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 114 SER OG : rot -69:sc= 0.943 USER MOD Set 1.2: A 119 MET CE :methyl -142:sc= -3.45 (180deg=-5.31!) USER MOD Set 2.1: A 78 THR OG1 : rot 180:sc= 0.405 USER MOD Set 2.2: A 82 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 18 SER OG : rot 64:sc= 1.25 USER MOD Single : A 4 SER OG : rot 25:sc= 0.205 USER MOD Single : A 5 ASN : amide:sc= 1.29 K(o=1.3,f=-5.3!) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 131:sc= 1.22 (180deg=0.178) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -1.15! K(o=-1.2!,f=-0.024) USER MOD Single : A 43 SER OG : rot -173:sc= 1.01 USER MOD Single : A 47 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.051) USER MOD Single : A 48 GLN : amide:sc= -0.0466 K(o=-0.047,f=-0.72) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0.0151 USER MOD Single : A 69 THR OG1 : rot 94:sc= 1.32 USER MOD Single : A 70 SER OG : rot -72:sc= 1.25 USER MOD Single : A 71 GLN : amide:sc= -1.62! K(o=-1.6!,f=0) USER MOD Single : A 73 HIS : no HE2:sc= 0.047 K(o=0.047,f=-5.6!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.262 K(o=-0.26,f=-1) USER MOD Single : A 85 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.17) USER MOD Single : A 88 ASN : amide:sc=-0.00446 K(o=-0.0045,f=-1.1) USER MOD Single : A 96 ASN : amide:sc= -1.57! K(o=-1.6!,f=-0.028) USER MOD Single : A 105 SER OG : rot 9:sc= -0.575 USER MOD Single : A 111 CYS SG : rot -73:sc= -0.584 USER MOD Single : A 117 LYS NZ :NH3+ -168:sc= -0.0287 (180deg=-0.223) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 179:sc= -3.93! (180deg=-4.03!) USER MOD Single : A 132 THR OG1 : rot 63:sc= 1.25 USER MOD Single : A 133 TYR OH : rot 78:sc= 0.0635 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 137 HIS : no HD1:sc= 1.09 K(o=1.1,f=-3.8!) USER MOD Single : A 143 GLN : amide:sc= 0.228 X(o=0.23,f=-0.075) USER MOD Single : A 145 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 150 THR OG1 : rot -140:sc= -0.0425 USER MOD Single : A 157 ASN : amide:sc= -0.03 X(o=-0.03,f=0) USER MOD Single : A 158 ASN : amide:sc= -0.123 X(o=-0.12,f=-0.2) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= -0.945 K(o=-0.94,f=-5.7!) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 4.985 -0.854 12.853 1.00 0.88 N ATOM 49 CA SER A 4 3.710 -0.707 12.158 1.00 0.77 C ATOM 50 C SER A 4 3.930 -0.288 10.706 1.00 0.62 C ATOM 51 O SER A 4 3.258 -0.776 9.800 1.00 0.64 O ATOM 52 CB SER A 4 2.832 0.315 12.883 1.00 1.02 C ATOM 53 OG SER A 4 2.742 0.006 14.267 1.00 1.34 O ATOM 0 HA SER A 4 3.202 -1.671 12.159 1.00 0.77 H new ATOM 0 HB2 SER A 4 3.247 1.315 12.755 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.835 0.324 12.442 1.00 1.02 H new ATOM 0 HG SER A 4 3.527 -0.514 14.538 1.00 1.34 H new ATOM 59 N ASN A 5 4.891 0.601 10.489 1.00 0.59 N ATOM 60 CA ASN A 5 5.226 1.042 9.141 1.00 0.55 C ATOM 61 C ASN A 5 5.785 -0.115 8.320 1.00 0.43 C ATOM 62 O ASN A 5 5.497 -0.242 7.130 1.00 0.44 O ATOM 63 CB ASN A 5 6.228 2.204 9.177 1.00 0.65 C ATOM 64 CG ASN A 5 5.572 3.521 9.566 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.395 3.747 9.289 1.00 1.71 O ATOM 66 ND2 ASN A 5 6.326 4.402 10.207 1.00 0.67 N ATOM 0 H ASN A 5 5.451 1.030 11.226 1.00 0.59 H new ATOM 0 HA ASN A 5 4.311 1.395 8.666 1.00 0.55 H new ATOM 0 HB2 ASN A 5 7.023 1.973 9.886 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.695 2.309 8.198 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.934 5.301 10.487 1.00 0.67 H new ATOM 0 HD22 ASN A 5 7.299 4.181 10.421 1.00 0.67 H new ATOM 73 N ARG A 6 6.571 -0.975 8.959 1.00 0.41 N ATOM 74 CA ARG A 6 7.137 -2.122 8.273 1.00 0.41 C ATOM 75 C ARG A 6 6.070 -3.192 8.037 1.00 0.37 C ATOM 76 O ARG A 6 6.151 -3.938 7.064 1.00 0.38 O ATOM 77 CB ARG A 6 8.318 -2.708 9.054 1.00 0.54 C ATOM 78 CG ARG A 6 9.140 -3.692 8.233 1.00 0.65 C ATOM 79 CD ARG A 6 10.365 -4.191 8.984 1.00 0.83 C ATOM 80 NE ARG A 6 10.010 -4.959 10.175 1.00 1.50 N ATOM 81 CZ ARG A 6 10.043 -6.292 10.235 1.00 2.14 C ATOM 82 NH1 ARG A 6 10.410 -6.997 9.168 1.00 2.16 N ATOM 83 NH2 ARG A 6 9.721 -6.915 11.363 1.00 3.18 N ATOM 0 H ARG A 6 6.827 -0.898 9.943 1.00 0.41 H new ATOM 0 HA ARG A 6 7.507 -1.781 7.306 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.963 -1.896 9.392 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.944 -3.210 9.946 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.515 -4.541 7.957 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.455 -3.213 7.306 1.00 0.65 H new ATOM 0 HD2 ARG A 6 10.968 -4.811 8.321 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.983 -3.341 9.273 1.00 0.83 H new ATOM 0 HE ARG A 6 9.720 -4.447 11.008 1.00 1.50 H new ATOM 0 HH11 ARG A 6 10.666 -6.519 8.304 1.00 2.16 H new ATOM 0 HH12 ARG A 6 10.435 -8.016 9.214 1.00 2.16 H new ATOM 0 HH21 ARG A 6 9.448 -6.375 12.184 1.00 3.18 H new ATOM 0 HH22 ARG A 6 9.746 -7.934 11.408 1.00 3.18 H new ATOM 97 N GLU A 7 5.065 -3.256 8.920 1.00 0.36 N ATOM 98 CA GLU A 7 3.947 -4.188 8.743 1.00 0.37 C ATOM 99 C GLU A 7 3.270 -3.940 7.409 1.00 0.29 C ATOM 100 O GLU A 7 2.933 -4.875 6.686 1.00 0.29 O ATOM 101 CB GLU A 7 2.895 -4.038 9.852 1.00 0.46 C ATOM 102 CG GLU A 7 3.355 -4.464 11.235 1.00 0.60 C ATOM 103 CD GLU A 7 2.236 -4.387 12.257 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.819 -3.257 12.610 1.00 2.00 O ATOM 105 OE2 GLU A 7 1.770 -5.450 12.713 1.00 1.58 O ATOM 0 H GLU A 7 5.004 -2.677 9.758 1.00 0.36 H new ATOM 0 HA GLU A 7 4.361 -5.195 8.785 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.581 -2.995 9.895 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.017 -4.624 9.581 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.736 -5.484 11.192 1.00 0.60 H new ATOM 0 HG3 GLU A 7 4.181 -3.828 11.554 1.00 0.60 H new ATOM 112 N LEU A 8 3.096 -2.666 7.090 1.00 0.27 N ATOM 113 CA LEU A 8 2.420 -2.256 5.871 1.00 0.28 C ATOM 114 C LEU A 8 3.211 -2.716 4.660 1.00 0.28 C ATOM 115 O LEU A 8 2.646 -3.183 3.673 1.00 0.39 O ATOM 116 CB LEU A 8 2.268 -0.736 5.860 1.00 0.31 C ATOM 117 CG LEU A 8 1.720 -0.148 7.154 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.680 1.364 7.072 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.339 -0.712 7.447 1.00 0.35 C ATOM 0 H LEU A 8 3.419 -1.890 7.668 1.00 0.27 H new ATOM 0 HA LEU A 8 1.431 -2.713 5.833 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.240 -0.288 5.655 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.608 -0.455 5.040 1.00 0.31 H new ATOM 0 HG LEU A 8 2.383 -0.426 7.973 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.286 1.769 8.004 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.687 1.746 6.908 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.038 1.667 6.245 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.040 -0.283 8.375 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.337 -0.463 6.629 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.402 -1.795 7.548 1.00 0.35 H new ATOM 131 N VAL A 9 4.525 -2.587 4.756 1.00 0.26 N ATOM 132 CA VAL A 9 5.421 -3.063 3.722 1.00 0.28 C ATOM 133 C VAL A 9 5.342 -4.583 3.624 1.00 0.29 C ATOM 134 O VAL A 9 4.979 -5.128 2.584 1.00 0.31 O ATOM 135 CB VAL A 9 6.870 -2.646 4.025 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.818 -3.205 2.981 1.00 0.38 C ATOM 137 CG2 VAL A 9 6.983 -1.133 4.099 1.00 0.31 C ATOM 0 H VAL A 9 4.995 -2.151 5.549 1.00 0.26 H new ATOM 0 HA VAL A 9 5.117 -2.619 2.774 1.00 0.28 H new ATOM 0 HB VAL A 9 7.151 -3.059 4.994 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.838 -2.898 3.214 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.758 -4.293 2.980 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.541 -2.826 1.997 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.015 -0.855 4.314 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.681 -0.699 3.146 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.334 -0.758 4.890 1.00 0.31 H new ATOM 147 N VAL A 10 5.671 -5.247 4.729 1.00 0.30 N ATOM 148 CA VAL A 10 5.675 -6.702 4.806 1.00 0.32 C ATOM 149 C VAL A 10 4.376 -7.298 4.280 1.00 0.35 C ATOM 150 O VAL A 10 4.399 -8.163 3.403 1.00 0.36 O ATOM 151 CB VAL A 10 5.897 -7.170 6.259 1.00 0.37 C ATOM 152 CG1 VAL A 10 5.637 -8.659 6.400 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.308 -6.834 6.713 1.00 0.38 C ATOM 0 H VAL A 10 5.943 -4.788 5.598 1.00 0.30 H new ATOM 0 HA VAL A 10 6.495 -7.052 4.179 1.00 0.32 H new ATOM 0 HB VAL A 10 5.187 -6.642 6.896 1.00 0.37 H new ATOM 0 HG11 VAL A 10 5.801 -8.961 7.434 1.00 0.42 H new ATOM 0 HG12 VAL A 10 4.607 -8.877 6.118 1.00 0.42 H new ATOM 0 HG13 VAL A 10 6.316 -9.210 5.749 1.00 0.42 H new ATOM 0 HG21 VAL A 10 7.450 -7.170 7.740 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.028 -7.334 6.065 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.460 -5.756 6.660 1.00 0.38 H new ATOM 163 N ASP A 11 3.251 -6.832 4.806 1.00 0.39 N ATOM 164 CA ASP A 11 1.958 -7.391 4.436 1.00 0.46 C ATOM 165 C ASP A 11 1.667 -7.166 2.960 1.00 0.44 C ATOM 166 O ASP A 11 1.103 -8.036 2.297 1.00 0.50 O ATOM 167 CB ASP A 11 0.828 -6.803 5.282 1.00 0.55 C ATOM 168 CG ASP A 11 -0.493 -7.494 5.011 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.600 -8.715 5.253 1.00 0.92 O ATOM 170 OD2 ASP A 11 -1.437 -6.815 4.547 1.00 0.84 O ATOM 0 H ASP A 11 3.207 -6.073 5.486 1.00 0.39 H new ATOM 0 HA ASP A 11 2.008 -8.463 4.627 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.078 -6.897 6.339 1.00 0.55 H new ATOM 0 HB3 ASP A 11 0.732 -5.738 5.071 1.00 0.55 H new ATOM 175 N PHE A 12 2.076 -6.016 2.437 1.00 0.41 N ATOM 176 CA PHE A 12 1.852 -5.711 1.029 1.00 0.42 C ATOM 177 C PHE A 12 2.681 -6.650 0.159 1.00 0.37 C ATOM 178 O PHE A 12 2.188 -7.191 -0.835 1.00 0.41 O ATOM 179 CB PHE A 12 2.208 -4.250 0.710 1.00 0.44 C ATOM 180 CG PHE A 12 1.662 -3.773 -0.610 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.299 -4.092 -1.800 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.506 -3.009 -0.659 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.793 -3.658 -3.011 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.003 -2.573 -1.868 1.00 0.68 C ATOM 185 CZ PHE A 12 0.642 -2.899 -3.045 1.00 0.60 C ATOM 0 H PHE A 12 2.560 -5.286 2.960 1.00 0.41 H new ATOM 0 HA PHE A 12 0.793 -5.854 0.815 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.826 -3.609 1.505 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.293 -4.141 0.706 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.201 -4.686 -1.780 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.003 -2.752 0.258 1.00 0.62 H new ATOM 0 HE1 PHE A 12 2.299 -3.913 -3.930 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -0.904 -1.978 -1.892 1.00 0.68 H new ATOM 0 HZ PHE A 12 0.246 -2.560 -3.991 1.00 0.60 H new ATOM 195 N LEU A 13 3.935 -6.859 0.548 1.00 0.33 N ATOM 196 CA LEU A 13 4.823 -7.743 -0.194 1.00 0.32 C ATOM 197 C LEU A 13 4.315 -9.177 -0.098 1.00 0.33 C ATOM 198 O LEU A 13 4.251 -9.897 -1.095 1.00 0.35 O ATOM 199 CB LEU A 13 6.257 -7.654 0.344 1.00 0.32 C ATOM 200 CG LEU A 13 6.795 -6.234 0.551 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.272 -6.262 0.904 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.556 -5.377 -0.680 1.00 0.38 C ATOM 0 H LEU A 13 4.357 -6.429 1.371 1.00 0.33 H new ATOM 0 HA LEU A 13 4.832 -7.431 -1.238 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.304 -8.184 1.295 1.00 0.32 H new ATOM 0 HB3 LEU A 13 6.919 -8.178 -0.346 1.00 0.32 H new ATOM 0 HG LEU A 13 6.252 -5.789 1.385 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.632 -5.243 1.046 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.416 -6.829 1.824 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.830 -6.734 0.096 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.947 -4.374 -0.507 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.063 -5.821 -1.537 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.486 -5.319 -0.881 1.00 0.38 H new ATOM 214 N SER A 14 3.922 -9.564 1.110 1.00 0.34 N ATOM 215 CA SER A 14 3.385 -10.893 1.363 1.00 0.38 C ATOM 216 C SER A 14 2.098 -11.114 0.569 1.00 0.39 C ATOM 217 O SER A 14 1.843 -12.212 0.080 1.00 0.41 O ATOM 218 CB SER A 14 3.132 -11.078 2.867 1.00 0.45 C ATOM 219 OG SER A 14 2.632 -12.372 3.160 1.00 1.14 O ATOM 0 H SER A 14 3.967 -8.968 1.937 1.00 0.34 H new ATOM 0 HA SER A 14 4.114 -11.634 1.036 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.060 -10.914 3.415 1.00 0.45 H new ATOM 0 HB3 SER A 14 2.421 -10.327 3.211 1.00 0.45 H new ATOM 0 HG SER A 14 2.484 -12.455 4.125 1.00 1.14 H new ATOM 225 N TYR A 15 1.312 -10.053 0.410 1.00 0.42 N ATOM 226 CA TYR A 15 0.037 -10.130 -0.302 1.00 0.47 C ATOM 227 C TYR A 15 0.265 -10.475 -1.770 1.00 0.45 C ATOM 228 O TYR A 15 -0.536 -11.183 -2.386 1.00 0.52 O ATOM 229 CB TYR A 15 -0.718 -8.798 -0.177 1.00 0.55 C ATOM 230 CG TYR A 15 -2.066 -8.771 -0.871 1.00 0.66 C ATOM 231 CD1 TYR A 15 -3.174 -9.396 -0.311 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.231 -8.112 -2.085 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.405 -9.367 -0.941 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.458 -8.080 -2.720 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.541 -8.709 -2.145 1.00 1.02 C ATOM 236 OH TYR A 15 -5.763 -8.677 -2.779 1.00 1.20 O ATOM 0 H TYR A 15 1.536 -9.124 0.766 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.566 -10.919 0.147 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.863 -8.575 0.880 1.00 0.55 H new ATOM 0 HB3 TYR A 15 -0.096 -8.003 -0.588 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -3.072 -9.913 0.632 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.385 -7.617 -2.539 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -5.256 -9.858 -0.492 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.568 -7.564 -3.663 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.685 -8.172 -3.615 1.00 1.20 H new ATOM 246 N LYS A 16 1.368 -9.987 -2.317 1.00 0.40 N ATOM 247 CA LYS A 16 1.700 -10.241 -3.709 1.00 0.41 C ATOM 248 C LYS A 16 2.380 -11.595 -3.859 1.00 0.35 C ATOM 249 O LYS A 16 1.996 -12.396 -4.707 1.00 0.39 O ATOM 250 CB LYS A 16 2.598 -9.130 -4.256 1.00 0.49 C ATOM 251 CG LYS A 16 1.904 -7.780 -4.348 1.00 0.90 C ATOM 252 CD LYS A 16 0.751 -7.816 -5.338 1.00 0.83 C ATOM 253 CE LYS A 16 -0.002 -6.497 -5.366 1.00 1.35 C ATOM 254 NZ LYS A 16 -1.101 -6.505 -6.368 1.00 1.39 N ATOM 0 H LYS A 16 2.048 -9.413 -1.818 1.00 0.40 H new ATOM 0 HA LYS A 16 0.775 -10.255 -4.285 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.476 -9.036 -3.617 1.00 0.49 H new ATOM 0 HB3 LYS A 16 2.953 -9.415 -5.246 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.532 -7.492 -3.365 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.623 -7.019 -4.652 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.133 -8.039 -6.334 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.066 -8.621 -5.071 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -0.414 -6.293 -4.378 1.00 1.35 H new ATOM 0 HE3 LYS A 16 0.692 -5.688 -5.595 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -1.976 -6.159 -5.926 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -0.848 -5.887 -7.166 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -1.248 -7.475 -6.714 1.00 1.39 H new ATOM 268 N LEU A 17 3.375 -11.850 -3.019 1.00 0.30 N ATOM 269 CA LEU A 17 4.121 -13.099 -3.065 1.00 0.27 C ATOM 270 C LEU A 17 3.212 -14.306 -2.858 1.00 0.31 C ATOM 271 O LEU A 17 3.355 -15.317 -3.545 1.00 0.32 O ATOM 272 CB LEU A 17 5.222 -13.085 -2.008 1.00 0.25 C ATOM 273 CG LEU A 17 6.308 -12.044 -2.239 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.201 -11.939 -1.024 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.124 -12.394 -3.467 1.00 0.25 C ATOM 0 H LEU A 17 3.685 -11.203 -2.294 1.00 0.30 H new ATOM 0 HA LEU A 17 4.567 -13.186 -4.056 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.769 -12.908 -1.033 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.684 -14.071 -1.971 1.00 0.25 H new ATOM 0 HG LEU A 17 5.833 -11.077 -2.405 1.00 0.24 H new ATOM 0 HD11 LEU A 17 7.973 -11.191 -1.203 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.606 -11.646 -0.159 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.669 -12.904 -0.832 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.896 -11.640 -3.618 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.591 -13.369 -3.328 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.472 -12.426 -4.340 1.00 0.25 H new ATOM 287 N SER A 18 2.269 -14.192 -1.929 1.00 0.37 N ATOM 288 CA SER A 18 1.339 -15.283 -1.654 1.00 0.44 C ATOM 289 C SER A 18 0.458 -15.552 -2.871 1.00 0.47 C ATOM 290 O SER A 18 0.040 -16.685 -3.112 1.00 0.51 O ATOM 291 CB SER A 18 0.476 -14.953 -0.432 1.00 0.54 C ATOM 292 OG SER A 18 1.283 -14.704 0.709 1.00 1.26 O ATOM 0 H SER A 18 2.128 -13.360 -1.356 1.00 0.37 H new ATOM 0 HA SER A 18 1.915 -16.183 -1.439 1.00 0.44 H new ATOM 0 HB2 SER A 18 -0.141 -14.079 -0.643 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.203 -15.781 -0.228 1.00 0.54 H new ATOM 0 HG SER A 18 1.829 -13.905 0.555 1.00 1.26 H new ATOM 298 N GLN A 19 0.204 -14.508 -3.655 1.00 0.48 N ATOM 299 CA GLN A 19 -0.602 -14.630 -4.859 1.00 0.53 C ATOM 300 C GLN A 19 0.236 -15.239 -5.980 1.00 0.48 C ATOM 301 O GLN A 19 -0.278 -15.927 -6.863 1.00 0.55 O ATOM 302 CB GLN A 19 -1.124 -13.251 -5.273 1.00 0.59 C ATOM 303 CG GLN A 19 -2.152 -13.279 -6.389 1.00 0.71 C ATOM 304 CD GLN A 19 -2.554 -11.886 -6.828 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.477 -11.289 -6.275 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.869 -11.357 -7.830 1.00 1.65 N ATOM 0 H GLN A 19 0.548 -13.565 -3.474 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.452 -15.283 -4.662 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.565 -12.766 -4.402 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.281 -12.636 -5.588 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.747 -13.824 -7.241 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -3.036 -13.822 -6.054 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -1.110 -11.883 -8.263 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -2.100 -10.423 -8.169 1.00 1.65 H new ATOM 315 N LYS A 20 1.537 -14.992 -5.915 1.00 0.41 N ATOM 316 CA LYS A 20 2.483 -15.510 -6.895 1.00 0.40 C ATOM 317 C LYS A 20 2.868 -16.953 -6.576 1.00 0.44 C ATOM 318 O LYS A 20 3.614 -17.586 -7.322 1.00 0.48 O ATOM 319 CB LYS A 20 3.737 -14.630 -6.920 1.00 0.36 C ATOM 320 CG LYS A 20 3.480 -13.207 -7.392 1.00 0.68 C ATOM 321 CD LYS A 20 3.286 -13.146 -8.898 1.00 0.61 C ATOM 322 CE LYS A 20 2.781 -11.784 -9.354 1.00 1.06 C ATOM 323 NZ LYS A 20 2.724 -11.695 -10.836 1.00 1.87 N ATOM 0 H LYS A 20 1.967 -14.427 -5.182 1.00 0.41 H new ATOM 0 HA LYS A 20 2.006 -15.493 -7.875 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.167 -14.599 -5.919 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.479 -15.090 -7.572 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.595 -12.812 -6.894 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.318 -12.571 -7.106 1.00 0.68 H new ATOM 0 HD2 LYS A 20 4.231 -13.367 -9.394 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.578 -13.916 -9.204 1.00 0.61 H new ATOM 0 HE2 LYS A 20 1.789 -11.604 -8.939 1.00 1.06 H new ATOM 0 HE3 LYS A 20 3.435 -11.003 -8.966 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 2.376 -10.755 -11.114 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 3.675 -11.843 -11.229 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.081 -12.425 -11.203 1.00 1.87 H new ATOM 337 N GLY A 21 2.363 -17.462 -5.459 1.00 0.48 N ATOM 338 CA GLY A 21 2.629 -18.839 -5.086 1.00 0.54 C ATOM 339 C GLY A 21 3.885 -19.003 -4.245 1.00 0.53 C ATOM 340 O GLY A 21 4.508 -20.065 -4.260 1.00 0.67 O ATOM 0 H GLY A 21 1.774 -16.946 -4.805 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.776 -19.229 -4.532 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.724 -19.441 -5.990 1.00 0.54 H new ATOM 344 N TYR A 22 4.274 -17.959 -3.521 1.00 0.43 N ATOM 345 CA TYR A 22 5.415 -18.047 -2.613 1.00 0.42 C ATOM 346 C TYR A 22 4.975 -17.754 -1.182 1.00 0.43 C ATOM 347 O TYR A 22 4.078 -16.940 -0.959 1.00 0.46 O ATOM 348 CB TYR A 22 6.528 -17.077 -3.033 1.00 0.40 C ATOM 349 CG TYR A 22 7.097 -17.360 -4.409 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.587 -18.619 -4.741 1.00 0.65 C ATOM 351 CD2 TYR A 22 7.138 -16.366 -5.377 1.00 0.47 C ATOM 352 CE1 TYR A 22 8.104 -18.873 -5.998 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.652 -16.613 -6.636 1.00 0.57 C ATOM 354 CZ TYR A 22 8.134 -17.867 -6.941 1.00 0.69 C ATOM 355 OH TYR A 22 8.653 -18.121 -8.194 1.00 0.81 O ATOM 0 H TYR A 22 3.820 -17.046 -3.544 1.00 0.43 H new ATOM 0 HA TYR A 22 5.810 -19.062 -2.662 1.00 0.42 H new ATOM 0 HB2 TYR A 22 6.137 -16.060 -3.014 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.334 -17.123 -2.300 1.00 0.40 H new ATOM 0 HD1 TYR A 22 7.563 -19.410 -4.006 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.761 -15.381 -5.142 1.00 0.47 H new ATOM 0 HE1 TYR A 22 8.483 -19.855 -6.240 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.676 -15.827 -7.377 1.00 0.57 H new ATOM 0 HH TYR A 22 8.600 -17.309 -8.741 1.00 0.81 H new ATOM 365 N SER A 23 5.602 -18.415 -0.219 1.00 0.45 N ATOM 366 CA SER A 23 5.219 -18.272 1.178 1.00 0.49 C ATOM 367 C SER A 23 6.173 -17.339 1.925 1.00 0.43 C ATOM 368 O SER A 23 7.370 -17.612 2.033 1.00 0.44 O ATOM 369 CB SER A 23 5.186 -19.648 1.838 1.00 0.59 C ATOM 370 OG SER A 23 4.324 -20.522 1.124 1.00 1.41 O ATOM 0 H SER A 23 6.379 -19.056 -0.380 1.00 0.45 H new ATOM 0 HA SER A 23 4.226 -17.825 1.223 1.00 0.49 H new ATOM 0 HB2 SER A 23 6.192 -20.066 1.870 1.00 0.59 H new ATOM 0 HB3 SER A 23 4.846 -19.555 2.869 1.00 0.59 H new ATOM 0 HG SER A 23 4.315 -21.400 1.559 1.00 1.41 H new ATOM 376 N TRP A 24 5.624 -16.247 2.456 1.00 0.43 N ATOM 377 CA TRP A 24 6.422 -15.220 3.125 1.00 0.41 C ATOM 378 C TRP A 24 7.025 -15.730 4.436 1.00 0.47 C ATOM 379 O TRP A 24 8.096 -15.276 4.842 1.00 0.53 O ATOM 380 CB TRP A 24 5.577 -13.960 3.387 1.00 0.44 C ATOM 381 CG TRP A 24 6.319 -12.891 4.144 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.293 -12.674 5.493 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.200 -11.898 3.600 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.111 -11.624 5.817 1.00 0.57 N ATOM 385 CE2 TRP A 24 7.673 -11.126 4.676 1.00 0.50 C ATOM 386 CE3 TRP A 24 7.636 -11.585 2.311 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.559 -10.066 4.504 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.516 -10.532 2.140 1.00 0.43 C ATOM 389 CH2 TRP A 24 8.969 -9.783 3.231 1.00 0.48 C ATOM 0 H TRP A 24 4.623 -16.050 2.435 1.00 0.43 H new ATOM 0 HA TRP A 24 7.244 -14.965 2.457 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.240 -13.553 2.434 1.00 0.44 H new ATOM 0 HB3 TRP A 24 4.685 -14.240 3.948 1.00 0.44 H new ATOM 0 HD1 TRP A 24 5.712 -13.247 6.201 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.274 -11.271 6.760 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.292 -12.156 1.461 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 8.910 -9.488 5.346 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 8.859 -10.284 1.147 1.00 0.43 H new ATOM 0 HH2 TRP A 24 9.655 -8.966 3.065 1.00 0.48 H new ATOM 400 N SER A 25 6.355 -16.674 5.094 1.00 0.54 N ATOM 401 CA SER A 25 6.839 -17.194 6.372 1.00 0.63 C ATOM 402 C SER A 25 8.248 -17.781 6.236 1.00 0.63 C ATOM 403 O SER A 25 9.055 -17.699 7.162 1.00 0.75 O ATOM 404 CB SER A 25 5.873 -18.246 6.920 1.00 0.75 C ATOM 405 OG SER A 25 4.554 -17.728 7.013 1.00 1.20 O ATOM 0 H SER A 25 5.483 -17.092 4.768 1.00 0.54 H new ATOM 0 HA SER A 25 6.889 -16.362 7.075 1.00 0.63 H new ATOM 0 HB2 SER A 25 5.878 -19.122 6.272 1.00 0.75 H new ATOM 0 HB3 SER A 25 6.208 -18.575 7.904 1.00 0.75 H new ATOM 0 HG SER A 25 3.955 -18.420 7.364 1.00 1.20 H new ATOM 411 N GLN A 26 8.549 -18.341 5.067 1.00 0.61 N ATOM 412 CA GLN A 26 9.868 -18.906 4.799 1.00 0.73 C ATOM 413 C GLN A 26 10.923 -17.803 4.719 1.00 0.79 C ATOM 414 O GLN A 26 12.093 -18.018 5.042 1.00 0.93 O ATOM 415 CB GLN A 26 9.850 -19.704 3.488 1.00 0.80 C ATOM 416 CG GLN A 26 11.175 -20.382 3.160 1.00 1.25 C ATOM 417 CD GLN A 26 11.169 -21.067 1.805 1.00 1.53 C ATOM 418 OE1 GLN A 26 11.839 -22.080 1.612 1.00 1.91 O ATOM 419 NE2 GLN A 26 10.425 -20.514 0.859 1.00 2.26 N ATOM 0 H GLN A 26 7.895 -18.415 4.288 1.00 0.61 H new ATOM 0 HA GLN A 26 10.124 -19.575 5.621 1.00 0.73 H new ATOM 0 HB2 GLN A 26 9.070 -20.463 3.546 1.00 0.80 H new ATOM 0 HB3 GLN A 26 9.583 -19.035 2.670 1.00 0.80 H new ATOM 0 HG2 GLN A 26 11.973 -19.639 3.182 1.00 1.25 H new ATOM 0 HG3 GLN A 26 11.402 -21.117 3.932 1.00 1.25 H new ATOM 0 HE21 GLN A 26 9.884 -19.673 1.062 1.00 2.26 H new ATOM 0 HE22 GLN A 26 10.393 -20.929 -0.072 1.00 2.26 H new ATOM 644 N GLU A 42 -3.012 2.237 14.531 1.00 1.02 N ATOM 645 CA GLU A 42 -3.630 2.693 13.290 1.00 0.87 C ATOM 646 C GLU A 42 -3.131 1.860 12.111 1.00 0.73 C ATOM 647 O GLU A 42 -3.597 2.013 10.981 1.00 0.63 O ATOM 648 CB GLU A 42 -3.326 4.175 13.057 1.00 1.05 C ATOM 649 CG GLU A 42 -1.873 4.461 12.711 1.00 1.53 C ATOM 650 CD GLU A 42 -1.546 5.937 12.743 1.00 2.12 C ATOM 651 OE1 GLU A 42 -2.009 6.677 11.851 1.00 2.42 O ATOM 652 OE2 GLU A 42 -0.821 6.367 13.664 1.00 2.82 O ATOM 0 HA GLU A 42 -4.709 2.567 13.374 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -3.960 4.543 12.250 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -3.593 4.735 13.953 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -1.226 3.934 13.413 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -1.655 4.066 11.719 1.00 1.53 H new ATOM 659 N SER A 43 -2.190 0.968 12.401 1.00 0.79 N ATOM 660 CA SER A 43 -1.574 0.121 11.388 1.00 0.75 C ATOM 661 C SER A 43 -2.620 -0.737 10.681 1.00 0.67 C ATOM 662 O SER A 43 -2.539 -0.960 9.475 1.00 0.62 O ATOM 663 CB SER A 43 -0.507 -0.767 12.038 1.00 0.94 C ATOM 664 OG SER A 43 0.206 -1.528 11.079 1.00 1.14 O ATOM 0 H SER A 43 -1.834 0.812 13.344 1.00 0.79 H new ATOM 0 HA SER A 43 -1.104 0.760 10.640 1.00 0.75 H new ATOM 0 HB2 SER A 43 0.191 -0.144 12.598 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.981 -1.438 12.754 1.00 0.94 H new ATOM 0 HG SER A 43 0.798 -2.160 11.538 1.00 1.14 H new ATOM 670 N GLU A 44 -3.624 -1.178 11.425 1.00 0.72 N ATOM 671 CA GLU A 44 -4.645 -2.062 10.878 1.00 0.73 C ATOM 672 C GLU A 44 -5.517 -1.344 9.850 1.00 0.61 C ATOM 673 O GLU A 44 -6.105 -1.978 8.972 1.00 0.66 O ATOM 674 CB GLU A 44 -5.512 -2.639 11.997 1.00 0.85 C ATOM 675 CG GLU A 44 -4.748 -3.548 12.946 1.00 1.32 C ATOM 676 CD GLU A 44 -5.655 -4.227 13.945 1.00 1.96 C ATOM 677 OE1 GLU A 44 -6.233 -5.279 13.604 1.00 1.90 O ATOM 678 OE2 GLU A 44 -5.802 -3.707 15.070 1.00 2.98 O ATOM 0 H GLU A 44 -3.754 -0.939 12.408 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.134 -2.880 10.370 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -5.951 -1.819 12.566 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.337 -3.198 11.556 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.215 -4.304 12.370 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -3.997 -2.964 13.479 1.00 1.32 H new ATOM 685 N ALA A 45 -5.585 -0.025 9.946 1.00 0.53 N ATOM 686 CA ALA A 45 -6.375 0.760 9.014 1.00 0.45 C ATOM 687 C ALA A 45 -5.613 0.962 7.715 1.00 0.39 C ATOM 688 O ALA A 45 -6.122 0.678 6.633 1.00 0.39 O ATOM 689 CB ALA A 45 -6.738 2.097 9.632 1.00 0.48 C ATOM 0 H ALA A 45 -5.103 0.522 10.659 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.295 0.219 8.792 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.330 2.676 8.924 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.318 1.933 10.540 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.827 2.644 9.877 1.00 0.48 H new ATOM 695 N VAL A 46 -4.379 1.431 7.828 1.00 0.36 N ATOM 696 CA VAL A 46 -3.539 1.665 6.664 1.00 0.32 C ATOM 697 C VAL A 46 -3.207 0.353 5.953 1.00 0.34 C ATOM 698 O VAL A 46 -3.077 0.309 4.729 1.00 0.35 O ATOM 699 CB VAL A 46 -2.253 2.423 7.045 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.676 1.901 8.346 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.232 2.327 5.932 1.00 0.34 C ATOM 0 H VAL A 46 -3.936 1.658 8.718 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.102 2.291 5.972 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.510 3.472 7.190 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.769 2.454 8.590 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.406 2.030 9.145 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.438 0.843 8.240 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.330 2.868 6.218 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.986 1.280 5.753 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.644 2.764 5.022 1.00 0.34 H new ATOM 711 N LYS A 47 -3.102 -0.711 6.730 1.00 0.41 N ATOM 712 CA LYS A 47 -2.899 -2.053 6.194 1.00 0.50 C ATOM 713 C LYS A 47 -3.999 -2.391 5.183 1.00 0.51 C ATOM 714 O LYS A 47 -3.747 -3.020 4.155 1.00 0.59 O ATOM 715 CB LYS A 47 -2.904 -3.058 7.354 1.00 0.63 C ATOM 716 CG LYS A 47 -2.580 -4.489 6.968 1.00 0.84 C ATOM 717 CD LYS A 47 -2.474 -5.364 8.208 1.00 1.45 C ATOM 718 CE LYS A 47 -2.175 -6.810 7.857 1.00 1.93 C ATOM 719 NZ LYS A 47 -3.318 -7.466 7.171 1.00 2.14 N ATOM 0 H LYS A 47 -3.154 -0.673 7.748 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.940 -2.102 5.678 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.184 -2.728 8.103 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.886 -3.039 7.826 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.354 -4.878 6.306 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -1.642 -4.519 6.413 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.689 -4.978 8.858 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -3.407 -5.312 8.770 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -1.295 -6.852 7.215 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -1.934 -7.361 8.766 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.133 -8.486 7.086 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -4.187 -7.316 7.723 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -3.436 -7.056 6.223 1.00 2.14 H new ATOM 733 N GLN A 48 -5.214 -1.952 5.484 1.00 0.47 N ATOM 734 CA GLN A 48 -6.344 -2.128 4.580 1.00 0.52 C ATOM 735 C GLN A 48 -6.323 -1.059 3.489 1.00 0.48 C ATOM 736 O GLN A 48 -6.650 -1.326 2.332 1.00 0.54 O ATOM 737 CB GLN A 48 -7.655 -2.065 5.369 1.00 0.55 C ATOM 738 CG GLN A 48 -8.913 -2.219 4.520 1.00 0.85 C ATOM 739 CD GLN A 48 -8.960 -3.521 3.738 1.00 1.50 C ATOM 740 OE1 GLN A 48 -8.396 -4.534 4.151 1.00 2.23 O ATOM 741 NE2 GLN A 48 -9.647 -3.504 2.605 1.00 2.02 N ATOM 0 H GLN A 48 -5.443 -1.469 6.352 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.268 -3.105 4.103 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.646 -2.848 6.127 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.702 -1.112 5.896 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.788 -2.161 5.167 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.976 -1.383 3.823 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -10.101 -2.644 2.296 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -9.722 -4.351 2.041 1.00 2.02 H new ATOM 750 N ALA A 49 -5.922 0.149 3.872 1.00 0.42 N ATOM 751 CA ALA A 49 -5.853 1.275 2.952 1.00 0.40 C ATOM 752 C ALA A 49 -4.948 0.967 1.765 1.00 0.39 C ATOM 753 O ALA A 49 -5.324 1.188 0.616 1.00 0.42 O ATOM 754 CB ALA A 49 -5.360 2.512 3.680 1.00 0.36 C ATOM 0 H ALA A 49 -5.637 0.373 4.825 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.856 1.460 2.569 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.312 3.349 2.983 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.046 2.754 4.491 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.367 2.322 4.089 1.00 0.36 H new ATOM 760 N LEU A 50 -3.759 0.445 2.046 1.00 0.38 N ATOM 761 CA LEU A 50 -2.806 0.114 0.990 1.00 0.39 C ATOM 762 C LEU A 50 -3.294 -1.060 0.148 1.00 0.46 C ATOM 763 O LEU A 50 -2.925 -1.186 -1.016 1.00 0.49 O ATOM 764 CB LEU A 50 -1.415 -0.189 1.562 1.00 0.39 C ATOM 765 CG LEU A 50 -0.469 1.017 1.656 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.236 1.632 0.282 1.00 0.31 C ATOM 767 CD2 LEU A 50 -1.013 2.059 2.614 1.00 0.29 C ATOM 0 H LEU A 50 -3.432 0.242 2.991 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.728 0.990 0.347 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.534 -0.615 2.558 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -0.944 -0.953 0.943 1.00 0.39 H new ATOM 0 HG LEU A 50 0.487 0.662 2.041 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.437 2.484 0.374 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.209 0.888 -0.379 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.187 1.964 -0.134 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.325 2.903 2.663 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.986 2.404 2.263 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.120 1.620 3.606 1.00 0.29 H new ATOM 779 N ARG A 51 -4.131 -1.910 0.732 1.00 0.52 N ATOM 780 CA ARG A 51 -4.718 -3.021 -0.010 1.00 0.61 C ATOM 781 C ARG A 51 -5.660 -2.485 -1.087 1.00 0.62 C ATOM 782 O ARG A 51 -5.716 -3.007 -2.203 1.00 0.69 O ATOM 783 CB ARG A 51 -5.464 -3.975 0.929 1.00 0.67 C ATOM 784 CG ARG A 51 -6.108 -5.152 0.212 1.00 0.98 C ATOM 785 CD ARG A 51 -6.841 -6.075 1.173 1.00 1.49 C ATOM 786 NE ARG A 51 -5.927 -6.846 2.016 1.00 2.00 N ATOM 787 CZ ARG A 51 -6.287 -7.932 2.703 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.543 -8.362 2.674 1.00 3.39 N ATOM 789 NH2 ARG A 51 -5.387 -8.599 3.408 1.00 3.74 N ATOM 0 H ARG A 51 -4.417 -1.853 1.709 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.915 -3.582 -0.487 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.768 -4.353 1.678 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.235 -3.418 1.462 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -6.807 -4.781 -0.538 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -5.341 -5.717 -0.319 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -7.503 -5.484 1.806 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -7.471 -6.759 0.605 1.00 1.49 H new ATOM 0 HE ARG A 51 -4.958 -6.535 2.083 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -8.241 -7.861 2.124 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -7.810 -9.193 3.202 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -4.417 -8.283 3.427 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -5.663 -9.429 3.933 1.00 3.74 H new ATOM 803 N GLU A 52 -6.389 -1.429 -0.745 1.00 0.59 N ATOM 804 CA GLU A 52 -7.255 -0.755 -1.705 1.00 0.62 C ATOM 805 C GLU A 52 -6.432 0.102 -2.660 1.00 0.59 C ATOM 806 O GLU A 52 -6.646 0.087 -3.873 1.00 0.65 O ATOM 807 CB GLU A 52 -8.271 0.130 -0.979 1.00 0.66 C ATOM 808 CG GLU A 52 -9.322 -0.639 -0.202 1.00 0.92 C ATOM 809 CD GLU A 52 -10.228 -1.449 -1.102 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.109 -0.860 -1.759 1.00 1.45 O ATOM 811 OE2 GLU A 52 -10.048 -2.682 -1.169 1.00 1.88 O ATOM 0 H GLU A 52 -6.398 -1.021 0.190 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.784 -1.519 -2.275 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.738 0.789 -0.293 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -8.769 0.767 -1.710 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.830 -1.304 0.508 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.923 0.060 0.380 1.00 0.92 H new ATOM 818 N ALA A 53 -5.484 0.839 -2.098 1.00 0.52 N ATOM 819 CA ALA A 53 -4.676 1.780 -2.855 1.00 0.49 C ATOM 820 C ALA A 53 -3.788 1.077 -3.872 1.00 0.52 C ATOM 821 O ALA A 53 -3.773 1.445 -5.048 1.00 0.53 O ATOM 822 CB ALA A 53 -3.834 2.605 -1.902 1.00 0.43 C ATOM 0 H ALA A 53 -5.255 0.800 -1.105 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.349 2.433 -3.411 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.228 3.311 -2.470 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.486 3.152 -1.221 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.182 1.946 -1.329 1.00 0.43 H new ATOM 828 N GLY A 54 -3.058 0.065 -3.415 1.00 0.57 N ATOM 829 CA GLY A 54 -2.130 -0.643 -4.280 1.00 0.64 C ATOM 830 C GLY A 54 -2.810 -1.254 -5.485 1.00 0.74 C ATOM 831 O GLY A 54 -2.212 -1.363 -6.555 1.00 0.82 O ATOM 0 H GLY