USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 798 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: C 40 GLN : amide:sc= 0.58 K(o=1.2,f=-2!) USER MOD Set 1.2: C 43 ASN : amide:sc= 0.651 K(o=1.2,f=-0.3) USER MOD Set 2.1: C 23 ASN : amide:sc= -1.29 K(o=-0.8,f=-3.9!) USER MOD Set 2.2: C 55 GLN : amide:sc= 0.494 K(o=-0.8,f=-3.9) USER MOD Set 3.1: B 23 ASN : amide:sc= -1.94! C(o=-5.1!,f=-4.6!) USER MOD Set 3.2: B 26 GLN : amide:sc= -3.14! C(o=-5.1!,f=-3.9!) USER MOD Set 4.1: A 18 HIS : no HD1:sc= -1.07 K(o=-0.99,f=-0.094) USER MOD Set 4.2: A 20 SER OG : rot -30:sc= 0.0786 USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 14 ASN : amide:sc= -2.29! K(o=-2.3!,f=-0.35) USER MOD Single : A 19 SER OG : rot -124:sc= 1.35 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -1.11 K(o=-1.1,f=-0.3) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= -0.0437 USER MOD Single : A 30 THR OG1 : rot 46:sc= 0.198 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= 0.418 K(o=0.42,f=-0.71) USER MOD Single : B 32 HIS : no HD1:sc= -0.336 X(o=-0.34,f=0.017) USER MOD Single : B 33 SER OG : rot 5:sc= 1.11 USER MOD Single : B 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= -0.0725 K(o=-0.072,f=-1.3!) USER MOD Single : B 41 SER OG : rot -102:sc= 0.383 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=-0.0046) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0286) USER MOD Single : B 52 ASN : amide:sc= -1.16 K(o=-1.2,f=-2.3!) USER MOD Single : B 55 GLN : amide:sc= -0.161 K(o=-0.16,f=-0.8) USER MOD Single : C 18 TYR OH : rot 180:sc= -0.0196 USER MOD Single : C 21 ASN : amide:sc= 0.636 K(o=0.64,f=-0.67) USER MOD Single : C 26 GLN : amide:sc= -2.45! C(o=-2.5!,f=-7.5!) USER MOD Single : C 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 33 SER OG : rot 180:sc= 0 USER MOD Single : C 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 39 SER OG : rot 180:sc= 0 USER MOD Single : C 41 SER OG : rot -145:sc= 0.256 USER MOD Single : C 49 LYS NZ :NH3+ 162:sc= -0.0561 (180deg=-0.357) USER MOD Single : C 50 LYS NZ :NH3+ -164:sc= 1.35 (180deg=0.749) USER MOD Single : C 52 ASN : amide:sc= 0.115 K(o=0.11,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 10 16.198 -12.415 3.086 1.00 0.00 N ATOM 2 CA GLN A 10 15.885 -11.107 2.475 1.00 0.00 C ATOM 3 C GLN A 10 14.762 -10.425 3.222 1.00 0.00 C ATOM 4 O GLN A 10 14.190 -10.980 4.164 1.00 0.00 O ATOM 5 CB GLN A 10 15.491 -11.266 1.010 1.00 0.00 C ATOM 6 CG GLN A 10 14.337 -12.218 0.803 1.00 0.00 C ATOM 7 CD GLN A 10 13.931 -12.358 -0.652 1.00 0.00 C ATOM 8 OE1 GLN A 10 14.077 -11.428 -1.448 1.00 0.00 O ATOM 9 NE2 GLN A 10 13.406 -13.520 -1.010 1.00 0.00 N ATOM 0 HA GLN A 10 16.784 -10.494 2.535 1.00 0.00 H new ATOM 0 HB2 GLN A 10 15.225 -10.290 0.604 1.00 0.00 H new ATOM 0 HB3 GLN A 10 16.353 -11.622 0.446 1.00 0.00 H new ATOM 0 HG2 GLN A 10 14.609 -13.199 1.194 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.480 -11.871 1.381 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.301 -14.266 -0.322 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.106 -13.669 -1.974 1.00 0.00 H new ATOM 18 N ARG A 11 14.450 -9.223 2.790 1.00 0.00 N ATOM 19 