATOM 0 HB VAL A 123 12.545 -11.705 -2.033 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.311 -13.457 -0.332 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.951 -12.768 -0.364 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.814 -12.299 0.922 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.373 -12.085 -0.911 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.793 -10.848 0.298 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.575 -10.388 -1.408 1.00 0.31 H new ATOM 1929 N SER A 124 13.929 -10.133 1.566 1.00 0.29 N ATOM 1930 CA SER A 124 13.894 -9.768 2.972 1.00 0.35 C ATOM 1931 C SER A 124 14.341 -8.319 3.156 1.00 0.34 C ATOM 1932 O SER A 124 13.720 -7.556 3.898 1.00 0.44 O ATOM 1933 CB SER A 124 14.793 -10.708 3.785 1.00 0.43 C ATOM 1934 OG SER A 124 14.721 -10.419 5.172 1.00 1.32 O ATOM 0 H SER A 124 14.684 -10.771 1.316 1.00 0.29 H new ATOM 0 HA SER A 124 12.870 -9.864 3.332 1.00 0.35 H new ATOM 0 HB2 SER A 124 14.494 -11.742 3.611 1.00 0.43 H new ATOM 0 HB3 SER A 124 15.824 -10.613 3.445 1.00 0.43 H new ATOM 0 HG SER A 124 15.303 -11.035 5.665 1.00 1.32 H new ATOM 1940 N ARG A 125 15.401 -7.931 2.455 1.00 0.28 N ATOM 1941 CA ARG A 125 15.964 -6.599 2.617 1.00 0.31 C ATOM 1942 C ARG A 125 15.128 -5.554 1.884 1.00 0.24 C ATOM 1943 O ARG A 125 15.209 -4.370 2.191 1.00 0.24 O ATOM 1944 CB ARG A 125 17.429 -6.559 2.161 1.00 0.41 C ATOM 1945 CG ARG A 125 17.637 -6.794 0.673 1.00 0.91 C ATOM 1946 CD ARG A 125 19.109 -7.013 0.354 1.00 0.74 C ATOM 1947 NE ARG A 125 19.686 -8.092 1.151 1.00 1.01 N ATOM 1948 CZ ARG A 125 20.971 -8.433 1.123 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.813 -7.816 0.303 1.00 1.28 N ATOM 1950 NH2 ARG A 125 21.408 -9.398 1.918 1.00 1.84 N ATOM 0 H ARG A 125 15.884 -8.517 1.774 1.00 0.28 H new ATOM 0 HA ARG A 125 15.940 -6.355 3.679 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.851 -5.589 2.425 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.989 -7.312 2.716 1.00 0.41 H new ATOM 0 HG2 ARG A 125 17.060 -7.662 0.354 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.263 -5.938 0.111 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.220 -7.245 -0.705 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.661 -6.091 0.538 1.00 0.74 H new ATOM 0 HE ARG A 125 19.065 -8.616 1.767 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.476 -7.075 -0.311 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.797 -8.083 0.287 1.00 1.28 H new ATOM 0 HH21 ARG A 125 20.760 -9.874 2.546 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.392 -9.665 1.902 1.00 1.84 H new ATOM 1964 N ILE A 126 14.313 -5.994 0.929 1.00 0.21 N ATOM 1965 CA ILE A 126 13.364 -5.106 0.269 1.00 0.19 C ATOM 1966 C ILE A 126 12.417 -4.501 1.299 1.00 0.19 C ATOM 1967 O ILE A 126 12.203 -3.287 1.329 1.00 0.19 O ATOM 1968 CB ILE A 126 12.558 -5.854 -0.813 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.445 -6.127 -2.024 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.322 -5.068 -1.224 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.762 -6.934 -3.099 1.00 0.23 C ATOM 0 H ILE A 126 14.292 -6.958 0.596 1.00 0.21 H new ATOM 0 HA ILE A 126 13.927 -4.310 -0.219 1.00 0.19 H new ATOM 0 HB ILE A 126 12.222 -6.803 -0.395 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.772 -5.177 -2.446 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.340 -6.656 -1.697 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.776 -5.622 -1.988 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.680 -4.919 -0.356 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.623 -4.100 -1.624 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.451 -7.090 -3.929 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.459 -7.899 -2.692 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.882 -6.397 -3.453 1.00 0.23 H new ATOM 1983 N ALA A 127 11.869 -5.362 2.150 1.00 0.22 N ATOM 1984 CA ALA A 127 11.004 -4.923 3.234 1.00 0.25 C ATOM 1985 C ALA A 127 11.732 -3.935 4.135 1.00 0.24 C ATOM 1986 O ALA A 127 11.153 -2.953 4.598 1.00 0.26 O ATOM 1987 CB ALA A 127 10.526 -6.119 4.040 1.00 0.30 C ATOM 0 H ALA A 127 12.011 -6.371 2.108 1.00 0.22 H new ATOM 0 HA ALA A 127 10.138 -4.420 2.803 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.879 -5.778 4.849 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.970 -6.796 3.392 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.385 -6.642 4.459 1.00 0.30 H new ATOM 1993 N ALA A 128 13.010 -4.200 4.361 1.00 0.22 N ATOM 1994 CA ALA A 128 13.838 -3.342 5.191 1.00 0.23 C ATOM 1995 C ALA A 128 14.034 -1.978 4.539 1.00 0.19 C ATOM 1996 O ALA A 128 13.923 -0.944 5.201 1.00 0.19 O ATOM 1997 CB ALA A 128 15.180 -4.004 5.457 1.00 0.27 C ATOM 0 H ALA A 128 13.498 -5.009 3.977 1.00 0.22 H new ATOM 0 HA ALA A 128 13.328 -3.190 6.142 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.791 -3.351 6.080 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.022 -4.952 5.971 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.691 -4.185 4.511 1.00 0.27 H new ATOM 2003 N TRP A 129 14.315 -1.980 3.238 1.00 0.17 N ATOM 2004 CA TRP A 129 14.506 -0.738 2.492 1.00 0.17 C ATOM 2005 C TRP A 129 13.248 0.112 2.538 1.00 0.15 C ATOM 2006 O TRP A 129 13.307 1.310 2.826 1.00 0.18 O ATOM 2007 CB TRP A 129 14.864 -1.008 1.028 