USER MOD reduce.3.24.130724 H: found=0, std=0, add=1295, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1299 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 109 MET CE :methyl -137:sc= -2.86! (180deg=-4.67!) USER MOD Set 1.2: A 124 MET CE :methyl -163:sc= -0.53 (180deg=-1.01) USER MOD Set 1.3: B 26 SER OG : rot -143:sc= -1.65! USER MOD Set 2.1: A 103 SER OG : rot 180:sc= -0.526 USER MOD Set 2.2: A 107 HIS : no HD1:sc= -1.59 K(o=-2.1,f=-4.8) USER MOD Set 3.1: A 101 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 135 GLN : amide:sc= 0 X(o=0,f=0.013) USER MOD Set 4.1: A 75 LYS NZ :NH3+ -114:sc= -0.998 (180deg=-3.84!) USER MOD Set 4.2: A 79 THR OG1 : rot 180:sc= 0.0305 USER MOD Set 5.1: A 60 ASN : amide:sc= -3.37! C(o=-3.5!,f=-10!) USER MOD Set 5.2: A 62 THR OG1 : rot -88:sc= -0.165 USER MOD Single : A 5 SER OG : rot 101:sc= 0.689 USER MOD Single : A 8 GLN : amide:sc= -0.0861 K(o=-0.086,f=-2.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 CYS SG : rot 16:sc= -0.266! USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 73:sc= 1.07 USER MOD Single : A 38 SER OG : rot 85:sc= 0.314 USER MOD Single : A 41 GLN : amide:sc= -0.549 K(o=-0.55,f=-1.2) USER MOD Single : A 42 ASN :FLIP amide:sc= -1.25 F(o=-7!,f=-1.3) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0152 USER MOD Single : A 49 GLN : amide:sc= -1.05 K(o=-1.1,f=-2.3!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -108:sc= 0.0745 USER MOD Single : A 70 SER OG : rot 180:sc= -0.134 USER MOD Single : A 72 MET CE :methyl 178:sc= -0.26 (180deg=-0.269) USER MOD Single : A 74 LYS NZ :NH3+ -164:sc= -0.0596 (180deg=-0.488) USER MOD Single : A 77 LYS NZ :NH3+ -163:sc= -0.0445 (180deg=-0.362) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.0884) USER MOD Single : A 96 GLN : amide:sc=-0.00654 X(o=-0.0065,f=-0.3) USER MOD Single : A 97 ASN : amide:sc= -0.41 K(o=-0.41,f=-9.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.42 K(o=-0.42,f=-1.2) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.46 K(o=-0.46,f=-3.7!) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -2.92 K(o=-2.9,f=-3.7!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.0255 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 MET CE :methyl 158:sc= -0.74 (180deg=-2.26) USER MOD Single : A 145 MET CE :methyl -172:sc= -0.329 (180deg=-0.404) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 21 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.12) USER MOD Single : B 25 SER OG : rot 79:sc= 1.27 USER MOD Single : B 28 SER OG : rot 74:sc= 1.15 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 ASN : amide:sc= -0.0357 K(o=-0.036,f=-1.4!) USER MOD Single : B 39 MET CE :methyl -178:sc= -0.344 (180deg=-0.375) USER MOD Single : B 41 SER OG : rot 160:sc= -0.975 USER MOD Single : B 42 ASN : amide:sc= -2.96! C(o=-3!,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 63 N SER A 5 -5.590 -13.339 2.271 1.00 0.00 N ATOM 64 CA SER A 5 -4.525 -13.598 3.226 1.00 0.00 C ATOM 65 C SER A 5 -4.912 -13.104 4.616 1.00 0.00 C ATOM 66 O SER A 5 -5.702 -12.172 4.751 1.00 0.00 O ATOM 67 CB SER A 5 -3.242 -12.904 2.769 1.00 0.00 C ATOM 68 OG SER A 5 -3.294 -11.533 3.143 1.00 0.00 O ATOM 0 HA SER A 5 -4.360 -14.674 3.276 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.374 -13.384 3.221 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.130 -12.995 1.689 1.00 0.00 H new ATOM 0 HG SER A 5 -2.763 -11.395 3.955 1.00 0.00 H new ATOM 74 N GLU A 6 -4.341 -13.729 5.646 1.00 0.00 N ATOM 75 CA GLU A 6 -4.637 -13.341 7.020 1.00 0.00 C ATOM 76 C GLU A 6 -4.453 -11.836 7.187 1.00 0.00 C ATOM 77 O GLU A 6 -5.257 -11.171 7.837 1.00 0.00 O ATOM 78 CB GLU A 6 -3.712 -14.087 7.979 1.00 0.00 C ATOM 79 CG GLU A 6 -3.934 -15.593 7.835 1.00 0.00 C ATOM 80 CD GLU A 6 -2.916 -16.353 8.675 1.00 0.00 C ATOM 81 OE1 GLU A 6 -2.936 -16.195 9.884 1.00 0.00 O ATOM 82 OE2 GLU A 6 -2.128 -17.084 8.097 1.00 0.00 O ATOM 0 H GLU A 6 -3.678 -14.498 5.554 1.00 0.00 H new ATOM 0 HA GLU A 6 -5.671 -13.599 7.248 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.672 -13.840 7.764 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.908 -13.776 9.005 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.944 -15.852 8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -3.844 -15.884 6.788 1.00 0.00 H new ATOM 89 N GLU A 7 -3.392 -11.299 6.587 1.00 0.00 N ATOM 90 CA GLU A 7 -3.120 -9.861 6.672 1.00 0.00 C ATOM 91 C GLU A 7 -4.258 -9.083 6.021 1.00 0.00 C ATOM 92 O GLU A 7 -4.835 -8.186 6.631 1.00 0.00 O ATOM 93 CB GLU A 7 -1.800 -9.540 5.971 1.00 0.00 C ATOM 94 CG GLU A 7 -0.645 -10.245 6.701 1.00 0.00 C ATOM 95 CD GLU A 7 -0.505 -11.682 6.204 1.00 0.00 C ATOM 96 OE1 GLU A 7 -1.329 -12.101 5.405 1.00 0.00 O ATOM 97 OE2 GLU A 7 0.428 -12.341 6.619 1.00 0.00 O ATOM 0 H GLU A 7 -2.712 -11.829 6.042 1.00 0.00 H new ATOM 0 HA GLU A 7 -3.044 -9.572 7.720 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -1.840 -9.866 4.932 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -1.634 -8.463 5.961 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.285 -9.702 6.534 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.828 -10.240 7.776 1.00 0.00 H new ATOM 104 N GLN A 8 -4.590 -9.447 4.778 1.00 0.00 N ATOM 105 CA GLN A 8 -5.672 -8.778 4.069 1.00 0.00 C ATOM 106 C GLN A 8 -6.908 -8.722 4.966 1.00 0.00 C ATOM 107 O GLN A 8 -7.539 -7.676 5.104 1.00 0.00 O ATOM 108 CB GLN A 8 -5.988 -9.543 2.776 1.00 0.00 C ATOM 109 CG GLN A 8 -7.405 -9.204 2.302 1.00 0.00 C ATOM 110 CD GLN A 8 -7.574 -9.558 0.837 1.00 0.00 C ATOM 111 OE1 GLN A 8 -6.586 -9.775 0.138 1.00 0.00 O ATOM 112 NE2 GLN A 8 -8.768 -9.621 0.326 1.00 0.00 N ATOM 0 H GLN A 8 -4.130 -10.191 4.253 1.00 0.00 H new ATOM 0 HA GLN A 8 -5.372 -7.762 3.813 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.265 -9.283 2.003 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.899 -10.616 2.947 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -8.135 -9.749 2.900 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -7.600 -8.142 2.450 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.583 -9.440 0.911 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.889 -9.852 -0.660 1.00 0.00 H new ATOM 121 N ILE A 9 -7.255 -9.856 5.563 1.00 0.00 N ATOM 122 CA ILE A 9 -8.417 -9.915 6.437 1.00 0.00 C ATOM 123 C ILE A 9 -8.213 -8.999 7.631 1.00 0.00 C ATOM 124 O ILE A 9 -9.128 -8.282 8.035 1.00 0.00 O ATOM 125 CB ILE A 9 -8.634 -11.357 6.922 1.00 0.00 C ATOM 126 CG1 ILE A 9 -9.109 -12.229 5.746 1.00 0.00 C ATOM 127 CG2 ILE A 9 -9.685 -11.377 8.043 1.00 0.00 C ATOM 128 CD1 ILE A 9 -10.630 -12.092 5.578 1.00 0.00 C ATOM 0 H ILE A 9 -6.753 -10.738 5.459 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.296 -9.588 5.881 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.695 -11.753 7.308 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.604 -11.926 4.829 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -8.846 -13.272 5.925 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.835 -12.402 8.383 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -9.340 -10.765 8.876 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.627 -10.978 7.666 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.961 -12.711 4.744 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -11.128 -12.417 6.492 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -10.882 -11.050 5.379 1.00 0.00 H new ATOM 140 N VAL A 10 -7.013 -9.032 8.202 1.00 0.00 N ATOM 141 CA VAL A 10 -6.717 -8.194 9.357 1.00 0.00 C ATOM 142 C VAL A 10 -6.862 -6.717 8.993 1.00 0.00 C ATOM 143 O VAL A 10 -7.547 -5.968 9.689 1.00 0.00 O ATOM 144 CB VAL A 10 -5.283 -8.470 9.836 1.00 0.00 C ATOM 145 CG1 VAL A 10 -4.827 -7.360 10.787 1.00 0.00 C ATOM 146 CG2 VAL A 10 -5.240 -9.816 10.569 1.00 0.00 C ATOM 0 H VAL A 10 -6.241 -9.621 7.889 1.00 0.00 H new ATOM 0 HA VAL A 10 -7.422 -8.429 10.155 1.00 0.00 H new ATOM 0 HB VAL A 10 -4.618 -8.499 8.973 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.810 -7.563 11.122 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.854 -6.402 10.268 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.493 -7.324 11.649 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -4.223 -10.013 10.909 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -5.910 -9.784 11.428 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -5.556 -10.609 9.892 1.00 0.00 H new ATOM 156 N ASP A 11 -6.211 -6.310 7.909 1.00 0.00 N ATOM 157 CA ASP A 11 -6.271 -4.915 7.478 1.00 0.00 C ATOM 158 C ASP A 11 -7.722 -4.503 7.255 1.00 0.00 C ATOM 159 O ASP A 11 -8.187 -3.504 7.805 1.00 0.00 O ATOM 160 CB ASP A 11 -5.483 -4.743 6.180 1.00 0.00 C ATOM 161 CG ASP A 11 -5.638 -3.319 5.662 1.00 0.00 C ATOM 162 OD1 ASP A 11 -4.841 -2.481 6.047 1.00 0.00 O ATOM 163 OD2 ASP A 11 -6.557 -3.086 4.893 1.00 0.00 O ATOM 0 H ASP A 11 -5.642 -6.916 7.318 1.00 0.00 H new ATOM 0 HA ASP A 11 -5.835 -4.283 8.252 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.430 -4.964 6.352 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -5.839 -5.452 5.432 1.00 0.00 H new ATOM 168 N PHE A 12 -8.442 -5.294 6.463 1.00 0.00 N ATOM 169 CA PHE A 12 -9.851 -5.007 6.191 1.00 0.00 C ATOM 170 C PHE A 12 -10.649 -5.024 7.492 1.00 0.00 C ATOM 171 O PHE A 12 -11.504 -4.165 7.722 1.00 0.00 O ATOM 172 CB PHE A 12 -10.415 -6.047 5.214 1.00 0.00 C ATOM 173 CG PHE A 12 -10.094 -5.637 3.794 1.00 0.00 C ATOM 174 CD1 PHE A 12 -8.765 -5.428 3.412 1.00 0.00 C ATOM 175 CD2 PHE A 12 -11.128 -5.461 2.869 1.00 0.00 C ATOM 176 CE1 PHE A 12 -8.470 -5.043 2.100 1.00 0.00 C ATOM 177 CE2 PHE A 12 -10.835 -5.075 1.559 1.00 0.00 C ATOM 178 CZ PHE A 12 -9.506 -4.868 1.173 1.00 0.00 C ATOM 0 H PHE A 12 -8.080 -6.129 6.003 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.932 -4.017 5.742 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.989 -7.028 5.425 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -11.494 -6.134 5.343 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -7.968 -5.564 4.128 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -12.153 -5.624 3.168 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.445 -4.881 1.802 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -11.633 -4.936 0.845 1.00 0.00 H new ATOM 0 HZ PHE A 12 -9.279 -4.573 0.159 1.00 0.00 H new ATOM 188 N LYS A 13 -10.367 -6.009 8.340 1.00 0.00 N ATOM 189 CA LYS A 13 -11.063 -6.125 9.614 1.00 0.00 C ATOM 190 C LYS A 13 -10.811 -4.885 10.469 1.00 0.00 C ATOM 191 O LYS A 13 -11.691 -4.430 11.198 1.00 0.00 O ATOM 192 CB LYS A 13 -10.588 -7.373 10.360 1.00 0.00 C ATOM 193 CG LYS A 13 -11.384 -7.535 11.651 1.00 0.00 C ATOM 194 CD LYS A 13 -11.157 -8.936 12.223 1.00 0.00 C ATOM 195 CE LYS A 13 -9.658 -9.175 12.419 1.00 0.00 C ATOM 196 NZ LYS A 13 -9.455 -10.347 13.314 1.00 0.00 N ATOM 0 H LYS A 13 -9.668 -6.732 8.169 1.00 0.00 H new ATOM 0 HA LYS A 13 -12.132 -6.210 9.420 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -10.714 -8.254 9.731 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -9.525 -7.291 10.585 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -11.077 -6.781 12.376 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -12.445 -7.378 11.458 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -11.679 -9.040 13.174 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -11.570 -9.686 11.549 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -9.178 -9.352 11.456 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -9.191 -8.289 12.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -8.436 -10.510 13.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -9.900 -10.161 14.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.887 -11.190 12.885 1.00 0.00 H new ATOM 210 N GLU A 14 -9.597 -4.349 10.381 1.00 0.00 N ATOM 211 CA GLU A 14 -9.238 -3.164 11.158 1.00 0.00 C ATOM 212 C GLU A 14 -10.103 -1.978 10.733 1.00 0.00 C ATOM 213 O GLU A 14 -10.713 -1.310 11.568 1.00 0.00 O ATOM 214 CB GLU A 14 -7.763 -2.832 10.945 1.00 0.00 C ATOM 215 CG GLU A 14 -7.315 -1.813 11.993 1.00 0.00 C ATOM 216 CD GLU A 14 -5.821 -1.552 11.859 1.00 0.00 C ATOM 217 OE1 GLU A 14 -5.168 -2.310 11.160 1.00 0.00 O ATOM 218 OE2 GLU A 14 -5.345 -0.612 12.471 1.00 0.00 O ATOM 0 H GLU A 14 -8.851 -4.711 9.786 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.410 -3.368 12.215 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -7.161 -3.737 11.021 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.610 -2.431 9.943 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -7.868 -0.882 11.867 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -7.540 -2.184 12.993 1.00 0.00 H new ATOM 225 N ALA A 15 -10.164 -1.731 9.423 1.00 0.00 N ATOM 226 CA ALA A 15 -10.963 -0.623 8.901 1.00 0.00 C ATOM 227 C ALA A 15 -12.407 -0.746 9.386 1.00 0.00 C ATOM 228 O ALA A 15 -13.056 0.253 9.711 1.00 0.00 O ATOM 229 CB ALA A 15 -10.923 -0.634 7.369 1.00 0.00 C ATOM 0 H ALA A 15 -9.676 -2.276 8.712 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.549 0.318 9.263 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -11.519 0.193 6.984 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.892 -0.526 7.031 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -11.329 -1.576 7.001 1.00 0.00 H new ATOM 235 N PHE A 16 -12.902 -1.980 9.440 1.00 0.00 N ATOM 236 CA PHE A 16 -14.267 -2.220 9.901 1.00 0.00 C ATOM 237 C PHE A 16 -14.423 -1.745 11.346 1.00 0.00 C ATOM 238 O PHE A 16 -15.396 -1.072 11.687 1.00 0.00 O ATOM 239 CB PHE A 16 -14.597 -3.713 9.804 1.00 0.00 C ATOM 240 CG PHE A 16 -15.897 -3.992 10.520 1.00 0.00 C ATOM 241 CD1 PHE A 16 -15.884 -4.306 11.886 1.00 0.00 C ATOM 242 CD2 PHE A 16 -17.107 -3.934 9.826 1.00 0.00 C ATOM 243 CE1 PHE A 16 -17.083 -4.563 12.554 1.00 0.00 C ATOM 244 CE2 PHE A 16 -18.307 -4.191 10.493 1.00 0.00 C ATOM 245 CZ PHE A 16 -18.295 -4.507 11.857 1.00 0.00 C ATOM 0 H PHE A 16 -12.387 -2.819 9.174 1.00 0.00 H new ATOM 0 HA PHE A 16 -14.957 -1.662 9.268 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -14.675 -4.011 8.759 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -13.793 -4.303 10.245 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -14.947 -4.349 12.422 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -17.115 -3.691 8.774 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -17.075 -4.805 13.607 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -19.244 -4.146 9.957 1.00 0.00 H new ATOM 0 HZ PHE A 16 -19.223 -4.708 12.372 1.00 0.00 H new ATOM 255 N GLY A 17 -13.466 -2.110 12.191 1.00 0.00 N ATOM 256 CA GLY A 17 -13.510 -1.722 13.597 1.00 0.00 C ATOM 257 C GLY A 17 -13.597 -0.209 13.726 1.00 0.00 C ATOM 258 O GLY A 17 -14.293 0.313 14.601 1.00 0.00 O ATOM 0 H GLY A 17 -12.655 -2.670 11.930 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -14.369 -2.185 14.082 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.620 -2.087 14.110 1.00 0.00 H new ATOM 262 N LEU A 18 -12.890 0.501 12.850 1.00 0.00 N ATOM 263 CA LEU A 18 -12.910 1.964 12.889 1.00 0.00 C ATOM 264 C LEU A 18 -14.316 2.492 12.636 1.00 0.00 C ATOM 265 O LEU A 18 -14.831 3.296 13.412 1.00 0.00 O ATOM 266 CB LEU A 18 -11.949 2.520 11.817 1.00 0.00 C ATOM 267 CG LEU A 18 -10.556 2.726 12.415 1.00 0.00 C ATOM 268 CD1 LEU A 18 -9.950 1.373 12.788 1.00 0.00 C ATOM 269 CD2 LEU A 18 -9.665 3.425 11.393 1.00 0.00 C ATOM 0 H LEU A 18 -12.306 0.098 12.117 1.00 0.00 H new ATOM 0 HA LEU A 18 -12.590 2.290 13.879 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -11.893 1.830 10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -12.331 3.465 11.430 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.633 3.342 13.311 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.958 1.524 13.214 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.588 0.878 13.520 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.872 0.751 11.896 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.672 3.573 11.817 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.589 2.810 10.496 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.097 4.392 11.135 1.00 0.00 H new ATOM 281 N PHE A 19 -14.925 2.036 11.554 1.00 0.00 N ATOM 282 CA PHE A 19 -16.270 2.481 11.214 1.00 0.00 C ATOM 283 C PHE A 19 -17.209 2.282 12.393 1.00 0.00 C ATOM 284 O PHE A 19 -18.140 3.065 12.597 1.00 0.00 O ATOM 285 CB PHE A 19 -16.796 1.685 10.010 1.00 0.00 C ATOM 286 CG PHE A 19 -16.271 2.288 8.727 1.00 0.00 C ATOM 287 CD1 PHE A 19 -16.636 3.595 8.374 1.00 0.00 C ATOM 288 CD2 PHE A 19 -15.421 1.551 7.897 1.00 0.00 C ATOM 289 CE1 PHE A 19 -16.154 4.160 7.193 1.00 0.00 C ATOM 290 CE2 PHE A 19 -14.940 2.116 6.717 1.00 0.00 C ATOM 291 CZ PHE A 19 -15.304 3.421 6.363 1.00 0.00 C ATOM 0 H PHE A 19 -14.517 1.366 10.902 1.00 0.00 H new ATOM 0 HA PHE A 19 -16.229 3.541 10.964 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -16.484 0.643 10.087 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -17.886 1.692 10.006 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -17.291 4.165 9.017 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -15.137 0.545 8.170 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.436 5.166 6.920 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -14.285 1.546 6.074 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.929 3.857 5.449 1.00 0.00 H new ATOM 301 N ASP A 20 -16.962 1.235 13.170 1.00 0.00 N ATOM 302 CA ASP A 20 -17.798 0.945 14.333 1.00 0.00 C ATOM 303 C ASP A 20 -17.152 1.432 15.623 1.00 0.00 C ATOM 304 O ASP A 20 -16.600 0.642 16.387 1.00 0.00 O ATOM 305 CB ASP A 20 -18.044 -0.562 14.422 1.00 0.00 C ATOM 306 CG ASP A 20 -18.867 -1.028 13.226 1.00 0.00 C ATOM 307 OD1 ASP A 20 -19.666 -0.252 12.739 1.00 0.00 O ATOM 308 OD2 ASP A 20 -18.687 -2.157 12.820 1.00 0.00 O ATOM 0 H ASP A 20 -16.197 0.577 13.020 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.743 1.473 14.209 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.093 -1.093 14.448 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -18.567 -0.799 15.348 1.00 0.00 H new ATOM 313 N LYS A 21 -17.213 2.736 15.850 1.00 0.00 N ATOM 314 CA LYS A 21 -16.629 3.321 17.047 1.00 0.00 C ATOM 315 C LYS A 21 -17.127 2.588 18.285 1.00 0.00 C ATOM 316 O LYS A 21 -16.464 2.568 19.321 1.00 0.00 O ATOM 317 CB LYS A 21 -17.008 4.801 17.146 1.00 0.00 C ATOM 318 CG LYS A 21 -16.945 5.435 15.757 1.00 0.00 C ATOM 319 CD LYS A 21 -17.033 6.956 15.884 1.00 0.00 C ATOM 320 CE LYS A 21 -18.413 7.354 16.415 1.00 0.00 C ATOM 321 NZ LYS A 21 -18.634 8.809 16.188 1.00 0.00 N ATOM 0 H LYS A 21 -17.659 3.406 15.224 1.00 0.00 H new ATOM 0 HA LYS A 21 -15.545 3.229 16.986 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -18.011 4.904 17.560 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.329 5.317 17.825 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.016 5.154 15.260 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -17.762 5.063 15.139 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.256 7.319 16.557 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.858 7.422 14.914 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -19.188 6.775 15.913 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -18.484 7.126 17.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -19.571 9.078 16.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -17.902 9.353 16.