CA ARG A 11 13.383 -8.455 3.393 1.00 0.00 C ATOM 20 C ARG A 11 12.416 -7.958 2.330 1.00 0.00 C ATOM 21 O ARG A 11 12.816 -7.550 1.240 1.00 0.00 O ATOM 22 CB ARG A 11 13.942 -7.282 4.191 1.00 0.00 C ATOM 23 CG ARG A 11 14.612 -6.255 3.323 1.00 0.00 C ATOM 24 CD ARG A 11 15.026 -5.029 4.117 1.00 0.00 C ATOM 25 NE ARG A 11 15.939 -5.372 5.210 1.00 0.00 N ATOM 26 CZ ARG A 11 16.399 -4.500 6.106 1.00 0.00 C ATOM 27 NH1 ARG A 11 16.061 -3.220 6.027 1.00 0.00 N ATOM 28 NH2 ARG A 11 17.203 -4.909 7.078 1.00 0.00 N ATOM 0 H ARG A 11 14.924 -8.754 2.018 1.00 0.00 H new ATOM 0 HA ARG A 11 12.842 -9.108 4.078 1.00 0.00 H new ATOM 0 HB2 ARG A 11 13.133 -6.809 4.748 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.658 -7.655 4.924 1.00 0.00 H new ATOM 0 HG2 ARG A 11 15.490 -6.695 2.850 1.00 0.00 H new ATOM 0 HG3 ARG A 11 13.934 -5.958 2.523 1.00 0.00 H new ATOM 0 HD2 ARG A 11 15.507 -4.311 3.453 1.00 0.00 H new ATOM 0 HD3 ARG A 11 14.139 -4.542 4.523 1.00 0.00 H new ATOM 0 HE ARG A 11 16.243 -6.342 5.290 1.00 0.00 H new ATOM 0 HH11 ARG A 11 15.447 -2.900 5.278 1.00 0.00 H new ATOM 0 HH12 ARG A 11 16.415 -2.556 6.715 1.00 0.00 H new ATOM 0 HH21 ARG A 11 17.470 -5.892 7.140 1.00 0.00 H new ATOM 0 HH22 ARG A 11 17.555 -4.241 7.764 1.00 0.00 H new ATOM 42 N LEU A 12 11.146 -8.020 2.663 1.00 0.00 N ATOM 43 CA LEU A 12 10.075 -7.578 1.798 1.00 0.00 C ATOM 44 C LEU A 12 9.203 -6.598 2.541 1.00 0.00 C ATOM 45 O LEU A 12 9.447 -6.310 3.710 1.00 0.00 O ATOM 46 CB LEU A 12 9.218 -8.761 1.323 1.00 0.00 C ATOM 47 CG LEU A 12 9.839 -9.645 0.243 1.00 0.00 C ATOM 48 CD1 LEU A 12 10.500 -8.785 -0.807 1.00 0.00 C ATOM 49 CD2 LEU A 12 10.837 -10.628 0.830 1.00 0.00 C ATOM 0 H LEU A 12 10.823 -8.386 3.559 1.00 0.00 H new ATOM 0 HA LEU A 12 10.518 -7.102 0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.985 -9.385 2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.272 -8.371 0.946 1.00 0.00 H new ATOM 0 HG LEU A 12 9.041 -10.226 -0.218 1.00 0.00 H new ATOM 0 HD11 LEU A 12 10.941 -9.422 -1.574 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.757 -8.130 -1.262 1.00 0.00 H new ATOM 0 HD13 LEU A 12 11.281 -8.181 -0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 12 11.258 -11.240 0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.637 -10.080 1.328 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.333 -11.270 1.552 1.00 0.00 H new ATOM 61 N ALA A 13 8.193 -6.085 1.870 1.00 0.00 N ATOM 62 CA ALA A 13 7.275 -5.173 2.503 1.00 0.00 C ATOM 63 C ALA A 13 5.855 -5.678 2.406 1.00 0.00 C ATOM 64 O ALA A 13 5.351 -5.965 1.320 1.00 0.00 O ATOM 65 CB ALA A 13 7.380 -3.784 1.910 1.00 0.00 C ATOM 0 H ALA A 13 7.991 -6.285 0.891 1.00 0.00 H new ATOM 0 HA ALA A 13 7.550 -5.114 3.556 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.674 -3.121 2.410 1.00 0.00 H new ATOM 0 HB2 ALA A 13 8.393 -3.406 2.047 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.149 -3.824 0.846 1.00 0.00 H new ATOM 71 N ASN A 14 5.232 -5.802 3.554 1.00 0.00 N ATOM 72 CA ASN A 14 3.833 -6.147 3.636 1.00 0.00 C ATOM 73 C ASN A 14 3.026 -4.862 3.601 1.00 0.00 C ATOM 74 O ASN A 14 3.498 -3.818 4.052 1.00 0.00 O ATOM 75 CB ASN A 14 3.546 -6.915 