1.00 0.20 C ATOM 2008 CG TRP A 129 16.153 -1.738 0.829 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.199 -1.829 1.703 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.536 -2.467 -0.338 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.208 -2.576 1.148 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.825 -2.979 -0.105 1.00 0.36 C ATOM 2013 CE3 TRP A 129 15.910 -2.738 -1.556 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.499 -3.746 -1.050 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.580 -3.499 -2.493 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.862 -3.996 -2.236 1.00 0.50 C ATOM 0 H TRP A 129 14.415 -2.827 2.679 1.00 0.17 H new ATOM 0 HA TRP A 129 15.332 -0.207 2.965 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.060 -1.585 0.571 1.00 0.20 H new ATOM 0 HB3 TRP A 129 14.914 -0.057 0.498 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.228 -1.380 2.685 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.098 -2.796 1.595 1.00 0.33 H new ATOM 0 HE3 TRP A 129 14.920 -2.359 -1.762 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.489 -4.130 -0.855 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.107 -3.714 -3.440 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.360 -4.589 -2.989 1.00 0.50 H new ATOM 2027 N MET A 130 12.111 -0.517 2.266 1.00 0.16 N ATOM 2028 CA MET A 130 10.843 0.194 2.236 1.00 0.21 C ATOM 2029 C MET A 130 10.514 0.749 3.611 1.00 0.19 C ATOM 2030 O MET A 130 10.115 1.902 3.739 1.00 0.21 O ATOM 2031 CB MET A 130 9.710 -0.716 1.762 1.00 0.29 C ATOM 2032 CG MET A 130 9.789 -1.104 0.296 1.00 0.33 C ATOM 2033 SD MET A 130 8.422 -2.166 -0.201 1.00 0.71 S ATOM 2034 CE MET A 130 7.028 -1.143 0.266 1.00 0.29 C ATOM 0 H MET A 130 12.043 -1.514 2.064 1.00 0.16 H new ATOM 0 HA MET A 130 10.941 1.018 1.530 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.712 -1.623 2.366 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.759 -0.215 1.942 1.00 0.29 H new ATOM 0 HG2 MET A 130 9.788 -0.203 -0.317 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.732 -1.617 0.108 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.108 -1.584 -0.119 1.00 0.29 H new ATOM 0 HE2 MET A 130 6.972 -1.078 1.353 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.154 -0.144 -0.151 1.00 0.29 H new ATOM 2044 N ALA A 131 10.710 -0.072 4.636 1.00 0.18 N ATOM 2045 CA ALA A 131 10.448 0.341 6.005 1.00 0.20 C ATOM 2046 C ALA A 131 11.330 1.522 6.385 1.00 0.21 C ATOM 2047 O ALA A 131 10.875 2.471 7.018 1.00 0.23 O ATOM 2048 CB ALA A 131 10.674 -0.820 6.959 1.00 0.23 C ATOM 0 H ALA A 131 11.050 -1.029 4.542 1.00 0.18 H new ATOM 0 HA ALA A 131 9.406 0.653 6.079 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.474 -0.496 7.980 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.003 -1.639 6.700 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.707 -1.159 6.882 1.00 0.23 H new ATOM 2054 N THR A 132 12.588 1.463 5.969 1.00 0.22 N ATOM 2055 CA THR A 132 13.539 2.531 6.241 1.00 0.25 C ATOM 2056 C THR A 132 13.107 3.829 5.559 1.00 0.24 C ATOM 2057 O THR A 132 12.951 4.859 6.215 1.00 0.25 O ATOM 2058 CB THR A 132 14.957 2.148 5.768 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.374 0.930 6.401 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.954 3.252 6.088 1.00 0.37 C ATOM 0 H THR A 132 12.975 0.682 5.439 1.00 0.22 H new ATOM 0 HA THR A 132 13.559 2.683 7.320 1.00 0.25 H new ATOM 0 HB THR A 132 14.927 2.007 4.688 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.045 0.164 5.886 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.946 2.957 5.745 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.654 4.171 5.584 1.00 0.37 H new ATOM 0 HG23 THR A 132 15.978 3.420 7.165 1.00 0.37 H new ATOM 2068 N TYR A 133 12.905 3.777 4.244 1.00 0.23 N ATOM 2069 CA TYR A 133 12.522 4.964 3.492 1.00 0.24 C ATOM 2070 C TYR A 133 11.190 5.510 4.003 1.00 0.21 C ATOM 2071 O TYR A 133 11.013 6.721 4.128 1.00 0.23 O ATOM 2072 CB TYR A 133 12.433 4.660 1.993 1.00 0.27 C ATOM 2073 CG TYR A 133 12.200 5.893 1.144 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.268 6.661 0.697 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.915 6.293 0.800 1.00 0.36 C ATOM 2076 CE1 TYR A 133 13.061 7.792 -0.068 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.699 7.422 0.036 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.775 8.168 -0.395 1.00 0.51 C ATOM 2079 OH TYR A 133 11.565 9.297 -1.151 1.00 0.61 O ATOM 0 H TYR A 133 13.000 2.931 3.683 1.00 0.23 H new ATOM 0 HA TYR A 133 13.292 5.721 3.639 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.355 4.176 1.672 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.624 3.951 1.821 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.276 6.369 0.952 1.00 0.42 H new ATOM 0 HD2 TYR A 133 10.070 5.710 1.136 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.901 8.379 -0.408 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.693 7.719 -0.222 1.00 0.45 H new ATOM 0 HH TYR A 133 11.957 10.072 -0.697 1.00 0.61 H new ATOM 2089 N LEU A 134 10.268 4.611 4.318 1.00 0.20 N ATOM 2090 CA LEU A 134 8.965 4.992 4.841 1.00 0.20 C ATOM 2091 C LEU A 134 9.096 5.657 6.209 1.00 0.21 C ATOM 2092 O LEU A 134 8.635 6.776 6.403 1.00 0.24 O ATOM 2093 CB LEU A 134 8.054 3.760 4.917 1.00 