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -18.584 9.013 15.169 1.00 0.00 H new ATOM 335 N ASP A 22 -18.314 1.990 18.178 1.00 0.00 N ATOM 336 CA ASP A 22 -18.903 1.264 19.299 1.00 0.00 C ATOM 337 C ASP A 22 -18.861 -0.220 19.052 1.00 0.00 C ATOM 338 O ASP A 22 -19.792 -0.921 19.436 1.00 0.00 O ATOM 339 CB ASP A 22 -20.356 1.696 19.501 1.00 0.00 C ATOM 340 CG ASP A 22 -21.157 1.453 18.225 1.00 0.00 C ATOM 341 OD1 ASP A 22 -20.648 0.769 17.353 1.00 0.00 O ATOM 342 OD2 ASP A 22 -22.263 1.960 18.138 1.00 0.00 O ATOM 0 H ASP A 22 -18.882 1.995 17.331 1.00 0.00 H new ATOM 0 HA ASP A 22 -18.323 1.494 20.193 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -20.797 1.140 20.328 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -20.396 2.752 19.769 1.00 0.00 H new ATOM 347 N GLY A 23 -17.778 -0.697 18.421 1.00 0.00 N ATOM 348 CA GLY A 23 -17.610 -2.127 18.122 1.00 0.00 C ATOM 349 C GLY A 23 -18.865 -2.930 18.433 1.00 0.00 C ATOM 350 O GLY A 23 -18.878 -3.758 19.341 1.00 0.00 O ATOM 0 H GLY A 23 -17.004 -0.112 18.107 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -17.354 -2.249 17.069 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -16.775 -2.522 18.701 1.00 0.00 H new ATOM 354 N ASP A 24 -19.945 -2.621 17.713 1.00 0.00 N ATOM 355 CA ASP A 24 -21.224 -3.286 17.952 1.00 0.00 C ATOM 356 C ASP A 24 -21.279 -4.570 17.147 1.00 0.00 C ATOM 357 O ASP A 24 -21.967 -5.520 17.515 1.00 0.00 O ATOM 358 CB ASP A 24 -22.387 -2.379 17.548 1.00 0.00 C ATOM 359 CG ASP A 24 -22.326 -2.090 16.054 1.00 0.00 C ATOM 360 OD1 ASP A 24 -21.312 -2.394 15.448 1.00 0.00 O ATOM 361 OD2 ASP A 24 -23.287 -1.546 15.536 1.00 0.00 O ATOM 0 H ASP A 24 -19.959 -1.923 16.969 1.00 0.00 H new ATOM 0 HA ASP A 24 -21.311 -3.510 19.015 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -23.335 -2.857 17.796 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -22.344 -1.446 18.110 1.00 0.00 H new ATOM 366 N GLY A 25 -20.539 -4.604 16.035 1.00 0.00 N ATOM 367 CA GLY A 25 -20.510 -5.789 15.176 1.00 0.00 C ATOM 368 C GLY A 25 -21.182 -5.512 13.835 1.00 0.00 C ATOM 369 O GLY A 25 -21.414 -6.429 13.047 1.00 0.00 O ATOM 0 H GLY A 25 -19.957 -3.831 15.711 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -19.478 -6.098 15.012 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -21.015 -6.616 15.675 1.00 0.00 H new ATOM 373 N CYS A 26 -21.490 -4.246 13.581 1.00 0.00 N ATOM 374 CA CYS A 26 -22.133 -3.865 12.327 1.00 0.00 C ATOM 375 C CYS A 26 -21.948 -2.378 12.068 1.00 0.00 C ATOM 376 O CYS A 26 -21.591 -1.617 12.974 1.00 0.00 O ATOM 377 CB CYS A 26 -23.624 -4.189 12.384 1.00 0.00 C ATOM 378 SG CYS A 26 -24.407 -3.208 13.689 1.00 0.00 S ATOM 0 H CYS A 26 -21.308 -3.471 14.219 1.00 0.00 H new ATOM 0 HA CYS A 26 -21.670 -4.428 11.517 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -24.091 -3.973 11.423 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -23.769 -5.252 12.577 1.00 0.00 H new ATOM 0 HG CYS A 26 -23.618 -2.233 14.031 1.00 0.00 H new ATOM 384 N ILE A 27 -22.188 -1.963 10.821 1.00 0.00 N ATOM 385 CA ILE A 27 -22.046 -0.549 10.451 1.00 0.00 C ATOM 386 C ILE A 27 -23.386 0.010 10.013 1.00 0.00 C ATOM 387 O ILE A 27 -24.005 -0.507 9.093 1.00 0.00 O ATOM 388 CB ILE A 27 -21.032 -0.413 9.321 1.00 0.00 C ATOM 389 CG1 ILE A 27 -19.661 -0.895 9.807 1.00 0.00 C ATOM 390 CG2 ILE A 27 -20.937 1.054 8.901 1.00 0.00 C ATOM 391 CD1 ILE A 27 -18.741 -1.113 8.606 1.00 0.00 C ATOM 0 H ILE A 27 -22.478 -2.575 10.058 1.00 0.00 H new ATOM 0 HA ILE A 27 -21.695 0.013 11.317 1.00 0.00 H new ATOM 0 HB ILE A 27 -21.349 -1.016 8.470 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -19.225 -0.161 10.484 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -19.768 -1.823 10.369 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.213 1.155 8.093 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.913 1.398 8.559 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -20.618 1.656 9.752 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -17.766 -1.456 8.952 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.176 -1.863 7.946 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -18.624 -0.176 8.062 1.00 0.00 H new ATOM 403 N THR A 28 -23.831 1.075 10.676 1.00 0.00 N ATOM 404 CA THR A 28 -25.111 1.700 10.343 1.00 0.00 C ATOM 405 C THR A 28 -24.895 3.021 9.615 1.00 0.00 C ATOM 406 O THR A 28 -23.879 3.687 9.806 1.00 0.00 O ATOM 407 CB THR A 28 -25.908 1.945 11.629 1.00 0.00 C ATOM 408 OG1 THR A 28 -25.827 0.795 12.464 1.00 0.00 O ATOM 409 CG2 THR A 28 -27.373 2.215 11.280 1.00 0.00 C ATOM 0 H THR A 28 -23.328 1.522 11.443 1.00 0.00 H new ATOM 0 HA THR A 28 -25.666 1.031 9.685 1.00 0.00 H new ATOM 0 HB THR A 28 -25.494 2.807 12.152 1.00 0.00 H new ATOM 0 HG1 THR A 28 -26.335 0.952 13.287 1.00 0.00 H new ATOM 0 HG21 THR A 28 -27.939 2.389 12.195 1.00 0.00 H new ATOM 0 HG22 THR A 28 -27.438 3.095 10.640 1.00 0.00 H new ATOM 0 HG23 THR A 28 -27.787 1.354 10.756 1.00 0.00 H new ATOM 417 N VAL A 29 -25.864 3.395 8.788 1.00 0.00 N ATOM 418 CA VAL A 29 -25.773 4.637 8.036 1.00 0.00 C ATOM 419 C VAL A 29 -25.389 5.790 8.959 1.00 0.00 C ATOM 420 O VAL A 29 -24.593 6.655 8.589 1.00 0.00 O ATOM 421 CB VAL A 29 -27.116 4.942 7.366 1.00 0.00 C ATOM 422 CG1 VAL A 29 -27.015 6.260 6.592 1.00 0.00 C ATOM 423 CG2 VAL A 29 -27.469 3.811 6.399 1.00 0.00 C ATOM 0 H VAL A 29 -26.716 2.859 8.623 1.00 0.00 H new ATOM 0 HA VAL A 29 -25.004 4.524 7.271 1.00 0.00 H new ATOM 0 HB VAL A 29 -27.891 5.027 8.128 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -27.971 6.476 6.115 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -26.761 7.067 7.279 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -26.241 6.176 5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -28.425 4.026 5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -26.693 3.728 5.638 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -27.541 2.872 6.948 1.00 0.00 H new ATOM 433 N GLU A 30 -25.964 5.800 10.159 1.00 0.00 N ATOM 434 CA GLU A 30 -25.676 6.858 11.123 1.00 0.00 C ATOM 435 C GLU A 30 -24.194 6.850 11.493 1.00 0.00 C ATOM 436 O GLU A 30 -23.510 7.866 11.371 1.00 0.00 O ATOM 437 CB GLU A 30 -26.520 6.656 12.380 1.00 0.00 C ATOM 438 CG GLU A 30 -27.999 6.838 12.036 1.00 0.00 C ATOM 439 CD GLU A 30 -28.857 6.577 13.269 1.00 0.00 C ATOM 440 OE1 GLU A 30 -28.290 6.369 14.329 1.00 0.00 O ATOM 441 OE2 GLU A 30 -30.070 6.592 13.136 1.00 0.00 O ATOM 0 H GLU A 30 -26.625 5.095 10.485 1.00 0.00 H new ATOM 0 HA GLU A 30 -25.922 7.819 10.672 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -26.351 5.660 12.788 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -26.224 7.370 13.148 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -28.174 7.849 11.669 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -28.281 6.155 11.235 1.00 0.00 H new ATOM 448 N GLU A 31 -23.705 5.697 11.941 1.00 0.00 N ATOM 449 CA GLU A 31 -22.301 5.571 12.324 1.00 0.00 C ATOM 450 C GLU A 31 -21.398 5.871 11.129 1.00 0.00 C ATOM 451 O GLU A 31 -20.413 6.605 11.244 1.00 0.00 O ATOM 452 CB GLU A 31 -22.029 4.154 12.832 1.00 0.00 C ATOM 453 CG GLU A 31 -22.755 3.941 14.161 1.00 0.00 C ATOM 454 CD GLU A 31 -22.619 2.488 14.597 1.00 0.00 C ATOM 455 OE1 GLU A 31 -22.856 1.619 13.774 1.00 0.00 O ATOM 456 OE2 GLU A 31 -22.290 2.260 15.750 1.00 0.00 O ATOM 0 H GLU A 31 -24.254 4.844 12.047 1.00 0.00 H new ATOM 0 HA GLU A 31 -22.087 6.288 13.117 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.368 3.422 12.099 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -20.958 4.002 12.962 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -22.338 4.599 14.923 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.808 4.202 14.056 1.00 0.00 H new ATOM 463 N LEU A 32 -21.749 5.305 9.978 1.00 0.00 N ATOM 464 CA LEU A 32 -20.972 5.523 8.767 1.00 0.00 C ATOM 465 C LEU A 32 -21.041 6.989 8.347 1.00 0.00 C ATOM 466 O LEU A 32 -20.053 7.562 7.879 1.00 0.00 O ATOM 467 CB LEU A 32 -21.495 4.635 7.637 1.00 0.00 C ATOM 468 CG LEU A 32 -20.482 4.626 6.476 1.00 0.00 C ATOM 469 CD1 LEU A 32 -19.437 3.523 6.716 1.00 0.00 C ATOM 470 CD2 LEU A 32 -21.214 4.357 5.163 1.00 0.00 C ATOM 0 H LEU A 32 -22.560 4.697 9.861 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.933 5.264 8.972 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -21.654 3.620 8.002 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -22.460 5.003 7.288 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.983 5.594 6.422 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -18.720 3.516 5.895 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -18.914 3.715 7.653 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -19.935 2.555 6.770 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -20.497 4.351 4.342 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -21.713 3.390 5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -21.954 5.139 4.992 1.00 0.00 H new ATOM 482 N ALA A 33 -22.217 7.591 8.507 1.00 0.00 N ATOM 483 CA ALA A 33 -22.408 8.991 8.141 1.00 0.00 C ATOM 484 C ALA A 33 -21.512 9.881 9.001 1.00 0.00 C ATOM 485 O ALA A 33 -20.853 10.783 8.497 1.00 0.00 O ATOM 486 CB ALA A 33 -23.871 9.386 8.335 1.00 0.00 C ATOM 0 H ALA A 33 -23.047 7.134 8.885 1.00 0.00 H new ATOM 0 HA ALA A 33 -22.140 9.123 7.093 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -24.005 10.432 8.060 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -24.503 8.761 7.704 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -24.150 9.247 9.380 1.00 0.00 H new ATOM 492 N THR A 34 -21.490 9.614 10.305 1.00 0.00 N ATOM 493 CA THR A 34 -20.672 10.400 11.222 1.00 0.00 C ATOM 494 C THR A 34 -19.211 10.341 10.798 1.00 0.00 C ATOM 495 O THR A 34 -18.515 11.359 10.788 1.00 0.00 O ATOM 496 CB THR A 34 -20.817 9.858 12.645 1.00 0.00 C ATOM 497 OG1 THR A 34 -22.197 9.711 12.955 1.00 0.00 O ATOM 498 CG2 THR A 34 -20.166 10.825 13.630 1.00 0.00 C ATOM 0 H THR A 34 -22.025 8.866 10.746 1.00 0.00 H new ATOM 0 HA THR A 34 -21.010 11.436 11.196 1.00 0.00 H new ATOM 0 HB THR A 34 -20.325 8.888 12.718 1.00 0.00 H new ATOM 0 HG1 THR A 34 -22.560 8.940 12.472 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.270 10.437 14.643 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.108 10.932 13.390 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.654 11.797 13.562 1.00 0.00 H new ATOM 506 N VAL A 35 -18.748 9.146 10.438 1.00 0.00 N ATOM 507 CA VAL A 35 -17.365 8.974 10.005 1.00 0.00 C ATOM 508 C VAL A 35 -17.116 9.740 8.707 1.00 0.00 C ATOM 509 O VAL A 35 -16.107 10.432 8.566 1.00 0.00 O ATOM 510 CB VAL A 35 -17.069 7.489 9.787 1.00 0.00 C ATOM 511 CG1 VAL A 35 -15.655 7.325 9.221 1.00 0.00 C ATOM 512 CG2 VAL A 35 -17.174 6.751 11.122 1.00 0.00 C ATOM 0 H VAL A 35 -19.304 8.291 10.437 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.706 9.366 10.780 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.790 7.074 9.083 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.446 6.267 9.066 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.580 7.853 8.270 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.932 7.739 9.923 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.964 5.692 10.970 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.453 7.167 11.825 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.181 6.867 11.524 1.00 0.00 H new ATOM 522 N ILE A 36 -18.040 9.611 7.759 1.00 0.00 N ATOM 523 CA ILE A 36 -17.910 10.299 6.479 1.00 0.00 C ATOM 524 C ILE A 36 -17.970 11.814 6.673 1.00 0.00 C ATOM 525 O ILE A 36 -17.179 12.553 6.092 1.00 0.00 O ATOM 526 CB ILE A 36 -19.030 9.855 5.533 1.00 0.00 C ATOM 527 CG1 ILE A 36 -18.817 8.391 5.140 1.00 0.00 C ATOM 528 CG2 ILE A 36 -19.016 10.728 4.274 1.00 0.00 C ATOM 529 CD1 ILE A 36 -20.078 7.857 4.461 1.00 0.00 C ATOM 0 H ILE A 36 -18.881 9.041 7.852 1.00 0.00 H new ATOM 0 HA ILE A 36 -16.944 10.041 6.045 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.991 9.961 6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.964 8.304 4.467 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.587 7.796 6.024 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.814 10.411 3.602 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -19.170 11.771 4.552 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.055 10.625 3.770 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -19.927 6.815 4.181 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -20.920 7.929 5.149 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.288 8.446 3.568 1.00 0.00 H new ATOM 541 N ARG A 37 -18.920 12.261 7.491 1.00 0.00 N ATOM 542 CA ARG A 37 -19.078 13.686 7.753 1.00 0.00 C ATOM 543 C ARG A 37 -17.836 14.243 8.432 1.00 0.00 C ATOM 544 O ARG A 37 -17.429 15.376 8.173 1.00 0.00 O ATOM 545 CB ARG A 37 -20.309 13.923 8.627 1.00 0.00 C ATOM 546 CG ARG A 37 -21.576 13.662 7.812 1.00 0.00 C ATOM 547 CD ARG A 37 -22.799 13.776 8.724 1.00 0.00 C ATOM 548 NE ARG A 37 -22.813 12.678 9.686 1.00 0.00 N ATOM 549 CZ ARG A 37 -23.703 12.640 10.671 1.00 0.00 C ATOM 550 NH1 ARG A 37 -24.584 13.595 10.792 1.00 0.00 N ATOM 551 NH2 ARG A 37 -23.695 11.648 11.519 1.00 0.00 N ATOM 0 H ARG A 37 -19.586 11.662 7.979 1.00 0.00 H new ATOM 0 HA ARG A 37 -19.213 14.203 6.803 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -20.282 13.266 9.496 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -20.310 14.947 9.001 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -21.650 14.379 6.995 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -21.535 12.670 7.363 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -22.782 14.730 9.250 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -23.711 13.758 8.127 1.00 0.00 H new ATOM 0 HE ARG A 37 -22.128 11.927 9.600 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -24.589 14.371 10.130 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -25.267 13.566 11.549 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -23.005 10.902 11.425 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -24.378 11.618 12.276 1.00 0.00 H new ATOM 565 N SER A 38 -17.237 13.440 9.302 1.00 0.00 N ATOM 566 CA SER A 38 -16.034 13.860 10.016 1.00 0.00 C ATOM 567 C SER A 38 -14.802 13.595 9.168 1.00 0.00 C ATOM 568 O SER A 38 -13.681 13.542 9.679 1.00 0.00 O ATOM 569 CB SER A 38 -15.912 13.104 11.336 1.00 0.00 C ATOM 570 OG SER A 38 -16.992 13.468 12.183 1.00 0.00 O ATOM 0 H SER A 38 -17.560 12.500 9.531 1.00 0.00 H new ATOM 0 HA SER A 38 -16.109 14.928 10.219 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.922 12.029 11.156 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.962 13.338 11.817 1.00 0.00 H new ATOM 0 HG SER A 38 -17.775 12.919 11.969 1.00 0.00 H new ATOM 576 N LEU A 39 -15.011 13.421 7.861 1.00 0.00 N ATOM 577 CA LEU A 39 -13.905 13.162 6.946 1.00 0.00 C ATOM 578 C LEU A 39 -13.728 14.292 5.967 1.00 0.00 C ATOM 579 O LEU A 39 -13.080 14.101 4.938 1.00 0.00 O ATOM 580 CB LEU A 39 -14.164 11.844 6.178 1.00 0.00 C ATOM 581 CG LEU A 39 -12.926 10.917 6.267 1.00 0.00 C ATOM 582 CD1 LEU A 39 -13.372 9.467 6.262 1.00 0.00 C ATOM 583 CD2 LEU A 39 -12.011 11.187 5.071 1.00 0.00 C ATOM 0 H LEU A 39 -15.929 13.455 7.418 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.991 13.076 7.533 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -15.036 11.339 6.593 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -14.389 12.062 5.134 1.00 0.00 H new ATOM 0 HG LEU A 39 -12.383 11.115 7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.499 8.818 6.325 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -14.023 9.284 7.117 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -13.915 9.257 5.341 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.137 10.538 5.127 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -12.552 10.987 4.146 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.690 12.229 5.086 1.00 0.00 H new ATOM 595 N ASP A 40 -14.300 15.444 6.284 1.00 0.00 N ATOM 596 CA ASP A 40 -14.202 16.617 5.416 1.00 0.00 C ATOM 597 C ASP A 40 -15.325 16.613 4.384 1.00 0.00 C ATOM 598 O ASP A 40 -15.786 17.669 3.956 1.00 0.00 O ATOM 599 CB ASP A 40 -12.835 16.642 4.704 1.00 0.00 C ATOM 600 CG ASP A 40 -12.447 18.061 4.347 1.00 0.00 C ATOM 601 OD1 ASP A 40 -13.333 18.895 4.304 1.00 0.00 O ATOM 602 OD2 ASP A 40 -11.273 18.290 4.130 1.00 0.00 O ATOM 0 H ASP A 40 -14.839 15.596 7.137 1.00 0.00 H new ATOM 0 HA ASP A 40 -14.297 17.510 6.033 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -12.074 16.203 5.349 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -12.878 16.033 3.801 1.00 0.00 H new ATOM 607 N GLN A 41 -15.754 15.418 3.986 1.00 0.00 N ATOM 608 CA GLN A 41 -16.822 15.289 3.001 1.00 0.00 C ATOM 609 C GLN A 41 -18.172 15.318 3.694 1.00 0.00 C ATOM 610 O GLN A 41 -18.314 14.836 4.811 1.00 0.00 O ATOM 611 CB GLN A 41 -16.666 13.984 2.224 1.00 0.00 C ATOM 612 CG GLN A 41 -15.392 14.038 1.383 1.00 0.00 C ATOM 613 CD GLN A 41 -15.540 15.075 0.274 1.00 0.00 C ATOM 614 OE1 GLN A 41 -15.298 16.263 0.492 1.00 0.00 O ATOM 615 NE2 GLN A 41 -15.932 14.696 -0.912 1.00 0.00 N ATOM 0 H GLN A 41 -15.381 14.532 4.328 1.00 0.00 H new ATOM 0 HA GLN A 41 -16.760 16.125 2.304 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -16.623 13.141 2.914 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -17.532 13.826 1.581 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -14.540 14.289 2.015 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -15.190 13.058 0.951 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -16.132 13.712 -1.093 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -16.038 15.383 -1.658 1.00 0.00 H new ATOM 624 N ASN A 42 -19.172 15.889 3.027 1.00 0.00 N ATOM 625 CA ASN A 42 -20.518 15.977 3.600 1.00 0.00 C ATOM 626 C ASN A 42 -21.570 15.736 2.516 1.00 0.00 C ATOM 627 O ASN A 42 -22.315 16.644 2.146 1.00 0.00 O ATOM 628 CB ASN A 42 -20.727 17.357 4.215 1.00 0.00 C ATOM 629 CG ASN A 42 -20.494 18.443 3.171 1.00 0.00 C ATOM 630 OD1 ASN A 42 -20.230 18.103 1.939 1.00 0.00 O flip ATOM 631 ND2 ASN A 42 -20.555 19.631 3.485 1.00 0.00 N flip ATOM 0 H ASN A 42 -19.080 16.296 2.096 1.00 0.00 H new ATOM 0 HA ASN A 42 -20.622 15.215 4.372 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -21.739 17.436 4.612 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -20.044 17.496 5.053 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -20.762 19.894 4.449 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -20.399 20.353 2.782 1.00 0.00 H new ATOM 638 N PRO A 43 -21.636 14.532 2.007 1.00 0.00 N ATOM 639 CA PRO A 43 -22.610 14.161 0.943 1.00 0.00 C ATOM 640 C PRO A 43 -24.028 14.004 1.489 1.00 0.00 C ATOM 641 O PRO A 43 -24.220 13.698 2.662 1.00 0.00 O ATOM 642 CB PRO A 43 -22.064 12.831 0.404 1.00 0.00 C ATOM 643 CG PRO A 43 -21.306 12.227 1.548 1.00 0.00 C ATOM 644 CD PRO A 43 -20.791 13.392 2.400 1.00 0.00 C ATOM 0 HA PRO A 43 -22.697 14.929 0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -22.872 12.177 0.077 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -21.416 12.991 -0.458 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -21.950 11.573 2.136 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.478 11.618 1.185 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -20.883 13.177 3.465 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.737 13.592 2.205 1.00 0.00 H new ATOM 652 N THR A 44 -25.013 14.204 0.620 1.00 0.00 N ATOM 653 CA THR A 44 -26.406 14.075 1.023 1.00 0.00 C ATOM 654 C THR A 44 -26.684 12.674 1.561 1.00 0.00 C ATOM 655 O THR A 44 -26.061 11.702 1.139 1.00 0.00 O ATOM 656 CB THR A 44 -27.322 14.353 -0.171 1.00 0.00 C ATOM 657 OG1 THR A 44 -28.668 14.074 0.190 1.00 0.00 O ATOM 658 CG2 THR A 44 -26.915 13.467 -1.352 1.00 0.00 C ATOM 0 H THR A 44 -24.874 14.454 -0.359 1.00 0.00 H new ATOM 0 HA THR A 44 -26.603 14.800 1.812 1.00 0.00 H new ATOM 0 HB THR A 44 -27.231 15.400 -0.459 1.00 0.00 H new ATOM 0 HG1 THR A 44 -29.255 14.253 -0.574 1.00 0.00 H new ATOM 0 HG21 THR A 44 -27.570 13.668 -2.200 1.00 0.00 H new ATOM 0 HG22 THR A 44 -25.884 13.683 -1.630 1.00 0.00 H new ATOM 0 HG23 THR A 44 -27.002 12.418 -1.067 1.00 0.00 H new ATOM 666 N GLU A 45 -27.624 12.582 2.494 1.00 0.00 N ATOM 667 CA GLU A 45 -27.981 11.296 3.082 1.00 0.00 C ATOM 668 C GLU A 45 -28.643 10.397 2.042 1.00 0.00 C ATOM 669 O GLU A 45 -28.542 9.173 2.113 1.00 0.00 O ATOM 670 CB GLU A 45 -28.929 11.509 4.265 1.00 0.00 C ATOM 671 CG GLU A 45 -30.216 12.177 3.777 1.00 0.00 C ATOM 672 CD GLU A 45 -31.126 12.481 4.959 1.00 0.00 C ATOM 673 OE1 GLU A 45 -31.100 11.721 5.912 1.00 0.00 O ATOM 674 OE2 GLU A 45 -31.839 13.468 4.894 1.00 0.00 O ATOM 0 H GLU