A 54 -3.093 -0.280 -2.456 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.354 0.045 -4.615 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -1.634 -1.429 -3.710 1.00 0.64 H new ATOM 835 N ASP A 55 -4.067 -1.635 -5.318 1.00 0.79 N ATOM 836 CA ASP A 55 -4.832 -2.219 -6.409 1.00 0.92 C ATOM 837 C ASP A 55 -5.408 -1.123 -7.292 1.00 0.88 C ATOM 838 O ASP A 55 -5.453 -1.255 -8.515 1.00 0.97 O ATOM 839 CB ASP A 55 -5.954 -3.103 -5.869 1.00 1.04 C ATOM 840 CG ASP A 55 -6.747 -3.767 -6.975 1.00 1.12 C ATOM 841 OD1 ASP A 55 -6.258 -4.766 -7.543 1.00 1.34 O ATOM 842 OD2 ASP A 55 -7.867 -3.301 -7.280 1.00 1.29 O ATOM 0 H ASP A 55 -4.578 -1.551 -4.439 1.00 0.79 H new ATOM 0 HA ASP A 55 -4.162 -2.838 -7.005 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -5.529 -3.869 -5.220 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -6.624 -2.501 -5.256 1.00 1.04 H new ATOM 847 N GLU A 56 -5.829 -0.031 -6.661 1.00 0.79 N ATOM 848 CA GLU A 56 -6.367 1.114 -7.381 1.00 0.83 C ATOM 849 C GLU A 56 -5.320 1.648 -8.353 1.00 0.78 C ATOM 850 O GLU A 56 -5.617 1.908 -9.518 1.00 0.85 O ATOM 851 CB GLU A 56 -6.788 2.217 -6.400 1.00 0.83 C ATOM 852 CG GLU A 56 -7.629 3.316 -7.029 1.00 0.94 C ATOM 853 CD GLU A 56 -8.998 2.825 -7.449 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.772 2.391 -6.570 1.00 1.38 O ATOM 855 OE2 GLU A 56 -9.305 2.858 -8.661 1.00 2.06 O ATOM 0 H GLU A 56 -5.807 0.083 -5.648 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.247 0.796 -7.940 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.350 1.766 -5.582 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -5.894 2.662 -5.964 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.742 4.135 -6.319 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -7.107 3.717 -7.898 1.00 0.94 H new ATOM 862 N PHE A 57 -4.088 1.773 -7.869 1.00 0.72 N ATOM 863 CA PHE A 57 -2.986 2.268 -8.685 1.00 0.76 C ATOM 864 C PHE A 57 -2.619 1.245 -9.758 1.00 0.82 C ATOM 865 O PHE A 57 -2.347 1.600 -10.908 1.00 0.90 O ATOM 866 CB PHE A 57 -1.766 2.570 -7.800 1.00 0.77 C ATOM 867 CG PHE A 57 -0.630 3.247 -8.523 1.00 0.94 C ATOM 868 CD1 PHE A 57 0.343 2.502 -9.177 1.00 1.05 C ATOM 869 CD2 PHE A 57 -0.536 4.629 -8.549 1.00 1.07 C ATOM 870 CE1 PHE A 57 1.383 3.125 -9.841 1.00 1.25 C ATOM 871 CE2 PHE A 57 0.502 5.255 -9.210 1.00 1.26 C ATOM 872 CZ PHE A 57 1.462 4.503 -9.858 1.00 1.34 C ATOM 0 H PHE A 57 -3.828 1.537 -6.911 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.301 3.189 -9.175 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.081 3.202 -6.970 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.403 1.636 -7.370 1.00 0.77 H new ATOM 0 HD1 PHE A 57 0.286 1.424 -9.167 1.00 1.05 H new ATOM 0 HD2 PHE A 57 -1.284 5.224 -8.046 1.00 1.07 H new ATOM 0 HE1 PHE A 57 2.133 2.534 -10.346 1.00 1.25 H new ATOM 0 HE2 PHE A 57 0.563 6.333 -9.220 1.00 1.26 H new ATOM 0 HZ PHE A 57 2.273 4.992 -10.377 1.00 1.34 H new ATOM 882 N GLU A 58 -2.651 -0.029 -9.381 1.00 0.83 N ATOM 883 CA GLU A 58 -2.224 -1.113 -10.264 1.00 0.95 C ATOM 884 C GLU A 58 -3.188 -1.281 -11.437 1.00 0.99 C ATOM 885 O GLU A 58 -2.794 -1.701 -12.520 1.00 1.08 O ATOM 886 CB GLU A 58 -2.123 -2.422 -9.468 1.00 1.05 C ATOM 887 CG GLU A 58 -1.585 -3.604 -10.260 1.00 1.35 C ATOM 888 CD GLU A 58 -1.583 -4.879 -9.443 1.00 1.27 C ATOM 889 OE1 GLU A 58 -2.605 -5.596 -9.457 1.00 1.61 O ATOM 890 OE2 GLU A 58 -0.571 -5.165 -8.773 1.00 1.45 O ATOM 0 H GLU A 58 -2.970 -0.339 -8.463 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.244 -0.860 -10.669 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.480 -2.258 -8.603 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.112 -2.677 -9.086 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.191 -3.747 -11.155 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -0.571 -3.385 -10.594 1.00 1.35 H new ATOM 897 N LEU A 59 -4.455 -0.965 -11.218 1.00 0.98 N ATOM 898 CA LEU A 59 -5.449 -1.046 -12.278 1.00 1.10 C ATOM 899 C LEU A 59 -5.555 0.278 -13.035 1.00 1.10 C ATOM 900 O LEU A 59 -6.151 0.349 -14.111 1.00 1.24 O ATOM 901 CB LEU A 59 -6.808 -1.425 -11.689 1.00 1.19 C ATOM 902 CG LEU A 59 -7.913 -1.686 -12.711 1.00 1.36 C ATOM 903 CD1 LEU A 59 -7.584 -2.909 -13.556 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.251 -1.858 -12.013 1.00 1.56 C ATOM 0 H LEU A 59 -4.819 -0.651 -10.318 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.135 -1.815 -12.984 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -6.684 -2.318 -11.077 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.133 -0.625 -11.024 1.00 1.19 H new ATOM 0 HG LEU A 59 -7.981 -0.824 -13.374 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -8.383 -3.078 -14.278 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -6.646 -2.744 -14.086 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -7.487 -3.782 -12.910 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.027 -2.043 -12.755 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.197 -2.702 -11.326 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.490 -0.952 -11.456 1.00 1.56 H new ATOM 916 N ARG A 60 -4.969 1.325 -12.475 1.00 1.00 N ATOM 917 CA ARG A 60 -5.086 2.659 -13.056 1.00 1.06 C ATOM 918 C ARG A 60 -3.891 2.978 -13.954 1.00 1.00 C ATOM 919 O ARG A 60 -4.046 3.566 -15.024 1.00 1.07 O ATOM 920 CB ARG A 60 -5.212 3.714 -11.949 1.00 1.10 C ATOM 921 CG ARG A 60 -5.473 5.120 -12.461 1.00 1.19 C ATOM 922 CD ARG A 60 -6.808 5.217 -13.183 1.00 1.31 C ATOM 923 NE ARG A 60 -7.065 6.569 -13.669 1.00 1.81 N ATOM 924 CZ ARG A 60 -8.273 7.125 -13.716 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.340 6.442 -13.313 1.00 2.15 N ATOM 926 NH2 ARG A 60 -8.409 8.365 -14.168 1.00 3.21 N ATOM 0 H ARG A 60 -4.410 1.280 -11.623 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.986 2.679 -13.670 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -6.022 3.427 -11.278 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -4.295 3.718 -11.359 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -5.459 5.820 -11.625 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -4.671 5.416 -13.137 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -6.819 4.521 -14.022 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.609 4.915 -12.508 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.271 7.121 -13.992 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.234 5.489 -12.966 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.264 6.871 -13.350 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -7.590 8.888 -14.478 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -9.333 8.796 -14.206 1.00 3.21 H new ATOM 940 N TYR A 61 -2.702 2.585 -13.518 1.00 0.91 N ATOM 941 CA TYR A 61 -1.483 2.870 -14.266 1.00 0.90 C ATOM 942 C TYR A 61 -0.654 1.606 -14.431 1.00 0.84 C ATOM 943 O TYR A 61 0.554 1.626 -14.219 1.00 0.83 O ATOM 944 CB TYR A 61 -0.641 3.933 -13.550 1.00 0.96 C ATOM 945 CG TYR A 61 -1.284 5.298 -13.478 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.332 6.126 -14.592 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.858 5.754 -12.297 1.00 1.04 C ATOM 948 CE1 TYR A 61 -1.933 7.369 -14.532 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.458 6.996 -12.229 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.440 7.822 -13.341 1.00 1.27 C ATOM 951 OH TYR A 61 -3.100 9.031 -13.287 1.00 1.41 O ATOM 0 H TYR A 61 -2.555 2.068 -12.651 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.774 3.246 -15.247 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.431 3.590 -12.537 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.318 4.023 -14.061 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -0.892 5.793 -15.521 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.834 5.127 -11.418 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -2.003 7.981 -15.419 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -2.937 7.320 -11.317 1.00 1.14 H new ATOM 0 HH TYR A 61 -3.396 9.201 -12.369 1.00 1.41 H new ATOM 961 N ARG A 62 -1.294 0.516 -14.830 1.00 0.86 N ATOM 962 CA ARG A 62 -0.613 -0.773 -14.913 1.00 0.85 C ATOM 963 C ARG A 62 0.476 -0.760 -15.981 1.00 0.87 C ATOM 964 O ARG A 62 1.575 -1.275 -15.765 1.00 0.85 O ATOM 965 CB ARG A 62 -1.612 -1.894 -15.195 1.00 0.95 C ATOM 966 CG ARG A 62 -0.994 -3.283 -15.149 1.00 1.04 C ATOM 967 CD ARG A 62 -2.054 -4.368 -15.205 1.00 1.23 C ATOM 968 NE ARG A 62 -2.926 -4.349 -14.030 1.00 1.73 N ATOM 969 CZ ARG A 62 -3.663 -5.390 -13.636 1.00 2.16 C ATOM 970 NH1 ARG A 62 -3.646 -6.522 -14.335 1.00 2.24 N ATOM 971 NH2 ARG A 62 -4.411 -5.302 -12.541 1.00 3.02 N ATOM 0 H ARG A 62 -2.277 0.495 -15.100 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.140 -0.957 -13.948 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.421 -1.841 -14.467 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -2.057 -1.735 -16.177 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.305 -3.403 -15.985 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.409 -3.392 -14.236 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -2.656 -4.239 -16.104 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -1.571 -5.342 -15.281 1.00 1.23 H new ATOM 0 HE ARG A 62 -2.973 -3.491 -13.480 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -3.069 -6.595 -15.173 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -4.210 -7.317 -14.033 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -4.423 -4.438 -12.000 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -4.973 -6.099 -12.242 1.00 3.02 H new ATOM 985 N ARG A 63 0.175 -0.151 -17.120 1.00 0.94 N ATOM 986 CA ARG A 63 1.118 -0.106 -18.230 1.00 1.01 C ATOM 987 C ARG A 63 2.295 0.806 -17.890 1.00 0.95 C ATOM 988 O ARG A 63 3.436 0.536 -18.272 1.00 0.99 O ATOM 989 CB ARG A 63 0.414 0.366 -19.508 1.00 1.16 C ATOM 990 CG ARG A 63 1.299 0.328 -20.747 1.00 1.70 C ATOM 991 CD ARG A 63 0.533 0.713 -22.002 1.00 2.14 C ATOM 992 NE ARG A 63 0.018 2.081 -21.940 1.00 2.71 N ATOM 993 CZ ARG A 63 -0.295 2.806 -23.012 1.00 3.58 C ATOM 994 NH1 ARG A 63 -0.130 2.306 -24.231 1.00 3.92 N ATOM 995 NH2 ARG A 63 -0.766 4.039 -22.869 1.00 4.52 N ATOM 0 H ARG A 63 -0.713 0.318 -17.300 1.00 0.94 H new ATOM 0 HA ARG A 63 1.504 -1.111 -18.404 1.00 1.01 H new ATOM 0 HB2 ARG A 63 -0.463 -0.258 -19.680 1.00 1.16 H new ATOM 0 HB3 ARG A 63 0.056 1.385 -19.360 1.00 1.16 H new ATOM 0 HG2 ARG A 63 2.141 1.007 -20.613 1.00 1.70 H new ATOM 0 HG3 ARG A 63 1.713 -0.673 -20.867 1.00 1.70 H new ATOM 0 HD2 ARG A 63 1.186 0.612 -22.869 1.00 2.14 H new ATOM 0 HD3 ARG A 63 -0.297 0.021 -22.145 1.00 2.14 H new ATOM 0 HE ARG A 63 -0.109 2.505 -21.021 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.238 1.362 -24.350 1.00 3.92 H new ATOM 0 HH12 ARG A 63 -0.371 2.866 -25.049 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -0.889 4.433 -21.936 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -1.005 4.592 -23.692 1.00 4.52 H new ATOM 1009 N ALA A 64 2.015 1.876 -17.155 1.00 0.90 N ATOM 1010 CA ALA A 64 3.056 2.797 -16.724 1.00 0.89 C ATOM 1011 C ALA A 64 3.875 2.191 -15.591 1.00 0.75 C ATOM 1012 O ALA A 64 5.095 2.353 -15.534 1.00 0.73 O ATOM 1013 CB ALA A 64 2.443 4.116 -16.287 1.00 0.94 C ATOM 0 H ALA A 64 1.076 2.126 -16.846 1.00 0.90 H new ATOM 0 HA ALA A 64 3.722 2.983 -17.566 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.233 4.796 -15.967 1.00 0.94 H new ATOM 0 HB2 ALA A 64 1.899 4.559 -17.121 1.00 0.94 H new ATOM 0 HB3 ALA A 64 1.757 3.941 -15.458 1.00 0.94 H new ATOM 1019 N PHE A 65 3.189 1.486 -14.696 1.00 0.69 N ATOM 1020 CA PHE A 65 3.824 0.842 -13.553 1.00 0.61 C ATOM 1021 C PHE A 65 4.936 -0.092 -14.004 1.00 0.59 C ATOM 1022 O PHE A 65 6.085 0.063 -13.594 1.00 0.59 O ATOM 1023 CB PHE A 65 2.787 0.058 -12.734 1.00 0.62 C ATOM 1024 CG PHE A 65 3.372 -0.682 -11.563 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.683 -0.014 -10.392 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.612 -2.048 -11.637 1.00 0.64 C ATOM 1027 CE1 PHE A 65 4.222 -0.691 -9.316 1.00 0.64 C ATOM 1028 CE2 PHE A 65 4.151 -2.727 -10.564 1.00 0.68 C ATOM 1029 CZ PHE A 65 4.456 -2.048 -9.402 1.00 0.66 C ATOM 0 H PHE A 65 2.180 1.346 -14.743 1.00 0.69 H new ATOM 0 HA PHE A 65 4.257 1.622 -12.927 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.026 0.749 -12.372 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.285 -0.655 -13.388 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.502 1.048 -10.319 1.00 0.60 H new ATOM 0 HD2 PHE A 65 3.374 -2.584 -12.544 1.00 0.64 H new ATOM 0 HE1 PHE A 65 4.460 -0.158 -8.407 1.00 0.64 H new ATOM 0 HE2 PHE A 65 4.334 -3.789 -10.633 1.00 0.68 H new ATOM 0 HZ PHE A 65 4.877 -2.578 -8.561 1.00 0.66 H new ATOM 1039 N SER A 66 4.595 -1.041 -14.865 1.00 0.64 N ATOM 1040 CA SER A 66 5.546 -2.048 -15.309 1.00 0.68 C ATOM 1041 C SER A 66 6.773 -1.407 -15.956 1.00 0.66 C ATOM 1042 O SER A 66 7.898 -1.863 -15.754 1.00 0.68 O ATOM 1043 CB SER A 66 4.862 -3.019 -16.276 1.00 0.83 C ATOM 1044 OG SER A 66 4.055 -2.321 -17.211 1.00 1.20 O ATOM 0 H SER A 66 3.664 -1.134 -15.270 1.00 0.64 H new ATOM 0 HA SER A 66 5.892 -2.604 -14.437 1.00 0.68 H new ATOM 0 HB2 SER A 66 5.616 -3.602 -16.805 1.00 0.83 H new ATOM 0 HB3 SER A 66 4.248 -3.724 -15.715 1.00 0.83 H new ATOM 0 HG SER A 66 3.630 -2.962 -17.819 1.00 1.20 H new ATOM 1050 N ASP A 67 6.560 -0.330 -16.704 1.00 0.68 N ATOM 1051 CA ASP A 67 7.659 0.344 -17.389 1.00 0.73 C ATOM 1052 C ASP A 67 8.554 1.086 -16.399 1.00 0.65 C ATOM 1053 O ASP A 67 9.777 1.016 -16.490 1.00 0.66 O ATOM 1054 CB ASP A 67 7.135 1.326 -18.440 1.00 0.89 C ATOM 1055 CG ASP A 67 8.250 1.902 -19.293 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.902 2.877 -18.862 1.00 2.06 O ATOM 1057 OD2 ASP A 67 8.477 1.384 -20.407 1.00 1.41 O ATOM 0 H ASP A 67 5.644 0.093 -16.851 1.00 0.68 H new ATOM 0 HA ASP A 67 8.248 -0.426 -17.888 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.414 0.819 -19.081 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.604 2.138 -17.943 1.00 0.89 H new ATOM 1062 N LEU A 68 7.946 1.780 -15.445 1.00 0.63 N ATOM 1063 CA LEU A 68 8.696 2.598 -14.498 1.00 0.66 C ATOM 1064 C LEU A 68 9.406 1.730 -13.458 1.00 0.57 C ATOM 1065 O LEU A 68 10.487 2.076 -12.978 1.00 0.63 O ATOM 1066 CB LEU A 68 7.759 3.603 -13.813 1.00 0.75 C ATOM 1067 CG LEU A 68 8.432 4.587 -12.850 1.00 0.81 C ATOM 1068 CD1 LEU A 68 9.464 5.435 -13.579 1.00 1.64 C ATOM 1069 CD2 LEU A 68 7.389 5.476 -12.193 1.00 1.07 C ATOM 0 H LEU A 68 6.936 1.793 -15.306 1.00 0.63 H new ATOM 0 HA LEU A 68 9.460 3.146 -15.050 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.242 4.174 -14.584 1.00 0.75 H new ATOM 0 HB3 LEU A 68 6.999 3.047 -13.264 1.00 0.75 H new ATOM 0 HG LEU A 68 8.944 4.014 -12.077 1.00 0.81 H new ATOM 0 HD11 LEU A 68 9.929 6.126 -12.876 1.00 1.64 H new ATOM 0 HD12 LEU A 68 10.228 4.788 -14.010 1.00 1.64 H new ATOM 0 HD13 LEU A 68 8.976 5.999 -14.373 1.00 1.64 H new ATOM 0 HD21 LEU A 68 7.880 6.170 -11.511 1.00 1.07 H new ATOM 0 HD22 LEU A 68 6.854 6.037 -12.959 1.00 1.07 H new ATOM 0 HD23 LEU A 68 6.684 4.859 -11.636 1.00 1.07 H new ATOM 1081 N THR A 69 8.811 0.587 -13.135 1.00 0.49 N ATOM 1082 CA THR A 69 9.367 -0.304 -12.121 1.00 0.49 C ATOM 1083 C THR A 69 10.665 -0.961 -12.603 1.00 0.46 C ATOM 1084 O THR A 69 11.476 -1.415 -11.794 1.00 0.51 O ATOM 1085 CB THR A 69 8.346 -1.387 -11.709 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.107 -0.769 -11.342 1.00 0.71 O ATOM 1087 CG2 THR A 69 8.849 -2.214 -10.537 1.00 0.63 C ATOM 0 H THR A 69 7.945 0.255 -13.559 1.00 0.49 H new ATOM 0 HA THR A 69 9.596 0.307 -11.248 1.00 0.49 H new ATOM 0 HB THR A 69 8.203 -2.048 -12.564 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.510 -0.745 -12.119 1.00 0.71 H new ATOM 0 HG21 THR A 69 8.104 -2.965 -10.276 1.00 0.63 H new ATOM 0 HG22 THR A 69 9.781 -2.708 -10.813 1.00 0.63 H new ATOM 0 HG23 THR A 69 9.024 -1.563 -9.681 1.00 0.63 H new ATOM 1095 N SER A 70 10.888 -0.966 -13.916 1.00 0.46 N ATOM 1096 CA SER A 70 12.091 -1.575 -14.480 1.00 0.49 C ATOM 1097 C SER A 70 13.336 -0.840 -13.988 1.00 0.48 C ATOM 1098 O SER A 70 14.392 -1.439 -13.783 1.00 0.53 O ATOM 1099 CB SER A 70 12.043 -1.557 -16.012 1.00 0.57 C ATOM 1100 OG SER A 70 12.059 -0.229 -16.510 1.00 1.31 O ATOM 0 H SER A 70 10.256 -0.558 -14.605 1.00 0.46 H new ATOM 0 HA SER A 70 12.136 -2.612 -14.148 1.00 0.49 H new ATOM 0 HB2 SER A 70 12.894 -2.108 -16.412 1.00 0.57 H new ATOM 0 HB3 SER A 70 11.143 -2.067 -16.356 1.00 0.57 H new ATOM 0 HG SER A 70 11.196 0.198 -16.330 1.00 1.31 H new ATOM 1106 N GLN A 71 13.177 0.458 -13.767 1.00 0.49 N ATOM 1107 CA GLN A 71 14.252 1.316 -13.291 1.00 0.53 C ATOM 1108 C GLN A 71 14.614 0.971 -11.844 1.00 0.46 C ATOM 1109 O GLN A 71 15.679 1.339 -11.344 1.00 0.53 O ATOM 1110 CB GLN A 71 13.804 2.778 -13.410 1.00 0.63 C ATOM 1111 CG GLN A 71 14.807 3.799 -12.905 1.00 0.69 C ATOM 1112 CD GLN A 71 14.308 5.225 -13.083 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.572 5.858 -14.104 1.00 1.22 O ATOM 1114 NE2 GLN A 71 13.564 5.734 -12.107 1.00 0.82 N ATOM 0 H GLN A 71 12.294 0.947 -13.914 1.00 0.49 H new ATOM 0 HA GLN A 71 15.144 1.161 -13.898 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.586 2.992 -14.456 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.872 2.903 -12.859 1.00 0.63 H new ATOM 0 HG2 GLN A 71 15.011 3.615 -11.850 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.750 3.676 -13.438 1.00 0.69 H new ATOM 0 HE21 GLN A 71 13.366 5.179 -11.274 1.00 0.82 H new ATOM 0 HE22 GLN A 71 13.191 6.680 -12.190 1.00 0.82 H new ATOM 1123 N LEU A 72 13.730 0.235 -11.187 1.00 0.39 N ATOM 1124 CA LEU A 72 13.918 -0.123 -9.790 1.00 0.33 C ATOM 1125 C LEU A 72 14.247 -1.613 -9.646 1.00 0.34 C ATOM 1126 O LEU A 72 14.276 -2.137 -8.536 1.00 0.37 O ATOM 1127 CB LEU A 72 12.655 0.235 -8.989 1.00 0.37 C ATOM 1128 CG LEU A 72 12.767 0.099 -7.469 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.949 0.893 -6.941 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.481 0.558 -6.804 1.00 0.92 C ATOM 0 H LEU A 72 12.871 -0.127 -11.602 1.00 0.39 H new ATOM 0 HA LEU A 72 14.761 0.442 -9.394 1.00 0.33 H new ATOM 0 HB2 LEU A 72 12.379 1.263 -9.223 