4.931 1.00 0.00 C ATOM 76 CG ASN A 14 4.067 -8.348 4.924 1.00 0.00 C ATOM 77 OD1 ASN A 14 3.498 -9.227 5.570 1.00 0.00 O ATOM 78 ND2 ASN A 14 5.144 -8.601 4.198 1.00 0.00 N ATOM 0 H ASN A 14 5.682 -5.666 4.459 1.00 0.00 H new ATOM 0 HA ASN A 14 3.559 -6.788 2.798 1.00 0.00 H new ATOM 0 HB2 ASN A 14 3.995 -6.379 5.767 1.00 0.00 H new ATOM 0 HB3 ASN A 14 2.470 -6.930 5.103 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.525 -9.547 4.163 1.00 0.00 H new ATOM 0 HD22 ASN A 14 5.593 -7.850 3.673 1.00 0.00 H new ATOM 85 N PHE A 15 1.829 -4.915 3.055 1.00 0.00 N ATOM 86 CA PHE A 15 1.005 -3.728 2.989 1.00 0.00 C ATOM 87 C PHE A 15 -0.141 -3.845 3.977 1.00 0.00 C ATOM 88 O PHE A 15 -0.914 -4.800 3.937 1.00 0.00 O ATOM 89 CB PHE A 15 0.474 -3.508 1.571 1.00 0.00 C ATOM 90 CG PHE A 15 -0.043 -2.116 1.342 1.00 0.00 C ATOM 91 CD1 PHE A 15 0.817 -1.103 0.942 1.00 0.00 C ATOM 92 CD2 PHE A 15 -1.384 -1.814 1.532 1.00 0.00 C ATOM 93 CE1 PHE A 15 0.350 0.179 0.735 1.00 0.00 C ATOM 94 CE2 PHE A 15 -1.855 -0.532 1.325 1.00 0.00 C ATOM 95 CZ PHE A 15 -0.987 0.466 0.927 1.00 0.00 C ATOM 0 H PHE A 15 1.410 -5.755 2.656 1.00 0.00 H new ATOM 0 HA PHE A 15 1.615 -2.864 3.253 1.00 0.00 H new ATOM 0 HB2 PHE A 15 1.270 -3.715 0.856 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.325 -4.222 1.374 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.864 -1.320 0.791 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.067 -2.590 1.845 1.00 0.00 H new ATOM 0 HE1 PHE A 15 1.030 0.958 0.423 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -2.901 -0.310 1.474 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.353 1.469 0.766 1.00 0.00 H new ATOM 105 N LEU A 16 -0.227 -2.886 4.875 1.00 0.00 N ATOM 106 CA LEU A 16 -1.265 -2.879 5.886 1.00 0.00 C ATOM 107 C LEU A 16 -1.990 -1.547 5.847 1.00 0.00 C ATOM 108 O LEU A 16 -1.497 -0.580 5.268 1.00 0.00 O ATOM 109 CB LEU A 16 -0.681 -3.144 7.286 1.00 0.00 C ATOM 110 CG LEU A 16 -0.016 -1.952 7.993 1.00 0.00 C ATOM 111 CD1 LEU A 16 0.625 -2.400 9.297 1.00 0.00 C ATOM 112 CD2 LEU A 16 1.014 -1.289 7.111 1.00 0.00 C ATOM 0 H LEU A 16 0.415 -2.095 4.926 1.00 0.00 H new ATOM 0 HA LEU A 16 -1.972 -3.681 5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.483 -3.514 7.925 1.00 0.00 H new ATOM 0 HB3 LEU A 16 0.055 -3.944 7.202 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.795 -1.220 8.209 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.092 -1.545 9.786 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.138 -2.820 9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.382 -3.157 9.089 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.463 -0.451 7.643 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.788 -2.010 6.850 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.535 -0.926 6.202 1.00 0.00 H new ATOM 124 N VAL A 17 -3.154 -1.492 6.446 1.00 0.00 N ATOM 125 CA VAL A 17 -3.946 -0.287 6.408 1.00 0.00 C ATOM 126 C VAL A 17 -4.802 -0.125 7.657 1.00 0.00 C ATOM 127 O VAL A 17 -5.504 -1.048 8.076 1.00 0.00 O ATOM 128 CB VAL A 17 -4.833 -0.264 5.146 1.00 0.00 C ATOM 129 CG1 VAL A 17 -5.492 -1.601 4.912 1.00 0.00 C ATOM 130 CG2 VAL A 17 -5.882 0.817 