A 45 -28.150 13.377 2.858 1.00 0.00 H new ATOM 0 HA GLU A 45 -27.071 10.810 3.433 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -29.159 10.553 4.736 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -28.449 12.130 5.021 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -29.978 13.098 3.245 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -30.729 11.524 3.071 1.00 0.00 H new ATOM 681 N GLU A 46 -29.333 11.012 1.088 1.00 0.00 N ATOM 682 CA GLU A 46 -30.022 10.254 0.049 1.00 0.00 C ATOM 683 C GLU A 46 -29.046 9.333 -0.670 1.00 0.00 C ATOM 684 O GLU A 46 -29.340 8.155 -0.888 1.00 0.00 O ATOM 685 CB GLU A 46 -30.657 11.217 -0.959 1.00 0.00 C ATOM 686 CG GLU A 46 -31.780 12.004 -0.281 1.00 0.00 C ATOM 687 CD GLU A 46 -32.356 13.030 -1.250 1.00 0.00 C ATOM 688 OE1 GLU A 46 -31.956 13.019 -2.401 1.00 0.00 O ATOM 689 OE2 GLU A 46 -33.185 13.819 -0.823 1.00 0.00 O ATOM 0 H GLU A 46 -29.430 12.025 1.012 1.00 0.00 H new ATOM 0 HA GLU A 46 -30.800 9.649 0.515 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -29.903 11.902 -1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -31.051 10.661 -1.810 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -32.564 11.323 0.049 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -31.398 12.506 0.608 1.00 0.00 H new ATOM 696 N GLU A 47 -27.883 9.868 -1.032 1.00 0.00 N ATOM 697 CA GLU A 47 -26.877 9.076 -1.721 1.00 0.00 C ATOM 698 C GLU A 47 -26.472 7.877 -0.869 1.00 0.00 C ATOM 699 O GLU A 47 -26.615 6.730 -1.287 1.00 0.00 O ATOM 700 CB GLU A 47 -25.648 9.940 -2.013 1.00 0.00 C ATOM 701 CG GLU A 47 -24.618 9.118 -2.805 1.00 0.00 C ATOM 702 CD GLU A 47 -23.715 8.343 -1.852 1.00 0.00 C ATOM 703 OE1 GLU A 47 -22.793 8.944 -1.325 1.00 0.00 O ATOM 704 OE2 GLU A 47 -23.969 7.169 -1.649 1.00 0.00 O ATOM 0 H GLU A 47 -27.618 10.838 -0.860 1.00 0.00 H new ATOM 0 HA GLU A 47 -27.297 8.715 -2.660 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -25.938 10.823 -2.582 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -25.208 10.292 -1.080 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -25.131 8.427 -3.474 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -24.017 9.779 -3.429 1.00 0.00 H new ATOM 711 N LEU A 48 -25.969 8.149 0.328 1.00 0.00 N ATOM 712 CA LEU A 48 -25.544 7.081 1.228 1.00 0.00 C ATOM 713 C LEU A 48 -26.632 6.022 1.331 1.00 0.00 C ATOM 714 O LEU A 48 -26.355 4.832 1.283 1.00 0.00 O ATOM 715 CB LEU A 48 -25.274 7.661 2.620 1.00 0.00 C ATOM 716 CG LEU A 48 -24.290 8.826 2.511 1.00 0.00 C ATOM 717 CD1 LEU A 48 -24.071 9.444 3.895 1.00 0.00 C ATOM 718 CD2 LEU A 48 -22.950 8.315 1.962 1.00 0.00 C ATOM 0 H LEU A 48 -25.845 9.092 0.698 1.00 0.00 H new ATOM 0 HA LEU A 48 -24.635 6.627 0.834 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -26.207 8.001 3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -24.868 6.889 3.274 1.00 0.00 H new ATOM 0 HG LEU A 48 -24.696 9.580 1.837 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -23.369 10.274 3.816 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -25.021 9.808 4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -23.666 8.690 4.570 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -22.248 9.145 1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -22.545 7.560 2.636 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -23.104 7.877 0.976 1.00 0.00 H new ATOM 730 N GLN A 49 -27.879 6.461 1.458 1.00 0.00 N ATOM 731 CA GLN A 49 -28.997 5.526 1.555 1.00 0.00 C ATOM 732 C GLN A 49 -29.083 4.655 0.307 1.00 0.00 C ATOM 733 O GLN A 49 -29.237 3.436 0.402 1.00 0.00 O ATOM 734 CB GLN A 49 -30.305 6.304 1.729 1.00 0.00 C ATOM 735 CG GLN A 49 -30.376 6.882 3.146 1.00 0.00 C ATOM 736 CD GLN A 49 -30.556 5.755 4.157 1.00 0.00 C ATOM 737 OE1 GLN A 49 -31.000 4.663 3.799 1.00 0.00 O ATOM 738 NE2 GLN A 49 -30.240 5.954 5.406 1.00 0.00 N ATOM 0 H GLN A 49 -28.141 7.446 1.496 1.00 0.00 H new ATOM 0 HA GLN A 49 -28.835 4.881 2.418 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -30.362 7.107 0.995 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -31.157 5.648 1.550 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -29.465 7.439 3.367 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -31.206 7.585 3.220 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -29.872 6.859 5.701 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -30.360 5.205 6.088 1.00 0.00 H new ATOM 747 N ASP A 50 -28.984 5.286 -0.857 1.00 0.00 N ATOM 748 CA ASP A 50 -29.045 4.549 -2.117 1.00 0.00 C ATOM 749 C ASP A 50 -27.831 3.638 -2.272 1.00 0.00 C ATOM 750 O ASP A 50 -27.965 2.455 -2.587 1.00 0.00 O ATOM 751 CB ASP A 50 -29.099 5.529 -3.290 1.00 0.00 C ATOM 752 CG ASP A 50 -29.356 4.773 -4.589 1.00 0.00 C ATOM 753 OD1 ASP A 50 -30.371 4.102 -4.669 1.00 0.00 O ATOM 754 OD2 ASP A 50 -28.536 4.879 -5.488 1.00 0.00 O ATOM 0 H ASP A 50 -28.863 6.294 -0.957 1.00 0.00 H new ATOM 0 HA ASP A 50 -29.945 3.934 -2.110 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -29.887 6.264 -3.125 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -28.160 6.079 -3.359 1.00 0.00 H new ATOM 759 N MET A 51 -26.646 4.196 -2.044 1.00 0.00 N ATOM 760 CA MET A 51 -25.415 3.425 -2.159 1.00 0.00 C ATOM 761 C MET A 51 -25.377 2.296 -1.136 1.00 0.00 C ATOM 762 O MET A 51 -25.033 1.162 -1.462 1.00 0.00 O ATOM 763 CB MET A 51 -24.205 4.341 -1.959 1.00 0.00 C ATOM 764 CG MET A 51 -22.921 3.512 -2.019 1.00 0.00 C ATOM 765 SD MET A 51 -21.502 4.610 -2.255 1.00 0.00 S ATOM 766 CE MET A 51 -21.086 4.844 -0.511 1.00 0.00 C ATOM 0 H MET A 51 -26.513 5.172 -1.780 1.00 0.00 H new ATOM 0 HA MET A 51 -25.382 2.987 -3.157 1.00 0.00 H new ATOM 0 HB2 MET A 51 -24.189 5.112 -2.729 1.00 0.00 H new ATOM 0 HB3 MET A 51 -24.277 4.851 -0.998 1.00 0.00 H new ATOM 0 HG2 MET A 51 -22.802 2.940 -1.099 1.00 0.00 H new ATOM 0 HG3 MET A 51 -22.978 2.793 -2.836 1.00 0.00 H new ATOM 0 HE1 MET A 51 -20.221 5.502 -0.428 1.00 0.00 H new ATOM 0 HE2 MET A 51 -21.933 5.291 0.008 1.00 0.00 H new ATOM 0 HE3 MET A 51 -20.852 3.880 -0.060 1.00 0.00 H new ATOM 776 N ILE A 52 -25.736 2.616 0.094 1.00 0.00 N ATOM 777 CA ILE A 52 -25.751 1.629 1.160 1.00 0.00 C ATOM 778 C ILE A 52 -26.808 0.560 0.909 1.00 0.00 C ATOM 779 O ILE A 52 -26.568 -0.626 1.130 1.00 0.00 O ATOM 780 CB ILE A 52 -26.022 2.309 2.509 1.00 0.00 C ATOM 781 CG1 ILE A 52 -24.832 3.224 2.867 1.00 0.00 C ATOM 782 CG2 ILE A 52 -26.184 1.238 3.603 1.00 0.00 C ATOM 783 CD1 ILE A 52 -23.684 2.401 3.466 1.00 0.00 C ATOM 0 H ILE A 52 -26.021 3.552 0.380 1.00 0.00 H new ATOM 0 HA ILE A 52 -24.772 1.150 1.182 1.00 0.00 H new ATOM 0 HB ILE A 52 -26.935 2.900 2.440 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -24.486 3.747 1.975 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -25.152 3.985 3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -26.376 1.722 4.560 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -27.020 0.585 3.352 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -25.270 0.647 3.672 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -22.853 3.062 3.713 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -24.029 1.899 4.370 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -23.353 1.657 2.741 1.00 0.00 H new ATOM 795 N SER A 53 -27.969 0.998 0.447 1.00 0.00 N ATOM 796 CA SER A 53 -29.063 0.079 0.165 1.00 0.00 C ATOM 797 C SER A 53 -28.765 -0.755 -1.078 1.00 0.00 C ATOM 798 O SER A 53 -29.139 -1.926 -1.158 1.00 0.00 O ATOM 799 CB SER A 53 -30.360 0.855 -0.037 1.00 0.00 C ATOM 800 OG SER A 53 -30.194 1.778 -1.105 1.00 0.00 O ATOM 0 H SER A 53 -28.178 1.979 0.260 1.00 0.00 H new ATOM 0 HA SER A 53 -29.171 -0.592 1.017 1.00 0.00 H new ATOM 0 HB2 SER A 53 -31.177 0.168 -0.258 1.00 0.00 H new ATOM 0 HB3 SER A 53 -30.627 1.384 0.878 1.00 0.00 H new ATOM 0 HG SER A 53 -30.154 2.689 -0.747 1.00 0.00 H new ATOM 806 N GLU A 54 -28.103 -0.142 -2.050 1.00 0.00 N ATOM 807 CA GLU A 54 -27.778 -0.832 -3.290 1.00 0.00 C ATOM 808 C GLU A 54 -27.004 -2.112 -3.006 1.00 0.00 C ATOM 809 O GLU A 54 -27.204 -3.129 -3.672 1.00 0.00 O ATOM 810 CB GLU A 54 -26.937 0.080 -4.191 1.00 0.00 C ATOM 811 CG GLU A 54 -26.676 -0.617 -5.531 1.00 0.00 C ATOM 812 CD GLU A 54 -25.866 0.296 -6.445 1.00 0.00 C ATOM 813 OE1 GLU A 54 -25.403 1.319 -5.970 1.00 0.00 O ATOM 814 OE2 GLU A 54 -25.728 -0.040 -7.611 1.00 0.00 O ATOM 0 H GLU A 54 -27.782 0.825 -2.004 1.00 0.00 H new ATOM 0 HA GLU A 54 -28.710 -1.087 -3.794 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -27.457 1.024 -4.356 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -25.992 0.318 -3.703 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -26.138 -1.550 -5.366 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -27.622 -0.875 -6.007 1.00 0.00 H new ATOM 821 N VAL A 55 -26.116 -2.057 -2.020 1.00 0.00 N ATOM 822 CA VAL A 55 -25.314 -3.223 -1.657 1.00 0.00 C ATOM 823 C VAL A 55 -26.046 -4.093 -0.645 1.00 0.00 C ATOM 824 O VAL A 55 -26.175 -5.303 -0.831 1.00 0.00 O ATOM 825 CB VAL A 55 -23.974 -2.770 -1.076 1.00 0.00 C ATOM 826 CG1 VAL A 55 -23.126 -3.994 -0.729 1.00 0.00 C ATOM 827 CG2 VAL A 55 -23.234 -1.904 -2.107 1.00 0.00 C ATOM 0 H VAL A 55 -25.933 -1.224 -1.460 1.00 0.00 H new ATOM 0 HA VAL A 55 -25.141 -3.814 -2.557 1.00 0.00 H new ATOM 0 HB VAL A 55 -24.149 -2.186 -0.173 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -22.171 -3.670 -0.315 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -23.651 -4.604 0.006 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -22.950 -4.582 -1.630 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -22.279 -1.581 -1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -23.059 -2.486 -3.012 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -23.839 -1.030 -2.349 1.00 0.00 H new ATOM 837 N ASP A 56 -26.518 -3.469 0.428 1.00 0.00 N ATOM 838 CA ASP A 56 -27.231 -4.199 1.468 1.00 0.00 C ATOM 839 C ASP A 56 -28.439 -4.926 0.886 1.00 0.00 C ATOM 840 O ASP A 56 -29.520 -4.350 0.764 1.00 0.00 O ATOM 841 CB ASP A 56 -27.689 -3.233 2.564 1.00 0.00 C ATOM 842 CG ASP A 56 -26.505 -2.828 3.434 1.00 0.00 C ATOM 843 OD1 ASP A 56 -25.750 -3.709 3.814 1.00 0.00 O ATOM 844 OD2 ASP A 56 -26.380 -1.650 3.716 1.00 0.00 O ATOM 0 H ASP A 56 -26.421 -2.468 0.600 1.00 0.00 H new ATOM 0 HA ASP A 56 -26.553 -4.937 1.896 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -28.139 -2.348 2.114 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -28.457 -3.705 3.178 1.00 0.00 H new ATOM 849 N ALA A 57 -28.249 -6.194 0.536 1.00 0.00 N ATOM 850 CA ALA A 57 -29.332 -6.994 -0.028 1.00 0.00 C ATOM 851 C ALA A 57 -30.609 -6.811 0.782 1.00 0.00 C ATOM 852 O ALA A 57 -31.547 -6.147 0.341 1.00 0.00 O ATOM 853 CB ALA A 57 -28.941 -8.470 -0.033 1.00 0.00 C ATOM 0 H ALA A 57 -27.362 -6.688 0.632 1.00 0.00 H new ATOM 0 HA ALA A 57 -29.510 -6.660 -1.050 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -29.754 -9.060 -0.455 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -28.043 -8.606 -0.635 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -28.746 -8.798 0.988 1.00 0.00 H new ATOM 859 N ASP A 58 -30.635 -7.390 1.977 1.00 0.00 N ATOM 860 CA ASP A 58 -31.803 -7.279 2.845 1.00 0.00 C ATOM 861 C ASP A 58 -32.054 -5.830 3.223 1.00 0.00 C ATOM 862 O ASP A 58 -32.869 -5.549 4.102 1.00 0.00 O ATOM 863 CB ASP A 58 -31.591 -8.102 4.118 1.00 0.00 C ATOM 864 CG ASP A 58 -30.281 -7.697 4.793 1.00 0.00 C ATOM 865 OD1 ASP A 58 -29.539 -6.921 4.203 1.00 0.00 O ATOM 866 OD2 ASP A 58 -30.034 -8.172 5.889 1.00 0.00 O ATOM 0 H ASP A 58 -29.867 -7.937 2.366 1.00 0.00 H new ATOM 0 HA ASP A 58 -32.668 -7.660 2.302 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -32.425 -7.948 4.803 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -31.570 -9.164 3.874 1.00 0.00 H new ATOM 871 N GLY A 59 -31.355 -4.909 2.550 1.00 0.00 N ATOM 872 CA GLY A 59 -31.511 -3.482 2.814 1.00 0.00 C ATOM 873 C GLY A 59 -31.844 -3.227 4.278 1.00 0.00 C ATOM 874 O GLY A 59 -32.932 -2.757 4.606 1.00 0.00 O ATOM 0 H GLY A 59 -30.678 -5.130 1.820 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -30.592 -2.958 2.551 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -32.301 -3.077 2.182 1.00 0.00 H new ATOM 878 N ASN A 60 -30.911 -3.567 5.158 1.00 0.00 N ATOM 879 CA ASN A 60 -31.120 -3.388 6.595 1.00 0.00 C ATOM 880 C ASN A 60 -30.392 -2.141 7.080 1.00 0.00 C ATOM 881 O ASN A 60 -29.975 -2.065 8.235 1.00 0.00 O ATOM 882 CB ASN A 60 -30.608 -4.611 7.358 1.00 0.00 C ATOM 883 CG ASN A 60 -29.161 -4.897 6.979 1.00 0.00 C ATOM 884 OD1 ASN A 60 -28.555 -4.130 6.236 1.00 0.00 O ATOM 885 ND2 ASN A 60 -28.571 -5.964 7.445 1.00 0.00 N ATOM 0 H ASN A 60 -30.006 -3.966 4.907 1.00 0.00 H new ATOM 0 HA ASN A 60 -32.188 -3.273 6.779 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -30.683 -4.437 8.431 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -31.229 -5.477 7.131 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -27.603 -6.163 7.192 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -29.078 -6.599 8.062 1.00 0.00 H new ATOM 892 N GLY A 61 -30.244 -1.163 6.190 1.00 0.00 N ATOM 893 CA GLY A 61 -29.570 0.083 6.544 1.00 0.00 C ATOM 894 C GLY A 61 -28.305 -0.197 7.339 1.00 0.00 C ATOM 895 O GLY A 61 -27.762 0.690 7.999 1.00 0.00 O ATOM 0 H GLY A 61 -30.578 -1.208 5.227 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.321 0.637 5.639 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -30.241 0.712 7.129 1.00 0.00 H new ATOM 899 N THR A 62 -27.835 -1.441 7.279 1.00 0.00 N ATOM 900 CA THR A 62 -26.630 -1.830 8.003 1.00 0.00 C ATOM 901 C THR A 62 -25.769 -2.751 7.152 1.00 0.00 C ATOM 902 O THR A 62 -26.281 -3.626 6.434 1.00 0.00 O ATOM 903 CB THR A 62 -27.008 -2.543 9.304 1.00 0.00 C ATOM 904 OG1 THR A 62 -28.000 -3.522 9.033 1.00 0.00 O ATOM 905 CG2 THR A 62 -27.549 -1.526 10.308 1.00 0.00 C ATOM 0 H THR A 62 -28.268 -2.191 6.740 1.00 0.00 H new ATOM 0 HA THR A 62 -26.062 -0.929 8.234 1.00 0.00 H new ATOM 0 HB THR A 62 -26.126 -3.027 9.724 1.00 0.00 H new ATOM 0 HG1 THR A 62 -28.888 -3.113 9.093 1.00 0.00 H new ATOM 0 HG21 THR A 62 -27.817 -2.036 11.233 1.00 0.00 H new ATOM 0 HG22 THR A 62 -26.785 -0.777 10.515 1.00 0.00 H new ATOM 0 HG23 THR A 62 -28.431 -1.039 9.893 1.00 0.00 H new ATOM 913 N ILE A 63 -24.452 -2.564 7.229 1.00 0.00 N ATOM 914 CA ILE A 63 -23.529 -3.391 6.461 1.00 0.00 C ATOM 915 C ILE A 63 -22.793 -4.361 7.375 1.00 0.00 C ATOM 916 O ILE A 63 -22.208 -3.961 8.387 1.00 0.00 O ATOM 917 CB ILE A 63 -22.509 -2.505 5.752 1.00 0.00 C ATOM 918 CG1 ILE A 63 -23.237 -1.489 4.867 1.00 0.00 C ATOM 919 CG2 ILE A 63 -21.593 -3.363 4.873 1.00 0.00 C ATOM 920 CD1 ILE A 63 -22.227 -0.488 4.281 1.00 0.00 C ATOM 0 H ILE A 63 -24.006 -1.854 7.810 1.00 0.00 H new ATOM 0 HA ILE A 63 -24.104 -3.957 5.727 1.00 0.00 H new ATOM 0 HB ILE A 63 -21.913 -1.984 6.502 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -23.761 -2.004 4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -23.991 -0.960 5.450 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -20.868 -2.723 4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -21.068 -4.089 5.494 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -22.191 -3.888 4.128 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -22.751 0.232 3.652 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -21.723 0.038 5.092 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -21.490 -1.023 3.682 1.00 0.00 H new ATOM 932 N GLU A 64 -22.824 -5.642 7.010 1.00 0.00 N ATOM 933 CA GLU A 64 -22.150 -6.672 7.796 1.00 0.00 C ATOM 934 C GLU A 64 -20.720 -6.860 7.306 1.00 0.00 C ATOM 935 O GLU A 64 -20.376 -6.456 6.196 1.00 0.00 O ATOM 936 CB GLU A 64 -22.907 -7.996 7.689 1.00 0.00 C ATOM 937 CG GLU A 64 -24.252 -7.871 8.402 1.00 0.00 C ATOM 938 CD GLU A 64 -25.050 -9.162 8.238 1.00 0.00 C ATOM 939 OE1 GLU A 64 -24.535 -10.077 7.618 1.00 0.00 O ATOM 940 OE2 GLU A 64 -26.164 -9.213 8.733 1.00 0.00 O ATOM 0 H GLU A 64 -23.306 -5.989 6.180 1.00 0.00 H new ATOM 0 HA GLU A 64 -22.130 -6.353 8.838 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -23.061 -8.256 6.642 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -22.320 -8.800 8.134 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -24.094 -7.663 9.460 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -24.814 -7.032 7.992 1.00 0.00 H new ATOM 947 N PHE A 65 -19.888 -7.469 8.141 1.00 0.00 N ATOM 948 CA PHE A 65 -18.489 -7.692 7.784 1.00 0.00 C ATOM 949 C PHE A 65 -18.388 -8.298 6.386 1.00 0.00 C ATOM 950 O PHE A 65 -17.609 -7.831 5.556 1.00 0.00 O ATOM 951 CB PHE A 65 -17.841 -8.643 8.797 1.00 0.00 C ATOM 952 CG PHE A 65 -16.447 -9.006 8.333 1.00 0.00 C ATOM 953 CD1 PHE A 65 -15.434 -8.041 8.353 1.00 0.00 C ATOM 954 CD2 PHE A 65 -16.174 -10.302 7.880 1.00 0.00 C ATOM 955 CE1 PHE A 65 -14.146 -8.372 7.919 1.00 0.00 C ATOM 956 CE2 PHE A 65 -14.887 -10.634 7.447 1.00 0.00 C ATOM 957 CZ PHE A 65 -13.872 -9.669 7.467 1.00 0.00 C ATOM 0 H PHE A 65 -20.152 -7.816 9.063 1.00 0.00 H new ATOM 0 HA PHE A 65 -17.969 -6.734 7.796 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -17.797 -8.170 9.778 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -18.446 -9.544 8.904 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -15.646 -7.042 8.703 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -16.957 -11.045 7.865 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -13.363 -7.628 7.932 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -14.675 -11.634 7.097 1.00 0.00 H new ATOM 0 HZ PHE A 65 -12.877 -9.925 7.134 1.00 0.00 H new ATOM 967 N ASP A 66 -19.177 -9.334 6.133 1.00 0.00 N ATOM 968 CA ASP A 66 -19.156 -9.990 4.833 1.00 0.00 C ATOM 969 C ASP A 66 -19.493 -8.996 3.725 1.00 0.00 C ATOM 970 O ASP A 66 -18.896 -9.029 2.641 1.00 0.00 O ATOM 971 CB ASP A 66 -20.175 -11.136 4.816 1.00 0.00 C ATOM 972 CG ASP A 66 -19.677 -12.295 5.672 1.00 0.00 C ATOM 973 OD1 ASP A 66 -18.508 -12.289 6.019 1.00 0.00 O ATOM 974 OD2 ASP A 66 -20.472 -13.172 5.967 1.00 0.00 O ATOM 0 H ASP A 66 -19.833 -9.735 6.803 1.00 0.00 H new ATOM 0 HA ASP A 66 -18.155 -10.385 4.660 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -21.136 -10.784 5.191 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -20.337 -11.474 3.792 1.00 0.00 H new ATOM 979 N GLU A 67 -20.443 -8.110 4.001 1.00 0.00 N ATOM 980 CA GLU A 67 -20.843 -7.107 3.024 1.00 0.00 C ATOM 981 C GLU A 67 -19.784 -6.013 2.900 1.00 0.00 C ATOM 982 O GLU A 67 -19.489 -5.540 1.803 1.00 0.00 O ATOM 983 CB GLU A 67 -22.177 -6.486 3.432 1.00 0.00 C ATOM 984 CG GLU A 67 -23.281 -7.540 3.342 1.00 0.00 C ATOM 985 CD GLU A 67 -24.597 -6.964 3.862 1.00 0.00 C ATOM 986 OE1 GLU A 67 -24.594 -5.821 4.285 1.00 0.00 O ATOM 987 OE2 GLU A 67 -25.589 -7.672 3.830 1.00 0.00 O ATOM 0 H GLU A 67 -20.947 -8.066 4.887 1.00 0.00 H new ATOM 0 HA GLU A 67 -20.949 -7.597 2.056 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -22.113 -6.097 4.448 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -22.411 -5.643 2.782 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -23.400 -7.866 2.309 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -23.004 -8.419 3.924 1.00 0.00 H new ATOM 994 N PHE A 68 -19.215 -5.618 4.035 1.00 0.00 N ATOM 995 CA PHE A 68 -18.191 -4.585 4.043 1.00 0.00 C ATOM 996 C PHE A 68 -16.974 -5.032 3.243 1.00 0.00 C ATOM 997 O PHE A 68 -16.435 -4.273 2.435 1.00 0.00 O ATOM 998 CB PHE A 68 -17.775 -4.272 5.485 1.00 0.00 C ATOM 999 CG PHE A 68 -16.646 -3.268 5.481 1.00 0.00 C ATOM 1000 CD1 PHE A 68 -15.320 -3.711 5.406 1.00 0.00 C ATOM 1001 CD2 PHE A 68 -16.923 -1.898 5.547 1.00 0.00 C ATOM 1002 CE1 PHE A 68 -14.271 -2.784 5.401 1.00 0.00 C ATOM 1003 CE2 PHE A 68 -15.874 -0.972 5.540 1.00 0.00 C ATOM 1004 CZ PHE A 68 -14.548 -1.413 5.467 1.00 0.00 C ATOM 0 H PHE A 68 -19.445 -5.996 4.954 1.00 0.00 H new ATOM 0 HA PHE A 68 -18.602 -3.687 3.582 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.625 -3.876 6.041 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -17.461 -5.186 5.990 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -15.106 -4.768 5.352 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.946 -1.556 5.603 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -13.248 -3.126 5.346 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.088 0.085 5.591 1.00 0.00 H new ATOM 0 HZ PHE A 68 -13.739 -0.697 5.462 1.00 0.00 H new ATOM 1014 N LEU A 69 -16.530 -6.262 3.488 1.00 0.00 N ATOM 1015 CA LEU A 69 -15.359 -6.782 2.796 1.00 0.00 C ATOM 1016 C LEU A 69 -15.616 -6.836 1.290 1.00 0.00 C ATOM 1017 O LEU A 69 -14.802 -6.376 0.491 1.00 0.00 O ATOM 1018 CB LEU A 69 -15.040 -8.196 3.320 1.00 0.00 C ATOM 1019 CG LEU A 69 -13.537 -8.465 3.193 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -13.222 -9.865 3.712 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -13.113 -8.350 1.722 1.00 0.00 C ATOM 0 H LEU A 69 -16.958 -6.908 4.151 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.512 -6.123 2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.349 -8.287 4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.602 -8.940 2.755 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.988 -7.730 3.782 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -12.153 -10.055 3.621 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.516 -9.940 4.759 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -13.772 -10.602 3.127 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -12.044 -8.542 1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -13.662 -9.080 1.127 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -13.332 -7.346 1.358 1.00 0.00 H new ATOM 1033 N SER A 70 -16.760 -7.401 0.911 1.00 0.00 N ATOM 1034 CA SER A 70 -17.110 -7.504 -0.502 1.00 0.00 C ATOM 1035 C SER A 70 -17.288 -6.119 -1.112 1.00 0.00 C ATOM 1036 O SER A 70 -16.823 -5.852 -2.220 1.00 0.00 O ATOM 1037 CB SER A 70 -18.401 -8.302 -0.660 1.00 0.00 C ATOM 1038 OG SER A 70 -19.438 -7.663 0.073 1.00 0.00 O ATOM 0 H SER A 70 -17.451 -7.789 1.553 1.00 0.00 H new ATOM 0 HA SER A 70 -16.300 -8.015 -1.022 1.00 0.00 H new ATOM 0 HB2 SER A 70 -18.673 -8.371 -1.713 1.00 0.00 H new ATOM 0 HB3 SER A 70 -18.259 -9.321 -0.300 1.00 0.00 H new ATOM 0 HG SER A 70 -20.270 -8.171 -0.026 1.00 0.00 H new ATOM 1044 N LEU A 71 -17.959 -5.239 -0.382 1.00 0.00 N ATOM 1045 CA LEU A 71 -18.196 -3.893 -0.872 1.00 0.00 C ATOM 1046 C LEU A 71 -16.879 -3.187 -1.179 1.00 0.00 C ATOM 1047 O LEU A 71 -16.720 -2.583 -2.239 1.00 0.00 O ATOM 1048 CB LEU A 71 -18.967 -3.084 0.183 1.00 0.00 C ATOM 1049 CG LEU A 71 -19.109 -1.624 -0.277 1.00 0.00 C ATOM 1050 CD1 LEU A 71 -19.776 -1.582 -1.659 1.00 0.00 C ATOM 1051 CD2 LEU A 71 -19.965 -0.853 0.728 1.00 0.00 C ATOM 0 H LEU A 71 -18.345 -5.432 0.542 1.00 0.00 H new ATOM 0 HA LEU A 71 -18.781 -3.962 -1.789 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -19.953 -3.522 0.341 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -18.444 -3.124 1.138 1.00 0.00 H new ATOM 0 HG LEU A 71 -18.122 -1.166 -0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -19.876 -0.546 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -19.163 -2.129 -2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -20.763 -2.041 -1.601 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -20.066 0.182 0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -20.952 -1.311 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -19.488 -0.880 1.708 1.00 0.00 H new ATOM 1063 N MET A 72 -15.948 -3.253 -0.240 1.00 0.00 N ATOM 1064 CA MET A 72 -14.656 -2.609 -0.416 1.00 0.00 C ATOM 1065 C MET A 72 -13.812 -3.352 -1.444 1.00 0.00 C ATOM 1066 O MET A 72 -13.075 -2.740 -2.217 1.00 0.00 O ATOM 1067 CB MET A 72 -13.909 -2.558 0.922 1.00 0.00 C ATOM 1068 CG MET A 72 -12.778 -1.525 0.843 1.00 0.00 C ATOM 1069 SD MET A 72 -13.462 0.130 1.086 1.00 0.00 S ATOM 1070 CE MET A 72 -11.948 1.057 0.733 1.00 0.00 C ATOM 0 H MET A 72 -16.062 -3.743 0.647 1.00 0.00 H new ATOM 0 HA MET A 72 -14.829 -1.595 -0.776 1.00 0.00 H new ATOM 0 HB2 MET A 72 -14.598 -2.296 1.725 1.00 0.00 H new ATOM 0 HB3 MET A 72 -13.501 -3.541 1.160 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.025 -1.735 1.602 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.281 -1.587 -0.125 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.154 2.126 0.792 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.182 0.794 1.462 1.00 0.00 H new ATOM 0 HE3 MET A 72 -11.595 0.810 -0.268 1.00 0.00 H new ATOM 1080 N ALA A 73 -13.909 -4.674 -1.429 1.00 0.00 N ATOM 1081 CA ALA A 73 -13.136 -5.496 -2.348 1.00 0.00 C ATOM 1082 C ALA A 73 -13.478 -5.161 -3.795 1.00 0.00 C ATOM 1083 O ALA A 73 -12.631 -5.279 -4.683 1.00 0.00 O ATOM 1084 CB ALA A 73 -13.422 -6.978 -2.092 1.00 0.00 C ATOM 0 H ALA A 73 -14.512 -5.198 -0.794 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.079 -5.290 -2.179 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.839 -7.586 -2.784 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.147 -7.230 -1.068 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.484 -7.175 -2.241 1.00 0.00 H new ATOM 1090 N LYS A 74 -14.716 -4.744 -4.023 1.00 0.00 N ATOM 1091 CA LYS A 74 -15.148 -4.397 -5.370 1.00 0.00 C ATOM 1092 C LYS A 74 -14.322 -3.256 -5.943 1.00 0.00 C ATOM 1093 O LYS A 74 -13.603 -3.434 -6.927 1.00 0.00 O ATOM 1094 CB LYS A 74 -16.630 -3.996 -5.350 1.00 0.00 C ATOM 1095 CG LYS A 74 -17.509 -5.249 -5.335 1.00 0.00 C ATOM 1096 CD LYS A 74 -18.978 -4.843 -5.215 1.00 0.00 C ATOM 1097 CE LYS A 74 -19.839 -6.095 -5.040 1.00 0.00 C ATOM 1098 NZ LYS A 74 -19.651 -6.995 -6.211 1.00 0.00 N ATOM 0 H LYS A 74 -15.431 -4.639 -3.303 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.006 -5.272 -6.005 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -16.838 -3.385 -4.472 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -16.863 -3.388 -6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -17.354 -5.825 -6.247 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -17.229 -5.892 -4.500 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -19.113 -4.174 -4.365 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -19.289 -4.296 -6.105 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -19.563 -6.613 -4.122 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -20.889 -5.817 -4.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -20.416 -7.699 -6.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -19.669 -6.434 -7.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -18.736 -7.482 -6.131 1.00 0.00 H new ATOM 1112 N LYS A 75 -14.431 -2.086 -5.326 1.00 0.00 N ATOM 1113 CA LYS A 75 -13.698 -0.927 -5.794 1.00 0.00 C ATOM 1114 C LYS A 75 -12.271 -1.286 -6.108 1.00 0.00 C ATOM 1115 O LYS A 75 -11.956 -1.553 -7.264 1.00 0.00 O ATOM 1116 CB LYS A 75 -13.730 0.178 -4.741 1.00 0.00 C ATOM 1117 CG LYS A 75 -12.941 1.400 -5.227 1.00 0.00 C ATOM 1118 CD LYS A 75 -13.609 1.975 -6.484 1.00 0.00 C ATOM 1119 CE LYS A 75 -13.154 3.416 -6.691 1.00 0.00 C ATOM 1120 NZ LYS A 75 -11.687 3.445 -6.945 1.00 0.00 N ATOM 0 H LYS A 75 -15.016 -1.920 -4.507 1.00 0.00 H new ATOM 0 HA LYS A 75 -14.176 -0.570 -6.706 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.762 0.462 -4.533 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -13.306 -0.189 -3.806 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.904 2.157 -4.444 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.911 1.117 -5.446 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.349 1.372 -7.354 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -14.694 1.936 -6.382 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.688 3.859 -7.532 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.393 4.013 -5.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -11.208 3.928 -6.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -11.329 2.472 -7.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.498 3.956 -7.831 1.00 0.00 H new ATOM 1134 N VAL A 76 -11.410 -1.281 -5.080 1.00 0.00 N ATOM 1135 CA VAL A 76 -9.984 -1.603 -5.248 1.00 0.00 C ATOM 1136 C VAL A 76 -9.718 -2.188 -6.629 1.00 0.00 C ATOM 1137 O VAL A 76 -10.268 -3.234 -6.981 1.00 0.00 O ATOM 1138 CB VAL A 76 -9.565 -2.613 -4.186 1.00 0.00 C ATOM 1139 CG1 VAL A 76 -8.083 -2.940 -4.364 1.00 0.00 C ATOM 1140 CG2 VAL A 76 -9.795 -2.020 -2.794 1.00 0.00 C ATOM 0 H VAL A 76 -11.676 -1.057 -4.121 1.00 0.00 H new ATOM 0 HA VAL A 76 -9.407 -0.684 -5.142 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.157 -3.522 -4.291 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.776 -3.662 -3.607 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.920 -3.362 -5.356 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.494 -2.029 -4.256 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.495 -2.744 -2.036 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.203 -1.112 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.851 -1.782 -2.670 1.00 0.00 H new ATOM 1150 N LYS A 77 -8.919 -1.492 -7.412 1.00 0.00 N ATOM 1151 CA LYS A 77 -8.620 -1.936 -8.770 1.00 0.00 C ATOM 1152 C LYS A 77 -7.559 -1.032 -9.400 1.00 0.00 C ATOM 1153 O LYS A 77 -6.386 -1.113 -9.046 1.00 0.00 O ATOM 1154 CB LYS A 77 -9.888 -1.921 -9.632 1.00 0.00 C ATOM 1155 CG LYS A 77 -9.591 -2.561 -10.993 1.00 0.00 C ATOM 1156 CD LYS A 77 -10.888 -2.699 -11.784 1.00 0.00 C ATOM 1157 CE LYS A 77 -10.597 -3.370 -13.126 1.00 0.00 C ATOM 1158 NZ LYS A 77 -9.769 -2.461 -13.969 1.00 0.00 N ATOM 0 H LYS A 77 -8.464 -0.621 -7.139 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.239 -2.956 -8.721 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -10.688 -2.465 -9.130 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.235 -0.897 -9.768 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -8.878 -1.950 -11.547 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -9.131 -3.540 -10.854 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -11.610 -3.289 -11.219 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -11.334 -1.718 -11.945 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.073 -4.313 -12.967 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.531 -3.606 -13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -9.810 -2.773 -14.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -10.136 -1.490 -13.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -8.783 -2.484 -13.639 1.00 0.00 H new ATOM 1172 N ASP A 78 -7.980 -0.183 -10.337 1.00 0.00 N ATOM 1173 CA ASP A 78 -7.061 0.717 -11.010 1.00 0.00 C ATOM 1174 C ASP A 78 -7.827 1.650 -11.946 1.00 0.00 C ATOM 1175 O ASP A 78 -7.346 1.996 -13.025 1.00 0.00 O ATOM 1176 CB ASP A 78 -6.035 -0.084 -11.816 1.00 0.00 C ATOM 1177 CG ASP A 78 -4.976 0.852 -12.382 1.00 0.00 C ATOM 1178 OD1 ASP A 78 -5.126 2.052 -12.221 1.00 0.00 O ATOM 1179 OD2 ASP A 78 -4.022 0.357 -12.956 1.00 0.00 O ATOM 0 H ASP A 78 -8.950 -0.104 -10.642 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.543 1.311 -10.257 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.567 -0.835 -11.180 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.532 -0.617 -12.626 1.00 0.00 H new ATOM 1184 N THR A 79 -9.023 2.048 -11.529 1.00 0.00 N ATOM 1185 CA THR A 79 -9.843 2.935 -12.342 1.00 0.00 C ATOM 1186 C THR A 79 -9.169 4.287 -12.532 1.00 0.00 C ATOM 1187 O THR A 79 -8.803 4.661 -13.645 1.00 0.00 O ATOM 1188 CB THR A 79 -11.206 3.142 -11.676 1.00 0.00 C ATOM 1189 OG1 THR A 79 -11.021 3.655 -10.364 1.00 0.00 O ATOM 1190 CG2 THR A 79 -11.949 1.807 -11.603 1.00 0.00 C ATOM 0 H THR A 79 -9.443 1.773 -10.641 1.00 0.00 H new ATOM 0 HA THR A 79 -9.973 2.469 -13.319 1.00 0.00 H new ATOM 0 HB THR A 79 -11.791 3.850 -12.263 1.00 0.00 H new ATOM 0 HG1 THR A 79 -11.894 3.789 -9.939 1.00 0.00 H new ATOM 0 HG21 THR A 79 -12.919 1.956 -11.129 1.00 0.00 H new ATOM 0 HG22 THR A 79 -12.094 1.416 -12.610 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.364 1.097 -11.018 1.00 0.00 H new ATOM 1198 N ASP A 80 -9.010 5.023 -11.437 1.00 0.00 N ATOM 1199 CA ASP A 80 -8.377 6.343 -11.492 1.00 0.00 C ATOM 1200 C ASP A 80 -6.877 6.248 -11.198 1.00 0.00 C ATOM 1201 O ASP A 80 -6.463 5.883 -10.086 1.00 0.00 O ATOM 1202 CB ASP A 80 -9.049 7.269 -10.479 1.00 0.00 C ATOM 1203 CG ASP A 80 -10.447 7.656 -10.950 1.00 0.00 C ATOM 1204 OD1 ASP A 80 -10.732 7.461 -12.117 1.00 0.00 O ATOM 1205 OD2 ASP A 80 -11.214 8.141 -10.132 1.00 0.00 O ATOM 0 H ASP A 80 -9.307 4.734 -10.505 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.498 6.745 -12.498 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -9.110 6.774 -9.510 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.445 8.166 -10.341 1.00 0.00 H new ATOM 1210 N ALA A 81 -6.082 6.598 -12.200 1.00 0.00 N ATOM 1211 CA ALA A 81 -4.627 6.561 -12.048 1.00 0.00 C ATOM 1212 C ALA A 81 -4.150 7.736 -11.198 1.00 0.00 C ATOM 1213 O ALA A 81 -3.441 7.556 -10.208 1.00 0.00 O ATOM 1214 CB ALA A 81 -3.953 6.600 -13.414 1.00 0.00 C ATOM 0 H ALA A 81 -6.410 6.907 -13.115 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.356 5.632 -11.546 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.871 6.572 -13.287 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.272 5.739 -14.002 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.234 7.517 -13.932 1.00 0.00 H new ATOM 1220 N GLU A 82 -4.549 8.939 -11.588 1.00 0.00 N ATOM 1221 CA GLU A 82 -4.163 10.140 -10.856 1.00 0.00 C ATOM 1222 C GLU A 82 -4.559 10.020 -9.389 1.00 0.00 C ATOM 1223 O GLU A 82 -4.098 10.782 -8.543 1.00 0.00 O ATOM 1224 CB GLU A 82 -4.838 11.367 -11.479 1.00 0.00 C ATOM 1225 CG GLU A 82 -6.341 11.324 -11.201 1.00 0.00 C ATOM 1226 CD GLU A 82 -7.061 12.369 -12.044 1.00 0.00 C ATOM 1227 OE1 GLU A 82 -6.829 13.546 -11.818 1.00 0.00 O ATOM 1228 OE2 GLU A 82 -7.831 11.977 -12.904 1.00 0.00 O ATOM 0 H GLU A 82 -5.137 9.110 -12.403 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.081 10.254 -10.917 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -4.408 12.280 -11.066 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.657 11.387 -12.554 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.732 10.332 -11.426 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.528 11.507 -10.143 1.00 0.00 H new ATOM 1235 N GLU A 83 -5.418 9.049 -9.092 1.00 0.00 N ATOM 1236 CA GLU A 83 -5.873 8.839 -7.719 1.00 0.00 C ATOM 1237 C GLU A 83 -4.888 7.975 -6.950 1.00 0.00 C ATOM 1238 O GLU A 83 -4.359 8.394 -5.923 1.00 0.00 O ATOM 1239 CB GLU A 83 -7.251 8.173 -7.729 1.00 0.00 C ATOM 1240 CG GLU A 83 -8.335 9.222 -8.009 1.00 0.00 C ATOM 1241 CD GLU A 83 -8.502 10.125 -6.792 1.00 0.00 C ATOM 1242 OE1 GLU A 83 -8.706 9.598 -5.712 1.00 0.00 O ATOM 1243 OE2 GLU A 83 -8.418 11.331 -6.957 1.00 0.00 O ATOM 0 H GLU A 83 -5.810 8.401 -9.775 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.940 9.808 -7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.282 7.393 -8.490 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.438 7.690 -6.770 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.063 9.817 -8.881 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.280 8.730 -8.241 1.00 0.00 H new ATOM 1250 N GLU A 84 -4.650 6.770 -7.450 1.00 0.00 N ATOM 1251 CA GLU A 84 -3.723 5.858 -6.786 1.00 0.00 C ATOM 1252 C GLU A 84 -2.302 6.414 -6.840 1.00 0.00 C ATOM 1253 O GLU A 84 -1.510 6.221 -5.917 1.00 0.00 O ATOM 1254 CB GLU A 84 -3.766 4.489 -7.465 1.00 0.00 C ATOM 1255 CG GLU A 84 -2.923 3.493 -6.665 1.00 0.00 C ATOM 1256 CD GLU A 84 -2.990 2.114 -7.314 1.00 0.00 C ATOM 1257 OE1 GLU A 84 -3.888 1.898 -8.109 1.00 0.00 O ATOM 1258 OE2 GLU A 84 -2.135 1.298 -7.010 1.00 0.00 O ATOM 0 H GLU A 84 -5.078 6.403 -8.300 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.022 5.754 -5.743 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.796 4.138 -7.533 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.387 4.565 -8.484 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.888 3.833 -6.620 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.286 3.439 -5.638 1.00 0.00 H new ATOM 1265 N LEU A 85 -1.985 7.095 -7.931 1.00 0.00 N ATOM 1266 CA LEU A 85 -0.659 7.668 -8.097 1.00 0.00 C ATOM 1267 C LEU A 85 -0.460 8.866 -7.173 1.00 0.00 C ATOM 1268 O LEU A 85 0.646 9.098 -6.645 1.00 0.00 O ATOM 1269 CB LEU A 85 -0.452 8.112 -9.559 1.00 0.00 C ATOM 1270 CG LEU A 85 1.035 8.026 -9.928 1.00 0.00 C ATOM 1271 CD1 LEU A 85 1.370 6.597 -10.367 1.00 0.00 C ATOM 1272 CD2 LEU A 85 1.335 8.994 -11.071 1.00 0.00 C ATOM 0 H LEU A 85 -2.623 7.263 -8.709 1.00 0.00 H new ATOM 0 HA LEU A 85 0.072 6.901 -7.839 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.038 7.480 -10.226 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.810 9.133 -9.692 1.00 0.00 H new ATOM 0 HG LEU A 85 1.640 8.291 -9.061 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.426 6.535 -10.629 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.158 5.906 -9.551 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.765 6.331 -11.234 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.391 8.932 -11.332 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.730 8.731 -11.939 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.097 10.011 -10.758 1.00 0.00 H new ATOM 1284 N LYS A 86 -1.536 9.636 -6.977 1.00 0.00 N ATOM 1285 CA LYS A 86 -1.467 10.813 -6.116 1.00 0.00 C ATOM 1286 C LYS A 86 -1.656 10.428 -4.651 1.00 0.00 C ATOM 1287 O LYS A 86 -0.907 10.876 -3.784 1.00 0.00 O ATOM 1288 CB LYS A 86 -2.542 11.815 -6.535 1.00 0.00 C ATOM 1289 CG LYS A 86 -2.391 13.097 -5.719 1.00 0.00 C ATOM 1290 CD LYS A 86 -3.439 14.115 -6.172 1.00 0.00 C ATOM 1291 CE LYS A 86 -3.277 15.405 -5.365 1.00 0.00 C ATOM 1292 NZ LYS A 86 -4.287 16.403 -5.817 1.00 0.00 N ATOM 0 H LYS A 86 -2.450 9.466 -7.397 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.482 11.267 -6.224 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.453 12.036 -7.599 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.533 11.387 -6.380 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.512 12.882 -4.657 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.390 13.508 -5.848 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.325 14.322 -7.236 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.441 13.709 -6.032 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.403 15.200 -4.302 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.271 15.805 -5.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -4.178 17.280 -5.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.146 16.606 -6.