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.838 -0.400 -9.332 1.00 0.37 H new ATOM 0 HG LEU A 72 12.930 -0.952 -7.230 1.00 0.46 H new ATOM 0 HD11 LEU A 72 14.008 0.781 -5.858 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.868 0.522 -7.395 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.820 1.946 -7.190 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.574 0.456 -5.723 1.00 0.92 H new ATOM 0 HD22 LEU A 72 11.294 1.602 -7.055 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.651 -0.054 -7.156 1.00 0.92 H new ATOM 1142 N HIS A 73 14.508 -2.284 -10.776 1.00 0.41 N ATOM 1143 CA HIS A 73 14.862 -3.711 -10.765 1.00 0.46 C ATOM 1144 C HIS A 73 15.947 -3.993 -9.733 1.00 0.41 C ATOM 1145 O HIS A 73 17.011 -3.377 -9.762 1.00 0.45 O ATOM 1146 CB HIS A 73 15.352 -4.173 -12.144 1.00 0.60 C ATOM 1147 CG HIS A 73 14.294 -4.814 -12.990 1.00 1.34 C ATOM 1148 ND1 HIS A 73 13.584 -5.926 -12.593 1.00 2.07 N ATOM 1149 CD2 HIS A 73 13.837 -4.502 -14.224 1.00 2.33 C ATOM 1150 CE1 HIS A 73 12.741 -6.271 -13.550 1.00 2.86 C ATOM 1151 NE2 HIS A 73 12.874 -5.422 -14.549 1.00 3.01 N ATOM 0 H HIS A 73 14.481 -1.865 -11.705 1.00 0.41 H new ATOM 0 HA HIS A 73 13.960 -4.264 -10.504 1.00 0.46 H new ATOM 0 HB2 HIS A 73 15.758 -3.315 -12.679 1.00 0.60 H new ATOM 0 HB3 HIS A 73 16.170 -4.880 -12.008 1.00 0.60 H new ATOM 0 HD1 HIS A 73 13.692 -6.407 -11.700 1.00 2.07 H new ATOM 0 HD2 HIS A 73 14.169 -3.680 -14.840 1.00 2.33 H new ATOM 0 HE1 HIS A 73 12.058 -7.107 -13.519 1.00 2.86 H new ATOM 1160 N ILE A 74 15.678 -4.919 -8.826 1.00 0.37 N ATOM 1161 CA ILE A 74 16.596 -5.193 -7.737 1.00 0.36 C ATOM 1162 C ILE A 74 17.829 -5.959 -8.232 1.00 0.45 C ATOM 1163 O ILE A 74 17.753 -7.134 -8.602 1.00 0.61 O ATOM 1164 CB ILE A 74 15.889 -5.949 -6.582 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.861 -6.175 -5.425 1.00 0.31 C ATOM 1166 CG2 ILE A 74 15.295 -7.274 -7.053 1.00 0.35 C ATOM 1167 CD1 ILE A 74 16.194 -6.670 -4.166 1.00 0.34 C ATOM 0 H ILE A 74 14.833 -5.491 -8.824 1.00 0.37 H new ATOM 0 HA ILE A 74 16.938 -4.236 -7.343 1.00 0.36 H new ATOM 0 HB ILE A 74 15.063 -5.328 -6.234 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.618 -6.896 -5.733 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.379 -5.241 -5.209 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.809 -7.773 -6.215 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.562 -7.086 -7.838 1.00 0.35 H new ATOM 0 HG23 ILE A 74 16.089 -7.911 -7.443 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.944 -6.808 -3.387 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.456 -5.940 -3.834 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.699 -7.620 -4.366 1.00 0.34 H new ATOM 1179 N THR A 75 18.952 -5.256 -8.307 1.00 0.61 N ATOM 1180 CA THR A 75 20.216 -5.866 -8.686 1.00 0.73 C ATOM 1181 C THR A 75 20.624 -6.930 -7.665 1.00 0.58 C ATOM 1182 O THR A 75 20.553 -6.693 -6.457 1.00 0.57 O ATOM 1183 CB THR A 75 21.327 -4.797 -8.778 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.910 -3.728 -9.637 1.00 1.38 O ATOM 1185 CG2 THR A 75 22.625 -5.393 -9.303 1.00 1.56 C ATOM 0 H THR A 75 19.011 -4.257 -8.109 1.00 0.61 H new ATOM 0 HA THR A 75 20.085 -6.334 -9.662 1.00 0.73 H new ATOM 0 HB THR A 75 21.506 -4.413 -7.774 1.00 1.02 H new ATOM 0 HG1 THR A 75 21.619 -3.054 -9.688 1.00 1.38 H new ATOM 0 HG21 THR A 75 23.387 -4.615 -9.356 1.00 1.56 H new ATOM 0 HG22 THR A 75 22.960 -6.184 -8.632 1.00 1.56 H new ATOM 0 HG23 THR A 75 22.459 -5.807 -10.298 1.00 1.56 H new ATOM 1193 N PRO A 76 21.028 -8.123 -8.134 1.00 0.66 N ATOM 1194 CA PRO A 76 21.530 -9.182 -7.256 1.00 0.73 C ATOM 1195 C PRO A 76 22.702 -8.698 -6.412 1.00 0.72 C ATOM 1196 O PRO A 76 23.808 -8.496 -6.919 1.00 0.81 O ATOM 1197 CB PRO A 76 21.982 -10.276 -8.227 1.00 0.93 C ATOM 1198 CG PRO A 76 21.202 -10.028 -9.471 1.00 1.06 C ATOM 1199 CD PRO A 76 21.011 -8.538 -9.547 1.00 0.90 C ATOM 0 HA PRO A 76 20.776 -9.523 -6.546 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.054 -10.220 -8.415 1.00 0.93 H new ATOM 0 HB3 PRO A 76 21.781 -11.269 -7.825 1.00 0.93 H new ATOM 0 HG2 PRO A 76 21.735 -10.399 -10.347 1.00 1.06 H new ATOM 0 HG3 PRO A 76 20.242 -10.544 -9.440 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.807 -8.059 -10.117 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.070 -8.277 -10.032 1.00 0.90 H new ATOM 1207 N GLY A 77 22.447 -8.487 -5.128 1.00 0.86 N ATOM 1208 CA GLY A 77 23.463 -7.954 -4.245 1.00 1.10 C ATOM 1209 C GLY A 77 23.604 -6.450 -4.387 1.00 1.00 C ATOM 1210 O GLY A 77 24.711 -5.931 -4.524 1.00 1.32 O ATOM 0 H GLY A 77 21.550 -8.677 -4.681 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.212 -8.199 -3.213 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.419 -8.430 -4.462 1.00 1.10 H new ATOM 1214 N THR A 78 22.477 -5.753 -4.365 1.00 0.85 N ATOM 1215 CA THR A 78 22.468 -4.301 -4.495 1.00 0.82 C ATOM 1216 C THR A 78 22.493 -3.639 -3.108 1.00 0.85 C ATOM 1217 O THR A 78 22.909 -4.265 -2.130 1.00 1.52 O ATOM 1218 CB THR A 78 21.237 -3.834 -5.315 1.00 0.90 C ATOM 1219 OG1 THR A 78 21.309 -2.432 -5.595 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.936 -4.140 -4.588 1.00 1.15 C ATOM 0 H THR A 78 21.553 -6.171 -4.258 1.00 0.85 H new ATOM 0 HA THR A 78 23.365 -3.994 -5.033 1.00 0.82 H new ATOM 0 HB THR A 78 21.250 -4.387 -6.254 1.00 0.90 H new ATOM 0 HG1 THR A 78 20.523 -2.161 -6.114 1.00 1.52 H new ATOM 0 HG21 THR A 78 19.094 -3.800 -5.190 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.855 -5.215 -4.425 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.926 -3.625 -3.627 1.00 1.15 H new ATOM 1228 N ALA A 79 22.056 -2.388 -3.019 1.00 0.68 N ATOM 1229 CA ALA A 79 22.077 -1.659 -1.759 1.00 0.73 C ATOM 1230 C ALA A 79 20.953 -0.628 -1.699 1.00 0.62 C ATOM 1231 O ALA A 79 20.337 -0.307 -2.720 1.00 0.56 O ATOM 1232 CB ALA A 79 23.423 -0.978 -1.572 1.00 0.85 C ATOM 0 H ALA A 79 21.683 -1.858 -3.806 1.00 0.68 H new ATOM 0 HA ALA A 79 21.922 -2.374 -0.951 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.428 -0.436 -0.627 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.213 -1.729 -1.564 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.595 -0.280 -2.392 1.00 0.85 H new ATOM 1238 N TYR A 80 20.705 -0.100 -0.503 1.00 0.63 N ATOM 1239 CA TYR A 80 19.667 0.907 -0.297 1.00 0.58 C ATOM 1240 C TYR A 80 19.974 2.179 -1.082 1.00 0.50 C ATOM 1241 O TYR A 80 19.062 2.888 -1.494 1.00 0.46 O ATOM 1242 CB TYR A 80 19.514 1.232 1.198 1.00 0.67 C ATOM 1243 CG TYR A 80 18.487 2.309 1.498 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.135 2.102 1.244 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.871 3.535 2.033 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.199 3.083 1.515 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.939 4.519 2.308 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.605 4.288 2.046 1.00 1.58 C ATOM 1249 OH TYR A 80 15.673 5.263 2.321 1.00 2.03 O ATOM 0 H TYR A 80 21.213 -0.355 0.344 1.00 0.63 H new ATOM 0 HA TYR A 80 18.727 0.495 -0.664 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.236 0.322 1.730 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.481 1.548 1.591 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.811 1.159 0.828 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.915 3.721 2.237 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.153 2.905 1.311 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.254 5.464 2.726 1.00 1.55 H new ATOM 0 HH TYR A 80 16.123 6.050 2.692 1.00 2.03 H new ATOM 1259 N GLN A 81 21.253 2.455 -1.307 1.00 0.56 N ATOM 1260 CA GLN A 81 21.655 3.654 -2.034 1.00 0.59 C ATOM 1261 C GLN A 81 21.099 3.636 -3.458 1.00 0.54 C ATOM 1262 O GLN A 81 20.670 4.663 -3.983 1.00 0.63 O ATOM 1263 CB GLN A 81 23.179 3.776 -2.059 1.00 0.72 C ATOM 1264 CG GLN A 81 23.680 5.108 -2.594 1.00 0.84 C ATOM 1265 CD GLN A 81 23.140 6.293 -1.810 1.00 1.40 C ATOM 1266 OE1 GLN A 81 22.851 6.189 -0.617 1.00 2.01 O ATOM 1267 NE2 GLN A 81 23.004 7.430 -2.471 1.00 2.18 N ATOM 0 H GLN A 81 22.027 1.868 -0.998 1.00 0.56 H new ATOM 0 HA GLN A 81 21.244 4.521 -1.517 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.562 3.634 -1.048 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.588 2.972 -2.671 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.769 5.122 -2.562 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.391 5.207 -3.640 1.00 0.84 H new ATOM 0 HE21 GLN A 81 23.254 7.479 -3.459 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.650 8.258 -1.993 1.00 2.18 H new ATOM 1276 N SER A 82 21.089 2.461 -4.071 1.00 0.48 N ATOM 1277 CA SER A 82 20.548 2.310 -5.414 1.00 0.47 C ATOM 1278 C SER A 82 19.026 2.431 -5.377 1.00 0.40 C ATOM 1279 O SER A 82 18.417 3.081 -6.229 1.00 0.42 O ATOM 1280 CB SER A 82 20.967 0.956 -5.985 1.00 0.55 C ATOM 1281 OG SER A 82 22.359 0.745 -5.797 1.00 1.17 O ATOM 0 H SER A 82 21.449 1.599 -3.660 1.00 0.48 H new ATOM 0 HA SER A 82 20.941 3.098 -6.056 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.404 0.160 -5.498 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.727 0.913 -7.047 1.00 0.55 H new ATOM 0 HG SER A 82 22.611 -0.127 -6.167 1.00 1.17 H new ATOM 1287 N PHE A 83 18.433 1.827 -4.353 1.00 0.36 N ATOM 1288 CA PHE A 83 16.988 1.844 -4.159 1.00 0.33 C ATOM 1289 C PHE A 83 16.492 3.269 -3.887 1.00 0.31 C ATOM 1290 O PHE A 83 15.477 3.699 -4.439 1.00 0.32 O ATOM 1291 CB PHE A 83 16.624 0.904 -2.993 1.00 0.35 C ATOM 1292 CG PHE A 83 15.151 0.786 -2.706 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.346 -0.029 -3.488 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.570 1.499 -1.669 1.00 0.32 C ATOM 1295 CE1 PHE A 83 12.991 -0.132 -3.239 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.214 1.397 -1.416 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.437 0.553 -2.153 1.00 0.38 C ATOM 0 H PHE A 83 18.941 1.312 -3.634 1.00 0.36 H new ATOM 0 HA PHE A 83 16.498 1.495 -5.068 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.017 -0.089 -3.211 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.127 1.256 -2.092 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.783 -0.590 -4.301 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.182 2.141 -1.052 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.365 -0.737 -3.878 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.768 1.989 -0.630 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.397 0.414 -1.899 1.00 0.38 H new ATOM 1307 N GLU A 84 17.237 4.007 -3.065 1.00 0.34 N ATOM 1308 CA GLU A 84 16.839 5.353 -2.661 1.00 0.39 C ATOM 1309 C GLU A 84 16.815 6.303 -3.853 1.00 0.37 C ATOM 1310 O GLU A 84 15.873 7.067 -4.008 1.00 0.40 O ATOM 1311 CB GLU A 84 17.780 5.900 -1.575 1.00 0.51 C ATOM 1312 CG GLU A 84 17.431 7.313 -1.130 1.00 0.64 C ATOM 1313 CD GLU A 84 18.354 7.841 -0.049 1.00 0.90 C ATOM 1314 OE1 GLU A 84 19.500 8.213 -0.371 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.944 7.868 1.131 1.00 0.95 O ATOM 0 H GLU A 84 18.122 3.694 -2.665 1.00 0.34 H new ATOM 0 HA GLU A 84 15.831 5.286 -2.252 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.750 5.237 -0.711 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.803 5.887 -1.951 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.472 7.979 -1.992 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.405 7.329 -0.763 1.00 0.64 H new ATOM 1322 N GLN A 85 17.834 6.228 -4.705 1.00 0.37 N ATOM 1323 CA GLN A 85 17.941 7.128 -5.859 1.00 0.42 C ATOM 1324 C GLN A 85 16.675 7.089 -6.711 1.00 0.38 C ATOM 1325 O GLN A 85 16.275 8.096 -7.300 1.00 0.46 O ATOM 1326 CB GLN A 85 19.142 6.753 -6.730 1.00 0.50 C ATOM 1327 CG GLN A 85 20.496 7.005 -6.084 1.00 0.61 C ATOM 1328 CD GLN A 85 21.636 6.450 -6.916 1.00 1.44 C ATOM 1329 OE1 GLN A 85 22.185 7.137 -7.779 1.00 1.90 O ATOM 1330 NE2 GLN A 85 22.003 5.206 -6.661 1.00 2.16 N ATOM 0 H GLN A 85 18.597 5.557 -4.622 1.00 0.37 H new ATOM 0 HA GLN A 85 18.075 8.137 -5.470 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.069 5.697 -6.991 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.088 7.316 -7.662 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.637 8.077 -5.945 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.515 6.550 -5.094 1.00 0.61 H new ATOM 0 HE21 GLN A 85 21.523 4.671 -5.938 1.00 2.16 H new ATOM 0 HE22 GLN A 85 22.767 4.782 -7.187 1.00 2.16 H new ATOM 1339 N VAL A 86 16.045 5.925 -6.756 1.00 0.31 N ATOM 1340 CA VAL A 86 14.843 5.735 -7.541 1.00 0.31 C ATOM 1341 C VAL A 86 13.629 6.236 -6.777 1.00 0.29 C ATOM 1342 O VAL A 86 12.934 7.151 -7.213 1.00 0.32 O ATOM 1343 CB VAL A 86 14.633 4.246 -7.870 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.413 4.058 -8.754 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.874 3.656 -8.519 1.00 0.36 C ATOM 0 H VAL A 86 16.353 5.093 -6.252 1.00 0.31 H new ATOM 0 HA VAL A 86 14.960 6.299 -8.466 1.00 0.31 H new ATOM 0 HB VAL A 86 14.458 3.712 -6.936 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.283 2.998 -8.974 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.529 4.432 -8.238 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.550 4.608 -9.685 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.702 2.603 -8.742 1.00 0.36 H new ATOM 0 HG22 VAL A 86 16.091 4.192 -9.443 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.720 3.749 -7.838 1.00 0.36 H new ATOM 1355 N VAL A 87 13.393 5.633 -5.622 1.00 0.28 N ATOM 1356 CA VAL A 87 12.196 5.900 -4.845 1.00 0.32 C ATOM 1357 C VAL A 87 12.189 7.312 -4.257 1.00 0.35 C ATOM 1358 O VAL A 87 11.158 7.799 -3.802 1.00 0.37 O ATOM 1359 CB VAL A 87 12.027 4.862 -3.726 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.040 3.465 -4.319 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.109 5.012 -2.671 1.00 0.41 C ATOM 0 H VAL A 87 14.022 4.950 -5.200 1.00 0.28 H new ATOM 0 HA VAL A 87 11.353 5.825 -5.532 1.00 0.32 H new ATOM 0 HB VAL A 87 11.068 5.030 -3.236 1.00 0.38 H new ATOM 0 HG11 VAL A 87 11.920 2.731 -3.523 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.221 3.365 -5.032 1.00 0.38 H new ATOM 0 HG13 VAL A 87 12.988 3.295 -4.829 1.00 0.38 H new ATOM 0 HG21 VAL A 87 12.964 4.264 -1.892 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.087 4.872 -3.131 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.054 6.008 -2.232 1.00 0.41 H new ATOM 1371 N ASN A 88 13.336 7.975 -4.282 1.00 0.38 N ATOM 1372 CA ASN A 88 13.419 9.362 -3.826 1.00 0.47 C ATOM 1373 C ASN A 88 12.751 10.279 -4.843 1.00 0.44 C ATOM 1374 O ASN A 88 12.300 11.373 -4.509 1.00 0.45 O ATOM 1375 CB ASN A 88 14.877 9.793 -3.605 1.00 0.61 C ATOM 1376 CG ASN A 88 14.990 11.123 -2.875 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.117 11.488 -2.087 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.073 11.851 -3.116 1.00 0.97 N ATOM 0 H ASN A 88 14.218 7.582 -4.610 1.00 0.38 H new ATOM 0 HA ASN A 88 12.900 9.438 -2.870 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.397 9.024 -3.034 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.380 9.868 -4.569 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.203 12.745 -2.642 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.776 11.517 -3.775 1.00 0.97 H new ATOM 1385 N GLU A 89 12.655 9.812 -6.085 1.00 0.42 N ATOM 1386 CA GLU A 89 11.996 10.576 -7.139 1.00 0.45 C ATOM 1387 C GLU A 89 10.492 10.628 -6.898 1.00 0.38 C ATOM 1388 O GLU A 89 9.793 11.470 -7.453 1.00 0.43 O ATOM 1389 CB GLU A 89 12.298 9.984 -8.517 1.00 0.54 C ATOM 1390 CG GLU A 89 13.731 10.213 -8.966 1.00 0.65 C ATOM 1391 CD GLU A 89 14.062 11.686 -9.110 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.524 12.339 -10.030 1.00 1.28 O ATOM 1393 OE2 GLU A 89 14.857 12.202 -8.303 1.00 2.04 O ATOM 0 H GLU A 89 13.025 8.910 -6.385 1.00 0.42 H new ATOM 0 HA GLU A 89 12.388 11.593 -7.116 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.097 8.913 -8.497 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.620 10.422 -9.250 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.412 9.759 -8.246 1.00 0.65 H new ATOM 0 HG3 GLU A 89 13.895 9.711 -9.920 1.00 0.65 H new ATOM 1400 N LEU A 90 10.002 9.731 -6.056 1.00 0.31 N ATOM 1401 CA LEU A 90 8.606 9.755 -5.651 1.00 0.27 C ATOM 1402 C LEU A 90 8.353 10.986 -4.797 1.00 0.25 C ATOM 1403 O LEU A 90 7.315 11.634 -4.902 1.00 0.26 O ATOM 1404 CB LEU A 90 8.257 8.492 -4.868 1.00 0.26 C ATOM 1405 CG LEU A 90 8.533 7.180 -5.595 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.300 6.009 -4.664 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.660 7.059 -6.832 1.00 0.37 C ATOM 0 H LEU A 90 10.550 8.978 -5.640 1.00 0.31 H new ATOM 0 HA LEU A 90 7.976 9.793 -6.539 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.819 8.496 -3.934 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.200 8.528 -4.605 1.00 0.26 H new ATOM 0 HG LEU A 90 9.576 7.172 -5.913 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.500 5.078 -5.194 1.00 0.31 H new ATOM 0 HD12 LEU A 90 8.967 6.089 -3.805 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.265 6.017 -4.322 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.872 6.116 -7.336 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.610 7.086 -6.540 1.00 0.37 H new ATOM 0 HD23 LEU A 90 7.870 7.888 -7.508 1.00 0.37 H new ATOM 1419 N PHE A 91 9.335 11.310 -3.968 1.00 0.27 N ATOM 1420 CA PHE A 91 9.278 12.493 -3.127 1.00 0.29 C ATOM 1421 C PHE A 91 9.565 13.726 -3.977 1.00 0.33 C ATOM 1422 O PHE A 91 8.916 14.763 -3.836 1.00 0.33 O ATOM 1423 CB PHE A 91 10.304 12.377 -1.988 1.00 0.35 C ATOM 1424 CG PHE A 91 9.991 13.220 -0.780 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.265 14.579 -0.787 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.423 12.662 0.356 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.980 15.365 0.313 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.137 13.443 1.459 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.411 14.758 1.463 1.00 0.50 C ATOM 0 H PHE A 91 10.189 10.762 -3.861 1.00 0.27 H new ATOM 0 HA PHE A 91 8.284 12.583 -2.688 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.370 11.333 -1.680 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.285 