0.20 C ATOM 2094 CG LEU A 134 6.784 3.906 5.760 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.926 5.048 5.253 1.00 0.26 C ATOM 2096 CD2 LEU A 134 5.996 2.606 5.745 1.00 0.26 C ATOM 0 H LEU A 134 10.401 3.605 4.219 1.00 0.20 H new ATOM 0 HA LEU A 134 8.517 5.719 4.164 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.762 3.487 3.903 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.635 2.929 5.316 1.00 0.20 H new ATOM 0 HG LEU A 134 7.076 4.132 6.786 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.030 5.131 5.868 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.491 5.979 5.307 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.639 4.857 4.219 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.095 2.720 6.347 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.719 2.360 4.720 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.609 1.804 6.157 1.00 0.26 H new ATOM 2108 N ASN A 135 9.756 4.986 7.139 1.00 0.24 N ATOM 2109 CA ASN A 135 9.827 5.462 8.516 1.00 0.29 C ATOM 2110 C ASN A 135 10.707 6.706 8.642 1.00 0.30 C ATOM 2111 O ASN A 135 10.437 7.589 9.454 1.00 0.33 O ATOM 2112 CB ASN A 135 10.343 4.346 9.431 1.00 0.37 C ATOM 2113 CG ASN A 135 10.392 4.751 10.893 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.397 4.644 11.611 1.00 1.17 O ATOM 2115 ND2 ASN A 135 11.554 5.188 11.356 1.00 1.46 N ATOM 0 H ASN A 135 10.251 4.110 6.968 1.00 0.24 H new ATOM 0 HA ASN A 135 8.820 5.743 8.825 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.702 3.471 9.324 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.342 4.052 9.108 1.00 0.37 H new ATOM 0 HD21 ASN A 135 11.646 5.449 12.338 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.356 5.263 10.731 1.00 1.46 H new ATOM 2122 N ASP A 136 11.761 6.779 7.845 1.00 0.32 N ATOM 2123 CA ASP A 136 12.689 7.902 7.936 1.00 0.37 C ATOM 2124 C ASP A 136 12.315 9.049 6.995 1.00 0.34 C ATOM 2125 O ASP A 136 12.174 10.188 7.428 1.00 0.36 O ATOM 2126 CB ASP A 136 14.124 7.448 7.653 1.00 0.46 C ATOM 2127 CG ASP A 136 15.112 8.589 7.762 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.385 9.036 8.891 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.628 9.038 6.718 1.00 2.07 O ATOM 0 H ASP A 136 11.996 6.085 7.135 1.00 0.32 H new ATOM 0 HA ASP A 136 12.622 8.277 8.957 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.400 6.661 8.355 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.177 7.017 6.653 1.00 0.46 H new ATOM 2134 N HIS A 137 12.147 8.746 5.712 1.00 0.33 N ATOM 2135 CA HIS A 137 11.989 9.795 4.696 1.00 0.35 C ATOM 2136 C HIS A 137 10.523 10.161 4.469 1.00 0.29 C ATOM 2137 O HIS A 137 10.187 11.329 4.279 1.00 0.32 O ATOM 2138 CB HIS A 137 12.606 9.368 3.354 1.00 0.45 C ATOM 2139 CG HIS A 137 14.086 9.119 3.398 1.00 0.63 C ATOM 2140 ND1 HIS A 137 15.007 9.966 2.823 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.801 8.099 3.930 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.220 9.482 3.002 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.122 8.351 3.670 1.00 1.34 N ATOM 0 H HIS A 137 12.116 7.794 5.348 1.00 0.33 H new ATOM 0 HA HIS A 137 12.513 10.670 5.080 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.108 8.461 3.012 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.403 10.141 2.613 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.404 7.246 4.460 1.00 1.53 H new ATOM 0 HE1 HIS A 137 17.138 9.936 2.659 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.904 7.758 3.949 1.00 1.34 H new ATOM 2152 N LEU A 138 9.659 9.161 4.486 1.00 0.26 N ATOM 2153 CA LEU A 138 8.266 9.340 4.095 1.00 0.25 C ATOM 2154 C LEU A 138 7.405 9.803 5.272 1.00 0.24 C ATOM 2155 O LEU A 138 6.498 10.621 5.102 1.00 0.25 O ATOM 2156 CB LEU A 138 7.741 8.025 3.524 1.00 0.23 C ATOM 2157 CG LEU A 138 6.404 8.100 2.794 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.480 9.102 1.654 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.025 6.726 2.271 1.00 0.22 C ATOM 0 H LEU A 138 9.897 8.210 4.768 1.00 0.26 H new ATOM 0 HA LEU A 138 8.210 10.120 3.336 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.487 7.627 2.835 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.647 7.309 4.340 1.00 0.23 H new ATOM 0 HG LEU A 138 5.637 8.434 3.492 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.519 9.145 1.142 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.724 10.087 2.051 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.253 8.794 0.950 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.069 6.786 1.751 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.792 6.375 1.581 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.941 6.030 3.105 1.00 0.22 H new ATOM 2171 N GLU A 139 7.703 9.270 6.454 1.00 0.26 N ATOM 2172 CA GLU A 139 6.999 9.619 7.691 1.00 0.29 C ATOM 2173 C GLU A 139 6.841 11.141 7.878 1.00 0.30 C ATOM 2174 O GLU A 139 5.743 11.595 8.194 1.00 0.30 O ATOM 2175 CB GLU A 139 7.725 8.997 8.892 1.00 0.36 C ATOM 2176 CG GLU A 139 7.088 9.284 10.246 1.00 0.52 C ATOM 2177 CD GLU A 139 5.710 8.672 10.405 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.608 7.429 10.410 1.00 1.46 O ATOM 2179 OE2 GLU A 139 4.718 9.431 10.488 1.00 1.74 O ATOM 0 H GLU A 139 8.443 8.580 6.584 1.00 0.26 H new ATOM 0 HA GLU A 139 5.991 9.211 7.620 