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.243 16.020 -5.671 1.00 0.00 H new ATOM 1306 N GLU A 87 -2.659 9.595 -4.386 1.00 0.00 N ATOM 1307 CA GLU A 87 -2.935 9.154 -3.024 1.00 0.00 C ATOM 1308 C GLU A 87 -1.711 8.452 -2.448 1.00 0.00 C ATOM 1309 O GLU A 87 -1.347 8.668 -1.296 1.00 0.00 O ATOM 1310 CB GLU A 87 -4.128 8.198 -3.016 1.00 0.00 C ATOM 1311 CG GLU A 87 -5.413 8.982 -3.276 1.00 0.00 C ATOM 1312 CD GLU A 87 -6.581 8.022 -3.469 1.00 0.00 C ATOM 1313 OE1 GLU A 87 -6.378 6.832 -3.291 1.00 0.00 O ATOM 1314 OE2 GLU A 87 -7.657 8.489 -3.802 1.00 0.00 O ATOM 0 H GLU A 87 -3.290 9.215 -5.092 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.171 10.025 -2.412 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.997 7.431 -3.779 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.190 7.686 -2.056 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.616 9.651 -2.440 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.295 9.606 -4.162 1.00 0.00 H new ATOM 1321 N ALA A 88 -1.058 7.620 -3.265 1.00 0.00 N ATOM 1322 CA ALA A 88 0.133 6.908 -2.820 1.00 0.00 C ATOM 1323 C ALA A 88 1.244 7.898 -2.488 1.00 0.00 C ATOM 1324 O ALA A 88 1.742 7.935 -1.362 1.00 0.00 O ATOM 1325 CB ALA A 88 0.605 5.955 -3.919 1.00 0.00 C ATOM 0 H ALA A 88 -1.334 7.427 -4.228 1.00 0.00 H new ATOM 0 HA ALA A 88 -0.111 6.336 -1.925 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.496 5.424 -3.583 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.184 5.236 -4.141 1.00 0.00 H new ATOM 0 HB3 ALA A 88 0.840 6.524 -4.818 1.00 0.00 H new ATOM 1331 N PHE A 89 1.618 8.719 -3.475 1.00 0.00 N ATOM 1332 CA PHE A 89 2.669 9.715 -3.266 1.00 0.00 C ATOM 1333 C PHE A 89 2.303 10.633 -2.102 1.00 0.00 C ATOM 1334 O PHE A 89 3.161 11.023 -1.310 1.00 0.00 O ATOM 1335 CB PHE A 89 2.863 10.541 -4.535 1.00 0.00 C ATOM 1336 CG PHE A 89 3.983 11.530 -4.328 1.00 0.00 C ATOM 1337 CD1 PHE A 89 3.714 12.785 -3.766 1.00 0.00 C ATOM 1338 CD2 PHE A 89 5.292 11.192 -4.691 1.00 0.00 C ATOM 1339 CE1 PHE A 89 4.754 13.701 -3.572 1.00 0.00 C ATOM 1340 CE2 PHE A 89 6.331 12.108 -4.497 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.061 13.364 -3.938 1.00 0.00 C ATOM 0 H PHE A 89 1.215 8.713 -4.412 1.00 0.00 H new ATOM 0 HA PHE A 89 3.599 9.198 -3.029 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.093 9.886 -5.376 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.941 11.067 -4.783 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.705 13.045 -3.483 1.00 0.00 H new ATOM 0 HD2 PHE A 89 5.500 10.223 -5.121 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.547 14.669 -3.139 1.00 0.00 H new ATOM 0 HE2 PHE A 89 7.341 11.847 -4.778 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.863 14.072 -3.790 1.00 0.00 H new ATOM 1351 N LYS A 90 1.022 10.976 -2.005 1.00 0.00 N ATOM 1352 CA LYS A 90 0.552 11.847 -0.934 1.00 0.00 C ATOM 1353 C LYS A 90 0.838 11.215 0.426 1.00 0.00 C ATOM 1354 O LYS A 90 1.188 11.911 1.381 1.00 0.00 O ATOM 1355 CB LYS A 90 -0.951 12.094 -1.080 1.00 0.00 C ATOM 1356 CG LYS A 90 -1.416 13.078 -0.002 1.00 0.00 C ATOM 1357 CD LYS A 90 -2.916 13.326 -0.151 1.00 0.00 C ATOM 1358 CE LYS A 90 -3.380 14.309 0.926 1.00 0.00 C ATOM 1359 NZ LYS A 90 -4.845 14.545 0.787 1.00 0.00 N ATOM 0 H LYS A 90 0.296 10.666 -2.651 1.00 0.00 H new ATOM 0 HA LYS A 90 1.081 12.798 -1.002 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.170 12.493 -2.070 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.495 11.154 -0.988 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.199 12.678 0.988 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.871 14.017 -0.092 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.133 13.726 -1.141 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.462 12.387 -0.060 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.157 13.911 1.916 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.839 15.250 0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.160 15.213 1.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.045 14.942 -0.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.354 13.645 0.898 1.00 0.00 H new ATOM 1373 N VAL A 91 0.687 9.898 0.508 1.00 0.00 N ATOM 1374 CA VAL A 91 0.943 9.186 1.756 1.00 0.00 C ATOM 1375 C VAL A 91 2.442 9.034 1.992 1.00 0.00 C ATOM 1376 O VAL A 91 2.942 9.318 3.079 1.00 0.00 O ATOM 1377 CB VAL A 91 0.282 7.807 1.713 1.00 0.00 C ATOM 1378 CG1 VAL A 91 0.642 7.028 2.981 1.00 0.00 C ATOM 1379 CG2 VAL A 91 -1.240 7.972 1.627 1.00 0.00 C ATOM 0 H VAL A 91 0.391 9.305 -0.267 1.00 0.00 H new ATOM 0 HA VAL A 91 0.520 9.765 2.577 1.00 0.00 H new ATOM 0 HB VAL A 91 0.637 7.261 0.839 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.171 6.045 2.950 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.724 6.910 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.288 7.573 3.856 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.711 6.990 1.596 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.597 8.518 2.500 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.496 8.525 0.723 1.00 0.00 H new ATOM 1389 N PHE A 92 3.150 8.574 0.963 1.00 0.00 N ATOM 1390 CA PHE A 92 4.592 8.378 1.072 1.00 0.00 C ATOM 1391 C PHE A 92 5.272 9.690 1.424 1.00 0.00 C ATOM 1392 O PHE A 92 6.103 9.742 2.320 1.00 0.00 O ATOM 1393 CB PHE A 92 5.148 7.840 -0.250 1.00 0.00 C ATOM 1394 CG PHE A 92 4.803 6.376 -0.389 1.00 0.00 C ATOM 1395 CD1 PHE A 92 5.345 5.446 0.508 1.00 0.00 C ATOM 1396 CD2 PHE A 92 3.945 5.948 -1.407 1.00 0.00 C ATOM 1397 CE1 PHE A 92 5.028 4.090 0.384 1.00 0.00 C ATOM 1398 CE2 PHE A 92 3.628 4.593 -1.529 1.00 0.00 C ATOM 1399 CZ PHE A 92 4.168 3.665 -0.635 1.00 0.00 C ATOM 0 H PHE A 92 2.754 8.333 0.055 1.00 0.00 H new ATOM 0 HA PHE A 92 4.791 7.654 1.862 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.733 8.402 -1.086 1.00 0.00 H new ATOM 0 HB3 PHE A 92 6.229 7.973 -0.282 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.007 5.776 1.295 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.528 6.665 -2.099 1.00 0.00 H new ATOM 0 HE1 PHE A 92 5.446 3.372 1.074 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.965 4.263 -2.315 1.00 0.00 H new ATOM 0 HZ PHE A 92 3.921 2.618 -0.730 1.00 0.00 H new ATOM 1409 N ASP A 93 4.915 10.750 0.712 1.00 0.00 N ATOM 1410 CA ASP A 93 5.508 12.061 0.963 1.00 0.00 C ATOM 1411 C ASP A 93 4.710 12.806 2.017 1.00 0.00 C ATOM 1412 O ASP A 93 4.124 13.847 1.739 1.00 0.00 O ATOM 1413 CB ASP A 93 5.535 12.884 -0.328 1.00 0.00 C ATOM 1414 CG ASP A 93 6.499 14.061 -0.177 1.00 0.00 C ATOM 1415 OD1 ASP A 93 7.289 14.044 0.755 1.00 0.00 O ATOM 1416 OD2 ASP A 93 6.441 14.956 -1.001 1.00 0.00 O ATOM 0 H ASP A 93 4.224 10.731 -0.038 1.00 0.00 H new ATOM 0 HA ASP A 93 6.527 11.915 1.320 1.00 0.00 H new ATOM 0 HB2 ASP A 93 5.843 12.255 -1.163 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.534 13.250 -0.557 1.00 0.00 H new ATOM 1421 N LYS A 94 4.641 12.242 3.215 1.00 0.00 N ATOM 1422 CA LYS A 94 3.882 12.856 4.296 1.00 0.00 C ATOM 1423 C LYS A 94 4.029 14.375 4.287 1.00 0.00 C ATOM 1424 O LYS A 94 3.046 15.101 4.163 1.00 0.00 O ATOM 1425 CB LYS A 94 4.394 12.324 5.648 1.00 0.00 C ATOM 1426 CG LYS A 94 3.276 12.435 6.706 1.00 0.00 C ATOM 1427 CD LYS A 94 2.409 11.163 6.665 1.00 0.00 C ATOM 1428 CE LYS A 94 3.008 10.106 7.598 1.00 0.00 C ATOM 1429 NZ LYS A 94 2.659 10.441 9.006 1.00 0.00 N ATOM 0 H LYS A 94 5.099 11.365 3.462 1.00 0.00 H new ATOM 0 HA LYS A 94 2.831 12.603 4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.710 11.286 5.546 1.00 0.00 H new ATOM 0 HB3 LYS A 94 5.268 12.893 5.967 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.709 12.562 7.698 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.662 13.314 6.512 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.389 11.396 6.969 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.358 10.778 5.647 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.625 9.118 7.341 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.091 10.069 7.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.819 9.610 9.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.255 11.227 9.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.659 10.720 9.059 1.00 0.00 H new ATOM 1443 N ASP A 95 5.264 14.844 4.418 1.00 0.00 N ATOM 1444 CA ASP A 95 5.526 16.277 4.425 1.00 0.00 C ATOM 1445 C ASP A 95 5.129 16.915 3.100 1.00 0.00 C ATOM 1446 O ASP A 95 5.092 18.137 2.979 1.00 0.00 O ATOM 1447 CB ASP A 95 7.010 16.534 4.696 1.00 0.00 C ATOM 1448 CG ASP A 95 7.855 15.952 3.573 1.00 0.00 C ATOM 1449 OD1 ASP A 95 7.284 15.552 2.572 1.00 0.00 O ATOM 1450 OD2 ASP A 95 9.063 15.925 3.727 1.00 0.00 O ATOM 0 H ASP A 95 6.093 14.258 4.520 1.00 0.00 H new ATOM 0 HA ASP A 95 4.926 16.727 5.216 1.00 0.00 H new ATOM 0 HB2 ASP A 95 7.192 17.605 4.781 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.297 16.086 5.647 1.00 0.00 H new ATOM 1455 N GLN A 96 4.838 16.081 2.117 1.00 0.00 N ATOM 1456 CA GLN A 96 4.440 16.567 0.802 1.00 0.00 C ATOM 1457 C GLN A 96 5.332 17.718 0.370 1.00 0.00 C ATOM 1458 O GLN A 96 4.878 18.857 0.255 1.00 0.00 O ATOM 1459 CB GLN A 96 2.984 17.032 0.833 1.00 0.00 C ATOM 1460 CG GLN A 96 2.065 15.821 1.006 1.00 0.00 C ATOM 1461 CD GLN A 96 0.606 16.266 0.984 1.00 0.00 C ATOM 1462 OE1 GLN A 96 0.015 16.400 -0.087 1.00 0.00 O ATOM 1463 NE2 GLN A 96 -0.011 16.505 2.109 1.00 0.00 N ATOM 0 H GLN A 96 4.869 15.065 2.201 1.00 0.00 H new ATOM 0 HA GLN A 96 4.543 15.751 0.087 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.833 17.736 1.651 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.740 17.559 -0.090 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.246 15.100 0.209 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.286 15.318 1.947 1.00 0.00 H new ATOM 0 HE21 GLN A 96 0.482 16.393 2.995 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -0.986 16.804 2.102 1.00 0.00 H new ATOM 1472 N ASN A 97 6.606 17.419 0.129 1.00 0.00 N ATOM 1473 CA ASN A 97 7.563 18.444 -0.293 1.00 0.00 C ATOM 1474 C ASN A 97 7.929 18.259 -1.757 1.00 0.00 C ATOM 1475 O ASN A 97 8.728 19.015 -2.309 1.00 0.00 O ATOM 1476 CB ASN A 97 8.825 18.365 0.563 1.00 0.00 C ATOM 1477 CG ASN A 97 9.479 16.997 0.407 1.00 0.00 C ATOM 1478 OD1 ASN A 97 8.807 16.016 0.088 1.00 0.00 O ATOM 1479 ND2 ASN A 97 10.762 16.871 0.613 1.00 0.00 N ATOM 0 H ASN A 97 7.000 16.482 0.217 1.00 0.00 H new ATOM 0 HA ASN A 97 7.100 19.422 -0.165 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.524 19.147 0.267 1.00 0.00 H new ATOM 0 HB3 ASN A 97 8.576 18.540 1.609 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.208 15.960 0.510 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.318 17.684 0.877 1.00 0.00 H new ATOM 1486 N GLY A 98 7.336 17.250 -2.392 1.00 0.00 N ATOM 1487 CA GLY A 98 7.608 16.977 -3.802 1.00 0.00 C ATOM 1488 C GLY A 98 8.679 15.907 -3.947 1.00 0.00 C ATOM 1489 O GLY A 98 9.029 15.510 -5.061 1.00 0.00 O ATOM 0 H GLY A 98 6.669 16.612 -1.957 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.693 16.652 -4.297 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.932 17.892 -4.299 1.00 0.00 H new ATOM 1493 N TYR A 99 9.197 15.426 -2.815 1.00 0.00 N ATOM 1494 CA TYR A 99 10.228 14.394 -2.835 1.00 0.00 C ATOM 1495 C TYR A 99 9.987 13.380 -1.732 1.00 0.00 C ATOM 1496 O TYR A 99 9.515 13.723 -0.653 1.00 0.00 O ATOM 1497 CB TYR A 99 11.605 15.032 -2.645 1.00 0.00 C ATOM 1498 CG TYR A 99 11.841 16.051 -3.734 1.00 0.00 C ATOM 1499 CD1 TYR A 99 11.312 17.342 -3.607 1.00 0.00 C ATOM 1500 CD2 TYR A 99 12.587 15.709 -4.869 1.00 0.00 C ATOM 1501 CE1 TYR A 99 11.529 18.290 -4.613 1.00 0.00 C ATOM 1502 CE2 TYR A 99 12.804 16.659 -5.875 1.00 0.00 C ATOM 1503 CZ TYR A 99 12.276 17.949 -5.747 1.00 0.00 C ATOM 1504 OH TYR A 99 12.490 18.883 -6.739 1.00 0.00 O ATOM 0 H TYR A 99 8.921 15.733 -1.882 1.00 0.00 H new ATOM 0 HA TYR A 99 10.189 13.886 -3.798 1.00 0.00 H new ATOM 0 HB2 TYR A 99 11.665 15.509 -1.667 1.00 0.00 H new ATOM 0 HB3 TYR A 99 12.380 14.266 -2.674 1.00 0.00 H new ATOM 0 HD1 TYR A 99 10.736 17.606 -2.732 1.00 0.00 H new ATOM 0 HD2 TYR A 99 12.994 14.714 -4.968 1.00 0.00 H new ATOM 0 HE1 TYR A 99 11.120 19.285 -4.515 1.00 0.00 H new ATOM 0 HE2 TYR A 99 13.379 16.396 -6.750 1.00 0.00 H new ATOM 0 HH TYR A 99 13.028 18.483 -7.454 1.00 0.00 H new ATOM 1514 N ILE A 100 10.309 12.121 -2.007 1.00 0.00 N ATOM 1515 CA ILE A 100 10.116 11.061 -1.021 1.00 0.00 C ATOM 1516 C ILE A 100 11.415 10.798 -0.270 1.00 0.00 C ATOM 1517 O ILE A 100 12.417 10.372 -0.862 1.00 0.00 O ATOM 1518 CB ILE A 100 9.672 9.769 -1.714 1.00 0.00 C ATOM 1519 CG1 ILE A 100 8.567 10.083 -2.724 1.00 0.00 C ATOM 1520 CG2 ILE A 100 9.146 8.787 -0.676 1.00 0.00 C ATOM 1521 CD1 ILE A 100 8.096 8.793 -3.396 1.00 0.00 C ATOM 0 H ILE A 100 10.701 11.810 -2.896 1.00 0.00 H new ATOM 0 HA ILE A 100 9.347 11.382 -0.319 1.00 0.00 H new ATOM 0 HB ILE A 100 10.523 9.327 -2.232 1.00 0.00 H new ATOM 0 HG12 ILE A 100 7.730 10.568 -2.222 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.936 10.781 -3.475 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.831 7.869 -1.171 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.934 8.560 0.042 1.00 0.00 H new ATOM 0 HG23 ILE A 100 8.296 9.229 -0.155 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.309 9.023 -4.114 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.934 8.325 -3.913 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.709 8.109 -2.640 1.00 0.00 H new ATOM 1533 N SER A 101 11.393 11.059 1.036 1.00 0.00 N ATOM 1534 CA SER A 101 12.571 10.843 1.878 1.00 0.00 C ATOM 1535 C SER A 101 12.618 9.398 2.355 1.00 0.00 C ATOM 1536 O SER A 101 11.581 8.769 2.576 1.00 0.00 O ATOM 1537 CB SER A 101 12.541 11.786 3.082 1.00 0.00 C ATOM 1538 OG SER A 101 12.941 13.084 2.666 1.00 0.00 O ATOM 0 H SER A 101 10.578 11.418 1.533 1.00 0.00 H new ATOM 0 HA SER A 101 13.463 11.051 1.287 1.00 0.00 H new ATOM 0 HB2 SER A 101 11.538 11.820 3.508 1.00 0.00 H new ATOM 0 HB3 SER A 101 13.207 11.420 3.863 1.00 0.00 H new ATOM 0 HG SER A 101 12.922 13.694 3.433 1.00 0.00 H new ATOM 1544 N ALA A 102 13.825 8.871 2.514 1.00 0.00 N ATOM 1545 CA ALA A 102 13.991 7.495 2.968 1.00 0.00 C ATOM 1546 C ALA A 102 13.222 7.256 4.264 1.00 0.00 C ATOM 1547 O ALA A 102 12.554 6.240 4.409 1.00 0.00 O ATOM 1548 CB ALA A 102 15.480 7.196 3.199 1.00 0.00 C ATOM 0 H ALA A 102 14.697 9.370 2.337 1.00 0.00 H new ATOM 0 HA ALA A 102 13.598 6.832 2.197 1.00 0.00 H new ATOM 0 HB1 ALA A 102 15.596 6.167 3.538 1.00 0.00 H new ATOM 0 HB2 ALA A 102 16.028 7.335 2.267 1.00 0.00 H new ATOM 0 HB3 ALA A 102 15.874 7.874 3.956 1.00 0.00 H new ATOM 1554 N SER A 103 13.318 8.200 5.191 1.00 0.00 N ATOM 1555 CA SER A 103 12.622 8.078 6.466 1.00 0.00 C ATOM 1556 C SER A 103 11.114 7.983 6.251 1.00 0.00 C ATOM 1557 O SER A 103 10.441 7.161 6.873 1.00 0.00 O ATOM 1558 CB SER A 103 12.947 9.280 7.353 1.00 0.00 C ATOM 1559 OG SER A 103 12.022 9.329 8.429 1.00 0.00 O ATOM 0 H SER A 103 13.867 9.053 5.086 1.00 0.00 H new ATOM 0 HA SER A 103 12.959 7.165 6.958 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.965 9.200 7.736 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.896 10.201 6.772 1.00 0.00 H new ATOM 0 HG SER A 103 12.227 10.097 9.002 1.00 0.00 H new ATOM 1565 N GLU A 104 10.598 8.826 5.366 1.00 0.00 N ATOM 1566 CA GLU A 104 9.165 8.827 5.072 1.00 0.00 C ATOM 1567 C GLU A 104 8.761 7.507 4.415 1.00 0.00 C ATOM 1568 O GLU A 104 7.822 6.828 4.861 1.00 0.00 O ATOM 1569 CB GLU A 104 8.823 9.991 4.144 1.00 0.00 C ATOM 1570 CG GLU A 104 9.055 11.311 4.874 1.00 0.00 C ATOM 1571 CD GLU A 104 8.811 12.480 3.926 1.00 0.00 C ATOM 1572 OE1 GLU A 104 8.346 12.239 2.825 1.00 0.00 O ATOM 1573 OE2 GLU A 104 9.106 13.600 4.310 1.00 0.00 O ATOM 0 H GLU A 104 11.141 9.512 4.842 1.00 0.00 H new ATOM 0 HA GLU A 104 8.616 8.941 6.007 1.00 0.00 H new ATOM 0 HB2 GLU A 104 9.439 9.947 3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 104 7.784 9.919 3.822 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.388 11.383 5.733 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.074 11.350 5.258 1.00 0.00 H new ATOM 1580 N LEU A 105 9.490 7.130 3.370 1.00 0.00 N ATOM 1581 CA LEU A 105 9.208 5.884 2.678 1.00 0.00 C ATOM 1582 C LEU A 105 9.503 4.685 3.578 1.00 0.00 C ATOM 1583 O LEU A 105 8.954 3.591 3.382 1.00 0.00 O ATOM 1584 CB LEU A 105 10.068 5.783 1.406 1.00 0.00 C ATOM 1585 CG LEU A 105 9.871 4.414 0.741 1.00 0.00 C ATOM 1586 CD1 LEU A 105 8.384 4.208 0.423 1.00 0.00 C ATOM 1587 CD2 LEU A 105 10.686 4.350 -0.548 1.00 0.00 C ATOM 0 H LEU A 105 10.271 7.664 2.989 1.00 0.00 H new ATOM 0 HA LEU A 105 8.151 5.876 2.411 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.795 6.576 0.710 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.119 5.926 1.656 1.00 0.00 H new ATOM 0 HG LEU A 105 10.207 3.629 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.244 3.236 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.805 4.250 1.346 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.045 4.992 -0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 105 10.545 3.377 -1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.354 5.134 -1.228 1.00 0.00 H new ATOM 0 HD23 LEU A 105 11.742 4.493 -0.318 1.00 0.00 H new ATOM 1599 N ARG A 106 10.360 4.897 4.568 1.00 0.00 N ATOM 1600 CA ARG A 106 10.720 3.830 5.494 1.00 0.00 C ATOM 1601 C ARG A 106 9.677 3.687 6.593 1.00 0.00 C ATOM 1602 O ARG A 106 9.326 2.565 6.974 1.00 0.00 O ATOM 1603 CB ARG A 106 12.092 4.112 6.106 1.00 0.00 C ATOM 1604 CG ARG A 106 12.479 2.977 7.052 1.00 0.00 C ATOM 1605 CD ARG A 106 13.905 3.199 7.558 1.00 0.00 C ATOM 1606 NE ARG A 106 13.973 4.422 8.350 1.00 0.00 N ATOM 1607 CZ ARG A 106 15.141 4.917 8.749 1.00 0.00 C ATOM 1608 NH1 ARG A 106 16.250 4.309 8.430 1.00 0.00 N ATOM 1609 NH2 ARG A 106 15.177 6.013 9.457 1.00 0.00 N ATOM 0 H ARG A 106 10.816 5.791 4.750 1.00 0.00 H new ATOM 0 HA ARG A 106 10.760 2.893 4.939 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.838 4.212 5.318 1.00 0.00 H new ATOM 0 HB3 ARG A 106 12.072 5.058 6.647 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.786 2.937 7.892 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.410 2.019 6.536 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.221 2.348 8.161 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.592 3.265 6.714 1.00 0.00 H new ATOM 0 HE ARG A 106 13.111 4.905 8.602 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.221 3.454 7.875 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.146 4.689 8.736 1.00 0.00 H new ATOM 0 HH21 ARG A 106 14.310 6.489 9.704 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.073 6.393 9.763 1.00 0.00 H new ATOM 1623 N HIS A 107 9.199 4.825 7.099 1.00 0.00 N ATOM 1624 CA HIS A 107 8.204 4.814 8.166 1.00 0.00 C ATOM 1625 C HIS A 107 6.986 4.022 7.718 1.00 0.00 C ATOM 1626 O HIS A 107 6.517 3.135 8.427 1.00 0.00 O ATOM 1627 CB HIS A 107 7.792 6.246 8.506 1.00 0.00 C ATOM 1628 CG HIS A 107 8.916 6.930 9.234 1.00 0.00 C ATOM 1629 ND1 HIS A 107 10.086 6.268 9.574 1.00 0.00 N ATOM 1630 CD2 HIS A 107 9.062 8.213 9.695 1.00 0.00 C ATOM 1631 CE1 HIS A 107 10.876 7.149 10.212 1.00 0.00 C ATOM 1632 NE2 HIS A 107 10.300 8.350 10.313 1.00 0.00 N ATOM 0 H HIS A 107 9.482 5.755 6.790 1.00 0.00 H new ATOM 0 HA HIS A 107 8.633 4.347 9.052 1.00 0.00 H new ATOM 0 HB2 HIS A 107 7.549 6.792 7.595 1.00 0.00 H new ATOM 0 HB3 HIS A 107 6.894 6.241 9.124 1.00 0.00 H new ATOM 0 HD2 HIS A 107 8.327 8.998 9.594 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.858 6.914 10.596 1.00 0.00 H new ATOM 0 HE2 HIS A 107 10.685 9.187 10.750 1.00 0.00 H new ATOM 1641 N VAL A 108 6.464 4.347 6.537 1.00 0.00 N ATOM 1642 CA VAL A 108 5.293 3.639 6.023 1.00 0.00 C ATOM 1643 C VAL A 108 5.627 2.174 5.817 1.00 0.00 C ATOM 1644 O VAL A 108 5.057 1.306 6.473 1.00 0.00 O ATOM 1645 CB VAL A 108 4.872 4.249 4.685 1.00 0.00 C ATOM 1646 CG1 VAL A 108 3.597 3.570 4.187 1.00 0.00 C ATOM 1647 CG2 VAL A 108 4.622 5.746 4.866 1.00 0.00 C ATOM 0 H VAL A 108 6.824 5.081 5.928 1.00 0.00 H new ATOM 0 HA VAL A 108 4.479 3.729 6.742 1.00 0.00 H new ATOM 0 HB VAL A 108 5.665 4.099 3.953 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.300 4.007 3.234 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.780 2.504 4.056 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.800 3.714 4.916 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.322 6.183 3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.830 5.897 5.600 1.00 0.00 H new ATOM 0 HG23 VAL A 108 5.536 6.228 5.214 1.00 0.00 H new ATOM 1657 N MET A 109 6.560 1.890 4.893 1.00 0.00 N ATOM 1658 CA MET A 109 6.940 0.504 4.608 1.00 0.00 C ATOM 1659 C MET A 109 6.790 -0.372 5.853 1.00 0.00 C ATOM 1660 O MET A 109 5.854 -1.150 5.960 1.00 0.00 O ATOM 1661 CB MET A 109 8.402 0.466 4.139 1.00 0.00 C ATOM 1662 CG MET A 109 8.635 -0.772 3.275 1.00 0.00 C ATOM 1663 SD MET A 109 8.185 -0.396 1.563 1.00 0.00 S ATOM 1664 CE MET A 109 7.778 -2.088 1.052 1.00 0.00 C ATOM 0 H MET A 109 7.055 2.591 4.341 1.00 0.00 H new ATOM 0 HA MET A 109 6.282 0.118 3.830 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.635 1.367 3.571 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.070 0.451 5.000 1.00 0.00 H new ATOM 0 HG2 MET A 109 9.680 -1.077 3.330 1.00 0.00 H new ATOM 0 HG3 MET A 109 8.039 -1.606 3.645 1.00 0.00 H new ATOM 0 HE1 MET A 109 8.195 -2.280 0.063 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.199 -2.795 1.767 1.00 0.00 H new ATOM 0 HE3 MET A 109 6.695 -2.207 1.019 1.00 0.00 H new ATOM 1674 N ILE A 