12.660 -2.369 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.707 15.029 -1.664 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.202 11.605 0.378 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.187 16.425 0.298 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.687 12.990 2.330 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.199 15.352 2.339 1.00 0.50 H new ATOM 1439 N ARG A 92 10.515 13.575 -4.895 1.00 0.39 N ATOM 1440 CA ARG A 92 10.962 14.669 -5.749 1.00 0.49 C ATOM 1441 C ARG A 92 9.869 15.131 -6.711 1.00 0.51 C ATOM 1442 O ARG A 92 9.780 16.316 -7.027 1.00 0.62 O ATOM 1443 CB ARG A 92 12.207 14.248 -6.534 1.00 0.56 C ATOM 1444 CG ARG A 92 13.466 14.148 -5.684 1.00 1.24 C ATOM 1445 CD ARG A 92 13.884 15.512 -5.162 1.00 1.54 C ATOM 1446 NE ARG A 92 15.038 15.434 -4.272 1.00 2.30 N ATOM 1447 CZ ARG A 92 16.097 16.237 -4.356 1.00 2.99 C ATOM 1448 NH1 ARG A 92 16.185 17.130 -5.335 1.00 3.13 N ATOM 1449 NH2 ARG A 92 17.072 16.134 -3.465 1.00 3.95 N ATOM 0 H ARG A 92 10.996 12.692 -5.067 1.00 0.39 H new ATOM 0 HA ARG A 92 11.205 15.511 -5.101 1.00 0.49 H new ATOM 0 HB2 ARG A 92 12.019 13.282 -7.004 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.378 14.965 -7.337 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.290 13.473 -4.846 1.00 1.24 H new ATOM 0 HG3 ARG A 92 14.274 13.718 -6.275 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.120 16.164 -6.003 1.00 1.54 H new ATOM 0 HD3 ARG A 92 13.048 15.967 -4.631 1.00 1.54 H new ATOM 0 HE ARG A 92 15.033 14.722 -3.542 1.00 2.30 H new ATOM 0 HH11 ARG A 92 15.439 17.203 -6.027 1.00 3.13 H new ATOM 0 HH12 ARG A 92 16.998 17.743 -5.395 1.00 3.13 H new ATOM 0 HH21 ARG A 92 17.010 15.442 -2.719 1.00 3.95 H new ATOM 0 HH22 ARG A 92 17.885 16.747 -3.526 1.00 3.95 H new ATOM 1463 N ASP A 93 9.028 14.203 -7.156 1.00 0.46 N ATOM 1464 CA ASP A 93 7.956 14.527 -8.103 1.00 0.53 C ATOM 1465 C ASP A 93 6.726 15.095 -7.397 1.00 0.50 C ATOM 1466 O ASP A 93 5.622 15.062 -7.946 1.00 0.60 O ATOM 1467 CB ASP A 93 7.546 13.291 -8.921 1.00 0.62 C ATOM 1468 CG ASP A 93 8.339 13.133 -10.207 1.00 0.90 C ATOM 1469 OD1 ASP A 93 9.441 12.544 -10.160 1.00 1.14 O ATOM 1470 OD2 ASP A 93 7.881 13.615 -11.264 1.00 1.11 O ATOM 0 H ASP A 93 9.064 13.222 -6.880 1.00 0.46 H new ATOM 0 HA ASP A 93 8.353 15.288 -8.774 1.00 0.53 H new ATOM 0 HB2 ASP A 93 7.677 12.399 -8.309 1.00 0.62 H new ATOM 0 HB3 ASP A 93 6.485 13.359 -9.162 1.00 0.62 H new ATOM 1475 N GLY A 94 6.907 15.627 -6.191 1.00 0.45 N ATOM 1476 CA GLY A 94 5.785 16.239 -5.504 1.00 0.47 C ATOM 1477 C GLY A 94 5.004 15.256 -4.660 1.00 0.39 C ATOM 1478 O GLY A 94 3.778 15.334 -4.626 1.00 0.42 O ATOM 0 H GLY A 94 7.793 15.646 -5.686 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.151 17.045 -4.868 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.118 16.690 -6.239 1.00 0.47 H new ATOM 1482 N VAL A 95 5.720 14.311 -4.037 1.00 0.32 N ATOM 1483 CA VAL A 95 5.128 13.200 -3.271 1.00 0.26 C ATOM 1484 C VAL A 95 3.747 13.514 -2.687 1.00 0.25 C ATOM 1485 O VAL A 95 3.594 14.342 -1.793 1.00 0.29 O ATOM 1486 CB VAL A 95 6.064 12.745 -2.124 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.432 13.911 -1.219 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.419 11.620 -1.317 1.00 0.33 C ATOM 0 H VAL A 95 6.740 14.294 -4.049 1.00 0.32 H new ATOM 0 HA VAL A 95 5.002 12.397 -3.998 1.00 0.26 H new ATOM 0 HB VAL A 95 6.983 12.366 -2.572 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.090 13.561 -0.423 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.944 14.677 -1.802 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.527 14.332 -0.782 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.092 11.314 -0.516 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.481 11.972 -0.888 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.223 10.770 -1.970 1.00 0.33 H new ATOM 1498 N ASN A 96 2.744 12.877 -3.258 1.00 0.24 N ATOM 1499 CA ASN A 96 1.397 12.896 -2.710 1.00 0.29 C ATOM 1500 C ASN A 96 1.065 11.504 -2.193 1.00 0.23 C ATOM 1501 O ASN A 96 1.912 10.610 -2.259 1.00 0.21 O ATOM 1502 CB ASN A 96 0.375 13.354 -3.762 1.00 0.41 C ATOM 1503 CG ASN A 96 0.528 14.820 -4.130 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.227 15.225 -5.253 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.995 15.626 -3.189 1.00 2.00 N ATOM 0 H ASN A 96 2.837 12.331 -4.115 1.00 0.24 H new ATOM 0 HA ASN A 96 1.348 13.612 -1.890 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.486 12.745 -4.659 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.632 13.182 -3.383 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.116 16.620 -3.383 1.00 2.00 H new ATOM 0 HD22 ASN A 96 1.233 15.253 -2.270 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.142 11.314 -1.675 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.546 10.012 -1.143 1.00 0.24 C ATOM 1514 C TRP A 97 -0.389 8.902 -2.191 1.00 0.25 C ATOM 1515 O TRP A 97 -0.111 7.752 -1.846 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.991 10.053 -0.633 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.202 11.005 0.513 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.942 12.153 0.497 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.663 10.896 1.840 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.906 12.755 1.732 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.125 12.007 2.571 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.837 9.969 2.485 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.791 12.215 3.906 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.507 10.177 3.812 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.984 11.293 4.509 1.00 0.30 C ATOM 0 H TRP A 97 -0.857 12.038 -1.611 1.00 0.25 H new ATOM 0 HA TRP A 97 0.115 9.786 -0.307 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.649 10.336 -1.455 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.285 9.051 -0.320 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.477 12.532 -0.361 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.384 13.620 1.983 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.463 9.105 1.955 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.157 13.076 4.446 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.129 9.466 4.319 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.708 11.428 5.545 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.538 9.257 -3.467 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.396 8.282 -4.539 1.00 0.29 C ATOM 1538 C GLY A 98 1.027 7.767 -4.682 1.00 0.26 C ATOM 1539 O GLY A 98 1.244 6.629 -5.099 1.00 0.27 O ATOM 0 H GLY A 98 -0.755 10.204 -3.778 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.064 7.442 -4.351 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.710 8.735 -5.480 1.00 0.29 H new ATOM 1543 N ARG A 99 1.999 8.596 -4.319 1.00 0.26 N ATOM 1544 CA ARG A 99 3.407 8.208 -4.399 1.00 0.25 C ATOM 1545 C ARG A 99 3.712 7.155 -3.352 1.00 0.21 C ATOM 1546 O ARG A 99 4.553 6.284 -3.560 1.00 0.20 O ATOM 1547 CB ARG A 99 4.336 9.408 -4.198 1.00 0.30 C ATOM 1548 CG ARG A 99 4.323 10.431 -5.330 1.00 0.70 C ATOM 1549 CD ARG A 99 4.858 9.856 -6.636 1.00 1.40 C ATOM 1550 NE ARG A 99 3.875 9.030 -7.338 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.109 8.437 -8.508 1.00 2.46 C ATOM 1552 NH1 ARG A 99 5.300 8.546 -9.085 1.00 3.06 N ATOM 1553 NH2 ARG A 99 3.151 7.739 -9.103 1.00 2.98 N ATOM 0 H ARG A 99 1.841 9.540 -3.967 1.00 0.26 H new ATOM 0 HA ARG A 99 3.583 7.805 -5.396 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.060 9.911 -3.271 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.355 9.042 -4.071 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.304 10.787 -5.483 1.00 0.70 H new ATOM 0 HG3 ARG A 99 4.923 11.295 -5.043 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.170 10.673 -7.287 1.00 1.40 H new ATOM 0 HD3 ARG A 99 5.745 9.258 -6.428 1.00 1.40 H new ATOM 0 HE ARG A 99 2.959 8.901 -6.908 1.00 1.74 H new ATOM 0 HH11 ARG A 99 6.039 9.085 -8.633 1.00 3.06 H new ATOM 0 HH12 ARG A 99 5.476 8.091 -9.981 1.00 3.06 H new ATOM 0 HH21 ARG A 99 2.234 7.656 -8.665 1.00 2.98 H new ATOM 0 HH22 ARG A 99 3.332 7.286 -9.999 1.00 2.98 H new ATOM 1567 N ILE A 100 3.014 7.242 -2.227 1.00 0.22 N ATOM 1568 CA ILE A 100 3.140 6.252 -1.174 1.00 0.21 C ATOM 1569 C ILE A 100 2.633 4.915 -1.681 1.00 0.20 C ATOM 1570 O ILE A 100 3.274 3.880 -1.506 1.00 0.19 O ATOM 1571 CB ILE A 100 2.348 6.668 0.083 1.00 0.24 C ATOM 1572 CG1 ILE A 100 2.907 7.976 0.650 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.379 5.564 1.128 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.313 8.362 1.985 1.00 0.30 C ATOM 0 H ILE A 100 2.353 7.992 -2.023 1.00 0.22 H new ATOM 0 HA ILE A 100 4.191 6.172 -0.898 1.00 0.21 H new ATOM 0 HB ILE A 100 1.308 6.832 -0.198 1.00 0.24 H new ATOM 0 HG12 ILE A 100 3.988 7.883 0.756 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.725 8.779 -0.065 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.815 5.878 2.006 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.933 4.659 0.715 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.411 5.362 1.413 1.00 0.24 H new ATOM 0 HD11 ILE A 100 2.757 9.298 2.324 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.235 8.488 1.881 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.518 7.579 2.715 1.00 0.30 H new ATOM 1586 N VAL A 101 1.482 4.958 -2.329 1.00 0.21 N ATOM 1587 CA VAL A 101 0.901 3.785 -2.948 1.00 0.21 C ATOM 1588 C VAL A 101 1.884 3.164 -3.926 1.00 0.20 C ATOM 1589 O VAL A 101 2.203 1.977 -3.836 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.383 4.152 -3.703 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -0.993 2.921 -4.338 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.368 4.828 -2.772 1.00 0.26 C ATOM 0 H VAL A 101 0.927 5.806 -2.439 1.00 0.21 H new ATOM 0 HA VAL A 101 0.666 3.071 -2.159 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.133 4.854 -4.499 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.903 3.199 -4.870 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.282 2.483 -5.039 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.233 2.193 -3.563 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.274 5.082 -3.323 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.618 4.152 -1.954 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.922 5.737 -2.368 1.00 0.26 H new ATOM 1602 N ALA A 102 2.363 3.987 -4.850 1.00 0.19 N ATOM 1603 CA ALA A 102 3.317 3.551 -5.857 1.00 0.19 C ATOM 1604 C ALA A 102 4.560 2.950 -5.212 1.00 0.17 C ATOM 1605 O ALA A 102 5.063 1.919 -5.656 1.00 0.19 O ATOM 1606 CB ALA A 102 3.691 4.716 -6.758 1.00 0.21 C ATOM 0 H ALA A 102 2.102 4.970 -4.921 1.00 0.19 H new ATOM 0 HA ALA A 102 2.848 2.774 -6.461 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.406 4.380 -7.509 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.797 5.095 -7.252 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.139 5.509 -6.160 1.00 0.21 H new ATOM 1612 N PHE A 103 5.027 3.587 -4.145 1.00 0.16 N ATOM 1613 CA PHE A 103 6.197 3.114 -3.411 1.00 0.17 C ATOM 1614 C PHE A 103 5.978 1.691 -2.910 1.00 0.17 C ATOM 1615 O PHE A 103 6.864 0.839 -3.008 1.00 0.21 O ATOM 1616 CB PHE A 103 6.500 4.046 -2.229 1.00 0.17 C ATOM 1617 CG PHE A 103 7.663 3.595 -1.389 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.950 3.622 -1.898 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.468 3.132 -0.096 1.00 0.17 C ATOM 1620 CE1 PHE A 103 10.019 3.199 -1.137 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.534 2.707 0.668 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.811 2.739 0.147 1.00 0.26 C ATOM 0 H PHE A 103 4.611 4.438 -3.766 1.00 0.16 H new ATOM 0 HA PHE A 103 7.050 3.117 -4.090 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.704 5.047 -2.609 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.614 4.119 -1.598 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.119 3.979 -2.903 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.470 3.104 0.317 1.00 0.17 H new ATOM 0 HE1 PHE A 103 11.018 3.228 -1.546 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.369 2.349 1.674 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.647 2.404 0.743 1.00 0.26 H new ATOM 1632 N PHE A 104 4.787 1.436 -2.397 1.00 0.16 N ATOM 1633 CA PHE A 104 4.455 0.128 -1.861 1.00 0.18 C ATOM 1634 C PHE A 104 4.244 -0.880 -2.984 1.00 0.19 C ATOM 1635 O PHE A 104 4.681 -2.028 -2.886 1.00 0.23 O ATOM 1636 CB PHE A 104 3.213 0.210 -0.968 1.00 0.19 C ATOM 1637 CG PHE A 104 3.495 0.713 0.425 1.00 0.21 C ATOM 1638 CD1 PHE A 104 4.076 1.956 0.613 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.185 -0.050 1.541 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.341 2.427 1.883 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.449 0.418 2.813 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.002 1.627 3.000 1.00 0.30 C ATOM 0 H PHE A 104 4.032 2.120 -2.340 1.00 0.16 H new ATOM 0 HA PHE A 104 5.293 -0.212 -1.253 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.481 0.866 -1.439 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.759 -0.779 -0.902 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.325 2.564 -0.244 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.732 -1.022 1.414 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.801 3.394 2.023 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.208 -0.196 3.668 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.188 1.988 4.001 1.00 0.30 H new ATOM 1652 N SER A 105 3.597 -0.448 -4.061 1.00 0.18 N ATOM 1653 CA SER A 105 3.353 -1.326 -5.196 1.00 0.21 C ATOM 1654 C SER A 105 4.667 -1.734 -5.867 1.00 0.21 C ATOM 1655 O SER A 105 4.779 -2.843 -6.394 1.00 0.23 O ATOM 1656 CB SER A 105 2.401 -0.664 -6.201 1.00 0.25 C ATOM 1657 OG SER A 105 2.839 0.635 -6.556 1.00 1.04 O ATOM 0 H SER A 105 3.235 0.499 -4.171 1.00 0.18 H new ATOM 0 HA SER A 105 2.874 -2.233 -4.826 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.329 -1.282 -7.096 1.00 0.25 H new ATOM 0 HB3 SER A 105 1.401 -0.607 -5.772 1.00 0.25 H new ATOM 0 HG SER A 105 3.737 0.787 -6.195 1.00 1.04 H new ATOM 1663 N PHE A 106 5.668 -0.851 -5.822 1.00 0.20 N ATOM 1664 CA PHE A 106 6.982 -1.167 -6.374 1.00 0.21 C ATOM 1665 C PHE A 106 7.581 -2.358 -5.646 1.00 0.22 C ATOM 1666 O PHE A 106 8.040 -3.310 -6.275 1.00 0.24 O ATOM 1667 CB PHE A 106 7.941 0.029 -6.282 1.00 0.23 C ATOM 1668 CG PHE A 106 7.631 1.148 -7.236 1.00 0.24 C ATOM 1669 CD1 PHE A 106 7.120 0.885 -8.496 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.863 2.466 -6.876 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.842 1.910 -9.377 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.588 3.497 -7.752 1.00 0.30 C ATOM 1673 CZ PHE A 106 7.076 3.219 -9.004 1.00 0.33 C ATOM 0 H PHE A 106 5.592 0.080 -5.412 1.00 0.20 H new ATOM 0 HA PHE A 106 6.846 -1.410 -7.428 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.919 0.419 -5.264 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.957 -0.320 -6.468 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.936 -0.137 -8.793 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.264 2.689 -5.898 1.00 0.27 H new ATOM 0 HE1 PHE A 106 6.442 1.689 -10.356 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.773 4.520 -7.458 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.859 4.024 -9.690 1.00 0.33 H new ATOM 1683 N GLY A 107 7.555 -2.311 -4.316 1.00 0.23 N ATOM 1684 CA GLY A 107 8.044 -3.424 -3.529 1.00 0.27 C ATOM 1685 C GLY A 107 7.272 -4.694 -3.820 1.00 0.32 C ATOM 1686 O GLY A 107 7.837 -5.785 -3.819 1.00 0.37 O ATOM 0 H GLY A 107 7.204 -1.522 -3.773 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.101 -3.584 -3.741 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.964 -3.184 -2.469 1.00 0.27 H new ATOM 1690 N GLY A 108 5.977 -4.539 -4.082 1.00 0.33 N ATOM 1691 CA GLY A 108 5.132 -5.669 -4.435 1.00 0.41 C ATOM 1692 C GLY A 108 5.592 -6.369 -5.701 1.00 0.42 C ATOM 1693 O GLY A 108 5.308 -7.546 -5.907 1.00 0.63 O ATOM 0 H GLY A 108 5.493 -3.642 -4.056 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.124 -6.383 -3.612 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.107 -5.324 -4.567 1.00 0.41 H new ATOM 1697 N ALA A 109 6.285 -5.638 -6.559 1.00 0.27 N ATOM 1698 CA ALA A 109 6.879 -6.216 -7.752 1.00 0.26 C ATOM 1699 C ALA A 109 8.298 -6.697 -7.464 1.00 0.23 C ATOM 1700 O ALA A 109 8.712 -7.768 -7.916 1.00 0.24 O ATOM 1701 CB ALA A 109 6.882 -5.196 -8.877 1.00 0.29 C ATOM 0 H ALA A 109 6.450 -4.637 -6.450 1.00 0.27 H new ATOM 0 HA ALA A 109 6.283 -7.076 -8.059 1.00 0.26 H new ATOM 0 HB1 ALA A 109 7.329 -5.638 -9.768 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.858 -4.894 -9.097 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.461 -4.323 -8.575 1.00 0.29 H new ATOM 1707 N LEU A 110 9.025 -5.897 -6.692 1.00 0.22 N ATOM 1708 CA LEU A 110 10.407 -6.188 -6.330 1.00 0.23 C ATOM 1709 C LEU A 110 10.522 -7.506 -5.585 1.00 0.21 C ATOM 1710 O LEU A 110 11.373 -8.336 -5.896 1.00 0.21 O ATOM 1711 CB LEU A 110 10.958 -5.069 -5.453 1.00 0.25 C ATOM 1712 CG LEU A 110 11.022 -3.703 -6.117 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.487 -2.661 -5.121 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.943 -3.748 -7.319 1.00 0.36 C ATOM 0 H LEU A 110 8.671 -5.025 -6.298 1.00 0.22 H new ATOM 0 HA LEU A 110 10.983 -6.262 -7.252 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.341 -4.992 -4.558 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.961 -5.345 -5.126 1.00 0.25 H new ATOM 0 HG LEU A 110 10.025 -3.428 -6.461 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.529 -1.686 -5.607 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.789 -2.620 -4.285 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.478 -2.926 -4.753 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.980 -2.764 -7.786 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.944 -4.036 -6.999 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.568 -4.476 -8.038 1.00 0.36 H new ATOM 1726 N CYS A 111 9.668 -7.685 -4.591 1.00 0.21 N ATOM 1727 CA