5.251 1.00 0.00 C ATOM 0 H VAL A 17 -3.573 -2.264 6.964 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.253 0.554 6.374 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.187 -0.049 4.295 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.110 -1.550 4.015 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.727 -2.366 4.783 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -6.117 -1.854 5.769 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.497 0.816 4.351 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.512 0.630 6.121 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.396 1.787 5.357 1.00 0.00 H new ATOM 140 N HIS A 18 -4.719 1.056 8.254 1.00 0.00 N ATOM 141 CA HIS A 18 -5.592 1.419 9.354 1.00 0.00 C ATOM 142 C HIS A 18 -6.934 1.833 8.768 1.00 0.00 C ATOM 143 O HIS A 18 -7.063 2.923 8.211 1.00 0.00 O ATOM 144 CB HIS A 18 -4.990 2.558 10.184 1.00 0.00 C ATOM 145 CG HIS A 18 -5.688 2.787 11.496 1.00 0.00 C ATOM 146 ND1 HIS A 18 -6.553 3.836 11.722 1.00 0.00 N ATOM 147 CD2 HIS A 18 -5.637 2.094 12.657 1.00 0.00 C ATOM 148 CE1 HIS A 18 -7.002 3.774 12.963 1.00 0.00 C ATOM 149 NE2 HIS A 18 -6.461 2.726 13.550 1.00 0.00 N ATOM 0 H HIS A 18 -4.051 1.780 7.991 1.00 0.00 H new ATOM 0 HA HIS A 18 -5.717 0.568 10.023 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -3.939 2.340 10.375 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -5.023 3.478 9.600 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -5.053 1.205 12.845 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -7.695 4.465 13.419 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -6.628 2.433 14.513 1.00 0.00 H new ATOM 158 N SER A 19 -7.914 0.947 8.904 1.00 0.00 N ATOM 159 CA SER A 19 -9.198 1.044 8.208 1.00 0.00 C ATOM 160 C SER A 19 -9.842 2.435 8.272 1.00 0.00 C ATOM 161 O SER A 19 -10.576 2.823 7.357 1.00 0.00 O ATOM 162 CB SER A 19 -10.156 0.000 8.795 1.00 0.00 C ATOM 163 OG SER A 19 -11.429 0.041 8.174 1.00 0.00 O ATOM 0 H SER A 19 -7.841 0.129 9.508 1.00 0.00 H new ATOM 0 HA SER A 19 -9.002 0.857 7.152 1.00 0.00 H new ATOM 0 HB2 SER A 19 -9.726 -0.995 8.676 1.00 0.00 H new ATOM 0 HB3 SER A 19 -10.269 0.172 9.865 1.00 0.00 H new ATOM 0 HG SER A 19 -12.120 0.180 8.854 1.00 0.00 H new ATOM 169 N SER A 20 -9.566 3.187 9.327 1.00 0.00 N ATOM 170 CA SER A 20 -10.273 4.433 9.562 1.00 0.00 C ATOM 171 C SER A 20 -9.969 5.496 8.499 1.00 0.00 C ATOM 172 O SER A 20 -10.895 6.020 7.879 1.00 0.00 O ATOM 173 CB SER A 20 -9.916 4.957 10.949 1.00 0.00 C ATOM 174 OG SER A 20 -9.997 3.917 11.910 1.00 0.00 O ATOM 0 H SER A 20 -8.862 2.957 10.029 1.00 0.00 H new ATOM 0 HA SER A 20 -11.341 4.226 9.499 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.908 5.373 10.939 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.592 5.767 11.223 1.00 0.00 H new ATOM 0 HG SER A 20 -10.677 3.268 11.633 1.00 0.00 H new ATOM 180 N ASN A 21 -8.694 5.824 8.269 1.00 0.00 N ATOM 181 CA ASN A 21 -8.383 6.878 7.298 1.00 0.00 C ATOM 182 C ASN A 21 -7.234 6.547 6.341 1.00 0.00 C ATOM 183 O ASN A 21 -7.274 6.946 5.175 1.00 0.00 O ATOM 184 CB ASN A 21 -8.066 8.202 8.008 1.00 0.00 C ATOM 185 CG ASN A 21 -9.281 8.835 8.662 1.00 0.00 C ATOM 