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.772 7.917 8.750 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.752 9.361 8.906 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.739 8.904 11.033 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.016 10.363 10.384 1.00 0.52 H new ATOM 2186 N PRO A 140 7.911 11.960 7.694 1.00 0.33 N ATOM 2187 CA PRO A 140 7.802 13.420 7.814 1.00 0.36 C ATOM 2188 C PRO A 140 6.632 13.995 7.018 1.00 0.31 C ATOM 2189 O PRO A 140 5.820 14.746 7.561 1.00 0.36 O ATOM 2190 CB PRO A 140 9.132 13.931 7.254 1.00 0.42 C ATOM 2191 CG PRO A 140 10.092 12.822 7.496 1.00 0.42 C ATOM 2192 CD PRO A 140 9.298 11.544 7.395 1.00 0.35 C ATOM 0 HA PRO A 140 7.614 13.722 8.844 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.052 14.162 6.192 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.448 14.846 7.756 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.898 12.838 6.762 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.554 12.916 8.479 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.377 11.103 6.402 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.652 10.797 8.105 1.00 0.35 H new ATOM 2200 N TRP A 141 6.532 13.618 5.743 1.00 0.28 N ATOM 2201 CA TRP A 141 5.478 14.134 4.875 1.00 0.25 C ATOM 2202 C TRP A 141 4.126 13.603 5.329 1.00 0.22 C ATOM 2203 O TRP A 141 3.133 14.337 5.377 1.00 0.22 O ATOM 2204 CB TRP A 141 5.730 13.739 3.412 1.00 0.29 C ATOM 2205 CG TRP A 141 4.730 14.337 2.472 1.00 0.29 C ATOM 2206 CD1 TRP A 141 4.818 15.546 1.848 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.485 13.762 2.058 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.701 15.762 1.083 1.00 0.35 N ATOM 2209 CE2 TRP A 141 2.870 14.681 1.193 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.831 12.560 2.338 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.631 14.441 0.607 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.604 12.321 1.756 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.013 13.257 0.899 1.00 0.36 C ATOM 0 H TRP A 141 7.167 12.959 5.291 1.00 0.28 H new ATOM 0 HA TRP A 141 5.481 15.222 4.942 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.731 14.057 3.121 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.702 12.653 3.323 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.646 16.233 1.942 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.519 16.594 0.522 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.278 11.831 2.998 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.175 15.163 -0.054 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.089 11.395 1.965 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.050 13.040 0.460 1.00 0.36 H new ATOM 2224 N ILE A 142 4.103 12.323 5.671 1.00 0.20 N ATOM 2225 CA ILE A 142 2.898 11.669 6.152 1.00 0.19 C ATOM 2226 C ILE A 142 2.366 12.389 7.389 1.00 0.20 C ATOM 2227 O ILE A 142 1.200 12.790 7.434 1.00 0.20 O ATOM 2228 CB ILE A 142 3.183 10.184 6.473 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.477 9.413 5.184 1.00 0.21 C ATOM 2230 CG2 ILE A 142 2.021 9.546 7.216 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.862 7.973 5.418 1.00 0.23 C ATOM 0 H ILE A 142 4.918 11.711 5.623 1.00 0.20 H new ATOM 0 HA ILE A 142 2.140 11.713 5.370 1.00 0.19 H new ATOM 0 HB ILE A 142 4.058 10.141 7.121 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.597 9.446 4.542 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.283 9.913 4.647 1.00 0.21 H new ATOM 0 HG21 ILE A 142 2.253 8.502 7.427 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.853 10.077 8.153 1.00 0.25 H new ATOM 0 HG23 ILE A 142 1.122 9.601 6.602 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.056 7.488 4.461 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.760 7.932 6.034 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.048 7.457 5.928 1.00 0.23 H new ATOM 2243 N GLN A 143 3.239 12.569 8.371 1.00 0.25 N ATOM 2244 CA GLN A 143 2.894 13.235 9.621 1.00 0.30 C ATOM 2245 C GLN A 143 2.358 14.649 9.378 1.00 0.29 C ATOM 2246 O GLN A 143 1.395 15.068 10.022 1.00 0.31 O ATOM 2247 CB GLN A 143 4.124 13.275 10.536 1.00 0.40 C ATOM 2248 CG GLN A 143 3.886 13.946 11.881 1.00 0.51 C ATOM 2249 CD GLN A 143 2.808 13.267 12.708 1.00 0.95 C ATOM 2250 OE1 GLN A 143 2.595 12.056 12.608 1.00 1.51 O ATOM 2251 NE2 GLN A 143 2.120 14.040 13.536 1.00 1.60 N ATOM 0 H GLN A 143 4.209 12.257 8.324 1.00 0.25 H new ATOM 0 HA GLN A 143 2.099 12.667 10.105 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.467 12.255 10.708 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.929 13.799 10.020 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.818 13.952 12.446 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.606 14.986 11.716 1.00 0.51 H new ATOM 0 HE21 GLN A 143 2.325 15.038 13.591 1.00 1.60 H new ATOM 0 HE22 GLN A 143 1.386 13.637 14.118 1.00 1.60 H new ATOM 2260 N GLU A 144 2.965 15.372 8.436 1.00 0.29 N ATOM 2261 CA GLU A 144 2.545 16.742 8.136 1.00 0.33 C ATOM 2262 C GLU A 144 1.120 16.775 7.592 1.00 0.29 C ATOM 2263 O GLU A 144 0.397 17.750 7.784 1.00 0.35 O ATOM 2264 CB GLU A 144 3.487 17.407 7.129 1.00 0.41 C ATOM 2265 CG GLU A 144 4.898 17.633 7.650 1.00 0.64 C ATOM 2266 CD GLU A 144 5.769 18.375 6.658 1.00 1.09 C ATOM 2267 OE1 GLU A 144 6.208 17.754 5.667 1.00 1.25 