CYS A 111 9.695 -8.882 -3.771 1.00 0.21 C ATOM 1728 C CYS A 111 9.513 -10.133 -4.623 1.00 0.21 C ATOM 1729 O CYS A 111 10.180 -11.146 -4.409 1.00 0.25 O ATOM 1730 CB CYS A 111 8.615 -8.806 -2.694 1.00 0.22 C ATOM 1731 SG CYS A 111 6.940 -8.564 -3.326 1.00 1.34 S ATOM 0 H CYS A 111 8.945 -7.013 -4.333 1.00 0.21 H new ATOM 0 HA CYS A 111 10.670 -8.944 -3.288 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.639 -9.725 -2.108 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.855 -7.988 -2.014 1.00 0.22 H new ATOM 0 HG CYS A 111 6.806 -7.340 -3.743 1.00 1.34 H new ATOM 1737 N VAL A 112 8.634 -10.041 -5.610 1.00 0.19 N ATOM 1738 CA VAL A 112 8.334 -11.166 -6.475 1.00 0.20 C ATOM 1739 C VAL A 112 9.528 -11.504 -7.352 1.00 0.22 C ATOM 1740 O VAL A 112 9.988 -12.649 -7.377 1.00 0.25 O ATOM 1741 CB VAL A 112 7.115 -10.870 -7.363 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.856 -12.024 -8.314 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.890 -10.605 -6.506 1.00 0.25 C ATOM 0 H VAL A 112 8.114 -9.191 -5.830 1.00 0.19 H new ATOM 0 HA VAL A 112 8.106 -12.019 -5.836 1.00 0.20 H new ATOM 0 HB VAL A 112 7.326 -9.978 -7.953 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.989 -11.797 -8.935 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.728 -12.174 -8.950 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.664 -12.931 -7.741 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.035 -10.397 -7.149 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.679 -11.481 -5.893 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.076 -9.747 -5.861 1.00 0.25 H new ATOM 1753 N GLU A 113 10.032 -10.501 -8.061 1.00 0.22 N ATOM 1754 CA GLU A 113 11.171 -10.699 -8.948 1.00 0.25 C ATOM 1755 C GLU A 113 12.383 -11.180 -8.155 1.00 0.25 C ATOM 1756 O GLU A 113 13.196 -11.947 -8.657 1.00 0.30 O ATOM 1757 CB GLU A 113 11.511 -9.416 -9.720 1.00 0.29 C ATOM 1758 CG GLU A 113 12.076 -8.298 -8.861 1.00 0.30 C ATOM 1759 CD GLU A 113 12.406 -7.059 -9.666 1.00 0.39 C ATOM 1760 OE1 GLU A 113 11.519 -6.199 -9.820 1.00 0.51 O ATOM 1761 OE2 GLU A 113 13.550 -6.945 -10.156 1.00 0.50 O ATOM 0 H GLU A 113 9.672 -9.547 -8.039 1.00 0.22 H new ATOM 0 HA GLU A 113 10.899 -11.463 -9.676 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.232 -9.657 -10.501 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.610 -9.056 -10.217 1.00 0.29 H new ATOM 0 HG2 GLU A 113 11.356 -8.042 -8.084 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.976 -8.651 -8.357 1.00 0.30 H new ATOM 1768 N SER A 114 12.473 -10.747 -6.902 1.00 0.23 N ATOM 1769 CA SER A 114 13.568 -11.136 -6.032 1.00 0.28 C ATOM 1770 C SER A 114 13.549 -12.642 -5.806 1.00 0.27 C ATOM 1771 O SER A 114 14.582 -13.306 -5.888 1.00 0.31 O ATOM 1772 CB SER A 114 13.477 -10.394 -4.692 1.00 0.33 C ATOM 1773 OG SER A 114 14.641 -10.594 -3.909 1.00 0.99 O ATOM 0 H SER A 114 11.794 -10.122 -6.467 1.00 0.23 H new ATOM 0 HA SER A 114 14.508 -10.866 -6.513 1.00 0.28 H new ATOM 0 HB2 SER A 114 13.338 -9.328 -4.873 1.00 0.33 H new ATOM 0 HB3 SER A 114 12.602 -10.741 -4.141 1.00 0.33 H new ATOM 0 HG SER A 114 14.679 -11.527 -3.612 1.00 0.99 H new ATOM 1779 N VAL A 115 12.365 -13.183 -5.550 1.00 0.28 N ATOM 1780 CA VAL A 115 12.217 -14.610 -5.316 1.00 0.33 C ATOM 1781 C VAL A 115 12.428 -15.382 -6.612 1.00 0.37 C ATOM 1782 O VAL A 115 13.063 -16.436 -6.624 1.00 0.42 O ATOM 1783 CB VAL A 115 10.831 -14.939 -4.739 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.701 -16.430 -4.476 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.589 -14.147 -3.466 1.00 0.41 C ATOM 0 H VAL A 115 11.494 -12.654 -5.500 1.00 0.28 H new ATOM 0 HA VAL A 115 12.973 -14.908 -4.589 1.00 0.33 H new ATOM 0 HB VAL A 115 10.075 -14.656 -5.471 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.713 -16.643 -4.068 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.833 -16.977 -5.409 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.463 -16.741 -3.762 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.604 -14.390 -3.068 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.351 -14.401 -2.729 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.639 -13.081 -3.686 1.00 0.41 H new ATOM 1795 N ASP A 116 11.900 -14.840 -7.703 1.00 0.38 N ATOM 1796 CA ASP A 116 12.095 -15.431 -9.026 1.00 0.46 C ATOM 1797 C ASP A 116 13.579 -15.495 -9.381 1.00 0.47 C ATOM 1798 O ASP A 116 14.035 -16.444 -10.019 1.00 0.56 O ATOM 1799 CB ASP A 116 11.334 -14.632 -10.091 1.00 0.49 C ATOM 1800 CG ASP A 116 11.644 -15.100 -11.499 1.00 1.08 C ATOM 1801 OD1 ASP A 116 11.163 -16.188 -11.887 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.364 -14.383 -12.225 1.00 1.89 O ATOM 0 H ASP A 116 11.333 -13.992 -7.700 1.00 0.38 H new ATOM 0 HA ASP A 116 11.701 -16.447 -9.001 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.263 -14.720 -9.910 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.587 -13.576 -9.998 1.00 0.49 H new ATOM 1807 N LYS A 117 14.331 -14.494 -8.944 1.00 0.43 N ATOM 1808 CA LYS A 117 15.771 -14.447 -9.189 1.00 0.49 C ATOM 1809 C LYS A 117 16.530 -15.240 -8.125 1.00 0.47 C ATOM 1810 O LYS A 117 17.755 -15.126 -8.007 1.00 0.52 O ATOM 1811 CB LYS A 117 16.259 -12.995 -9.217 1.00 0.53 C ATOM 1812 CG LYS A 117 15.639 -12.166 -10.333 1.00 0.61 C ATOM 1813 CD LYS A 117 16.004 -10.695 -10.210 1.00 1.20 C ATOM 1814 CE LYS A 117 15.328 -9.860 -11.290 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.689 -10.324 -12.656 1.00 1.90 N ATOM 0 H LYS A 117 13.969 -13.700 -8.416 1.00 0.43 H new ATOM 0 HA LYS A 117 15.967 -14.903 -10.160 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.034 -12.526 -8.259 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.343 -12.987 -9.329 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.976 -12.545 -11.298 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.555 -12.275 -10.308 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.710 -10.327 -9.227 1.00 1.20 H new ATOM 0 HD3 LYS A 117 17.085 -10.580 -10.283 1.00 1.20 H new ATOM 0 HE2 LYS A 117 14.246 -9.910 -11.164 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.615 -8.815 -11.174 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 15.381 -9.618 -13.355 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.720 -10.447 -12.720 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.219 -11.232 -12.850 1.00 1.90 H new ATOM 1829 N GLU A 118 15.787 -16.032 -7.347 1.00 0.45 N ATOM 1830 CA GLU A 118 16.361 -16.929 -6.340 1.00 0.49 C ATOM 1831 C GLU A 118 17.029 -16.147 -5.216 1.00 0.45 C ATOM 1832 O GLU A 118 17.879 -16.670 -4.494 1.00 0.55 O ATOM 1833 CB GLU A 118 17.359 -17.886 -6.987 1.00 0.59 C ATOM 1834 CG GLU A 118 16.748 -18.749 -8.076 1.00 1.07 C ATOM 1835 CD GLU A 118 17.781 -19.584 -8.789 1.00 1.72 C ATOM 1836 OE1 GLU A 118 18.071 -20.703 -8.319 1.00 1.89 O ATOM 1837 OE2 GLU A 118 18.304 -19.133 -9.830 1.00 2.54 O ATOM 0 H GLU A 118 14.769 -16.069 -7.398 1.00 0.45 H new ATOM 0 HA GLU A 118 15.546 -17.509 -5.906 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.182 -17.310 -7.409 1.00 0.59 H new ATOM 0 HB3 GLU A 118 17.783 -18.531 -6.218 1.00 0.59 H new ATOM 0 HG2 GLU A 118 15.994 -19.403 -7.638 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.237 -18.112 -8.798 1.00 1.07 H new ATOM 1844 N MET A 119 16.623 -14.902 -5.060 1.00 0.35 N ATOM 1845 CA MET A 119 17.164 -14.046 -4.024 1.00 0.33 C ATOM 1846 C MET A 119 16.161 -13.938 -2.885 1.00 0.31 C ATOM 1847 O MET A 119 15.530 -12.896 -2.684 1.00 0.27 O ATOM 1848 CB MET A 119 17.496 -12.660 -4.584 1.00 0.34 C ATOM 1849 CG MET A 119 18.404 -12.697 -5.803 1.00 0.41 C ATOM 1850 SD MET A 119 18.785 -11.057 -6.450 1.00 0.47 S ATOM 1851 CE MET A 119 17.141 -10.373 -6.636 1.00 0.44 C ATOM 0 H MET A 119 15.914 -14.458 -5.644 1.00 0.35 H new ATOM 0 HA MET A 119 18.089 -14.483 -3.647 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.568 -12.152 -4.848 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.973 -12.067 -3.804 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.333 -13.203 -5.541 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.928 -13.288 -6.585 1.00 0.41 H new ATOM 0 HE1 MET A 119 17.098 -9.771 -7.543 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.415 -11.183 -6.704 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.907 -9.748 -5.774 1.00 0.44 H new ATOM 1861 N GLN A 120 16.006 -15.031 -2.154 1.00 0.36 N ATOM 1862 CA GLN A 120 15.030 -15.107 -1.074 1.00 0.39 C ATOM 1863 C GLN A 120 15.500 -14.337 0.152 1.00 0.41 C ATOM 1864 O GLN A 120 14.738 -14.133 1.094 1.00 0.47 O ATOM 1865 CB GLN A 120 14.751 -16.565 -0.708 1.00 0.49 C ATOM 1866 CG GLN A 120 14.023 -17.335 -1.803 1.00 0.53 C ATOM 1867 CD GLN A 120 13.773 -18.788 -1.443 1.00 0.65 C ATOM 1868 OE1 GLN A 120 13.659 -19.142 -0.267 1.00 0.71 O ATOM 1869 NE2 GLN A 120 13.660 -19.636 -2.455 1.00 0.70 N ATOM 0 H GLN A 120 16.547 -15.885 -2.289 1.00 0.36 H new ATOM 0 HA GLN A 120 14.106 -14.648 -1.427 1.00 0.39 H new ATOM 0 HB2 GLN A 120 15.695 -17.064 -0.489 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.156 -16.595 0.205 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.069 -16.849 -2.009 1.00 0.53 H new ATOM 0 HG3 GLN A 120 14.608 -17.290 -2.721 1.00 0.53 H new ATOM 0 HE21 GLN A 120 13.761 -19.302 -3.414 1.00 0.70 H new ATOM 0 HE22 GLN A 120 13.472 -20.622 -2.275 1.00 0.70 H new ATOM 1878 N VAL A 121 16.753 -13.916 0.147 1.00 0.39 N ATOM 1879 CA VAL A 121 17.254 -13.059 1.206 1.00 0.44 C ATOM 1880 C VAL A 121 16.980 -11.593 0.882 1.00 0.38 C ATOM 1881 O VAL A 121 16.728 -10.786 1.772 1.00 0.47 O ATOM 1882 CB VAL A 121 18.759 -13.272 1.460 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.015 -14.676 1.981 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.568 -13.014 0.201 1.00 0.92 C ATOM 0 H VAL A 121 17.437 -14.151 -0.572 1.00 0.39 H new ATOM 0 HA VAL A 121 16.723 -13.331 2.118 1.00 0.44 H new ATOM 0 HB VAL A 121 19.079 -12.556 2.217 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.083 -14.810 2.155 1.00 0.98 H new ATOM 0 HG12 VAL A 121 18.474 -14.822 2.916 1.00 0.98 H new ATOM 0 HG13 VAL A 121 18.673 -15.405 1.246 1.00 0.98 H new ATOM 0 HG21 VAL A 121 20.626 -13.172 0.410 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.247 -13.698 -0.584 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.412 -11.986 -0.127 1.00 0.92 H new ATOM 1894 N LEU A 122 16.984 -11.260 -0.404 1.00 0.30 N ATOM 1895 CA LEU A 122 16.776 -9.884 -0.825 1.00 0.27 C ATOM 1896 C LEU A 122 15.333 -9.454 -0.630 1.00 0.23 C ATOM 1897 O LEU A 122 15.070 -8.294 -0.335 1.00 0.23 O ATOM 1898 CB LEU A 122 17.196 -9.668 -2.277 1.00 0.28 C ATOM 1899 CG LEU A 122 18.668 -9.319 -2.487 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.563 -10.496 -2.144 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.896 -8.867 -3.913 1.00 0.41 C ATOM 0 H LEU A 122 17.128 -11.921 -1.167 1.00 0.30 H new ATOM 0 HA LEU A 122 17.409 -9.263 -0.191 1.00 0.27 H new ATOM 0 HB2 LEU A 122 16.970 -10.573 -2.841 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.587 -8.869 -2.699 1.00 0.28 H new ATOM 0 HG LEU A 122 18.927 -8.501 -1.815 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.605 -10.219 -2.303 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.416 -10.773 -1.100 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.311 -11.343 -2.783 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.949 -8.620 -4.053 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.617 -9.668 -4.598 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.287 -7.986 -4.117 1.00 0.41 H new ATOM 1913 N VAL A 123 14.405 -10.389 -0.767 1.00 0.23 N ATOM 1914 CA VAL A 123 12.994 -10.081 -0.592 1.00 0.25 C ATOM 1915 C VAL A 123 12.722 -9.565 0.824 1.00 0.27 C ATOM 1916 O VAL A 123 11.848 -8.725 1.040 1.00 0.31 O ATOM 1917 CB VAL A 123 12.103 -11.305 -0.898 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.441 -12.473 0.006 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.638 -10.939 -0.773 1.00 0.31 C ATOM 0 H VAL A 123 14.602 -11.363 -0.998 1.00 0.23 H new ATOM 0 HA VAL A 123 12.741 -9.296 -1.305 1.00 0.25 H new ATOM 0 HB VAL A 123 12.298 -11.613 -1.925 1.00 0.28 H new ATOM 0 HG11 VAL A 123 11.796 -13.318 -0.235 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.483 -12.758 -0.142 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.288 -12.185 1.046 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.025 -11.813 -0.992 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.434 -10.597 0.242 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.400 -10.143 -1.479 1.00 0.31 H new ATOM 1929 N SER A 124 13.512 -10.045 1.774 1.00 0.29 N ATOM 1930 CA SER A 124 13.391 -9.619 3.159 1.00 0.35 C ATOM 1931 C SER A 124 13.952 -8.209 3.329 1.00 0.34 C ATOM 1932 O SER A 124 13.347 -7.362 3.993 1.00 0.44 O ATOM 1933 CB SER A 124 14.127 -10.602 4.078 1.00 0.43 C ATOM 1934 OG SER A 124 13.978 -10.256 5.447 1.00 1.32 O ATOM 0 H SER A 124 14.247 -10.733 1.609 1.00 0.29 H new ATOM 0 HA SER A 124 12.336 -9.607 3.433 1.00 0.35 H new ATOM 0 HB2 SER A 124 13.744 -11.609 3.914 1.00 0.43 H new ATOM 0 HB3 SER A 124 15.186 -10.617 3.820 1.00 0.43 H new ATOM 0 HG SER A 124 14.459 -10.905 6.003 1.00 1.32 H new ATOM 1940 N ARG A 125 15.096 -7.946 2.701 1.00 0.28 N ATOM 1941 CA ARG A 125 15.741 -6.648 2.836 1.00 0.31 C ATOM 1942 C ARG A 125 15.032 -5.594 1.986 1.00 0.24 C ATOM 1943 O ARG A 125 15.192 -4.402 2.216 1.00 0.24 O ATOM 1944 CB ARG A 125 17.239 -6.725 2.502 1.00 0.41 C ATOM 1945 CG ARG A 125 17.560 -7.014 1.046 1.00 0.91 C ATOM 1946 CD ARG A 125 19.028 -7.387 0.878 1.00 0.74 C ATOM 1947 NE ARG A 125 19.391 -8.543 1.700 1.00 1.01 N ATOM 1948 CZ ARG A 125 20.461 -9.309 1.488 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.280 -9.054 0.478 1.00 1.28 N ATOM 1950 NH2 ARG A 125 20.713 -10.326 2.300 1.00 1.84 N ATOM 0 H ARG A 125 15.588 -8.608 2.101 1.00 0.28 H new ATOM 0 HA ARG A 125 15.659 -6.344 3.880 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.707 -5.781 2.781 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.694 -7.500 3.119 1.00 0.41 H new ATOM 0 HG2 ARG A 125 16.930 -7.827 0.685 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.331 -6.139 0.438 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.230 -7.608 -0.170 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.653 -6.536 1.150 1.00 0.74 H new ATOM 0 HE ARG A 125 18.785 -8.778 2.486 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.094 -8.267 -0.144 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.097 -9.645 0.322 1.00 1.28 H new ATOM 0 HH21 ARG A 125 20.089 -10.520 3.083 1.00 1.84 H new ATOM 0 HH22 ARG A 125 21.531 -10.915 2.141 1.00 1.84 H new ATOM 1964 N ILE A 126 14.242 -6.041 1.012 1.00 0.21 N ATOM 1965 CA ILE A 126 13.368 -5.143 0.265 1.00 0.19 C ATOM 1966 C ILE A 126 12.406 -4.452 1.219 1.00 0.19 C ATOM 1967 O ILE A 126 12.302 -3.225 1.234 1.00 0.19 O ATOM 1968 CB ILE A 126 12.579 -5.903 -0.822 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.508 -6.243 -1.983 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.385 -5.093 -1.306 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.850 -7.046 -3.077 1.00 0.23 C ATOM 0 H ILE A 126 14.190 -7.018 0.723 1.00 0.21 H new ATOM 0 HA ILE A 126 13.989 -4.397 -0.231 1.00 0.19 H new ATOM 0 HB ILE A 126 12.192 -6.826 -0.390 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.896 -5.317 -2.408 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.363 -6.801 -1.600 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.850 -5.655 -2.071 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.717 -4.894 -0.468 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.732 -4.149 -1.726 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.574 -7.248 -3.866 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.487 -7.989 -2.668 1.00 0.23 H new ATOM 0 HD13 ILE A 126 12.013 -6.482 -3.489 1.00 0.23 H new ATOM 1983 N ALA A 127 11.717 -5.251 2.025 1.00 0.22 N ATOM 1984 CA ALA A 127 10.823 -4.723 3.042 1.00 0.25 C ATOM 1985 C ALA A 127 11.571 -3.796 3.990 1.00 0.24 C ATOM 1986 O ALA A 127 11.035 -2.785 4.441 1.00 0.26 O ATOM 1987 CB ALA A 127 10.176 -5.859 3.813 1.00 0.30 C ATOM 0 H ALA A 127 11.762 -6.269 1.992 1.00 0.22 H new ATOM 0 HA ALA A 127 10.042 -4.146 2.547 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.509 -5.450 4.572 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.605 -6.485 3.127 1.00 0.30 H new ATOM 0 HB3 ALA A 127 10.949 -6.458 4.294 1.00 0.30 H new ATOM 1993 N ALA A 128 12.820 -4.145 4.272 1.00 0.22 N ATOM 1994 CA ALA A 128 13.665 -3.341 5.141 1.00 0.23 C ATOM 1995 C ALA A 128 13.960 -1.985 4.510 1.00 0.19 C ATOM 1996 O ALA A 128 13.834 -0.951 5.163 1.00 0.19 O ATOM 1997 CB ALA A 128 14.954 -4.081 5.449 1.00 0.27 C ATOM 0 H ALA A 128 13.271 -4.985 3.908 1.00 0.22 H new ATOM 0 HA ALA A 128 13.131 -3.167 6.075 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.578 -3.469 6.100 1.00 0.27 H new ATOM 0 HB2 ALA A 128 14.723 -5.022 5.948 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.488 -4.284 4.521 1.00 0.27 H new ATOM 2003 N TRP A 129 14.340 -1.992 3.235 1.00 0.17 N ATOM 2004 CA TRP A 129 14.633 -0.751 2.519 1.00 0.17 C ATOM 2005 C TRP A 129 13.386 0.113 2.408 1.00 0.15 C ATOM 2006 O TRP A 129 13.448 1.332 2.583 1.00 0.18 O ATOM 2007 CB TRP A 129 15.189 -1.023 1.119 1.00 0.20 C ATOM 2008 CG TRP A 129 16.495 -1.752 1.114 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.446 -1.744 2.094 1.00 0.27 C ATOM 2010 CD2 TRP A 129 17.001 -2.584 0.068 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.509 -2.530 1.722 1.00 0.33 N ATOM 2012 CE2 TRP A 129 18.259 -3.054 0.480 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.508 -2.979 -1.178 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 19.032 -3.899 -0.310 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 17.274 -3.817 -1.961 1.00 0.47 C ATOM 2016 CH2 TRP A 129 18.526 -4.270 -1.524 1.00 0.50 C ATOM 0 H TRP A 129 14.452 -2.839 2.677 1.00 0.17 H new ATOM 0 HA TRP A 129 15.392 -0.221 3.094 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.458 -1.604 0.556 