110 7.705 -0.223 6.793 1.00 0.00 N ATOM 1675 CA ILE A 110 7.644 -1.006 8.015 1.00 0.00 C ATOM 1676 C ILE A 110 6.235 -0.987 8.596 1.00 0.00 C ATOM 1677 O ILE A 110 5.681 -2.034 8.930 1.00 0.00 O ATOM 1678 CB ILE A 110 8.629 -0.427 9.044 1.00 0.00 C ATOM 1679 CG1 ILE A 110 8.567 -1.250 10.337 1.00 0.00 C ATOM 1680 CG2 ILE A 110 8.268 1.025 9.348 1.00 0.00 C ATOM 1681 CD1 ILE A 110 8.986 -2.695 10.052 1.00 0.00 C ATOM 0 H ILE A 110 8.491 0.425 6.737 1.00 0.00 H new ATOM 0 HA ILE A 110 7.913 -2.037 7.783 1.00 0.00 H new ATOM 0 HB ILE A 110 9.638 -0.469 8.634 1.00 0.00 H new ATOM 0 HG12 ILE A 110 9.224 -0.813 11.089 1.00 0.00 H new ATOM 0 HG13 ILE A 110 7.556 -1.228 10.745 1.00 0.00 H new ATOM 0 HG21 ILE A 110 8.970 1.429 10.078 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.319 1.612 8.431 1.00 0.00 H new ATOM 0 HG23 ILE A 110 7.257 1.072 9.753 1.00 0.00 H new ATOM 0 HD11 ILE A 110 8.940 -3.276 10.973 1.00 0.00 H new ATOM 0 HD12 ILE A 110 8.312 -3.131 9.315 1.00 0.00 H new ATOM 0 HD13 ILE A 110 10.005 -2.709 9.665 1.00 0.00 H new ATOM 1693 N ASN A 111 5.672 0.206 8.729 1.00 0.00 N ATOM 1694 CA ASN A 111 4.332 0.349 9.287 1.00 0.00 C ATOM 1695 C ASN A 111 3.359 -0.575 8.572 1.00 0.00 C ATOM 1696 O ASN A 111 2.218 -0.744 9.000 1.00 0.00 O ATOM 1697 CB ASN A 111 3.855 1.795 9.156 1.00 0.00 C ATOM 1698 CG ASN A 111 2.558 1.992 9.925 1.00 0.00 C ATOM 1699 OD1 ASN A 111 1.478 1.725 9.399 1.00 0.00 O ATOM 1700 ND2 ASN A 111 2.599 2.449 11.146 1.00 0.00 N ATOM 0 H ASN A 111 6.117 1.084 8.461 1.00 0.00 H new ATOM 0 HA ASN A 111 4.370 0.079 10.342 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.619 2.473 9.537 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.704 2.042 8.105 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.734 2.586 11.668 1.00 0.00 H new ATOM 0 HD22 ASN A 111 3.496 2.669 11.578 1.00 0.00 H new ATOM 1707 N LEU A 112 3.820 -1.181 7.482 1.00 0.00 N ATOM 1708 CA LEU A 112 2.982 -2.101 6.712 1.00 0.00 C ATOM 1709 C LEU A 112 3.470 -3.515 6.860 1.00 0.00 C ATOM 1710 O LEU A 112 4.181 -4.004 5.994 1.00 0.00 O ATOM 1711 CB LEU A 112 3.005 -1.717 5.232 1.00 0.00 C ATOM 1712 CG LEU A 112 2.504 -0.281 5.071 1.00 0.00 C ATOM 1713 CD1 LEU A 112 2.616 0.139 3.604 1.00 0.00 C ATOM 1714 CD2 LEU A 112 1.035 -0.191 5.519 1.00 0.00 C ATOM 0 H LEU A 112 4.762 -1.055 7.112 1.00 0.00 H new ATOM 0 HA LEU A 112 1.964 -2.033 7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.017 -1.807 4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.377 -2.399 4.658 1.00 0.00 H new ATOM 0 HG LEU A 112 3.111 0.383 5.687 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.259 1.162 3.490 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.657 0.081 3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.012 -0.527 2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.681 0.833 5.403 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.426 -0.857 4.907 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.955 -0.486 6.565 1.00 0.00 H new ATOM 1726 N GLY A 113 3.081 -4.173 7.963 1.00 0.00 N ATOM 1727 CA GLY A 113 3.489 -5.562 8.226 1.00 0.00 C ATOM 1728 C GLY A 113 4.610 -6.016 7.297 1.00 0.00 C ATOM 1729 O GLY A 113 4.433 -6.918 6.486 1.00 0.00 O ATOM 0 H GLY A 113 2.486 -3.767 8.685 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.817 -5.653 9.261 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.629 -6.221 8.105 1.00 0.00 H new ATOM 1733 N GLU A 114 5.751 -5.334 7.392 1.00 0.00 N ATOM 1734 CA GLU A 114 6.893 -5.641 6.535 1.00 0.00 C ATOM 1735 C GLU A 114 8.190 -5.442 7.298 1.00 0.00 C ATOM 1736 O GLU A 114 8.479 -4.352 7.781 1.00 0.00 O ATOM 1737 CB GLU A 114 6.887 -4.751 5.281 1.00 0.00 C ATOM 1738 CG GLU A 114 6.025 -5.398 4.194 1.00 0.00 C ATOM 1739 CD GLU A 114 5.861 -4.441 3.026 1.00 0.00 C ATOM 1740 OE1 GLU A 114 6.307 -3.315 3.149 1.00 0.00 O ATOM 1741 OE2 GLU A 114 5.275 -4.842 2.035 1.00 0.00 O ATOM 0 H GLU A 114 5.908 -4.570 8.050 1.00 0.00 H new ATOM 0 HA GLU A 114 6.815 -6.683 6.225 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.499 -3.763 5.527 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.905 -4.612 4.917 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.488 -6.324 3.854 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.048 -5.660 4.600 1.00 0.00 H new ATOM 1748 N LYS A 115 8.975 -6.507 7.405 1.00 0.00 N ATOM 1749 CA LYS A 115 10.244 -6.440 8.122 1.00 0.00 C ATOM 1750 C LYS A 115 11.395 -6.309 7.143 1.00 0.00 C ATOM 1751 O LYS A 115 11.984 -7.308 6.721 1.00 0.00 O ATOM 1752 CB LYS A 115 10.433 -7.707 8.957 1.00 0.00 C ATOM 1753 CG LYS A 115 9.141 -8.031 9.713 1.00 0.00 C ATOM 1754 CD LYS A 115 8.878 -6.959 10.773 1.00 0.00 C ATOM 1755 CE LYS A 115 7.678 -7.368 11.625 1.00 0.00 C ATOM 1756 NZ LYS A 115 7.454 -6.346 12.686 1.00 0.00 N ATOM 0 H LYS A 115 8.758 -7.421 7.008 1.00 0.00 H new ATOM 0 HA LYS A 115 10.230 -5.568 8.776 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.705 -8.541 8.311 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.253 -7.569 9.662 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.304 -8.080 9.017 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.221 -9.010 10.185 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.758 -6.832 11.403 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.687 -5.998 10.294 1.00 0.00 H new ATOM 0 HE2 LYS A 115 6.789 -7.461 11.001 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.854 -8.344 12.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.637 -6.622 13.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 8.300 -6.279 13.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.268 -5.423 12.245 1.00 0.00 H new ATOM 1770 N LEU A 116 11.729 -5.071 6.790 1.00 0.00 N ATOM 1771 CA LEU A 116 12.830 -4.813 5.859 1.00 0.00 C ATOM 1772 C LEU A 116 13.921 -3.991 6.524 1.00 0.00 C ATOM 1773 O LEU A 116 13.654 -2.954 7.131 1.00 0.00 O ATOM 1774 CB LEU A 116 12.304 -4.051 4.641 1.00 0.00 C ATOM 1775 CG LEU A 116 11.234 -4.887 3.934 1.00 0.00 C ATOM 1776 CD1 LEU A 116 10.521 -4.027 2.885 1.00 0.00 C ATOM 1777 CD2 LEU A 116 11.887 -6.098 3.246 1.00 0.00 C ATOM 0 H LEU A 116 11.258 -4.233 7.131 1.00 0.00 H new ATOM 0 HA LEU A 116 13.249 -5.771 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.885 -3.094 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.122 -3.833 3.954 1.00 0.00 H new ATOM 0 HG LEU A 116 10.511 -5.239 4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 116 9.759 -4.623 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.050 -3.174 3.373 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.246 -3.672 2.152 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.120 -6.689 2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.615 -5.751 2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.389 -6.713 3.992 1.00 0.00 H new ATOM 1789 N THR A 117 15.154 -4.474 6.432 1.00 0.00 N ATOM 1790 CA THR A 117 16.282 -3.781 7.043 1.00 0.00 C ATOM 1791 C THR A 117 16.550 -2.466 6.324 1.00 0.00 C ATOM 1792 O THR A 117 16.011 -2.220 5.246 1.00 0.00 O ATOM 1793 CB THR A 117 17.534 -4.661 6.971 1.00 0.00 C ATOM 1794 OG1 THR A 117 17.897 -4.860 5.611 1.00 0.00 O ATOM 1795 CG2 THR A 117 17.255 -6.016 7.627 1.00 0.00 C ATOM 0 H THR A 117 15.398 -5.336 5.944 1.00 0.00 H new ATOM 0 HA THR A 117 16.038 -3.574 8.085 1.00 0.00 H new ATOM 0 HB THR A 117 18.350 -4.167 7.499 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.699 -5.421 5.565 1.00 0.00 H new ATOM 0 HG21 THR A 117 18.149 -6.637 7.573 1.00 0.00 H new ATOM 0 HG22 THR A 117 16.981 -5.865 8.671 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.436 -6.511 7.105 1.00 0.00 H new ATOM 1803 N ASP A 118 17.380 -1.625 6.929 1.00 0.00 N ATOM 1804 CA ASP A 118 17.709 -0.335 6.336 1.00 0.00 C ATOM 1805 C ASP A 118 18.414 -0.532 4.998 1.00 0.00 C ATOM 1806 O ASP A 118 18.332 0.312 4.114 1.00 0.00 O ATOM 1807 CB ASP A 118 18.620 0.457 7.277 1.00 0.00 C ATOM 1808 CG ASP A 118 18.743 1.899 6.795 1.00 0.00 C ATOM 1809 OD1 ASP A 118 17.849 2.348 6.097 1.00 0.00 O ATOM 1810 OD2 ASP A 118 19.734 2.529 7.123 1.00 0.00 O ATOM 0 H ASP A 118 17.834 -1.811 7.823 1.00 0.00 H new ATOM 0 HA ASP A 118 16.783 0.218 6.175 1.00 0.00 H new ATOM 0 HB2 ASP A 118 18.216 0.437 8.289 1.00 0.00 H new ATOM 0 HB3 ASP A 118 19.606 -0.007 7.318 1.00 0.00 H new ATOM 1815 N GLU A 119 19.096 -1.659 4.852 1.00 0.00 N ATOM 1816 CA GLU A 119 19.807 -1.953 3.612 1.00 0.00 C ATOM 1817 C GLU A 119 18.825 -2.121 2.455 1.00 0.00 C ATOM 1818 O GLU A 119 18.968 -1.491 1.411 1.00 0.00 O ATOM 1819 CB GLU A 119 20.622 -3.241 3.776 1.00 0.00 C ATOM 1820 CG GLU A 119 21.624 -3.073 4.918 1.00 0.00 C ATOM 1821 CD GLU A 119 22.707 -2.076 4.521 1.00 0.00 C ATOM 1822 OE1 GLU A 119 22.740 -1.693 3.364 1.00 0.00 O ATOM 1823 OE2 GLU A 119 23.489 -1.708 5.382 1.00 0.00 O ATOM 0 H GLU A 119 19.173 -2.380 5.569 1.00 0.00 H new ATOM 0 HA GLU A 119 20.474 -1.119 3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 119 19.957 -4.080 3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 119 21.147 -3.471 2.849 1.00 0.00 H new ATOM 0 HG2 GLU A 119 21.111 -2.726 5.815 1.00 0.00 H new ATOM 0 HG3 GLU A 119 22.075 -4.035 5.161 1.00 0.00 H new ATOM 1830 N GLU A 120 17.820 -2.972 2.651 1.00 0.00 N ATOM 1831 CA GLU A 120 16.820 -3.210 1.613 1.00 0.00 C ATOM 1832 C GLU A 120 16.111 -1.912 1.246 1.00 0.00 C ATOM 1833 O GLU A 120 15.875 -1.628 0.068 1.00 0.00 O ATOM 1834 CB GLU A 120 15.797 -4.238 2.105 1.00 0.00 C ATOM 1835 CG GLU A 120 16.471 -5.605 2.236 1.00 0.00 C ATOM 1836 CD GLU A 120 16.822 -6.147 0.855 1.00 0.00 C ATOM 1837 OE1 GLU A 120 16.173 -5.748 -0.099 1.00 0.00 O ATOM 1838 OE2 GLU A 120 17.714 -6.975 0.773 1.00 0.00 O ATOM 0 H GLU A 120 17.677 -3.503 3.510 1.00 0.00 H new ATOM 0 HA GLU A 120 17.323 -3.595 0.726 1.00 0.00 H new ATOM 0 HB2 GLU A 120 15.388 -3.928 3.067 1.00 0.00 H new ATOM 0 HB3 GLU A 120 14.961 -4.298 1.408 1.00 0.00 H new ATOM 0 HG2 GLU A 120 17.373 -5.519 2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 120 15.807 -6.299 2.750 1.00 0.00 H new ATOM 1845 N VAL A 121 15.772 -1.125 2.259 1.00 0.00 N ATOM 1846 CA VAL A 121 15.092 0.146 2.023 1.00 0.00 C ATOM 1847 C VAL A 121 16.007 1.121 1.281 1.00 0.00 C ATOM 1848 O VAL A 121 15.601 1.761 0.299 1.00 0.00 O ATOM 1849 CB VAL A 121 14.668 0.762 3.355 1.00 0.00 C ATOM 1850 CG1 VAL A 121 13.994 2.114 3.103 1.00 0.00 C ATOM 1851 CG2 VAL A 121 13.686 -0.176 4.061 1.00 0.00 C ATOM 0 H VAL A 121 15.953 -1.338 3.240 1.00 0.00 H new ATOM 0 HA VAL A 121 14.212 -0.045 1.409 1.00 0.00 H new ATOM 0 HB VAL A 121 15.547 0.908 3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 121 13.692 2.553 4.054 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.694 2.782 2.601 1.00 0.00 H new ATOM 0 HG13 VAL A 121 13.115 1.971 2.474 1.00 0.00 H new ATOM 0 HG21 VAL A 121 13.383 0.263 5.012 1.00 0.00 H new ATOM 0 HG22 VAL A 121 12.807 -0.323 3.433 1.00 0.00 H new ATOM 0 HG23 VAL A 121 14.167 -1.137 4.242 1.00 0.00 H new ATOM 1861 N GLU A 122 17.253 1.224 1.750 1.00 0.00 N ATOM 1862 CA GLU A 122 18.223 2.118 1.125 1.00 0.00 C ATOM 1863 C GLU A 122 18.463 1.724 -0.328 1.00 0.00 C ATOM 1864 O GLU A 122 18.869 2.554 -1.149 1.00 0.00 O ATOM 1865 CB GLU A 122 19.543 2.080 1.898 1.00 0.00 C ATOM 1866 CG GLU A 122 19.414 2.899 3.181 1.00 0.00 C ATOM 1867 CD GLU A 122 20.672 2.743 4.028 1.00 0.00 C ATOM 1868 OE1 GLU A 122 21.575 2.050 3.588 1.00 0.00 O ATOM 1869 OE2 GLU A 122 20.714 3.315 5.105 1.00 0.00 O ATOM 0 H GLU A 122 17.609 0.704 2.552 1.00 0.00 H new ATOM 0 HA GLU A 122 17.821 3.131 1.147 1.00 0.00 H new ATOM 0 HB2 GLU A 122 19.805 1.050 2.138 1.00 0.00 H new ATOM 0 HB3 GLU A 122 20.348 2.478 1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 122 19.258 3.950 2.937 1.00 0.00 H new ATOM 0 HG3 GLU A 122 18.542 2.570 3.746 1.00 0.00 H new ATOM 1876 N GLN A 123 18.202 0.466 -0.643 1.00 0.00 N ATOM 1877 CA GLN A 123 18.382 -0.013 -2.000 1.00 0.00 C ATOM 1878 C GLN A 123 17.255 0.478 -2.895 1.00 0.00 C ATOM 1879 O GLN A 123 17.494 1.148 -3.902 1.00 0.00 O ATOM 1880 CB GLN A 123 18.421 -1.548 -2.019 1.00 0.00 C ATOM 1881 CG GLN A 123 19.800 -2.033 -1.576 1.00 0.00 C ATOM 1882 CD GLN A 123 19.819 -3.553 -1.490 1.00 0.00 C ATOM 1883 OE1 GLN A 123 19.141 -4.136 -0.646 1.00 0.00 O ATOM 1884 NE2 GLN A 123 20.556 -4.232 -2.324 1.00 0.00 N ATOM 0 H GLN A 123 17.868 -0.236 0.018 1.00 0.00 H new ATOM 0 HA GLN A 123 19.328 0.377 -2.377 1.00 0.00 H new ATOM 0 HB2 GLN A 123 17.654 -1.949 -1.357 1.00 0.00 H new ATOM 0 HB3 GLN A 123 18.201 -1.915 -3.022 1.00 0.00 H new ATOM 0 HG2 GLN A 123 20.558 -1.692 -2.281 1.00 0.00 H new ATOM 0 HG3 GLN A 123 20.051 -1.603 -0.606 1.00 0.00 H new ATOM 0 HE21 GLN A 123 21.117 -3.744 -3.023 1.00 0.00 H new ATOM 0 HE22 GLN A 123 20.572 -5.251 -2.278 1.00 0.00 H new ATOM 1893 N MET A 124 16.017 0.122 -2.549 1.00 0.00 N ATOM 1894 CA MET A 124 14.878 0.516 -3.350 1.00 0.00 C ATOM 1895 C MET A 124 14.944 1.989 -3.715 1.00 0.00 C ATOM 1896 O MET A 124 14.829 2.348 -4.890 1.00 0.00 O ATOM 1897 CB MET A 124 13.588 0.253 -2.560 1.00 0.00 C ATOM 1898 CG MET A 124 12.370 0.689 -3.395 1.00 0.00 C ATOM 1899 SD MET A 124 10.926 -0.295 -2.925 1.00 0.00 S ATOM 1900 CE MET A 124 10.251 0.835 -1.699 1.00 0.00 C ATOM 0 H MET A 124 15.788 -0.434 -1.725 1.00 0.00 H new ATOM 0 HA MET A 124 14.889 -0.069 -4.270 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.511 -0.806 -2.313 1.00 0.00 H new ATOM 0 HB3 MET A 124 13.609 0.800 -1.617 1.00 0.00 H new ATOM 0 HG2 MET A 124 12.168 1.748 -3.236 1.00 0.00 H new ATOM 0 HG3 MET A 124 12.580 0.561 -4.457 1.00 0.00 H new ATOM 0 HE1 MET A 124 9.535 0.305 -1.071 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.059 1.225 -1.080 1.00 0.00 H new ATOM 0 HE3 MET A 124 9.749 1.661 -2.203 1.00 0.00 H new ATOM 1910 N ILE A 125 15.131 2.834 -2.709 1.00 0.00 N ATOM 1911 CA ILE A 125 15.207 4.274 -2.950 1.00 0.00 C ATOM 1912 C ILE A 125 16.378 4.603 -3.867 1.00 0.00 C ATOM 1913 O ILE A 125 16.237 5.386 -4.809 1.00 0.00 O ATOM 1914 CB ILE A 125 15.372 5.010 -1.622 1.00 0.00 C ATOM 1915 CG1 ILE A 125 15.341 6.519 -1.867 1.00 0.00 C ATOM 1916 CG2 ILE A 125 16.700 4.624 -0.980 1.00 0.00 C ATOM 1917 CD1 ILE A 125 15.218 7.257 -0.534 1.00 0.00 C ATOM 0 H ILE A 125 15.232 2.556 -1.733 1.00 0.00 H new ATOM 0 HA ILE A 125 14.284 4.595 -3.434 1.00 0.00 H new ATOM 0 HB ILE A 125 14.557 4.734 -0.954 1.00 0.00 H new ATOM 0 HG12 ILE A 125 16.248 6.832 -2.384 1.00 0.00 H new ATOM 0 HG13 ILE A 125 14.502 6.775 -2.514 1.00 0.00 H new ATOM 0 HG21 ILE A 125 16.813 5.152 -0.033 1.00 0.00 H new ATOM 0 HG22 ILE A 125 16.719 3.549 -0.801 1.00 0.00 H new ATOM 0 HG23 ILE A 125 17.519 4.895 -1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 125 15.196 8.332 -0.714 1.00 0.00 H new ATOM 0 HD12 ILE A 125 14.298 6.954 -0.034 1.00 0.00 H new ATOM 0 HD13 ILE A 125 16.072 7.012 0.098 1.00 0.00 H new ATOM 1929 N LYS A 126 17.534 4.004 -3.590 1.00 0.00 N ATOM 1930 CA LYS A 126 18.716 4.242 -4.405 1.00 0.00 C ATOM 1931 C LYS A 126 18.473 3.786 -5.839 1.00 0.00 C ATOM 1932 O LYS A 126 18.916 4.432 -6.789 1.00 0.00 O ATOM 1933 CB LYS A 126 19.908 3.489 -3.817 1.00 0.00 C ATOM 1934 CG LYS A 126 21.172 3.839 -4.605 1.00 0.00 C ATOM 1935 CD LYS A 126 22.392 3.211 -3.924 1.00 0.00 C ATOM 1936 CE LYS A 126 22.397 1.697 -4.163 1.00 0.00 C ATOM 1937 NZ LYS A 126 23.735 1.146 -3.820 1.00 0.00 N ATOM 0 H LYS A 126 17.674 3.357 -2.814 1.00 0.00 H new ATOM 0 HA LYS A 126 18.930 5.311 -4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 126 20.036 3.753 -2.767 1.00 0.00 H new ATOM 0 HB3 LYS A 126 19.728 2.415 -3.856 1.00 0.00 H new ATOM 0 HG2 LYS A 126 21.087 3.475 -5.629 1.00 0.00 H new ATOM 0 HG3 LYS A 126 21.290 4.921 -4.660 1.00 0.00 H new ATOM 0 HD2 LYS A 126 23.307 3.654 -4.317 1.00 0.00 H new ATOM 0 HD3 LYS A 126 22.371 3.420 -2.854 1.00 0.00 H new ATOM 0 HE2 LYS A 126 21.628 1.219 -3.555 1.00 0.00 H new ATOM 0 HE3 LYS A 126 22.159 1.482 -5.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 23.739 0.119 -3.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 24.459 1.594 -4.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 23.944 1.340 -2.820 1.00 0.00 H new ATOM 1951 N GLU A 127 17.768 2.669 -5.989 1.00 0.00 N ATOM 1952 CA GLU A 127 17.473 2.140 -7.315 1.00 0.00 C ATOM 1953 C GLU A 127 16.511 3.066 -8.058 1.00 0.00 C ATOM 1954 O GLU A 127 16.732 3.402 -9.221 1.00 0.00 O ATOM 1955 CB GLU A 127 16.849 0.744 -7.193 1.00 0.00 C ATOM 1956 CG GLU A 127 17.041 -0.023 -8.504 1.00 0.00 C ATOM 1957 CD GLU A 127 16.241 0.644 -9.618 1.00 0.00 C ATOM 1958 OE1 GLU A 127 15.136 1.085 -9.344 1.00 0.00 O ATOM 1959 OE2 GLU A 127 16.746 0.711 -10.725 1.00 0.00 O ATOM 0 H GLU A 127 17.394 2.118 -5.217 1.00 0.00 H new ATOM 0 HA GLU A 127 18.405 2.074 -7.877 1.00 0.00 H new ATOM 0 HB2 GLU A 127 17.312 0.199 -6.370 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.787 0.829 -6.962 1.00 0.00 H new ATOM 0 HG2 GLU A 127 18.098 -0.049 -8.769 1.00 0.00 H new ATOM 0 HG3 GLU A 127 16.718 -1.057 -8.381 1.00 0.00 H new ATOM 1966 N ALA A 128 15.447 3.477 -7.374 1.00 0.00 N ATOM 1967 CA ALA A 128 14.458 4.364 -7.977 1.00 0.00 C ATOM 1968 C ALA A 128 15.104 5.694 -8.350 1.00 0.00 C ATOM 1969 O ALA A 128 14.752 6.305 -9.360 1.00 0.00 O ATOM 1970 CB ALA A 128 13.303 4.603 -7.002 1.00 0.00 C ATOM 0 H ALA A 128 15.249 3.212 -6.409 1.00 0.00 H new ATOM 0 HA ALA A 128 14.069 3.893 -8.880 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.570 5.266 -7.462 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.829 3.652 -6.759 1.00 0.00 H new ATOM 0 HB3 ALA A 128 13.686 5.061 -6.090 1.00 0.00 H new ATOM 1976 N ASP A 129 16.050 6.142 -7.528 1.00 0.00 N ATOM 1977 CA ASP A 129 16.739 7.406 -7.783 1.00 0.00 C ATOM 1978 C ASP A 129 17.636 7.275 -9.008 1.00 0.00 C ATOM 1979 O ASP A 129 18.741 6.737 -8.929 1.00 0.00 O ATOM 1980 CB ASP A 129 17.579 7.794 -6.567 1.00 0.00 C ATOM 1981 CG ASP A 129 18.039 9.240 -6.694 1.00 0.00 C ATOM 1982 OD1 ASP A 129 18.146 9.709 -7.815 1.00 0.00 O ATOM 1983 OD2 ASP A 129 18.265 9.861 -5.671 1.00 0.00 O ATOM 0 H ASP A 129 16.356 5.654 -6.686 1.00 0.00 H new ATOM 0 HA ASP A 129 15.996 8.182 -7.968 1.00 0.00 H new ATOM 0 HB2 ASP A 129 16.995 7.668 -5.655 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.443 7.134 -6.486 1.00 0.00 H new ATOM 1988 N LEU A 130 17.149 7.764 -10.142 1.00 0.00 N ATOM 1989 CA LEU A 130 17.917 7.701 -11.381 1.00 0.00 C ATOM 1990 C LEU A 130 19.072 8.693 -11.366 1.00 0.00 C ATOM 1991 O LEU A 130 20.179 8.381 -11.807 1.00 0.00 O ATOM 1992 CB LEU A 130 17.005 7.994 -12.575 1.00 0.00 C ATOM 1993 CG LEU A 130 15.762 7.103 -12.499 1.00 0.00 C ATOM 1994 CD1 LEU A 130 14.854 7.389 -13.698 1.00 0.00 C ATOM 1995 CD2 LEU A 130 16.182 5.626 -12.515 1.00 0.00 C ATOM 0 H LEU A 130 16.234 8.205 -10.230 1.00 0.00 H new ATOM 0 HA LEU A 130 18.329 6.696 -11.471 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.713 9.044 -12.574 1.00 0.00 H new ATOM 0 HB3 LEU A 130 17.539 7.812 -13.508 1.00 0.00 H new ATOM 0 HG LEU A 130 15.223 7.315 -11.576 1.00 0.00 H new ATOM 0 HD11 LEU A 130 13.969 6.755 -13.644 1.00 0.00 H new ATOM 0 HD12 LEU A 130 14.551 8.436 -13.684 1.00 0.00 H new ATOM 0 HD13 LEU A 130 15.394 7.180 -14.621 1.00 0.00 H new ATOM 0 HD21 LEU A 130 15.295 4.995 -12.461 1.00 0.00 H new ATOM 0 HD22 LEU A 130 16.724 5.412 -13.436 1.00 0.00 H new ATOM 0 HD23 LEU A 130 16.826 5.421 -11.659 1.00 0.00 H new ATOM 2007 N ASP A 131 18.800 9.894 -10.878 1.00 0.00 N ATOM 2008 CA ASP A 131 19.818 10.941 -10.828 1.00 0.00 C ATOM 2009 C ASP A 131 20.655 10.819 -9.565 1.00 0.00 C ATOM 2010 O ASP A 131 21.549 11.626 -9.336 1.00 0.00 O ATOM 2011 CB ASP A 131 19.153 12.319 -10.868 1.00 0.00 C ATOM 2012 CG ASP A 131 18.114 12.432 -9.758 1.00 0.00 C ATOM 2013 OD1 ASP A 131 17.552 11.412 -9.394 1.00 0.00 O ATOM 2014 OD2 ASP A 131 17.895 13.536 -9.288 1.00 0.00 O ATOM 0 H ASP A 131 17.889 10.170 -10.512 1.00 0.00 H new ATOM 0 HA ASP A 131 20.470 10.825 -11.694 1.00 0.00 H new ATOM 0 HB2 ASP A 131 19.906 