186 OD1 ASN A 21 -10.037 9.569 8.020 1.00 0.00 O ATOM 187 ND2 ASN A 21 -9.463 8.579 9.947 1.00 0.00 N ATOM 0 H ASN A 21 -7.888 5.394 8.722 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.285 6.966 6.693 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -7.303 8.027 8.766 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -7.644 8.902 7.287 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -10.252 8.994 10.443 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -8.815 7.966 10.442 1.00 0.00 H new ATOM 194 N ASN A 22 -6.224 5.813 6.794 1.00 0.00 N ATOM 195 CA ASN A 22 -4.959 5.766 6.048 1.00 0.00 C ATOM 196 C ASN A 22 -4.415 4.356 5.854 1.00 0.00 C ATOM 197 O ASN A 22 -4.524 3.500 6.729 1.00 0.00 O ATOM 198 CB ASN A 22 -3.887 6.606 6.757 1.00 0.00 C ATOM 199 CG ASN A 22 -4.183 8.099 6.783 1.00 0.00 C ATOM 200 OD1 ASN A 22 -3.808 8.795 7.726 1.00 0.00 O ATOM 201 ND2 ASN A 22 -4.836 8.611 5.747 1.00 0.00 N ATOM 0 H ASN A 22 -6.246 5.255 7.648 1.00 0.00 H new ATOM 0 HA ASN A 22 -5.186 6.171 5.062 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -3.781 6.250 7.782 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -2.929 6.445 6.263 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -5.041 9.610 5.716 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -5.133 8.006 4.982 1.00 0.00 H new ATOM 208 N PHE A 23 -3.808 4.147 4.690 1.00 0.00 N ATOM 209 CA PHE A 23 -3.085 2.931 4.374 1.00 0.00 C ATOM 210 C PHE A 23 -1.592 3.146 4.614 1.00 0.00 C ATOM 211 O PHE A 23 -1.096 4.264 4.465 1.00 0.00 O ATOM 212 CB PHE A 23 -3.347 2.548 2.911 1.00 0.00 C ATOM 213 CG PHE A 23 -3.425 3.724 1.964 1.00 0.00 C ATOM 214 CD1 PHE A 23 -2.312 4.145 1.242 1.00 0.00 C ATOM 215 CD2 PHE A 23 -4.619 4.416 1.802 1.00 0.00 C ATOM 216 CE1 PHE A 23 -2.395 5.228 0.386 1.00 0.00 C ATOM 217 CE2 PHE A 23 -4.703 5.496 0.945 1.00 0.00 C ATOM 218 CZ PHE A 23 -3.590 5.903 0.238 1.00 0.00 C ATOM 0 H PHE A 23 -3.808 4.830 3.933 1.00 0.00 H new ATOM 0 HA PHE A 23 -3.427 2.120 5.016 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.555 1.878 2.576 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.281 1.989 2.856 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -1.374 3.621 1.351 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -5.494 4.105 2.354 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -1.524 5.546 -0.167 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -5.639 6.022 0.828 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.654 6.749 -0.430 1.00 0.00 H new ATOM 228 N GLY A 24 -0.878 2.093 4.994 1.00 0.00 N ATOM 229 CA GLY A 24 0.535 2.240 5.279 1.00 0.00 C ATOM 230 C GLY A 24 1.372 1.106 4.727 1.00 0.00 C ATOM 231 O GLY A 24 0.913 0.339 3.884 1.00 0.00 O ATOM 0 H GLY A 24 -1.248 1.150 5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.888 3.182 4.860 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.678 2.298 6.358 1.00 0.00 H new ATOM 235 N ALA A 25 2.596 0.991 5.219 1.00 0.00 N ATOM 236 CA ALA A 25 3.518 -0.029 4.758 1.00 0.00 C ATOM 237 C ALA A 25 4.292 -0.586 5.928 1.00 0.00 C ATOM 238 O ALA A 25 4.277 -0.017 7.012 1.00 0.00 O ATOM 239 CB ALA A 25 4.456 0.530 3.693 1.00 0.00 C