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.312 -0.074 0.598 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.373 -1.200 3.024 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.347 -2.697 2.279 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.544 -2.634 -1.522 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.997 -4.249 0.024 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.903 -4.129 -2.926 1.00 0.47 H new ATOM 0 HH2 TRP A 129 19.103 -4.926 -2.160 1.00 0.50 H new ATOM 2027 N MET A 130 12.254 -0.523 2.126 1.00 0.16 N ATOM 2028 CA MET A 130 10.991 0.194 2.025 1.00 0.21 C ATOM 2029 C MET A 130 10.634 0.815 3.364 1.00 0.19 C ATOM 2030 O MET A 130 10.264 1.986 3.435 1.00 0.21 O ATOM 2031 CB MET A 130 9.860 -0.726 1.563 1.00 0.29 C ATOM 2032 CG MET A 130 9.967 -1.172 0.114 1.00 0.33 C ATOM 2033 SD MET A 130 8.568 -2.188 -0.393 1.00 0.71 S ATOM 2034 CE MET A 130 7.212 -1.076 -0.031 1.00 0.29 C ATOM 0 H MET A 130 12.186 -1.528 1.964 1.00 0.16 H new ATOM 0 HA MET A 130 11.114 0.980 1.280 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.842 -1.609 2.202 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.909 -0.212 1.703 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.029 -0.295 -0.530 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.891 -1.734 -0.024 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.270 -1.550 -0.306 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.205 -0.846 1.034 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.335 -0.155 -0.601 1.00 0.29 H new ATOM 2044 N ALA A 131 10.771 0.030 4.425 1.00 0.18 N ATOM 2045 CA ALA A 131 10.507 0.509 5.771 1.00 0.20 C ATOM 2046 C ALA A 131 11.446 1.655 6.122 1.00 0.21 C ATOM 2047 O ALA A 131 11.043 2.628 6.747 1.00 0.23 O ATOM 2048 CB ALA A 131 10.655 -0.625 6.770 1.00 0.23 C ATOM 0 H ALA A 131 11.065 -0.945 4.376 1.00 0.18 H new ATOM 0 HA ALA A 131 9.483 0.879 5.814 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.455 -0.253 7.775 1.00 0.23 H new ATOM 0 HB2 ALA A 131 9.947 -1.417 6.528 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.670 -1.020 6.725 1.00 0.23 H new ATOM 2054 N THR A 132 12.697 1.531 5.700 1.00 0.22 N ATOM 2055 CA THR A 132 13.693 2.567 5.925 1.00 0.25 C ATOM 2056 C THR A 132 13.289 3.871 5.235 1.00 0.24 C ATOM 2057 O THR A 132 13.247 4.923 5.867 1.00 0.25 O ATOM 2058 CB THR A 132 15.083 2.121 5.427 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.467 0.906 6.085 1.00 0.33 O ATOM 2060 CG2 THR A 132 16.127 3.194 5.697 1.00 0.37 C ATOM 0 H THR A 132 13.047 0.716 5.196 1.00 0.22 H new ATOM 0 HA THR A 132 13.748 2.739 7.000 1.00 0.25 H new ATOM 0 HB THR A 132 15.024 1.956 4.351 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.841 0.191 5.844 1.00 0.33 H new ATOM 0 HG21 THR A 132 17.098 2.855 5.337 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.848 4.112 5.179 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.184 3.385 6.769 1.00 0.37 H new ATOM 2068 N TYR A 133 12.982 3.800 3.942 1.00 0.23 N ATOM 2069 CA TYR A 133 12.558 4.985 3.200 1.00 0.24 C ATOM 2070 C TYR A 133 11.276 5.557 3.797 1.00 0.21 C ATOM 2071 O TYR A 133 11.138 6.773 3.948 1.00 0.23 O ATOM 2072 CB TYR A 133 12.344 4.654 1.720 1.00 0.27 C ATOM 2073 CG TYR A 133 11.866 5.832 0.896 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.772 6.698 0.295 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.511 6.078 0.723 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.342 7.775 -0.454 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.073 7.155 -0.023 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.984 7.986 -0.622 1.00 0.51 C ATOM 2079 OH TYR A 133 10.559 9.073 -1.346 1.00 0.61 O ATOM 0 H TYR A 133 13.018 2.943 3.390 1.00 0.23 H new ATOM 0 HA TYR A 133 13.348 5.732 3.277 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.280 4.284 1.300 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.617 3.846 1.639 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.831 6.525 0.416 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.788 5.417 1.179 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.058 8.446 -0.905 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.015 7.342 -0.134 1.00 0.45 H new ATOM 0 HH TYR A 133 10.664 8.890 -2.303 1.00 0.61 H new ATOM 2089 N LEU A 134 10.352 4.671 4.141 1.00 0.20 N ATOM 2090 CA LEU A 134 9.086 5.065 4.737 1.00 0.20 C ATOM 2091 C LEU A 134 9.312 5.750 6.084 1.00 0.21 C ATOM 2092 O LEU A 134 8.732 6.789 6.358 1.00 0.24 O ATOM 2093 CB LEU A 134 8.187 3.829 4.878 1.00 0.20 C ATOM 2094 CG LEU A 134 6.941 3.982 5.754 1.00 0.22 C ATOM 2095 CD1 LEU A 134 6.102 5.161 5.308 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.116 2.706 5.708 1.00 0.26 C ATOM 0 H LEU A 134 10.459 3.664 4.015 1.00 0.20 H new ATOM 0 HA LEU A 134 8.588 5.787 4.089 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.867 3.525 3.881 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.789 3.015 5.281 1.00 0.20 H new ATOM 0 HG LEU A 134 7.264 4.166 6.779 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.224 5.245 5.948 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.692 6.075 5.379 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.786 5.013 4.276 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.231 2.822 6.334 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.811 2.507 4.681 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.714 1.873 6.077 1.00 0.26 H new ATOM 2108 N ASN A 135 10.187 5.186 6.898 1.00 0.24 N ATOM 2109 CA ASN A 135 10.469 5.728 8.226 1.00 0.29 C ATOM 2110 C ASN A 135 11.299 7.013 8.150 1.00 0.30 C ATOM 2111 O ASN A 135 11.114 7.929 8.949 1.00 0.33 O ATOM 2112 CB ASN A 135 11.202 4.675 9.065 1.00 0.37 C ATOM 2113 CG ASN A 135 11.526 5.140 10.477 1.00 0.92 C ATOM 2114 OD1 ASN A 135 10.790 5.924 11.078 1.00 1.17 O ATOM 2115 ND2 ASN A 135 12.630 4.648 11.021 1.00 1.46 N ATOM 0 H ASN A 135 10.720 4.348 6.665 1.00 0.24 H new ATOM 0 HA ASN A 135 9.519 5.979 8.698 1.00 0.29 H new ATOM 0 HB2 ASN A 135 10.590 3.775 9.119 1.00 0.37 H new ATOM 0 HB3 ASN A 135 12.128 4.400 8.560 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.895 4.917 11.969 1.00 1.46 H new ATOM 0 HD22 ASN A 135 13.215 4.001 10.492 1.00 1.46 H new ATOM 2122 N ASP A 136 12.207 7.088 7.186 1.00 0.32 N ATOM 2123 CA ASP A 136 13.125 8.226 7.101 1.00 0.37 C ATOM 2124 C ASP A 136 12.564 9.365 6.252 1.00 0.34 C ATOM 2125 O ASP A 136 12.411 10.484 6.736 1.00 0.36 O ATOM 2126 CB ASP A 136 14.487 7.789 6.546 1.00 0.46 C ATOM 2127 CG ASP A 136 15.452 8.952 6.416 1.00 1.19 C ATOM 2128 OD1 ASP A 136 16.082 9.325 7.428 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.589 9.497 5.304 1.00 2.07 O ATOM 0 H ASP A 136 12.331 6.385 6.457 1.00 0.32 H new ATOM 0 HA ASP A 136 13.251 8.600 8.117 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.919 7.032 7.201 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.348 7.324 5.570 1.00 0.46 H new ATOM 2134 N HIS A 137 12.247 9.084 4.993 1.00 0.33 N ATOM 2135 CA HIS A 137 11.861 10.145 4.054 1.00 0.35 C ATOM 2136 C HIS A 137 10.362 10.398 4.082 1.00 0.29 C ATOM 2137 O HIS A 137 9.912 11.541 4.105 1.00 0.32 O ATOM 2138 CB HIS A 137 12.264 9.806 2.608 1.00 0.45 C ATOM 2139 CG HIS A 137 13.740 9.798 2.338 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.409 10.870 1.789 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.667 8.823 2.496 1.00 1.53 C ATOM 2142 CE1 HIS A 137 15.679 10.555 1.621 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.866 9.316 2.040 1.00 1.34 N ATOM 0 H HIS A 137 12.248 8.144 4.597 1.00 0.33 H new ATOM 0 HA HIS A 137 12.392 11.040 4.379 1.00 0.35 H new ATOM 0 HB2 HIS A 137 11.860 8.825 2.356 1.00 0.45 H new ATOM 0 HB3 HIS A 137 11.793 10.526 1.939 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.495 7.838 2.905 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.439 11.202 1.209 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.752 8.810 2.027 1.00 1.34 H new ATOM 2152 N LEU A 138 9.595 9.324 4.092 1.00 0.26 N ATOM 2153 CA LEU A 138 8.160 9.405 3.870 1.00 0.25 C ATOM 2154 C LEU A 138 7.410 9.797 5.144 1.00 0.24 C ATOM 2155 O LEU A 138 6.449 10.563 5.094 1.00 0.25 O ATOM 2156 CB LEU A 138 7.672 8.057 3.351 1.00 0.23 C ATOM 2157 CG LEU A 138 6.300 8.057 2.692 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.281 9.023 1.519 1.00 0.26 C ATOM 2159 CD2 LEU A 138 5.946 6.653 2.234 1.00 0.22 C ATOM 0 H LEU A 138 9.943 8.379 4.252 1.00 0.26 H new ATOM 0 HA LEU A 138 7.959 10.184 3.135 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.400 7.681 2.632 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.654 7.354 4.183 1.00 0.23 H new ATOM 0 HG LEU A 138 5.556 8.385 3.418 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.294 9.014 1.056 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.507 10.029 1.873 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.029 8.720 0.786 1.00 0.26 H new ATOM 0 HD21 LEU A 138 4.963 6.661 1.763 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.689 6.306 1.516 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.931 5.983 3.093 1.00 0.22 H new ATOM 2171 N GLU A 139 7.868 9.264 6.272 1.00 0.26 N ATOM 2172 CA GLU A 139 7.268 9.517 7.585 1.00 0.29 C ATOM 2173 C GLU A 139 6.996 11.010 7.834 1.00 0.30 C ATOM 2174 O GLU A 139 5.868 11.373 8.178 1.00 0.30 O ATOM 2175 CB GLU A 139 8.178 8.943 8.681 1.00 0.36 C ATOM 2176 CG GLU A 139 7.653 9.110 10.098 1.00 0.52 C ATOM 2177 CD GLU A 139 6.529 8.153 10.429 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.359 8.492 10.167 1.00 1.74 O ATOM 2179 OE2 GLU A 139 6.812 7.071 10.990 1.00 1.46 O ATOM 0 H GLU A 139 8.673 8.638 6.305 1.00 0.26 H new ATOM 0 HA GLU A 139 6.299 9.018 7.609 1.00 0.29 H new ATOM 0 HB2 GLU A 139 8.330 7.881 8.488 1.00 0.36 H new ATOM 0 HB3 GLU A 139 9.154 9.423 8.611 1.00 0.36 H new ATOM 0 HG2 GLU A 139 8.471 8.959 10.803 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.302 10.133 10.231 1.00 0.52 H new ATOM 2186 N PRO A 140 8.004 11.908 7.669 1.00 0.33 N ATOM 2187 CA PRO A 140 7.803 13.345 7.885 1.00 0.36 C ATOM 2188 C PRO A 140 6.647 13.904 7.062 1.00 0.31 C ATOM 2189 O PRO A 140 5.831 14.666 7.576 1.00 0.36 O ATOM 2190 CB PRO A 140 9.128 13.976 7.445 1.00 0.42 C ATOM 2191 CG PRO A 140 10.130 12.890 7.601 1.00 0.42 C ATOM 2192 CD PRO A 140 9.401 11.611 7.287 1.00 0.35 C ATOM 0 HA PRO A 140 7.543 13.559 8.922 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.078 14.324 6.413 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.380 14.839 8.061 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.973 13.036 6.925 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.533 12.872 8.614 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.482 11.351 6.231 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.802 10.771 7.854 1.00 0.35 H new ATOM 2200 N TRP A 141 6.559 13.503 5.794 1.00 0.28 N ATOM 2201 CA TRP A 141 5.506 14.002 4.921 1.00 0.25 C ATOM 2202 C TRP A 141 4.157 13.446 5.365 1.00 0.22 C ATOM 2203 O TRP A 141 3.155 14.166 5.404 1.00 0.22 O ATOM 2204 CB TRP A 141 5.774 13.624 3.456 1.00 0.29 C ATOM 2205 CG TRP A 141 4.901 14.376 2.498 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.204 15.545 1.867 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.576 14.024 2.078 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.151 15.945 1.085 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.139 15.028 1.195 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.717 12.957 2.361 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.882 15.002 0.599 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.470 12.930 1.766 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.063 13.945 0.895 1.00 0.36 C ATOM 0 H TRP A 141 7.199 12.841 5.355 1.00 0.28 H new ATOM 0 HA TRP A 141 5.491 15.090 4.993 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.820 13.820 3.219 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.613 12.554 3.325 1.00 0.29 H new ATOM 0 HD1 TRP A 141 6.137 16.079 1.968 1.00 0.32 H new ATOM 0 HE1 TRP A 141 4.125 16.789 0.513 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.023 12.168 3.032 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.564 15.786 -0.072 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 0.799 12.111 1.977 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.082 13.894 0.446 1.00 0.36 H new ATOM 2224 N ILE A 142 4.148 12.166 5.713 1.00 0.20 N ATOM 2225 CA ILE A 142 2.937 11.493 6.160 1.00 0.19 C ATOM 2226 C ILE A 142 2.375 12.166 7.407 1.00 0.20 C ATOM 2227 O ILE A 142 1.243 12.654 7.401 1.00 0.20 O ATOM 2228 CB ILE A 142 3.221 10.001 6.449 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.562 9.269 5.153 1.00 0.21 C ATOM 2230 CG2 ILE A 142 2.033 9.336 7.130 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.967 7.835 5.372 1.00 0.23 C ATOM 0 H ILE A 142 4.975 11.569 5.694 1.00 0.20 H new ATOM 0 HA ILE A 142 2.198 11.563 5.362 1.00 0.19 H new ATOM 0 HB ILE A 142 4.073 9.945 7.126 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.699 9.299 4.488 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.372 9.796 4.648 1.00 0.21 H new ATOM 0 HG21 ILE A 142 2.263 8.288 7.320 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.826 9.839 8.074 1.00 0.25 H new ATOM 0 HG23 ILE A 142 1.158 9.404 6.483 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.196 7.371 4.413 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.849 7.800 6.012 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.150 7.295 5.850 1.00 0.23 H new ATOM 2243 N GLN A 143 3.182 12.205 8.462 1.00 0.25 N ATOM 2244 CA GLN A 143 2.767 12.774 9.737 1.00 0.30 C ATOM 2245 C GLN A 143 2.357 14.238 9.579 1.00 0.29 C ATOM 2246 O GLN A 143 1.378 14.680 10.180 1.00 0.31 O ATOM 2247 CB GLN A 143 3.901 12.648 10.759 1.00 0.40 C ATOM 2248 CG GLN A 143 3.546 13.153 12.152 1.00 0.51 C ATOM 2249 CD GLN A 143 2.380 12.405 12.775 1.00 0.95 C ATOM 2250 OE1 GLN A 143 2.572 11.394 13.451 1.00 1.51 O ATOM 2251 NE2 GLN A 143 1.164 12.890 12.560 1.00 1.60 N ATOM 0 H GLN A 143 4.136 11.845 8.457 1.00 0.25 H new ATOM 0 HA GLN A 143 1.900 12.218 10.094 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.197 11.601 10.829 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.767 13.201 10.394 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.418 13.060 12.799 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.302 14.214 12.097 1.00 0.51 H new ATOM 0 HE21 GLN A 143 1.043 13.730 11.995 1.00 1.60 H new ATOM 0 HE22 GLN A 143 0.350 12.423 12.960 1.00 1.60 H new ATOM 2260 N GLU A 144 3.096 14.974 8.751 1.00 0.29 N ATOM 2261 CA GLU A 144 2.829 16.393 8.528 1.00 0.33 C ATOM 2262 C GLU A 144 1.403 16.611 8.020 1.00 0.29 C ATOM 2263 O GLU A 144 0.729 17.563 8.416 1.00 0.35 O ATOM 2264 CB GLU A 144 3.831 16.974 7.524 1.00 0.41 C ATOM 2265 CG GLU A 144 3.661 18.464 7.274 1.00 0.64 C ATOM 2266 CD GLU A 144 4.476 18.954 6.095 1.00 1.09 C ATOM 2267 OE1 GLU A 144 3.953 18.936 4.963 1.00 1.75 O ATOM 2268 OE2 GLU A 144 5.637 19.365 6.289 1.00 1.25 O ATOM 0 H GLU A 144 3.888 14.609 8.222 1.00 0.29 H new ATOM 0 HA GLU A 144 2.939 16.907 9.483 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.842 16.790 7.887 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.731 16.443 6.577 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.607 18.681 7.098 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.955 19.014 8.168 1.00 0.64 H new ATOM 2275 N ASN A 145 0.939 15.714 7.160 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.385 15.850 6.561 1.00 0.28 C ATOM 2277 C ASN A 145 -1.447 15.118 7.374 1.00 0.30 C ATOM 2278 O ASN A 145 -2.570 14.932 6.908 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.389 15.342 5.114 1.00 0.32 C ATOM 2280 CG ASN A 145 0.358 16.270 4.170 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.214 17.222 3.641 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.636 16.003 3.940 1.00 0.33 N ATOM 0 H ASN A 145 1.456 14.887 6.862 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.629 16.912 6.561 1.00 0.28 H new ATOM 0 HB2 ASN A 145 0.064 14.351 5.079 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.419 15.234 4.773 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.175 16.595 3.308 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.080 15.206 4.395 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.096 14.711 8.587 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.075 14.104 9.472 1.00 0.30 C ATOM 2291 C GLY A 146 -1.712 12.689 9.871 1.00 0.30 C ATOM 2292 O GLY A 146 -2.051 12.240 10.965 1.00 0.41 O ATOM 0 H GLY A 146 -0.156 14.789 8.974 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.174 14.715 10.369 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.048 14.099 8.980 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.019 11.988 8.990 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.635 10.622 9.271 1.00 0.22 C ATOM 2298 C GLY A 147 -1.383 9.633 8.403 1.00 0.19 C ATOM 2299 O GLY A 147 -2.115 10.029 7.492 1.00 0.20 O ATOM 0 H GLY A 147 -0.715 12.341 8.083 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.437 10.507 9.111 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.826 10.400 10.321 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.202 8.349 8.686 1.00 0.20 N ATOM 2304 CA TRP A 148 -1.864 7.292 7.931 1.00 0.21 C ATOM 2305 C TRP A 148 -3.379 7.418 8.005 1.00 0.23 C ATOM 2306 O TRP A 148 -4.078 7.104 7.044 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.451 5.913 8.448 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.057 5.510 8.072 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.973 5.208 8.918 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.457 5.358 6.745 1.00 0.22 C ATOM 2311 NE1 TRP A 148 2.088 4.864 8.196 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.798 4.952 6.862 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.088 5.524 5.467 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.599 4.704 5.753 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.711 5.278 4.367 1.00 0.23 C ATOM 2316 CH2 TRP A 148 2.043 4.873 4.517 1.00 0.24 