13.098 -10.752 1.00 0.00 H new ATOM 0 HB3 ASP A 131 18.679 12.475 -11.837 1.00 0.00 H new ATOM 2019 N GLY A 132 20.358 9.805 -8.758 1.00 0.00 N ATOM 2020 CA GLY A 132 21.091 9.585 -7.518 1.00 0.00 C ATOM 2021 C GLY A 132 21.155 10.867 -6.693 1.00 0.00 C ATOM 2022 O GLY A 132 21.797 11.842 -7.078 1.00 0.00 O ATOM 0 H GLY A 132 19.619 9.126 -8.940 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.608 8.798 -6.939 1.00 0.00 H new ATOM 0 HA3 GLY A 132 22.101 9.241 -7.743 1.00 0.00 H new ATOM 2026 N ASP A 133 20.485 10.861 -5.548 1.00 0.00 N ATOM 2027 CA ASP A 133 20.476 12.034 -4.678 1.00 0.00 C ATOM 2028 C ASP A 133 20.062 11.646 -3.266 1.00 0.00 C ATOM 2029 O ASP A 133 20.345 12.363 -2.305 1.00 0.00 O ATOM 2030 CB ASP A 133 19.506 13.080 -5.225 1.00 0.00 C ATOM 2031 CG ASP A 133 18.092 12.510 -5.272 1.00 0.00 C ATOM 2032 OD1 ASP A 133 17.435 12.528 -4.246 1.00 0.00 O ATOM 2033 OD2 ASP A 133 17.686 12.064 -6.335 1.00 0.00 O ATOM 0 H ASP A 133 19.946 10.068 -5.201 1.00 0.00 H new ATOM 0 HA ASP A 133 21.483 12.451 -4.649 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.527 13.970 -4.597 1.00 0.00 H new ATOM 0 HB3 ASP A 133 19.816 13.388 -6.224 1.00 0.00 H new ATOM 2038 N GLY A 134 19.388 10.505 -3.140 1.00 0.00 N ATOM 2039 CA GLY A 134 18.937 10.032 -1.832 1.00 0.00 C ATOM 2040 C GLY A 134 17.453 10.312 -1.636 1.00 0.00 C ATOM 2041 O GLY A 134 16.908 10.093 -0.554 1.00 0.00 O ATOM 0 H GLY A 134 19.143 9.895 -3.920 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.124 8.962 -1.743 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.511 10.522 -1.046 1.00 0.00 H new ATOM 2045 N GLN A 135 16.801 10.794 -2.687 1.00 0.00 N ATOM 2046 CA GLN A 135 15.372 11.094 -2.621 1.00 0.00 C ATOM 2047 C GLN A 135 14.714 10.845 -3.967 1.00 0.00 C ATOM 2048 O GLN A 135 15.370 10.888 -5.011 1.00 0.00 O ATOM 2049 CB GLN A 135 15.169 12.566 -2.201 1.00 0.00 C ATOM 2050 CG GLN A 135 14.800 12.633 -0.719 1.00 0.00 C ATOM 2051 CD GLN A 135 14.941 14.056 -0.209 1.00 0.00 C ATOM 2052 OE1 GLN A 135 16.041 14.607 -0.209 1.00 0.00 O ATOM 2053 NE2 GLN A 135 13.888 14.689 0.227 1.00 0.00 N ATOM 0 H GLN A 135 17.234 10.985 -3.591 1.00 0.00 H new ATOM 0 HA GLN A 135 14.909 10.440 -1.882 1.00 0.00 H new ATOM 0 HB2 GLN A 135 16.080 13.136 -2.385 1.00 0.00 H new ATOM 0 HB3 GLN A 135 14.382 13.021 -2.803 1.00 0.00 H new ATOM 0 HG2 GLN A 135 13.776 12.287 -0.575 1.00 0.00 H new ATOM 0 HG3 GLN A 135 15.445 11.967 -0.145 1.00 0.00 H new ATOM 0 HE21 GLN A 135 12.978 14.228 0.225 1.00 0.00 H new ATOM 0 HE22 GLN A 135 13.974 15.646 0.570 1.00 0.00 H new ATOM 2062 N VAL A 136 13.400 10.600 -3.939 1.00 0.00 N ATOM 2063 CA VAL A 136 12.658 10.364 -5.173 1.00 0.00 C ATOM 2064 C VAL A 136 11.626 11.464 -5.401 1.00 0.00 C ATOM 2065 O VAL A 136 10.770 11.711 -4.560 1.00 0.00 O ATOM 2066 CB VAL A 136 11.957 9.001 -5.093 1.00 0.00 C ATOM 2067 CG1 VAL A 136 10.891 8.901 -6.182 1.00 0.00 C ATOM 2068 CG2 VAL A 136 12.979 7.889 -5.281 1.00 0.00 C ATOM 0 H VAL A 136 12.839 10.561 -3.088 1.00 0.00 H new ATOM 0 HA VAL A 136 13.357 10.370 -6.010 1.00 0.00 H new ATOM 0 HB VAL A 136 11.484 8.900 -4.116 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.397 7.931 -6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.155 9.693 -6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.359 9.008 -7.160 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.479 6.922 -5.224 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.456 7.994 -6.256 1.00 0.00 H new ATOM 0 HG23 VAL A 136 13.735 7.953 -4.498 1.00 0.00 H new ATOM 2078 N ASN A 137 11.711 12.106 -6.559 1.00 0.00 N ATOM 2079 CA ASN A 137 10.775 13.172 -6.900 1.00 0.00 C ATOM 2080 C ASN A 137 9.502 12.595 -7.502 1.00 0.00 C ATOM 2081 O ASN A 137 9.525 11.530 -8.121 1.00 0.00 O ATOM 2082 CB ASN A 137 11.418 14.139 -7.893 1.00 0.00 C ATOM 2083 CG ASN A 137 10.550 15.385 -8.049 1.00 0.00 C ATOM 2084 OD1 ASN A 137 10.241 16.052 -7.061 1.00 0.00 O ATOM 2085 ND2 ASN A 137 10.137 15.739 -9.234 1.00 0.00 N ATOM 0 H ASN A 137 12.412 11.910 -7.274 1.00 0.00 H new ATOM 0 HA ASN A 137 10.521 13.709 -5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 137 12.413 14.420 -7.547 1.00 0.00 H new ATOM 0 HB3 ASN A 137 11.543 13.650 -8.859 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.556 16.570 -9.344 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.395 15.185 -10.051 1.00 0.00 H new ATOM 2092 N TYR A 138 8.389 13.300 -7.319 1.00 0.00 N ATOM 2093 CA TYR A 138 7.114 12.841 -7.855 1.00 0.00 C ATOM 2094 C TYR A 138 7.250 12.516 -9.340 1.00 0.00 C ATOM 2095 O TYR A 138 6.722 11.510 -9.808 1.00 0.00 O ATOM 2096 CB TYR A 138 6.048 13.929 -7.660 1.00 0.00 C ATOM 2097 CG TYR A 138 4.790 13.553 -8.409 1.00 0.00 C ATOM 2098 CD1 TYR A 138 3.894 12.627 -7.860 1.00 0.00 C ATOM 2099 CD2 TYR A 138 4.530 14.122 -9.663 1.00 0.00 C ATOM 2100 CE1 TYR A 138 2.736 12.275 -8.562 1.00 0.00 C ATOM 2101 CE2 TYR A 138 3.373 13.769 -10.364 1.00 0.00 C ATOM 2102 CZ TYR A 138 2.477 12.846 -9.814 1.00 0.00 C ATOM 2103 OH TYR A 138 1.333 12.500 -10.503 1.00 0.00 O ATOM 0 H TYR A 138 8.345 14.182 -6.809 1.00 0.00 H new ATOM 0 HA TYR A 138 6.814 11.939 -7.323 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.828 14.050 -6.599 1.00 0.00 H new ATOM 0 HB3 TYR A 138 6.423 14.887 -8.019 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.097 12.185 -6.896 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.223 14.833 -10.088 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.043 11.564 -8.139 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.171 14.209 -11.330 1.00 0.00 H new ATOM 0 HH TYR A 138 1.304 12.986 -11.353 1.00 0.00 H new ATOM 2113 N GLU A 139 7.960 13.374 -10.071 1.00 0.00 N ATOM 2114 CA GLU A 139 8.152 13.161 -11.504 1.00 0.00 C ATOM 2115 C GLU A 139 8.916 11.860 -11.741 1.00 0.00 C ATOM 2116 O GLU A 139 8.500 11.018 -12.535 1.00 0.00 O ATOM 2117 CB GLU A 139 8.927 14.336 -12.101 1.00 0.00 C ATOM 2118 CG GLU A 139 8.741 14.346 -13.616 1.00 0.00 C ATOM 2119 CD GLU A 139 7.334 14.824 -13.962 1.00 0.00 C ATOM 2120 OE1 GLU A 139 6.698 15.414 -13.104 1.00 0.00 O ATOM 2121 OE2 GLU A 139 6.914 14.598 -15.085 1.00 0.00 O ATOM 0 H GLU A 139 8.407 14.213 -9.700 1.00 0.00 H new ATOM 0 HA GLU A 139 7.178 13.092 -11.988 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.573 15.274 -11.674 1.00 0.00 H new ATOM 0 HB3 GLU A 139 9.985 14.252 -11.854 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.481 15.000 -14.078 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.904 13.346 -14.018 1.00 0.00 H new ATOM 2128 N GLU A 140 10.027 11.690 -11.023 1.00 0.00 N ATOM 2129 CA GLU A 140 10.826 10.476 -11.149 1.00 0.00 C ATOM 2130 C GLU A 140 9.985 9.266 -10.745 1.00 0.00 C ATOM 2131 O GLU A 140 10.092 8.191 -11.343 1.00 0.00 O ATOM 2132 CB GLU A 140 12.064 10.569 -10.251 1.00 0.00 C ATOM 2133 CG GLU A 140 12.888 9.287 -10.374 1.00 0.00 C ATOM 2134 CD GLU A 140 14.092 9.353 -9.447 1.00 0.00 C ATOM 2135 OE1 GLU A 140 13.912 9.106 -8.267 1.00 0.00 O ATOM 2136 OE2 GLU A 140 15.174 9.649 -9.924 1.00 0.00 O ATOM 0 H GLU A 140 10.389 12.371 -10.356 1.00 0.00 H new ATOM 0 HA GLU A 140 11.147 10.364 -12.185 1.00 0.00 H new ATOM 0 HB2 GLU A 140 12.668 11.430 -10.537 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.763 10.721 -9.215 1.00 0.00 H new ATOM 0 HG2 GLU A 140 12.272 8.423 -10.123 1.00 0.00 H new ATOM 0 HG3 GLU A 140 13.218 9.154 -11.404 1.00 0.00 H new ATOM 2143 N PHE A 141 9.153 9.439 -9.719 1.00 0.00 N ATOM 2144 CA PHE A 141 8.304 8.350 -9.248 1.00 0.00 C ATOM 2145 C PHE A 141 7.303 7.951 -10.327 1.00 0.00 C ATOM 2146 O PHE A 141 7.129 6.774 -10.624 1.00 0.00 O ATOM 2147 CB PHE A 141 7.553 8.780 -7.989 1.00 0.00 C ATOM 2148 CG PHE A 141 6.682 7.644 -7.505 1.00 0.00 C ATOM 2149 CD1 PHE A 141 7.267 6.436 -7.105 1.00 0.00 C ATOM 2150 CD2 PHE A 141 5.290 7.796 -7.453 1.00 0.00 C ATOM 2151 CE1 PHE A 141 6.464 5.387 -6.658 1.00 0.00 C ATOM 2152 CE2 PHE A 141 4.487 6.744 -7.003 1.00 0.00 C ATOM 2153 CZ PHE A 141 5.075 5.540 -6.604 1.00 0.00 C ATOM 0 H PHE A 141 9.050 10.313 -9.204 1.00 0.00 H new ATOM 0 HA PHE A 141 8.937 7.493 -9.017 1.00 0.00 H new ATOM 0 HB2 PHE A 141 8.261 9.066 -7.211 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.941 9.657 -8.200 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.340 6.317 -7.143 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.837 8.727 -7.761 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.916 4.455 -6.353 1.00 0.00 H new ATOM 0 HE2 PHE A 141 3.414 6.861 -6.964 1.00 0.00 H new ATOM 0 HZ PHE A 141 4.456 4.727 -6.254 1.00 0.00 H new ATOM 2163 N VAL A 142 6.646 8.944 -10.915 1.00 0.00 N ATOM 2164 CA VAL A 142 5.658 8.680 -11.957 1.00 0.00 C ATOM 2165 C VAL A 142 6.290 7.959 -13.132 1.00 0.00 C ATOM 2166 O VAL A 142 5.732 6.991 -13.634 1.00 0.00 O ATOM 2167 CB VAL A 142 5.050 10.006 -12.439 1.00 0.00 C ATOM 2168 CG1 VAL A 142 4.154 9.747 -13.658 1.00 0.00 C ATOM 2169 CG2 VAL A 142 4.198 10.638 -11.300 1.00 0.00 C ATOM 0 H VAL A 142 6.777 9.931 -10.692 1.00 0.00 H new ATOM 0 HA VAL A 142 4.878 8.044 -11.538 1.00 0.00 H new ATOM 0 HB VAL A 142 5.853 10.690 -12.714 1.00 0.00 H new ATOM 0 HG11 VAL A 142 3.723 10.688 -13.999 1.00 0.00 H new ATOM 0 HG12 VAL A 142 4.748 9.308 -14.460 1.00 0.00 H new ATOM 0 HG13 VAL A 142 3.354 9.060 -13.382 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.769 11.578 -11.646 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.397 9.953 -11.022 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.831 10.826 -10.433 1.00 0.00 H new ATOM 2179 N LYS A 143 7.447 8.432 -13.559 1.00 0.00 N ATOM 2180 CA LYS A 143 8.141 7.820 -14.682 1.00 0.00 C ATOM 2181 C LYS A 143 8.493 6.368 -14.379 1.00 0.00 C ATOM 2182 O LYS A 143 8.453 5.514 -15.265 1.00 0.00 O ATOM 2183 CB LYS A 143 9.420 8.596 -14.995 1.00 0.00 C ATOM 2184 CG LYS A 143 9.060 9.951 -15.615 1.00 0.00 C ATOM 2185 CD LYS A 143 10.338 10.663 -16.069 1.00 0.00 C ATOM 2186 CE LYS A 143 11.152 11.101 -14.847 1.00 0.00 C ATOM 2187 NZ LYS A 143 12.138 12.136 -15.251 1.00 0.00 N ATOM 0 H LYS A 143 7.926 9.234 -13.149 1.00 0.00 H new ATOM 0 HA LYS A 143 7.475 7.847 -15.545 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.000 8.744 -14.084 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.045 8.025 -15.682 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.390 9.808 -16.463 1.00 0.00 H new ATOM 0 HG3 LYS A 143 8.528 10.565 -14.888 1.00 0.00 H new ATOM 0 HD2 LYS A 143 10.933 9.997 -16.694 1.00 0.00 H new ATOM 0 HD3 LYS A 143 10.085 11.531 -16.678 1.00 0.00 H new ATOM 0 HE2 LYS A 143 10.488 11.497 -14.078 1.00 0.00 H new ATOM 0 HE3 LYS A 143 11.667 10.243 -14.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 12.690 12.433 -14.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 12.778 11.743 -15.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 11.637 12.958 -15.645 1.00 0.00 H new ATOM 2201 N MET A 144 8.834 6.099 -13.128 1.00 0.00 N ATOM 2202 CA MET A 144 9.185 4.745 -12.714 1.00 0.00 C ATOM 2203 C MET A 144 7.944 3.852 -12.656 1.00 0.00 C ATOM 2204 O MET A 144 8.021 2.651 -12.912 1.00 0.00 O ATOM 2205 CB MET A 144 9.868 4.775 -11.347 1.00 0.00 C ATOM 2206 CG MET A 144 10.245 3.353 -10.931 1.00 0.00 C ATOM 2207 SD MET A 144 11.206 3.408 -9.399 1.00 0.00 S ATOM 2208 CE MET A 144 11.109 1.643 -9.007 1.00 0.00 C ATOM 0 H MET A 144 8.876 6.795 -12.384 1.00 0.00 H new ATOM 0 HA MET A 144 9.873 4.331 -13.451 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.759 5.401 -11.388 1.00 0.00 H new ATOM 0 HB3 MET A 144 9.202 5.217 -10.606 1.00 0.00 H new ATOM 0 HG2 MET A 144 9.346 2.754 -10.787 1.00 0.00 H new ATOM 0 HG3 MET A 144 10.825 2.873 -11.720 1.00 0.00 H new ATOM 0 HE1 MET A 144 11.929 1.373 -8.341 1.00 0.00 H new ATOM 0 HE2 MET A 144 10.159 1.431 -8.517 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.181 1.062 -9.926 1.00 0.00 H new ATOM 2218 N MET A 145 6.815 4.448 -12.301 1.00 0.00 N ATOM 2219 CA MET A 145 5.567 3.706 -12.200 1.00 0.00 C ATOM 2220 C MET A 145 5.000 3.405 -13.564 1.00 0.00 C ATOM 2221 O MET A 145 4.258 2.443 -13.708 1.00 0.00 O ATOM 2222 CB MET A 145 4.548 4.490 -11.376 1.00 0.00 C ATOM 2223 CG MET A 145 4.978 4.517 -9.891 1.00 0.00 C ATOM 2224 SD MET A 145 3.510 4.430 -8.836 1.00 0.00 S ATOM 2225 CE MET A 145 3.576 2.649 -8.517 1.00 0.00 C ATOM 0 H MET A 145 6.737 5.440 -12.079 1.00 0.00 H new ATOM 0 HA MET A 145 5.780 2.761 -11.701 1.00 0.00 H new ATOM 0 HB2 MET A 145 4.465 5.508 -11.758 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.563 4.033 -11.470 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.642 3.679 -9.678 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.537 5.428 -9.680 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.672 2.340 -7.992 1.00 0.00 H new ATOM 0 HE2 MET A 145 3.648 2.112 -9.463 1.00 0.00 H new ATOM 0 HE3 MET A 145 4.448 2.421 -7.903 1.00 0.00 H new ATOM 2235 N MET A 146 5.340 4.239 -14.538 1.00 0.00 N ATOM 2236 CA MET A 146 4.855 4.053 -15.896 1.00 0.00 C ATOM 2237 C MET A 146 5.259 2.692 -16.443 1.00 0.00 C ATOM 2238 O MET A 146 5.920 2.624 -17.466 1.00 0.00 O ATOM 2239 CB MET A 146 5.419 5.155 -16.809 1.00 0.00 C ATOM 2240 CG MET A 146 4.621 6.446 -16.617 1.00 0.00 C ATOM 2241 SD MET A 146 2.960 6.239 -17.312 1.00 0.00 S ATOM 2242 CE MET A 146 3.313 6.928 -18.947 1.00 0.00 C ATOM 0 H MET A 146 5.948 5.048 -14.412 1.00 0.00 H new ATOM 0 HA MET A 146 3.767 4.110 -15.875 1.00 0.00 H new ATOM 0 HB2 MET A 146 6.470 5.329 -16.578 1.00 0.00 H new ATOM 0 HB3 MET A 146 5.370 4.838 -17.851 1.00 0.00 H new ATOM 0 HG2 MET A 146 4.555 6.691 -15.557 1.00 0.00 H new ATOM 0 HG3 MET A 146 5.130 7.277 -17.105 1.00 0.00 H new ATOM 0 HE1 MET A 146 2.410 6.899 -19.557 1.00 0.00 H new ATOM 0 HE2 MET A 146 3.648 7.960 -18.842 1.00 0.00 H new ATOM 0 HE3 MET A 146 4.095 6.340 -19.428 1.00 0.00 H new ATOM 2308 N ALA B 19 14.499 -1.894 -7.506 1.00 0.00 N ATOM 2309 CA ALA B 19 13.445 -2.715 -6.845 1.00 0.00 C ATOM 2310 C ALA B 19 12.071 -2.221 -7.284 1.00 0.00 C ATOM 2311 O ALA B 19 11.299 -1.707 -6.474 1.00 0.00 O ATOM 2312 CB ALA B 19 13.587 -2.591 -5.326 1.00 0.00 C ATOM 0 HA ALA B 19 13.556 -3.761 -7.131 1.00 0.00 H new ATOM 0 HB1 ALA B 19 12.818 -3.190 -4.839 1.00 0.00 H new ATOM 0 HB2 ALA B 19 14.571 -2.947 -5.022 1.00 0.00 H new ATOM 0 HB3 ALA B 19 13.473 -1.547 -5.034 1.00 0.00 H new ATOM 2320 N ARG B 20 11.770 -2.382 -8.566 1.00 0.00 N ATOM 2321 CA ARG B 20 10.485 -1.951 -9.098 1.00 0.00 C ATOM 2322 C ARG B 20 9.347 -2.745 -8.465 1.00 0.00 C ATOM 2323 O ARG B 20 8.277 -2.200 -8.192 1.00 0.00 O ATOM 2324 CB ARG B 20 10.465 -2.134 -10.619 1.00 0.00 C ATOM 2325 CG ARG B 20 10.679 -3.610 -10.957 1.00 0.00 C ATOM 2326 CD ARG B 20 10.797 -3.775 -12.471 1.00 0.00 C ATOM 2327 NE ARG B 20 10.973 -5.184 -12.810 1.00 0.00 N ATOM 2328 CZ ARG B 20 9.927 -5.991 -12.956 1.00 0.00 C ATOM 2329 NH1 ARG B 20 8.719 -5.525 -12.791 1.00 0.00 N ATOM 2330 NH2 ARG B 20 10.108 -7.245 -13.263 1.00 0.00 N ATOM 0 H ARG B 20 12.394 -2.805 -9.253 1.00 0.00 H new ATOM 0 HA ARG B 20 10.346 -0.897 -8.859 1.00 0.00 H new ATOM 0 HB2 ARG B 20 9.513 -1.791 -11.025 1.00 0.00 H new ATOM 0 HB3 ARG B 20 11.245 -1.528 -11.079 1.00 0.00 H new ATOM 0 HG2 ARG B 20 11.581 -3.978 -10.469 1.00 0.00 H new ATOM 0 HG3 ARG B 20 9.847 -4.205 -10.580 1.00 0.00 H new ATOM 0 HD2 ARG B 20 9.903 -3.385 -12.958 1.00 0.00 H new ATOM 0 HD3 ARG B 20 11.642 -3.195 -12.843 1.00 0.00 H new ATOM 0 HE ARG B 20 11.914 -5.555 -12.937 1.00 0.00 H new ATOM 0 HH11 ARG B 20 8.579 -4.544 -12.551 1.00 0.00 H new ATOM 0 HH12 ARG B 20 7.915 -6.142 -12.902 1.00 0.00 H new ATOM 0 HH21 ARG B 20 11.053 -7.607 -13.391 1.00 0.00 H new ATOM 0 HH22 ARG B 20 9.305 -7.864 -13.375 1.00 0.00 H new ATOM 2344 N GLN B 21 9.585 -4.032 -8.241 1.00 0.00 N ATOM 2345 CA GLN B 21 8.571 -4.889 -7.646 1.00 0.00 C ATOM 2346 C GLN B 21 8.272 -4.448 -6.218 1.00 0.00 C ATOM 2347 O GLN B 21 7.112 -4.380 -5.809 1.00 0.00 O ATOM 2348 CB GLN B 21 9.051 -6.343 -7.646 1.00 0.00 C ATOM 2349 CG GLN B 21 7.860 -7.278 -7.421 1.00 0.00 C ATOM 2350 CD GLN B 21 7.044 -7.399 -8.703 1.00 0.00 C ATOM 2351 OE1 GLN B 21 5.901 -6.946 -8.759 1.00 0.00 O ATOM 2352 NE2 GLN B 21 7.568 -7.983 -9.746 1.00 0.00 N ATOM 0 H GLN B 21 10.464 -4.500 -8.461 1.00 0.00 H new ATOM 0 HA GLN B 21 7.659 -4.809 -8.237 1.00 0.00 H new ATOM 0 HB2 GLN B 21 9.535 -6.576 -8.594 1.00 0.00 H new ATOM 0 HB3 GLN B 21 9.795 -6.491 -6.863 1.00 0.00 H new ATOM 0 HG2 GLN B 21 8.213 -8.261 -7.110 1.00 0.00 H new ATOM 0 HG3 GLN B 21 7.233 -6.895 -6.616 1.00 0.00 H new ATOM 0 HE21 GLN B 21 8.515 -8.358 -9.698 1.00 0.00 H new ATOM 0 HE22 GLN B 21 7.030 -8.064 -10.609 1.00 0.00 H new ATOM 2361 N ARG B 22 9.326 -4.144 -5.465 1.00 0.00 N ATOM 2362 CA ARG B 22 9.159 -3.703 -4.089 1.00 0.00 C ATOM 2363 C ARG B 22 8.379 -2.395 -4.050 1.00 0.00 C ATOM 2364 O ARG B 22 7.492 -2.217 -3.213 1.00 0.00 O ATOM 2365 CB ARG B 22 10.529 -3.520 -3.432 1.00 0.00 C ATOM 2366 CG ARG B 22 10.351 -3.156 -1.949 1.00 0.00 C ATOM 2367 CD ARG B 22 9.981 -4.413 -1.154 1.00 0.00 C ATOM 2368 NE ARG B 22 10.854 -5.524 -1.524 1.00 0.00 N ATOM 2369 CZ ARG B 22 12.046 -5.677 -0.963 1.00 0.00 C ATOM 2370 NH1 ARG B 22 12.454 -4.828 -0.062 1.00 0.00 N ATOM 2371 NH2 ARG B 22 12.812 -6.671 -1.320 1.00 0.00 N ATOM 0 H ARG B 22 10.294 -4.195 -5.783 1.00 0.00 H new ATOM 0 HA ARG B 22 8.601 -4.460 -3.538 1.00 0.00 H new ATOM 0 HB2 ARG B 22 11.112 -4.437 -3.524 1.00 0.00 H new ATOM 0 HB3 ARG B 22 11.086 -2.736 -3.944 1.00 0.00 H new ATOM 0 HG2 ARG B 22 11.271 -2.723 -1.557 1.00 0.00 H new ATOM 0 HG3 ARG B 22 9.572 -2.402 -1.840 1.00 0.00 H new ATOM 0 HD2 ARG B 22 10.068 -4.214 -0.086 1.00 0.00 H new ATOM 0 HD3 ARG B 22 8.942 -4.679 -1.345 1.00 0.00 H new ATOM 0 HE ARG B 22 10.541 -6.194 -2.226 1.00 0.00 H new ATOM 0 HH11 ARG B 22 11.857 -4.047 0.211 1.00 0.00 H new ATOM 0 HH12 ARG B 22 13.370 -4.944 0.370 1.00 0.00 H new ATOM 0 HH21 ARG B 22 12.494 -7.330 -2.030 1.00 0.00 H new ATOM 0 HH22 ARG B 22 13.729 -6.789 -0.889 1.00 0.00 H new ATOM 2385 N TRP B 23 8.716 -1.480 -4.947 1.00 0.00 N ATOM 2386 CA TRP B 23 8.030 -0.193 -4.995 1.00 0.00 C ATOM 2387 C TRP B 23 6.536 -0.414 -5.214 1.00 0.00 C ATOM 2388 O TRP B 23 5.700 0.205 -4.548 1.00 0.00 O ATOM 2389 CB TRP B 23 8.616 0.663 -6.142 1.00 0.00 C ATOM 2390 CG TRP B 23 9.430 1.782 -5.583 1.00 0.00 C ATOM 2391 CD1 TRP B 23 10.757 1.927 -5.735 1.00 0.00 C ATOM 2392 CD2 TRP B 23 8.982 2.892 -4.751 1.00 0.00 C ATOM 2393 NE1 TRP B 23 11.159 3.070 -5.068 1.00 0.00 N ATOM 2394 CE2 TRP B 23 10.098 3.701 -4.448 1.00 0.00 C ATOM 2395 CE3 TRP B 23 7.726 3.279 -4.244 1.00 0.00 C ATOM 2396 CZ2 TRP B 23 9.976 4.854 -3.669 1.00 0.00 C ATOM 2397 CZ3 TRP B 23 7.601 4.438 -3.461 1.00 0.00 C ATOM 2398 CH2 TRP B 23 8.724 5.221 -3.178 1.00 0.00 C ATOM 0 H TRP B 23 9.451 -1.600 -5.644 1.00 0.00 H new ATOM 0 HA TRP B 23 8.174 0.332 -4.050 1.00 0.00 H new ATOM 0 HB2 TRP B 23 9.234 0.042 -6.790 1.00 0.00 H new ATOM 0 HB3 TRP B 23 7.809 1.062 -6.757 1.00 0.00 H new ATOM 0 HD1 TRP B 23 11.403 1.261 -6.287 1.00 0.00 H new ATOM 0 HE1 TRP B 23 12.122 3.406 -5.038 1.00 0.00 H new ATOM 0 HE3 TRP B 23 6.853 2.680 -4.459 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 10.845 5.456 -3.449 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 6.634 4.726 -3.076 1.00 0.00 H new ATOM 0 HH2 TRP B 23 8.621 6.113 -2.577 1.00 0.00 H new ATOM 2409 N ARG B 24 6.206 -1.306 -6.147 1.00 0.00 N ATOM 2410 CA ARG B 24 4.812 -1.609 -6.433 1.00 0.00 C ATOM 2411 C ARG B 24 4.166 -2.271 -5.222 1.00 0.00 C ATOM 2412 O ARG B 24 2.999 -2.029 -4.916 1.00 0.00 O ATOM 2413 CB ARG B 24 4.714 -2.535 -7.647 1.00 0.00 C ATOM 2414 CG ARG B 24 5.064 -1.756 -8.913 1.00 0.00 C ATOM 2415 CD ARG B 24 5.045 -2.700 -10.115 1.00 0.00 C ATOM 2416 NE ARG B 24 5.276 -1.957 -11.347 1.00 0.00 N ATOM 2417 CZ ARG B 24 5.037 -2.503 -12.535 1.00 0.00 C ATOM 2418 NH1 ARG B 24 4.593 -3.728 -12.612 1.00 0.00 N ATOM 2419 NH2 ARG B 24 5.245 -1.815 -13.623 1.00 0.00 N ATOM 0 H ARG B 24 6.880 -1.825 -6.710 1.00 