ATOM 0 H ALA A 25 2.974 1.600 5.945 1.00 0.00 H new ATOM 0 HA ALA A 25 2.949 -0.839 4.302 1.00 0.00 H new ATOM 0 HB1 ALA A 25 5.139 -0.253 3.362 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.872 0.885 2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 25 5.029 1.358 4.111 1.00 0.00 H new ATOM 245 N ILE A 26 4.924 -1.722 5.723 1.00 0.00 N ATOM 246 CA ILE A 26 5.713 -2.346 6.762 1.00 0.00 C ATOM 247 C ILE A 26 6.691 -3.346 6.167 1.00 0.00 C ATOM 248 O ILE A 26 6.331 -4.148 5.310 1.00 0.00 O ATOM 249 CB ILE A 26 4.818 -3.031 7.810 1.00 0.00 C ATOM 250 CG1 ILE A 26 5.676 -3.754 8.842 1.00 0.00 C ATOM 251 CG2 ILE A 26 3.840 -3.997 7.155 1.00 0.00 C ATOM 252 CD1 ILE A 26 4.890 -4.196 10.037 1.00 0.00 C ATOM 0 H ILE A 26 4.906 -2.234 4.841 1.00 0.00 H new ATOM 0 HA ILE A 26 6.279 -1.561 7.264 1.00 0.00 H new ATOM 0 HB ILE A 26 4.235 -2.260 8.314 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.142 -4.623 8.377 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.482 -3.095 9.165 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.222 -4.465 7.922 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.203 -3.453 6.458 1.00 0.00 H new ATOM 0 HG23 ILE A 26 4.394 -4.766 6.616 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.551 -4.705 10.739 1.00 0.00 H new ATOM 0 HD12 ILE A 26 4.445 -3.327 10.522 1.00 0.00 H new ATOM 0 HD13 ILE A 26 4.101 -4.879 9.721 1.00 0.00 H new ATOM 264 N LEU A 27 7.926 -3.287 6.612 1.00 0.00 N ATOM 265 CA LEU A 27 8.941 -4.205 6.145 1.00 0.00 C ATOM 266 C LEU A 27 8.954 -5.466 6.976 1.00 0.00 C ATOM 267 O LEU A 27 8.498 -5.487 8.117 1.00 0.00 O ATOM 268 CB LEU A 27 10.317 -3.563 6.156 1.00 0.00 C ATOM 269 CG LEU A 27 10.577 -2.580 5.022 1.00 0.00 C ATOM 270 CD1 LEU A 27 12.009 -2.134 5.047 1.00 0.00 C ATOM 271 CD2 LEU A 27 10.283 -3.205 3.677 1.00 0.00 C ATOM 0 H LEU A 27 8.253 -2.609 7.300 1.00 0.00 H new ATOM 0 HA LEU A 27 8.692 -4.465 5.116 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.452 -3.044 7.105 1.00 0.00 H new ATOM 0 HB3 LEU A 27 11.069 -4.351 6.114 1.00 0.00 H new ATOM 0 HG LEU A 27 9.916 -1.726 5.166 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.186 -1.431 4.233 1.00 0.00 H new ATOM 0 HD12 LEU A 27 12.222 -1.647 5.999 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.662 -2.999 4.928 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.478 -2.479 2.888 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.921 -4.077 3.534 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.237 -3.510 3.639 1.00 0.00 H new ATOM 283 N SER A 28 9.425 -6.528 6.369 1.00 0.00 N ATOM 284 CA SER A 28 9.460 -7.823 7.011 1.00 0.00 C ATOM 285 C SER A 28 10.715 -8.583 6.605 1.00 0.00 C ATOM 286 O SER A 28 10.944 -8.844 5.422 1.00 0.00 O ATOM 287 CB SER A 28 8.207 -8.618 6.648 1.00 0.00 C ATOM 288 OG SER A 28 7.033 -7.945 7.082 1.00 0.00 O ATOM 0 H SER A 28 9.794 -6.521 5.418 1.00 0.00 H new ATOM 0 HA SER A 28 9.483 -7.682 8.092 1.00 0.00 H new ATOM 0 HB2 SER A 28 8.167 -8.768 5.569 1.00 0.00 H new ATOM 0 HB3 SER A 28 8.254 -9.606 7.105 1.00 0.00 H new ATOM 0 HG SER A 28 6.244 -8.472 6.837 1.00 0.00 H new ATOM 294 N SER A 29 11.534 -8.899 7.590 1.00 