C ATOM 0 H TRP A 148 -0.599 8.013 9.437 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.552 7.400 6.892 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.540 5.903 9.534 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.149 5.169 8.064 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.918 5.236 9.996 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.987 4.588 8.590 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.114 5.838 5.343 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.626 4.388 5.865 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.301 5.400 3.375 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.643 4.691 3.638 1.00 0.24 H new ATOM 2327 N ASP A 149 -3.879 7.889 9.145 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.321 8.032 9.359 1.00 0.31 C ATOM 2329 C ASP A 149 -5.965 8.890 8.266 1.00 0.30 C ATOM 2330 O ASP A 149 -7.120 8.680 7.895 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.592 8.639 10.741 1.00 0.40 C ATOM 2332 CG ASP A 149 -7.070 8.799 11.033 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -7.748 7.771 11.235 1.00 1.94 O ATOM 2334 OD2 ASP A 149 -7.556 9.949 11.059 1.00 1.96 O ATOM 0 H ASP A 149 -3.307 8.179 9.938 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.769 7.039 9.311 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.142 8.006 11.505 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.106 9.612 10.807 1.00 0.40 H new ATOM 2339 N THR A 150 -5.199 9.831 7.732 1.00 0.27 N ATOM 2340 CA THR A 150 -5.677 10.701 6.666 1.00 0.29 C ATOM 2341 C THR A 150 -5.751 9.941 5.340 1.00 0.28 C ATOM 2342 O THR A 150 -6.700 10.096 4.570 1.00 0.33 O ATOM 2343 CB THR A 150 -4.749 11.920 6.517 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.646 12.602 7.775 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.265 12.880 5.456 1.00 0.37 C ATOM 0 H THR A 150 -4.238 10.012 8.022 1.00 0.27 H new ATOM 0 HA THR A 150 -6.678 11.043 6.929 1.00 0.29 H new ATOM 0 HB THR A 150 -3.767 11.565 6.205 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.653 13.570 7.624 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.588 13.730 5.375 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.320 12.366 4.496 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.258 13.232 5.736 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.749 9.106 5.095 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.681 8.323 3.867 1.00 0.25 C ATOM 2355 C PHE A 151 -5.758 7.240 3.851 1.00 0.26 C ATOM 2356 O PHE A 151 -6.371 6.975 2.813 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.291 7.693 3.726 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.143 6.830 2.506 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.135 7.391 1.242 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -3.002 5.460 2.628 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.989 6.601 0.121 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.858 4.662 1.513 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.889 5.236 0.249 1.00 0.34 C ATOM 0 H PHE A 151 -3.969 8.953 5.734 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.858 8.989 3.022 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.544 8.486 3.693 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.081 7.094 4.612 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.244 8.460 1.131 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -3.005 5.009 3.609 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -2.953 7.055 -0.858 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.722 3.596 1.622 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.835 4.612 -0.631 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.998 6.630 5.007 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.996 5.570 5.130 1.00 0.29 C ATOM 2375 C VAL A 152 -8.401 6.120 4.897 1.00 0.35 C ATOM 2376 O VAL A 152 -9.322 5.390 4.540 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.919 4.899 6.515 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.921 3.763 6.634 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.512 4.393 6.771 1.00 0.28 C ATOM 0 H VAL A 152 -5.513 6.852 5.877 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.780 4.821 4.368 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.171 5.645 7.268 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.842 3.310 7.622 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.930 4.151 6.492 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.711 3.012 5.873 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.468 3.921 7.752 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.242 3.665 6.006 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.813 5.229 6.739 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.548 7.417 5.085 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.808 8.091 4.827 1.00 0.46 C ATOM 2391 C GLU A 153 -10.104 8.123 3.327 1.00 0.51 C ATOM 2392 O GLU A 153 -11.257 8.042 2.905 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.752 9.509 5.394 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.025 10.309 5.193 1.00 0.70 C ATOM 2395 CD GLU A 153 -10.941 11.680 5.818 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -11.215 11.802 7.029 1.00 1.42 O ATOM 2397 OE2 GLU A 153 -10.583 12.641 5.108 1.00 2.17 O ATOM 0 H GLU A 153 -7.804 8.030 5.418 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.613 7.542 5.316 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.536 9.454 6.461 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -8.923 10.042 4.928 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.224 10.409 4.126 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.866 9.766 5.625 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.051 8.209 2.525 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.198 8.351 1.080 1.00 0.59 C ATOM 2406 C LEU A 154 -9.592 7.033 0.417 1.00 0.68 C ATOM 2407 O LEU A 154 -10.409 7.018 -0.502 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.902 8.882 0.460 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.477 10.270 0.940 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.119 10.636 0.365 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.515 11.310 0.549 1.00 0.67 C ATOM 0 H LEU A 154 -8.084 8.183 2.850 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.001 9.067 0.904 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.099 8.178 0.676 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.020 8.909 -0.623 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.400 10.251 2.027 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.830 11.627 0.716 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.378 9.906 0.690 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.173 10.638 -0.724 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.196 12.292 0.899 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.621 11.328 -0.536 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.473 11.057 1.003 1.00 0.67 H new ATOM 2444 N GLY A 156 -10.643 4.248 2.242 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.333 3.433 3.223 1.00 1.02 C ATOM 2446 C GLY A 156 -12.837 3.590 3.151 1.00 1.11 C ATOM 2447 O GLY A 156 -13.390 3.885 2.087 1.00 1.68 O ATOM 0 HA2 GLY A 156 -11.072 2.386 3.069 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -10.990 3.703 4.222 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.495 3.425 4.292 1.00 1.62 N ATOM 2452 CA ASN A 157 -14.950 3.467 4.361 1.00 2.05 C ATOM 2453 C ASN A 157 -15.478 4.865 4.063 1.00 2.33 C ATOM 2454 O ASN A 157 -16.577 5.016 3.537 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.433 3.001 5.739 1.00 3.21 C ATOM 2456 CG ASN A 157 -16.945 3.051 5.882 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -17.650 2.120 5.489 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -17.452 4.125 6.468 1.00 4.60 N ATOM 0 H ASN A 157 -13.039 3.259 5.189 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.340 2.790 3.601 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -15.090 1.981 5.913 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -14.979 3.626 6.508 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -18.459 4.202 6.608 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -16.835 4.875 6.780 1.00 4.60 H new ATOM 2465 N ASN A 158 -14.682 5.882 4.379 1.00 2.99 N ATOM 2466 CA ASN A 158 -15.087 7.274 4.166 1.00 4.03 C ATOM 2467 C ASN A 158 -15.483 7.520 2.712 1.00 4.18 C ATOM 2468 O ASN A 158 -16.420 8.274 2.429 1.00 4.81 O ATOM 2469 CB ASN A 158 -13.954 8.224 4.569 1.00 5.08 C ATOM 2470 CG ASN A 158 -14.257 9.677 4.246 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -13.922 10.168 3.165 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -14.885 10.378 5.175 1.00 6.76 N ATOM 0 H ASN A 158 -13.752 5.772 4.784 1.00 2.99 H new ATOM 0 HA ASN A 158 -15.958 7.469 4.792 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -13.768 8.126 5.639 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -13.038 7.927 4.058 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -15.108 11.359 5.010 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -15.146 9.937 6.057 1.00 6.76 H new ATOM 2479 N ALA A 159 -14.776 6.872 1.796 1.00 3.95 N ATOM 2480 CA ALA A 159 -15.063 7.000 0.375 1.00 4.72 C ATOM 2481 C ALA A 159 -16.372 6.302 0.016 1.00 4.66 C ATOM 2482 O ALA A 159 -17.231 6.875 -0.658 1.00 5.63 O ATOM 2483 CB ALA A 159 -13.918 6.424 -0.444 1.00 4.78 C ATOM 0 H ALA A 159 -13.997 6.250 2.013 1.00 3.95 H new ATOM 0 HA ALA A 159 -15.169 8.060 0.142 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -14.143 6.525 -1.506 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -12.999 6.964 -0.215 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.790 5.370 -0.199 1.00 4.78 H new ATOM 2489 N ALA A 160 -16.525 5.072 0.491 1.00 3.75 N ATOM 2490 CA ALA A 160 -17.693 4.259 0.166 1.00 4.08 C ATOM 2491 C ALA A 160 -18.960 4.770 0.852 1.00 4.33 C ATOM 2492 O ALA A 160 -20.056 4.669 0.299 1.00 5.11 O ATOM 2493 CB ALA A 160 -17.438 2.808 0.542 1.00 3.59 C ATOM 0 H ALA A 160 -15.852 4.613 1.105 1.00 3.75 H new ATOM 0 HA ALA A 160 -17.856 4.333 -0.909 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -18.315 2.209 0.296 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -16.576 2.435 -0.012 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -17.240 2.739 1.612 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.804 5.331 2.049 1.00 3.93 N ATOM 2500 CA ALA A 161 -19.940 5.802 2.841 1.00 4.43 C ATOM 2501 C ALA A 161 -20.720 6.908 2.131 1.00 5.54 C ATOM 2502 O ALA A 161 -21.892 7.131 2.423 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.468 6.284 4.204 1.00 4.39 C ATOM 0 H ALA A 161 -17.897 5.471 2.494 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.617 4.958 2.970 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.323 6.632 4.783 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -18.982 5.464 4.732 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -18.760 7.103 4.075 1.00 4.39 H new ATOM 2509 N GLU A 162 -20.078 7.587 1.188 1.00 5.98 N ATOM 2510 CA GLU A 162 -20.732 8.655 0.438 1.00 7.23 C ATOM 2511 C GLU A 162 -21.771 8.094 -0.532 1.00 7.80 C ATOM 2512 O GLU A 162 -22.618 8.827 -1.042 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.700 9.480 -0.330 1.00 7.72 C ATOM 2514 CG GLU A 162 -18.812 10.324 0.562 1.00 7.99 C ATOM 2515 CD GLU A 162 -19.591 11.363 1.341 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -19.948 12.408 0.758 1.00 9.09 O ATOM 2517 OE2 GLU A 162 -19.853 11.137 2.540 1.00 9.03 O ATOM 0 H GLU A 162 -19.107 7.418 0.924 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.242 9.298 1.155 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -19.076 8.808 -0.919 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -20.219 10.132 -1.033 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -18.281 9.675 1.259 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.058 10.822 -0.048 1.00 7.99 H new ATOM 2524 N SER A 163 -21.707 6.794 -0.782 1.00 7.39 N ATOM 2525 CA SER A 163 -22.631 6.155 -1.705 1.00 8.21 C ATOM 2526 C SER A 163 -23.839 5.575 -0.968 1.00 8.28 C ATOM 2527 O SER A 163 -24.729 4.990 -1.586 1.00 9.15 O ATOM 2528 CB SER A 163 -21.908 5.055 -2.482 1.00 8.03 C ATOM 2529 OG SER A 163 -20.735 5.559 -3.107 1.00 7.86 O ATOM 0 H SER A 163 -21.026 6.163 -0.359 1.00 7.39 H new ATOM 0 HA SER A 163 -22.996 6.910 -2.402 1.00 8.21 H new ATOM 0 HB2 SER A 163 -21.643 4.242 -1.806 1.00 8.03 H new ATOM 0 HB3 SER A 163 -22.576 4.639 -3.236 1.00 8.03 H new ATOM 0 HG SER A 163 -20.289 4.837 -3.596 1.00 7.86 H new ATOM 2535 N ARG A 164 -23.883 5.757 0.349 1.00 7.47 N ATOM 2536 CA ARG A 164 -24.962 5.198 1.159 1.00 7.60 C ATOM 2537 C ARG A 164 -26.288 5.899 0.874 1.00 8.33 C ATOM 2538 O ARG A 164 -27.343 5.264 0.867 1.00 8.87 O ATOM 2539 CB ARG A 164 -24.631 5.283 2.650 1.00 6.69 C ATOM 2540 CG ARG A 164 -23.478 4.385 3.069 1.00 6.19 C ATOM 2541 CD ARG A 164 -23.268 4.411 4.575 1.00 5.74 C ATOM 2542 NE ARG A 164 -24.444 3.927 5.302 1.00 5.66 N ATOM 2543 CZ ARG A 164 -24.435 3.576 6.589 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -23.307 3.621 7.290 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -25.554 3.160 7.166 1.00 6.02 N ATOM 0 H ARG A 164 -23.187 6.285 0.876 1.00 7.47 H new ATOM 0 HA ARG A 164 -25.063 4.148 0.886 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -24.387 6.315 2.901 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -25.517 5.016 3.226 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -23.676 3.363 2.746 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -22.565 4.706 2.568 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -22.405 3.796 4.831 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -23.040 5.429 4.892 1.00 5.74 H new ATOM 0 HE ARG A 164 -25.325 3.854 4.792 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -22.441 3.925 6.844 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -23.307 3.351 8.274 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -26.418 3.109 6.626 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -25.551 2.891 8.150 1.00 6.02 H new ATOM 2559 N LYS A 165 -26.237 7.202 0.639 1.00 8.52 N ATOM 2560 CA LYS A 165 -27.437 7.957 0.292 1.00 9.41 C ATOM 2561 C LYS A 165 -28.007 7.478 -1.044 1.00 10.47 C ATOM 2562 O LYS A 165 -29.223 7.412 -1.224 1.00 11.24 O ATOM 2563 CB LYS A 165 -27.141 9.461 0.260 1.00 9.61 C ATOM 2564 CG LYS A 165 -25.954 9.844 -0.609 1.00 9.69 C ATOM 2565 CD LYS A 165 -25.581 11.307 -0.427 1.00 10.12 C ATOM 2566 CE LYS A 165 -25.209 11.609 1.019 1.00 10.34 C ATOM 2567 NZ LYS A 165 -24.814 13.027 1.213 1.00 10.42 N ATOM 0 H LYS A 165 -25.383 7.758 0.681 1.00 8.52 H new ATOM 0 HA LYS A 165 -28.189 7.781 1.061 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -28.025 9.986 -0.100 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -26.958 9.806 1.278 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -25.100 9.215 -0.358 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -26.192 9.655 -1.656 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -24.743 11.555 -1.079 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -26.417 11.938 -0.729 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -26.055 11.378 1.666 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -24.388 10.960 1.324 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -24.570 13.186 2.211 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -23.990 13.243 0.616 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -25.605 13.647 0.947 1.00 10.42 H new ATOM 2581 N GLY A 166 -27.119 7.118 -1.965 1.00 10.61 N ATOM 2582 CA GLY A 166 -27.548 6.541 -3.223 1.00 11.72 C ATOM 2583 C GLY A 166 -28.127 5.156 -3.029 1.00 12.02 C ATOM 2584 O GLY A 166 -29.107 4.786 -3.674 1.00 13.02 O ATOM 0 H GLY A 166 -26.109 7.216 -1.861 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -28.294 7.187 -3.685 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -26.702 6.490 -3.909 1.00 11.72 H new ATOM 2588 N GLN A 167 -27.519 4.395 -2.122 1.00 11.25 N ATOM 2589 CA GLN A 167 -27.996 3.056 -1.782 1.00 11.64 C ATOM 2590 C GLN A 167 -29.429 3.116 -1.257 1.00 12.01 C ATOM 2591 O GLN A 167 -30.264 2.279 -1.606 1.00 12.84 O ATOM 2592 CB GLN A 167 -27.079 2.410 -0.730 1.00 10.86 C ATOM 2593 CG GLN A 167 -27.506 1.009 -0.306 1.00 11.50 C ATOM 2594 CD GLN A 167 -27.328 -0.029 -1.399 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -27.396 0.277 -2.590 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -27.094 -1.268 -1.001 1.00 12.41 N ATOM 0 H GLN A 167 -26.689 4.685 -1.606 1.00 11.25 H new ATOM 0 HA GLN A 167 -27.978 2.447 -2.686 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -26.065 2.364 -1.127 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -27.048 3.051 0.151 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -26.928 0.709 0.568 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -28.553 1.032 -0.003 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -27.045 -1.483 -0.005 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -26.963 -2.009 -1.690 1.00 12.41 H new ATOM 2605 N GLU A 168 -29.710 4.122 -0.433 1.00 11.51 N ATOM 2606 CA GLU A 168 -31.043 4.306 0.133 1.00 11.94 C ATOM 2607 C GLU A 168 -32.074 4.497 -0.975 1.00 13.03 C ATOM 2608 O GLU A 168 -33.213 4.035 -0.872 1.00 13.73 O ATOM 2609 CB GLU A 168 -31.054 5.509 1.082 1.00 11.38 C ATOM 2610 CG GLU A 168 -32.379 5.710 1.802 1.00 10.85 C ATOM 2611 CD GLU A 168 -32.377 6.933 2.693 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -32.666 8.041 2.196 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -32.083 6.795 3.900 1.00 10.74 O ATOM 0 H GLU A 168 -29.030 4.824 -0.142 1.00 11.51 H new ATOM 0 HA GLU A 168 -31.306 3.411 0.697 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -30.264 5.383 1.822 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -30.819 6.410 0.515 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -33.178 5.802 1.066 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -32.599 4.828 2.403 1.00 10.85 H new