O ATOM 2268 OE2 GLU A 144 6.018 19.581 6.858 1.00 1.75 O ATOM 0 H GLU A 144 3.744 15.035 7.871 1.00 0.29 H new ATOM 0 HA GLU A 144 2.582 17.297 9.073 1.00 0.33 H new ATOM 0 HB2 GLU A 144 3.537 16.789 6.233 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.064 18.366 6.831 1.00 0.41 H new ATOM 0 HG2 GLU A 144 4.852 18.197 8.582 1.00 0.64 H new ATOM 0 HG3 GLU A 144 5.355 16.671 7.882 1.00 0.64 H new ATOM 2275 N ASN A 145 0.719 15.706 6.919 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.620 15.628 6.342 1.00 0.28 C ATOM 2277 C ASN A 145 -1.588 14.910 7.278 1.00 0.30 C ATOM 2278 O ASN A 145 -2.692 14.545 6.878 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.588 14.932 4.974 1.00 0.32 C ATOM 2280 CG ASN A 145 0.031 15.802 3.891 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.667 16.552 3.209 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.341 15.714 3.719 1.00 0.33 N ATOM 0 H ASN A 145 1.298 14.882 6.758 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.976 16.649 6.204 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.023 14.003 5.056 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.603 14.663 4.683 1.00 0.32 H new ATOM 0 HD21 ASN A 145 1.801 16.278 3.004 1.00 0.33 H new ATOM 0 HD22 ASN A 145 1.891 15.082 4.301 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.175 14.708 8.523 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.074 14.145 9.518 1.00 0.30 C ATOM 2291 C GLY A 146 -1.801 12.684 9.814 1.00 0.30 C ATOM 2292 O GLY A 146 -2.359 12.122 10.756 1.00 0.41 O ATOM 0 H GLY A 146 -0.237 14.922 8.863 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -1.988 14.718 10.441 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.102 14.252 9.171 1.00 0.30 H new ATOM 2296 N GLY A 147 -0.952 12.065 9.014 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.615 10.674 9.230 1.00 0.22 C ATOM 2298 C GLY A 147 -1.383 9.746 8.312 1.00 0.19 C ATOM 2299 O GLY A 147 -2.115 10.203 7.430 1.00 0.20 O ATOM 0 H GLY A 147 -0.488 12.500 8.217 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.454 10.533 9.073 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.823 10.409 10.267 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.210 8.443 8.521 1.00 0.20 N ATOM 2304 CA TRP A 148 -1.912 7.431 7.739 1.00 0.21 C ATOM 2305 C TRP A 148 -3.421 7.634 7.783 1.00 0.23 C ATOM 2306 O TRP A 148 -4.102 7.384 6.795 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.591 6.023 8.245 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.215 5.541 7.896 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.769 5.155 8.764 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.327 5.382 6.581 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.880 4.755 8.066 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.635 4.888 6.727 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.167 5.605 5.292 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.454 4.613 5.640 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.649 5.332 4.211 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.948 4.838 4.392 1.00 0.24 C ATOM 0 H TRP A 148 -0.585 8.062 9.231 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.568 7.538 6.710 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.706 6.004 9.329 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.322 5.327 7.835 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.684 5.164 9.841 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.748 4.414 8.479 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.168 5.984 5.144 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.456 4.234 5.777 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.280 5.502 3.210 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.561 4.631 3.527 1.00 0.24 H new ATOM 2327 N ASP A 149 -3.928 8.094 8.928 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.372 8.282 9.119 1.00 0.31 C ATOM 2329 C ASP A 149 -5.995 9.065 7.970 1.00 0.30 C ATOM 2330 O ASP A 149 -7.064 8.709 7.471 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.659 9.000 10.443 1.00 0.40 C ATOM 2332 CG ASP A 149 -7.120 9.379 10.580 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -7.924 8.526 11.007 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -7.473 10.535 10.257 1.00 1.96 O ATOM 0 H ASP A 149 -3.362 8.344 9.739 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.822 7.289 9.143 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.372 8.356 11.274 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.044 9.898 10.509 1.00 0.40 H new ATOM 2339 N THR A 150 -5.308 10.111 7.539 1.00 0.27 N ATOM 2340 CA THR A 150 -5.790 10.953 6.458 1.00 0.29 C ATOM 2341 C THR A 150 -5.904 10.150 5.163 1.00 0.28 C ATOM 2342 O THR A 150 -6.910 10.223 4.457 1.00 0.33 O ATOM 2343 CB THR A 150 -4.836 12.141 6.248 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.604 12.806 7.499 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.404 13.130 5.242 1.00 0.37 C ATOM 0 H THR A 150 -4.409 10.398 7.925 1.00 0.27 H new ATOM 0 HA THR A 150 -6.777 11.327 6.728 1.00 0.29 H new ATOM 0 HB THR A 150 -3.895 11.755 5.856 1.00 0.33 H new ATOM 0 HG1 THR A 150 -3.973 13.544 7.365 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.708 13.959 5.114 