0.00 N ATOM 295 CA SER A 29 12.751 -9.660 7.368 1.00 0.00 C ATOM 296 C SER A 29 12.626 -11.030 8.019 1.00 0.00 C ATOM 297 O SER A 29 12.760 -12.066 7.365 1.00 0.00 O ATOM 298 CB SER A 29 13.949 -8.909 7.951 1.00 0.00 C ATOM 299 OG SER A 29 14.091 -7.625 7.362 1.00 0.00 O ATOM 0 H SER A 29 11.376 -8.637 8.563 1.00 0.00 H new ATOM 0 HA SER A 29 12.903 -9.788 6.296 1.00 0.00 H new ATOM 0 HB2 SER A 29 13.826 -8.805 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 29 14.858 -9.488 7.788 1.00 0.00 H new ATOM 0 HG SER A 29 14.864 -7.168 7.756 1.00 0.00 H new ATOM 305 N THR A 30 12.361 -11.018 9.314 1.00 0.00 N ATOM 306 CA THR A 30 12.162 -12.234 10.076 1.00 0.00 C ATOM 307 C THR A 30 10.675 -12.467 10.330 1.00 0.00 C ATOM 308 O THR A 30 10.036 -11.593 10.957 1.00 0.00 O ATOM 309 CB THR A 30 12.917 -12.173 11.416 1.00 0.00 C ATOM 310 OG1 THR A 30 12.653 -10.922 12.072 1.00 0.00 O ATOM 311 CG2 THR A 30 14.415 -12.336 11.203 1.00 0.00 C ATOM 0 H THR A 30 12.278 -10.164 9.865 1.00 0.00 H new ATOM 0 HA THR A 30 12.558 -13.065 9.492 1.00 0.00 H new ATOM 0 HB THR A 30 12.566 -12.992 12.043 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.693 -10.728 12.032 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.926 -12.289 12.164 1.00 0.00 H new ATOM 0 HG22 THR A 30 14.613 -13.299 10.733 1.00 0.00 H new ATOM 0 HG23 THR A 30 14.780 -11.536 10.559 1.00 0.00 H new TER 319 THR A 30 ATOM 320 N GLY B 13 -13.678 0.668 9.668 1.00 0.00 N ATOM 321 CA GLY B 13 -13.372 0.173 11.030 1.00 0.00 C ATOM 322 C GLY B 13 -12.156 0.857 11.615 1.00 0.00 C ATOM 323 O GLY B 13 -11.675 1.848 11.066 1.00 0.00 O ATOM 0 HA2 GLY B 13 -14.231 0.341 11.679 1.00 0.00 H new ATOM 0 HA3 GLY B 13 -13.203 -0.903 10.996 1.00 0.00 H new ATOM 327 N GLY B 14 -11.652 0.335 12.721 1.00 0.00 N ATOM 328 CA GLY B 14 -10.498 0.935 13.359 1.00 0.00 C ATOM 329 C GLY B 14 -9.306 0.001 13.415 1.00 0.00 C ATOM 330 O GLY B 14 -8.255 0.358 13.948 1.00 0.00 O ATOM 0 H GLY B 14 -12.020 -0.493 13.189 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -10.220 1.840 12.819 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.765 1.237 14.372 1.00 0.00 H new ATOM 334 N GLU B 15 -9.459 -1.196 12.865 1.00 0.00 N ATOM 335 CA GLU B 15 -8.383 -2.172 12.882 1.00 0.00 C ATOM 336 C GLU B 15 -7.413 -1.910 11.738 1.00 0.00 C ATOM 337 O GLU B 15 -7.738 -1.204 10.777 1.00 0.00 O ATOM 338 CB GLU B 15 -8.936 -3.594 12.771 1.00 0.00 C ATOM 339 CG GLU B 15 -9.543 -3.908 11.411 1.00 0.00 C ATOM 340 CD GLU B 15 -9.952 -5.360 11.275 1.00 0.00 C ATOM 341 OE1 GLU B 15 -11.161 -5.652 11.399 1.00 0.00 O ATOM 342 OE2 GLU B 15 -9.074 -6.215 11.048 1.00 0.00 O ATOM 0 H GLU B 15 -10.313 -1.511 12.405 1.00 0.00 H new ATOM 0 HA GLU B 15 -7.855 -2.075 13.831 1.00 0.00 H new ATOM 0 HB2 GLU B 15 -8.134 -4.304 12.974 1.00 0.00 H new ATOM 0 HB3 GLU B 15 -9.694 -3.741 13.540 1.00 0.00 H new ATOM 0 HG2 GLU B 15 -10.414 -3.273 11.251 1.00 0.00 H new ATOM 0 HG3 GLU B 15 -8.822 -3.663 10.631 1.00 0.00 H new ATOM 349 N ILE B 16 -6.221 -2.462 11.857 1.00 0.00 N ATOM 350 CA ILE B 16 -5.242 -2.404 10.793 1.00 0.00 C ATOM 351 C ILE B 16 -5.186 -3.743 10.084 1.00 0.00 C ATOM 352 O ILE B 16 -4.840 -4.757 