0.00 H new ATOM 0 HA ARG B 24 4.287 -0.680 -6.654 1.00 0.00 H new ATOM 0 HB2 ARG B 24 5.392 -3.380 -7.528 1.00 0.00 H new ATOM 0 HB3 ARG B 24 3.706 -2.943 -7.726 1.00 0.00 H new ATOM 0 HG2 ARG B 24 4.351 -0.945 -9.063 1.00 0.00 H new ATOM 0 HG3 ARG B 24 6.049 -1.300 -8.811 1.00 0.00 H new ATOM 0 HD2 ARG B 24 5.811 -3.466 -9.996 1.00 0.00 H new ATOM 0 HD3 ARG B 24 4.085 -3.214 -10.167 1.00 0.00 H new ATOM 0 HE ARG B 24 5.627 -1.001 -11.297 1.00 0.00 H new ATOM 0 HH11 ARG B 24 4.430 -4.266 -11.761 1.00 0.00 H new ATOM 0 HH12 ARG B 24 4.409 -4.148 -13.523 1.00 0.00 H new ATOM 0 HH21 ARG B 24 5.591 -0.857 -13.563 1.00 0.00 H new ATOM 0 HH22 ARG B 24 5.061 -2.234 -14.535 1.00 0.00 H new ATOM 2433 N SER B 25 4.935 -3.115 -4.535 1.00 0.00 N ATOM 2434 CA SER B 25 4.423 -3.808 -3.356 1.00 0.00 C ATOM 2435 C SER B 25 3.968 -2.801 -2.312 1.00 0.00 C ATOM 2436 O SER B 25 2.885 -2.932 -1.740 1.00 0.00 O ATOM 2437 CB SER B 25 5.513 -4.705 -2.766 1.00 0.00 C ATOM 2438 OG SER B 25 5.961 -5.616 -3.760 1.00 0.00 O ATOM 0 H SER B 25 5.903 -3.333 -4.771 1.00 0.00 H new ATOM 0 HA SER B 25 3.572 -4.422 -3.651 1.00 0.00 H new ATOM 0 HB2 SER B 25 6.346 -4.099 -2.410 1.00 0.00 H new ATOM 0 HB3 SER B 25 5.125 -5.250 -1.905 1.00 0.00 H new ATOM 0 HG SER B 25 6.578 -5.158 -4.369 1.00 0.00 H new ATOM 2444 N SER B 26 4.796 -1.788 -2.073 1.00 0.00 N ATOM 2445 CA SER B 26 4.451 -0.759 -1.095 1.00 0.00 C ATOM 2446 C SER B 26 3.180 -0.030 -1.518 1.00 0.00 C ATOM 2447 O SER B 26 2.287 0.212 -0.713 1.00 0.00 O ATOM 2448 CB SER B 26 5.598 0.245 -0.977 1.00 0.00 C ATOM 2449 OG SER B 26 6.812 -0.454 -0.763 1.00 0.00 O ATOM 0 H SER B 26 5.696 -1.657 -2.534 1.00 0.00 H new ATOM 0 HA SER B 26 4.281 -1.237 -0.130 1.00 0.00 H new ATOM 0 HB2 SER B 26 5.666 0.845 -1.884 1.00 0.00 H new ATOM 0 HB3 SER B 26 5.411 0.933 -0.153 1.00 0.00 H new ATOM 0 HG SER B 26 7.375 0.052 -0.141 1.00 0.00 H new ATOM 2455 N VAL B 27 3.098 0.305 -2.802 1.00 0.00 N ATOM 2456 CA VAL B 27 1.927 0.996 -3.328 1.00 0.00 C ATOM 2457 C VAL B 27 0.707 0.081 -3.293 1.00 0.00 C ATOM 2458 O VAL B 27 -0.404 0.515 -2.990 1.00 0.00 O ATOM 2459 CB VAL B 27 2.187 1.455 -4.764 1.00 0.00 C ATOM 2460 CG1 VAL B 27 0.943 2.161 -5.311 1.00 0.00 C ATOM 2461 CG2 VAL B 27 3.375 2.423 -4.783 1.00 0.00 C ATOM 0 H VAL B 27 3.823 0.111 -3.493 1.00 0.00 H new ATOM 0 HA VAL B 27 1.732 1.867 -2.703 1.00 0.00 H new ATOM 0 HB VAL B 27 2.413 0.589 -5.386 1.00 0.00 H new ATOM 0 HG11 VAL B 27 1.130 2.487 -6.334 1.00 0.00 H new ATOM 0 HG12 VAL B 27 0.099 1.472 -5.299 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.714 3.027 -4.690 1.00 0.00 H new ATOM 0 HG21 VAL B 27 3.561 2.751 -5.806 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.149 3.289 -4.160 1.00 0.00 H new ATOM 0 HG23 VAL B 27 4.261 1.919 -4.397 1.00 0.00 H new ATOM 2471 N SER B 28 0.918 -1.187 -3.632 1.00 0.00 N ATOM 2472 CA SER B 28 -0.178 -2.147 -3.649 1.00 0.00 C ATOM 2473 C SER B 28 -0.787 -2.293 -2.263 1.00 0.00 C ATOM 2474 O SER B 28 -1.999 -2.345 -2.111 1.00 0.00 O ATOM 2475 CB SER B 28 0.336 -3.509 -4.131 1.00 0.00 C ATOM 2476 OG SER B 28 0.724 -3.415 -5.496 1.00 0.00 O ATOM 0 H SER B 28 1.826 -1.569 -3.895 1.00 0.00 H new ATOM 0 HA SER B 28 -0.947 -1.783 -4.330 1.00 0.00 H new ATOM 0 HB2 SER B 28 1.183 -3.826 -3.522 1.00 0.00 H new ATOM 0 HB3 SER B 28 -0.441 -4.265 -4.014 1.00 0.00 H new ATOM 0 HG SER B 28 1.570 -2.925 -5.563 1.00 0.00 H new ATOM 2482 N ILE B 29 0.062 -2.359 -1.252 1.00 0.00 N ATOM 2483 CA ILE B 29 -0.416 -2.495 0.117 1.00 0.00 C ATOM 2484 C ILE B 29 -1.127 -1.223 0.561 1.00 0.00 C ATOM 2485 O ILE B 29 -2.027 -1.264 1.404 1.00 0.00 O ATOM 2486 CB ILE B 29 0.760 -2.785 1.051 1.00 0.00 C ATOM 2487 CG1 ILE B 29 1.361 -4.149 0.706 1.00 0.00 C ATOM 2488 CG2 ILE B 29 0.269 -2.797 2.503 1.00 0.00 C ATOM 2489 CD1 ILE B 29 2.706 -4.309 1.418 1.00 0.00 C ATOM 0 H ILE B 29 1.077 -2.321 -1.349 1.00 0.00 H new ATOM 0 HA ILE B 29 -1.123 -3.324 0.159 1.00 0.00 H new ATOM 0 HB ILE B 29 1.519 -2.012 0.930 1.00 0.00 H new ATOM 0 HG12 ILE B 29 0.681 -4.945 1.008 1.00 0.00 H new ATOM 0 HG13 ILE B 29 1.495 -4.237 -0.372 1.00 0.00 H new ATOM 0 HG21 ILE B 29 1.107 -3.004 3.169 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -0.160 -1.826 2.750 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -0.490 -3.570 2.624 1.00 0.00 H new ATOM 0 HD11 ILE B 29 3.134 -5.281 1.172 1.00 0.00 H new ATOM 0 HD12 ILE B 29 3.385 -3.521 1.094 1.00 0.00 H new ATOM 0 HD13 ILE B 29 2.558 -4.240 2.496 1.00 0.00 H new ATOM 2501 N VAL B 30 -0.719 -0.096 -0.009 1.00 0.00 N ATOM 2502 CA VAL B 30 -1.335 1.180 0.330 1.00 0.00 C ATOM 2503 C VAL B 30 -2.774 1.231 -0.170 1.00 0.00 C ATOM 2504 O VAL B 30 -3.671 1.679 0.544 1.00 0.00 O ATOM 2505 CB VAL B 30 -0.524 2.329 -0.284 1.00 0.00 C ATOM 2506 CG1 VAL B 30 -1.324 3.635 -0.201 1.00 0.00 C ATOM 2507 CG2 VAL B 30 0.796 2.492 0.484 1.00 0.00 C ATOM 0 H VAL B 30 0.028 -0.039 -0.701 1.00 0.00 H new ATOM 0 HA VAL B 30 -1.343 1.286 1.415 1.00 0.00 H new ATOM 0 HB VAL B 30 -0.315 2.100 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -0.742 4.446 -0.639 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -2.260 3.524 -0.748 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -1.539 3.864 0.843 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.372 3.308 0.048 1.00 0.00 H new ATOM 0 HG22 VAL B 30 0.583 2.716 1.529 1.00 0.00 H new ATOM 0 HG23 VAL B 30 1.370 1.568 0.420 1.00 0.00 H new ATOM 2517 N LYS B 31 -2.978 0.784 -1.407 1.00 0.00 N ATOM 2518 CA LYS B 31 -4.314 0.800 -1.986 1.00 0.00 C ATOM 2519 C LYS B 31 -5.226 -0.149 -1.211 1.00 0.00 C ATOM 2520 O LYS B 31 -6.417 0.099 -1.070 1.00 0.00 O ATOM 2521 CB LYS B 31 -4.223 0.396 -3.478 1.00 0.00 C ATOM 2522 CG LYS B 31 -4.475 -1.106 -3.638 1.00 0.00 C ATOM 2523 CD LYS B 31 -4.110 -1.550 -5.035 1.00 0.00 C ATOM 2524 CE LYS B 31 -4.329 -3.058 -5.157 1.00 0.00 C ATOM 2525 NZ LYS B 31 -3.934 -3.502 -6.521 1.00 0.00 N ATOM 0 H LYS B 31 -2.249 0.413 -2.016 1.00 0.00 H new ATOM 0 HA LYS B 31 -4.739 1.802 -1.920 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -4.954 0.958 -4.059 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -3.239 0.651 -3.871 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -3.887 -1.661 -2.907 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -5.523 -1.330 -3.440 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -4.719 -1.022 -5.768 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -3.070 -1.303 -5.248 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -3.741 -3.585 -4.406 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -5.375 -3.302 -4.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -4.081 -4.528 -6.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -4.514 -3.007 -7.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -2.930 -3.282 -6.681 1.00 0.00 H new ATOM 2539 N ASN B 32 -4.653 -1.268 -0.773 1.00 0.00 N ATOM 2540 CA ASN B 32 -5.416 -2.273 -0.056 1.00 0.00 C ATOM 2541 C ASN B 32 -5.757 -1.752 1.332 1.00 0.00 C ATOM 2542 O ASN B 32 -6.853 -1.980 1.845 1.00 0.00 O ATOM 2543 CB ASN B 32 -4.615 -3.570 0.059 1.00 0.00 C ATOM 2544 CG ASN B 32 -4.478 -4.224 -1.311 1.00 0.00 C ATOM 2545 OD1 ASN B 32 -5.380 -4.121 -2.143 1.00 0.00 O ATOM 2546 ND2 ASN B 32 -3.394 -4.891 -1.600 1.00 0.00 N ATOM 0 H ASN B 32 -3.667 -1.496 -0.904 1.00 0.00 H new ATOM 0 HA ASN B 32 -6.334 -2.481 -0.605 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -3.628 -3.362 0.471 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -5.111 -4.253 0.749 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -3.293 -5.328 -2.516 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -2.648 -4.975 -0.910 1.00 0.00 H new ATOM 2553 N ARG B 33 -4.797 -1.059 1.949 1.00 0.00 N ATOM 2554 CA ARG B 33 -5.002 -0.526 3.287 1.00 0.00 C ATOM 2555 C ARG B 33 -6.106 0.515 3.296 1.00 0.00 C ATOM 2556 O ARG B 33 -6.986 0.487 4.159 1.00 0.00 O ATOM 2557 CB ARG B 33 -3.701 0.106 3.797 1.00 0.00 C ATOM 2558 CG ARG B 33 -3.925 0.681 5.199 1.00 0.00 C ATOM 2559 CD ARG B 33 -2.585 1.123 5.791 1.00 0.00 C ATOM 2560 NE ARG B 33 -1.719 -0.034 5.994 1.00 0.00 N ATOM 2561 CZ ARG B 33 -1.822 -0.787 7.084 1.00 0.00 C ATOM 2562 NH1 ARG B 33 -2.706 -0.494 7.998 1.00 0.00 N ATOM 2563 NH2 ARG B 33 -1.037 -1.817 7.242 1.00 0.00 N ATOM 0 H ARG B 33 -3.882 -0.858 1.545 1.00 0.00 H new ATOM 0 HA ARG B 33 -5.296 -1.348 3.940 1.00 0.00 H new ATOM 0 HB2 ARG B 33 -2.907 -0.641 3.822 1.00 0.00 H new ATOM 0 HB3 ARG B 33 -3.377 0.894 3.117 1.00 0.00 H new ATOM 0 HG2 ARG B 33 -4.610 1.527 5.151 1.00 0.00 H new ATOM 0 HG3 ARG B 33 -4.389 -0.068 5.841 1.00 0.00 H new ATOM 0 HD2 ARG B 33 -2.101 1.836 5.123 1.00 0.00 H new ATOM 0 HD3 ARG B 33 -2.749 1.635 6.739 1.00 0.00 H new ATOM 0 HE ARG B 33 -1.022 -0.269 5.287 1.00 0.00 H new ATOM 0 HH11 ARG B 33 -3.318 0.313 7.876 1.00 0.00 H new ATOM 0 HH12 ARG B 33 -2.785 -1.072 8.835 1.00 0.00 H new ATOM 0 HH21 ARG B 33 -0.344 -2.044 6.529 1.00 0.00 H new ATOM 0 HH22 ARG B 33 -1.116 -2.395 8.079 1.00 0.00 H new ATOM 2577 N ALA B 34 -6.058 1.432 2.330 1.00 0.00 N ATOM 2578 CA ALA B 34 -7.062 2.489 2.240 1.00 0.00 C ATOM 2579 C ALA B 34 -7.458 2.978 3.632 1.00 0.00 C ATOM 2580 O ALA B 34 -8.598 2.810 4.058 1.00 0.00 O ATOM 2581 CB ALA B 34 -8.298 1.974 1.508 1.00 0.00 C ATOM 0 H ALA B 34 -5.341 1.464 1.605 1.00 0.00 H new ATOM 0 HA ALA B 34 -6.632 3.323 1.685 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -9.041 2.769 1.446 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -8.020 1.657 0.503 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -8.717 1.127 2.052 1.00 0.00 H new ATOM 2587 N ARG B 35 -6.503 3.572 4.338 1.00 0.00 N ATOM 2588 CA ARG B 35 -6.768 4.069 5.679 1.00 0.00 C ATOM 2589 C ARG B 35 -7.670 5.285 5.638 1.00 0.00 C ATOM 2590 O ARG B 35 -7.883 5.938 6.664 1.00 0.00 O ATOM 2591 CB ARG B 35 -5.434 4.422 6.383 1.00 0.00 C ATOM 2592 CG ARG B 35 -5.194 3.478 7.567 1.00 0.00 C ATOM 2593 CD ARG B 35 -6.091 3.906 8.735 1.00 0.00 C ATOM 2594 NE ARG B 35 -5.822 3.073 9.899 1.00 0.00 N ATOM 2595 CZ ARG B 35 -6.474 1.930 10.091 1.00 0.00 C ATOM 2596 NH1 ARG B 35 -7.369 1.534 9.225 1.00 0.00 N ATOM 2597 NH2 ARG B 35 -6.219 1.203 11.142 1.00 0.00 N ATOM 0 H ARG B 35 -5.549 3.719 4.008 1.00 0.00 H new ATOM 0 HA ARG B 35 -7.277 3.286 6.241 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -4.609 4.345 5.675 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.460 5.455 6.731 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -5.414 2.450 7.280 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -4.146 3.508 7.866 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -5.912 4.953 8.978 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -7.140 3.820 8.450 1.00 0.00 H new ATOM 0 HE ARG B 35 -5.122 3.371 10.578 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -7.568 2.102 8.401 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -7.869 0.657 9.373 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -5.519 1.511 11.817 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -6.719 0.326 11.289 1.00 0.00 H new ATOM 2611 N ARG B 36 -8.185 5.590 4.459 1.00 0.00 N ATOM 2612 CA ARG B 36 -9.066 6.745 4.294 1.00 0.00 C ATOM 2613 C ARG B 36 -10.366 6.330 3.632 1.00 0.00 C ATOM 2614 O ARG B 36 -11.252 7.153 3.427 1.00 0.00 O ATOM 2615 CB ARG B 36 -8.369 7.809 3.441 1.00 0.00 C ATOM 2616 CG ARG B 36 -7.054 8.232 4.107 1.00 0.00 C ATOM 2617 CD ARG B 36 -7.344 9.179 5.276 1.00 0.00 C ATOM 2618 NE ARG B 36 -6.114 9.802 5.738 1.00 0.00 N ATOM 2619 CZ ARG B 36 -6.130 10.715 6.703 1.00 0.00 C ATOM 2620 NH1 ARG B 36 -7.262 11.065 7.252 1.00 0.00 N ATOM 2621 NH2 ARG B 36 -5.016 11.264 7.099 1.00 0.00 N ATOM 0 H ARG B 36 -8.013 5.061 3.604 1.00 0.00 H new ATOM 0 HA ARG B 36 -9.290 7.157 5.278 1.00 0.00 H new ATOM 0 HB2 ARG B 36 -8.172 7.416 2.444 1.00 0.00 H new ATOM 0 HB3 ARG B 36 -9.020 8.675 3.320 1.00 0.00 H new ATOM 0 HG2 ARG B 36 -6.518 7.353 4.464 1.00 0.00 H new ATOM 0 HG3 ARG B 36 -6.409 8.725 3.379 1.00 0.00 H new ATOM 0 HD2 ARG B 36 -8.053 9.946 4.964 1.00 0.00 H new ATOM 0 HD3 ARG B 36 -7.809 8.627 6.093 1.00 0.00 H new ATOM 0 HE ARG B 36 -5.225 9.534 5.315 1.00 0.00 H new ATOM 0 HH11 ARG B 36 -8.134 10.637 6.940 1.00 0.00 H new ATOM 0 HH12 ARG B 36 -7.274 11.766 7.993 1.00 0.00 H new ATOM 0 HH21 ARG B 36 -4.132 10.993 6.668 1.00 0.00 H new ATOM 0 HH22 ARG B 36 -5.028 11.965 7.840 1.00 0.00 H new ATOM 2635 N PHE B 37 -10.476 5.047 3.305 1.00 0.00 N ATOM 2636 CA PHE B 37 -11.685 4.533 2.667 1.00 0.00 C ATOM 2637 C PHE B 37 -11.893 5.194 1.310 1.00 0.00 C ATOM 2638 O PHE B 37 -12.989 5.643 0.994 1.00 0.00 O ATOM 2639 CB PHE B 37 -12.897 4.796 3.561 1.00 0.00 C ATOM 2640 CG PHE B 37 -12.505 4.598 5.007 1.00 0.00 C ATOM 2641 CD1 PHE B 37 -12.368 3.307 5.525 1.00 0.00 C ATOM 2642 CD2 PHE B 37 -12.282 5.708 5.827 1.00 0.00 C ATOM 2643 CE1 PHE B 37 -12.010 3.127 6.866 1.00 0.00 C ATOM 2644 CE2 PHE B 37 -11.922 5.530 7.166 1.00 0.00 C ATOM 2645 CZ PHE B 37 -11.787 4.238 7.688 1.00 0.00 C ATOM 0 H PHE B 37 -9.751 4.349 3.469 1.00 0.00 H new ATOM 0 HA PHE B 37 -11.571 3.459 2.520 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -13.263 5.811 3.407 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -13.711 4.121 3.297 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -12.538 2.449 4.891 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -12.388 6.705 5.425 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -11.906 2.130 7.267 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -11.748 6.389 7.797 1.00 0.00 H new ATOM 0 HZ PHE B 37 -11.511 4.099 8.723 1.00 0.00 H new ATOM 2655 N ARG B 38 -10.835 5.253 0.511 1.00 0.00 N ATOM 2656 CA ARG B 38 -10.917 5.867 -0.810 1.00 0.00 C ATOM 2657 C ARG B 38 -12.221 5.482 -1.504 1.00 0.00 C ATOM 2658 O ARG B 38 -12.795 6.271 -2.251 1.00 0.00 O ATOM 2659 CB ARG B 38 -9.729 5.421 -1.664 1.00 0.00 C ATOM 2660 CG ARG B 38 -9.832 3.918 -1.938 1.00 0.00 C ATOM 2661 CD ARG B 38 -8.532 3.425 -2.576 1.00 0.00 C ATOM 2662 NE ARG B 38 -8.332 4.064 -3.873 1.00 0.00 N ATOM 2663 CZ ARG B 38 -8.924 3.598 -4.967 1.00 0.00 C ATOM 2664 NH1 ARG B 38 -9.701 2.551 -4.894 1.00 0.00 N ATOM 2665 NH2 ARG B 38 -8.730 4.186 -6.115 1.00 0.00 N ATOM 0 H ARG B 38 -9.914 4.886 0.752 1.00 0.00 H new ATOM 0 HA ARG B 38 -10.893 6.950 -0.689 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -9.716 5.973 -2.604 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -8.794 5.644 -1.150 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -10.020 3.380 -1.009 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -10.674 3.715 -2.600 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -7.690 3.646 -1.920 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -8.566 2.342 -2.697 1.00 0.00 H new ATOM 0 HE ARG B 38 -7.727 4.883 -3.940 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -9.854 2.091 -3.997 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -10.155 2.194 -5.734 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -8.123 5.004 -6.173 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -9.185 3.828 -6.955 1.00 0.00 H new ATOM 2679 N MET B 39 -12.682 4.263 -1.244 1.00 0.00 N ATOM 2680 CA MET B 39 -13.918 3.787 -1.844 1.00 0.00 C ATOM 2681 C MET B 39 -15.113 4.572 -1.311 1.00 0.00 C ATOM 2682 O MET B 39 -15.727 5.359 -2.034 1.00 0.00 O ATOM 2683 CB MET B 39 -14.111 2.299 -1.544 1.00 0.00 C ATOM 2684 CG MET B 39 -15.367 1.784 -2.257 1.00 0.00 C ATOM 2685 SD MET B 39 -16.835 2.209 -1.290 1.00 0.00 S ATOM 2686 CE MET B 39 -18.058 1.453 -2.381 1.00 0.00 C ATOM 0 H MET B 39 -12.222 3.594 -0.627 1.00 0.00 H new ATOM 0 HA MET B 39 -13.851 3.934 -2.922 1.00 0.00 H new ATOM 0 HB2 MET B 39 -13.238 1.736 -1.874 1.00 0.00 H new ATOM 0 HB3 MET B 39 -14.203 2.144 -0.469 1.00 0.00 H new ATOM 0 HG2 MET B 39 -15.437 2.222 -3.253 1.00 0.00 H new ATOM 0 HG3 MET B 39 -15.306 0.704 -2.387 1.00 0.00 H new ATOM 0 HE1 MET B 39 -19.058 1.631 -1.985 1.00 0.00 H new ATOM 0 HE2 MET B 39 -17.979 1.891 -3.376 1.00 0.00 H new ATOM 0 HE3 MET B 39 -17.877 0.380 -2.442 1.00 0.00 H new ATOM 2696 N ILE B 40 -15.447 4.341 -0.046 1.00 0.00 N ATOM 2697 CA ILE B 40 -16.578 5.022 0.568 1.00 0.00 C ATOM 2698 C ILE B 40 -16.341 6.528 0.589 1.00 0.00 C ATOM 2699 O ILE B 40 -17.253 7.309 0.307 1.00 0.00 O ATOM 2700 CB ILE B 40 -16.786 4.506 1.999 1.00 0.00 C ATOM 2701 CG1 ILE B 40 -17.263 3.048 1.951 1.00 0.00 C ATOM 2702 CG2 ILE B 40 -17.845 5.362 2.708 1.00 0.00 C ATOM 2703 CD1 ILE B 40 -17.322 2.479 3.371 1.00 0.00 C ATOM 0 H ILE B 40 -14.955 3.693 0.569 1.00 0.00 H new ATOM 0 HA ILE B 40 -17.472 4.816 -0.020 1.00 0.00 H new ATOM 0 HB ILE B 40 -15.844 4.567 2.545 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -18.247 2.992 1.485 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -16.586 2.453 1.338 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -17.991 4.993 3.723 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -17.511 6.399 2.743 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -18.786 5.302 2.162 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -17.661 1.444 3.334 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -16.330 2.520 3.821 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -18.017 3.067 3.970 1.00 0.00 H new ATOM 2715 N SER B 41 -15.129 6.926 0.941 1.00 0.00 N ATOM 2716 CA SER B 41 -14.796 8.343 1.014 1.00 0.00 C ATOM 2717 C SER B 41 -15.129 9.030 -0.306 1.00 0.00 C ATOM 2718 O SER B 41 -15.733 10.104 -0.321 1.00 0.00 O ATOM 2719 CB SER B 41 -13.304 8.510 1.304 1.00 0.00 C ATOM 2720 OG SER B 41 -12.569 8.358 0.097 1.00 0.00 O ATOM 0 H SER B 41 -14.364 6.295 1.179 1.00 0.00 H new ATOM 0 HA SER B 41 -15.379 8.798 1.815 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.114 9.492 1.737 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.979 7.770 2.036 1.00 0.00 H new ATOM 0 HG SER B 41 -11.685 8.768 0.199 1.00 0.00 H new ATOM 2726 N ASN B 42 -14.748 8.400 -1.412 1.00 0.00 N ATOM 2727 CA ASN B 42 -15.025 8.961 -2.730 1.00 0.00 C ATOM 2728 C ASN B 42 -16.527 9.027 -2.973 1.00 0.00 C ATOM 2729 O ASN B 42 -17.035 10.005 -3.528 1.00 0.00 O ATOM 2730 CB ASN B 42 -14.370 8.097 -3.813 1.00 0.00 C ATOM 2731 CG ASN B 42 -12.868 8.356 -3.843 1.00 0.00 C ATOM 2732 OD1 ASN B 42 -12.402 9.369 -3.322 1.00 0.00 O ATOM 2733 ND2 ASN B 42 -12.078 7.497 -4.427 1.00 0.00 N ATOM 0 H ASN B 42 -14.251 7.509 -1.424 1.00 0.00 H new ATOM 0 HA ASN B 42 -14.614 9.970 -2.771 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -14.562 7.042 -3.615 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -14.807 8.324 -4.786 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -11.072 7.664 -4.452 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -12.466 6.658 -4.858 1.00 0.00 H new ATOM 2740 N LEU B 43 -17.239 7.977 -2.566 1.00 0.00 N ATOM 2741 CA LEU B 43 -18.690 7.926 -2.758 1.00 0.00 C ATOM 2742 C LEU B 43 -19.408 8.287 -1.463 1.00 0.00 C ATOM 2743 O LEU B 43 -18.794 8.926 -0.626 1.00 0.00 O ATOM 2744 CB LEU B 43 -19.103 6.522 -3.198 1.00 0.00 C ATOM 2745 CG LEU B 43 -18.240 6.080 -4.384 1.00 0.00 C ATOM 2746 CD1 LEU B 43 -18.640 4.664 -4.806 1.00 0.00 C ATOM 2747 CD2 LEU B 43 -18.449 7.043 -5.560 1.00 0.00 C ATOM 2748 OXT LEU B 43 -20.563 7.918 -1.329 1.00 0.00 O ATOM 0 H LEU B 43 -16.842 7.158 -2.106 1.00 0.00 H new ATOM 0 HA LEU B 43 -18.967 8.645 -3.528 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -18.987 5.822 -2.370 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -20.156 6.513 -3.478 1.00 0.00 H new ATOM 0 HG LEU B 43 -17.190 6.090 -4.091 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -18.026 4.349 -5.650 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -18.489 3.979 -3.972 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -19.690 4.654 -5.097 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -17.834 6.727 -6.403 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -19.499 7.036 -5.854 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -18.163 8.051 -5.260 1.00 0.00 H new