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.553 12.630 4.285 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.359 13.511 5.605 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.870 9.370 4.876 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.825 8.559 3.669 1.00 0.25 C ATOM 2355 C PHE A 151 -5.854 7.434 3.735 1.00 0.26 C ATOM 2356 O PHE A 151 -6.542 7.144 2.755 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.418 7.985 3.489 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.259 7.133 2.263 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.521 7.649 1.007 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.840 5.819 2.367 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.372 6.871 -0.122 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.691 5.035 1.242 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.958 5.561 -0.004 1.00 0.34 C ATOM 0 H PHE A 151 -4.045 9.283 5.469 1.00 0.24 H new ATOM 0 HA PHE A 151 -5.068 9.188 2.813 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.704 8.807 3.443 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.164 7.391 4.367 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.846 8.674 0.909 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.627 5.402 3.340 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.579 7.287 -1.097 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.365 4.010 1.337 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.843 4.948 -0.886 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.961 6.814 4.902 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.905 5.729 5.115 1.00 0.29 C ATOM 2375 C VAL A 152 -8.333 6.215 4.945 1.00 0.35 C ATOM 2376 O VAL A 152 -9.157 5.544 4.341 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.743 5.119 6.516 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.776 4.031 6.752 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.338 4.574 6.690 1.00 0.28 C ATOM 0 H VAL A 152 -5.400 7.047 5.721 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.692 4.964 4.368 1.00 0.29 H new ATOM 0 HB VAL A 152 -6.905 5.902 7.257 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.643 3.613 7.750 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.777 4.455 6.667 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.651 3.243 6.009 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.235 4.144 7.686 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.151 3.804 5.942 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.617 5.382 6.567 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.604 7.399 5.464 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.937 7.981 5.407 1.00 0.46 C ATOM 2391 C GLU A 153 -10.375 8.227 3.958 1.00 0.51 C ATOM 2392 O GLU A 153 -11.561 8.397 3.676 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.941 9.282 6.206 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.321 9.855 6.464 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.275 11.003 7.445 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.921 12.127 7.033 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -11.577 10.786 8.638 1.00 1.42 O ATOM 0 H GLU A 153 -7.913 7.983 5.935 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.652 7.283 5.843 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.449 9.108 7.163 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.347 10.024 5.672 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.755 10.197 5.524 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.974 9.072 6.850 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.414 8.227 3.040 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.710 8.430 1.625 1.00 0.59 C ATOM 2406 C LEU A 154 -10.071 7.108 0.944 1.00 0.68 C ATOM 2407 O LEU A 154 -10.862 7.083 -0.001 1.00 0.74 O ATOM 2408 CB LEU A 154 -8.512 9.067 0.912 1.00 0.65 C ATOM 2409 CG LEU A 154 -8.015 10.381 1.517 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.827 10.914 0.731 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -9.134 11.409 1.558 1.00 0.67 C ATOM 0 H LEU A 154 -8.425 8.089 3.249 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.566 9.102 1.557 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.689 8.352 0.911 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.782 9.244 -0.129 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.692 10.187 2.540 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -6.487 11.849 1.176 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -6.017 10.185 0.756 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -7.124 11.091 -0.303 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.760 12.337 1.992 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -9.490 11.599 0.546 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.955 11.029 2.166 1.00 0.67 H new ATOM 2444 N GLY A 156 -10.992 4.281 2.841 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.612 3.462 3.862 1.00 1.02 C ATOM 2446 C GLY A 156 -13.022 3.918 4.155 1.00 1.11 C ATOM 2447 O GLY A 156 -13.259 4.657 5.112 1.00 1.68 O ATOM 0 HA2 GLY A 156 -11.625 2.421 3.538 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -11.018 3.504 4.775 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.967 3.486 3.331 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.356 3.912 3.475 1.00 2.05 C ATOM 2453 C ASN A 157 -16.018 3.235 4.670 1.00 2.33 C ATOM 2454 O ASN A 157 -17.084 3.656 5.118 1.00 2.52 O ATOM 2455 CB ASN A 157 -16.157 3.641 2.196 1.00 3.21 C ATOM 2456 CG ASN A 157 -16.038 2.209 1.717 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -16.806 1.336 2.122 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -15.078 1.960 0.843 1.00 4.60 N ATOM 0 H ASN A 157 -13.800 2.843 2.557 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.350 4.988 3.651 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -17.207 3.873 2.375 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -15.813 4.312 1.409 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -14.953 1.016 0.479 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -14.463 2.712 0.533 1.00 4.60 H new ATOM 2465 N ASN A 158 -15.375 2.205 5.204 1.00 2.99 N ATOM 2466 CA ASN A 158 -15.886 1.530 6.394 1.00 4.03 C ATOM 2467 C ASN A 158 -15.723 2.426 7.617 1.00 4.18 C ATOM 2468 O ASN A 158 -16.383 2.231 8.635 1.00 4.81 O ATOM 2469 CB ASN A 158 -15.187 0.184 6.627 1.00 5.08 C ATOM 2470 CG ASN A 158 -13.710 0.319 6.947 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -13.032 1.220 6.455 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -13.203 -0.575 7.780 1.00 6.76 N ATOM 0 H ASN A 158 -14.505 1.819 4.837 1.00 2.99 H new ATOM 0 HA ASN A 158 -16.945 1.330 6.233 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -15.682 -0.337 7.446 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -15.303 -0.436 5.738 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -12.216 -0.532 8.036 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -13.799 -1.307 8.167 1.00 6.76 H new ATOM 2479 N ALA A 159 -14.845 3.418 7.506 1.00 3.95 N ATOM 2480 CA ALA A 159 -14.668 4.404 8.563 1.00 4.72 C ATOM 2481 C ALA A 159 -15.895 5.302 8.655 1.00 4.66 C ATOM 2482 O ALA A 159 -16.284 5.741 9.735 1.00 5.63 O ATOM 2483 CB ALA A 159 -13.416 5.230 8.316 1.00 4.78 C ATOM 0 H ALA A 159 -14.245 3.559 6.693 1.00 3.95 H new ATOM 0 HA ALA A 159 -14.549 3.881 9.512 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -13.299 5.962 9.115 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -12.546 4.574 8.295 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.504 5.747 7.361 1.00 4.78 H new ATOM 2489 N ALA A 160 -16.509 5.562 7.509 1.00 3.75 N ATOM 2490 CA ALA A 160 -17.738 6.345 7.457 1.00 4.08 C ATOM 2491 C ALA A 160 -18.930 5.514 7.928 1.00 4.33 C ATOM 2492 O ALA A 160 -19.939 6.052 8.386 1.00 5.11 O ATOM 2493 CB ALA A 160 -17.973 6.857 6.043 1.00 3.59 C ATOM 0 H ALA A 160 -16.176 5.242 6.600 1.00 3.75 H new ATOM 0 HA ALA A 160 -17.633 7.198 8.127 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -18.893 7.440 6.016 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -17.136 7.486 5.740 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -18.058 6.012 5.360 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.791 4.195 7.832 1.00 3.93 N ATOM 2500 CA ALA A 161 -19.872 3.276 8.175 1.00 4.43 C ATOM 2501 C ALA A 161 -20.238 3.346 9.656 1.00 5.54 C ATOM 2502 O ALA A 161 -21.387 3.112 10.023 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.493 1.853 7.794 1.00 4.39 C ATOM 0 H ALA A 161 -17.936 3.737 7.518 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.751 3.581 7.607 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.307 1.177 8.055 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -19.308 1.801 6.721 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -18.592 1.560 8.333 1.00 4.39 H new ATOM 2509 N GLU A 162 -19.272 3.688 10.505 1.00 5.98 N ATOM 2510 CA GLU A 162 -19.524 3.748 11.943 1.00 7.23 C ATOM 2511 C GLU A 162 -20.455 4.913 12.286 1.00 7.80 C ATOM 2512 O GLU A 162 -21.122 4.903 13.318 1.00 8.75 O ATOM 2513 CB GLU A 162 -18.218 3.876 12.733 1.00 7.72 C ATOM 2514 CG GLU A 162 -17.474 5.178 12.498 1.00 7.99 C ATOM 2515 CD GLU A 162 -16.400 5.425 13.535 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -16.749 5.813 14.669 1.00 9.09 O ATOM 2517 OE2 GLU A 162 -15.202 5.241 13.223 1.00 9.03 O ATOM 0 H GLU A 162 -18.319 3.925 10.228 1.00 5.98 H new ATOM 0 HA GLU A 162 -20.008 2.814 12.227 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -18.439 3.784 13.796 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -17.564 3.044 12.470 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -17.021 5.160 11.507 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.183 6.006 12.509 1.00 7.99 H new ATOM 2524 N SER A 163 -20.507 5.910 11.408 1.00 7.39 N ATOM 2525 CA SER A 163 -21.372 7.062 11.612 1.00 8.21 C ATOM 2526 C SER A 163 -22.798 6.721 11.181 1.00 8.28 C ATOM 2527 O SER A 163 -23.727 7.507 11.360 1.00 9.15 O ATOM 2528 CB SER A 163 -20.838 8.266 10.826 1.00 8.03 C ATOM 2529 OG SER A 163 -21.522 9.460 11.168 1.00 7.86 O ATOM 0 H SER A 163 -19.959 5.941 10.548 1.00 7.39 H new ATOM 0 HA SER A 163 -21.383 7.322 12.670 1.00 8.21 H new ATOM 0 HB2 SER A 163 -19.773 8.387 11.024 1.00 8.03 H new ATOM 0 HB3 SER A 163 -20.944 8.079 9.757 1.00 8.03 H new ATOM 0 HG SER A 163 -22.482 9.278 11.238 1.00 7.86 H new ATOM 2535 N ARG A 164 -22.960 5.526 10.622 1.00 7.47 N ATOM 2536 CA ARG A 164 -24.267 5.032 10.208 1.00 7.60 C ATOM 2537 C ARG A 164 -24.849 4.136 11.291 1.00 8.33 C ATOM 2538 O ARG A 164 -25.832 3.424 11.074 1.00 8.87 O ATOM 2539 CB ARG A 164 -24.151 4.252 8.898 1.00 6.69 C ATOM 2540 CG ARG A 164 -23.619 5.079 7.745 1.00 6.19 C ATOM 2541 CD ARG A 164 -23.515 4.260 6.472 1.00 5.74 C ATOM 2542 NE ARG A 164 -23.038 5.060 5.347 1.00 5.66 N ATOM 2543 CZ ARG A 164 -22.603 4.546 4.198 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -22.540 3.229 4.030 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -22.206 5.353 3.223 1.00 6.02 N ATOM 0 H ARG A 164 -22.194 4.877 10.444 1.00 7.47 H new ATOM 0 HA ARG A 164 -24.929 5.884 10.052 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -23.496 3.395 9.052 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -25.132 3.859 8.630 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -24.275 5.933 7.576 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -22.638 5.477 8.004 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -22.838 3.421 6.634 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -24.491 3.839 6.230 1.00 5.74 H new ATOM 0 HE ARG A 164 -23.038 6.075 5.448 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -22.826 2.604 4.784 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -22.206 2.843 3.147 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -22.234 6.364 3.354 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -21.872 4.962 2.342 1.00 6.02 H new ATOM 2559 N LYS A 165 -24.236 4.183 12.466 1.00 8.52 N ATOM 2560 CA LYS A 165 -24.654 3.354 13.587 1.00 9.41 C ATOM 2561 C LYS A 165 -25.942 3.899 14.211 1.00 10.47 C ATOM 2562 O LYS A 165 -26.510 3.296 15.126 1.00 11.24 O ATOM 2563 CB LYS A 165 -23.530 3.287 14.627 1.00 9.61 C ATOM 2564 CG LYS A 165 -23.734 2.229 15.699 1.00 9.69 C ATOM 2565 CD LYS A 165 -22.583 2.214 16.690 1.00 10.12 C ATOM 2566 CE LYS A 165 -22.794 1.165 17.771 1.00 10.34 C ATOM 2567 NZ LYS A 165 -23.998 1.450 18.595 1.00 10.42 N ATOM 0 H LYS A 165 -23.442 4.791 12.668 1.00 8.52 H new ATOM 0 HA LYS A 165 -24.859 2.346 13.226 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -22.588 3.092 14.115 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -23.436 4.261 15.107 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -24.668 2.420 16.227 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -23.826 1.249 15.232 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -21.650 2.013 16.163 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -22.484 3.197 17.150 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -22.895 0.183 17.309 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -21.915 1.125 18.415 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -23.987 0.851 19.445 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -23.997 2.451 18.877 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -24.854 1.248 18.040 1.00 10.42 H new ATOM 2581 N GLY A 166 -26.409 5.035 13.694 1.00 10.61 N ATOM 2582 CA GLY A 166 -27.652 5.622 14.164 1.00 11.72 C ATOM 2583 C GLY A 166 -28.831 4.684 13.981 1.00 12.02 C ATOM 2584 O GLY A 166 -29.760 4.676 14.789 1.00 13.02 O ATOM 0 H GLY A 166 -25.944 5.561 12.954 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -27.555 5.880 15.219 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -27.841 6.550 13.625 1.00 11.72 H new ATOM 2588 N GLN A 167 -28.782 3.885 12.920 1.00 11.25 N ATOM 2589 CA GLN A 167 -29.801 2.870 12.666 1.00 11.64 C ATOM 2590 C GLN A 167 -29.914 1.919 13.861 1.00 12.01 C ATOM 2591 O GLN A 167 -31.014 1.536 14.266 1.00 12.84 O ATOM 2592 CB GLN A 167 -29.460 2.085 11.389 1.00 10.86 C ATOM 2593 CG GLN A 167 -30.488 1.027 11.007 1.00 11.50 C ATOM 2594 CD GLN A 167 -31.861 1.606 10.721 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -32.169 1.981 9.590 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -32.699 1.669 11.741 1.00 12.41 N ATOM 0 H GLN A 167 -28.043 3.921 12.218 1.00 11.25 H new ATOM 0 HA GLN A 167 -30.761 3.366 12.526 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -29.355 2.788 10.562 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -28.492 1.602 11.522 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -30.137 0.489 10.126 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -30.568 0.299 11.814 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -32.405 1.348 12.663 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -33.640 2.039 11.606 1.00 12.41 H new ATOM 2605 N GLU A 168 -28.769 1.581 14.445 1.00 11.51 N ATOM 2606 CA GLU A 168 -28.725 0.687 15.597 1.00 11.94 C ATOM 2607 C GLU A 168 -29.056 1.433 16.887 1.00 13.03 C ATOM 2608 O GLU A 168 -29.198 0.823 17.943 1.00 13.73 O ATOM 2609 CB GLU A 168 -27.345 0.038 15.722 1.00 11.38 C ATOM 2610 CG GLU A 168 -27.010 -0.922 14.594 1.00 10.85 C ATOM 2611 CD GLU A 168 -25.654 -1.575 14.770 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -25.504 -2.418 15.686 1.00 10.74 O ATOM 2613 OE2 GLU A 168 -24.735 -1.265 13.987 1.00 10.98 O ATOM 0 H GLU A 168 -27.855 1.914 14.138 1.00 11.51 H new ATOM 0 HA GLU A 168 -29.475 -0.088 15.440 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -26.588 0.821 15.756 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -27.291 -0.498 16.670 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -27.777 -1.694 14.539 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -27.030 -0.385 13.646 1.00 10.85 H new