10.690 1.00 0.00 O ATOM 353 CB ILE B 16 -3.847 -2.057 11.341 1.00 0.00 C ATOM 354 CG1 ILE B 16 -3.909 -0.750 12.124 1.00 0.00 C ATOM 355 CG2 ILE B 16 -2.837 -1.958 10.209 1.00 0.00 C ATOM 356 CD1 ILE B 16 -2.632 -0.419 12.855 1.00 0.00 C ATOM 0 H ILE B 16 -5.907 -2.960 12.690 1.00 0.00 H new ATOM 0 HA ILE B 16 -5.541 -1.623 10.094 1.00 0.00 H new ATOM 0 HB ILE B 16 -3.524 -2.853 12.012 1.00 0.00 H new ATOM 0 HG12 ILE B 16 -4.145 0.063 11.438 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -4.725 -0.807 12.844 1.00 0.00 H new ATOM 0 HG21 ILE B 16 -1.857 -1.712 10.617 1.00 0.00 H new ATOM 0 HG22 ILE B 16 -2.783 -2.912 9.685 1.00 0.00 H new ATOM 0 HG23 ILE B 16 -3.146 -1.179 9.512 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -2.752 0.524 13.389 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -2.404 -1.212 13.567 1.00 0.00 H new ATOM 0 HD13 ILE B 16 -1.816 -0.329 12.139 1.00 0.00 H new ATOM 368 N VAL B 17 -5.546 -3.759 8.814 1.00 0.00 N ATOM 369 CA VAL B 17 -5.536 -4.997 8.062 1.00 0.00 C ATOM 370 C VAL B 17 -4.291 -5.129 7.211 1.00 0.00 C ATOM 371 O VAL B 17 -3.970 -4.260 6.403 1.00 0.00 O ATOM 372 CB VAL B 17 -6.792 -5.193 7.186 1.00 0.00 C ATOM 373 CG1 VAL B 17 -7.919 -5.767 8.022 1.00 0.00 C ATOM 374 CG2 VAL B 17 -7.242 -3.907 6.523 1.00 0.00 C ATOM 0 H VAL B 17 -5.846 -2.938 8.288 1.00 0.00 H new ATOM 0 HA VAL B 17 -5.538 -5.786 8.814 1.00 0.00 H new ATOM 0 HB VAL B 17 -6.527 -5.890 6.391 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.802 -5.903 7.398 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -7.614 -6.729 8.433 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -8.153 -5.082 8.837 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -8.128 -4.100 5.919 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -7.478 -3.167 7.287 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -6.444 -3.528 5.885 1.00 0.00 H new ATOM 384 N TYR B 18 -3.577 -6.213 7.442 1.00 0.00 N ATOM 385 CA TYR B 18 -2.426 -6.578 6.639 1.00 0.00 C ATOM 386 C TYR B 18 -2.876 -7.383 5.428 1.00 0.00 C ATOM 387 O TYR B 18 -3.480 -8.449 5.573 1.00 0.00 O ATOM 388 CB TYR B 18 -1.435 -7.431 7.443 1.00 0.00 C ATOM 389 CG TYR B 18 -0.837 -6.766 8.665 1.00 0.00 C ATOM 390 CD1 TYR B 18 -1.525 -6.733 9.872 1.00 0.00 C ATOM 391 CD2 TYR B 18 0.432 -6.201 8.620 1.00 0.00 C ATOM 392 CE1 TYR B 18 -0.965 -6.157 10.997 1.00 0.00 C ATOM 393 CE2 TYR B 18 0.995 -5.622 9.737 1.00 0.00 C ATOM 394 CZ TYR B 18 0.295 -5.603 10.924 1.00 0.00 C ATOM 395 OH TYR B 18 0.856 -5.028 12.042 1.00 0.00 O ATOM 0 H TYR B 18 -3.780 -6.869 8.196 1.00 0.00 H new ATOM 0 HA TYR B 18 -1.935 -5.656 6.327 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -1.942 -8.342 7.760 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -0.623 -7.732 6.781 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -2.513 -7.164 9.932 1.00 0.00 H new ATOM 0 HD2 TYR B 18 0.987 -6.216 7.693 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -1.512 -6.141 11.928 1.00 0.00 H new ATOM 0 HE2 TYR B 18 1.981 -5.185 9.682 1.00 0.00 H new ATOM 0 HH TYR B 18 1.747 -4.686 11.821 1.00 0.00 H new ATOM 405 N LEU B 19 -2.606 -6.875 4.244 1.00 0.00 N ATOM 406 CA LEU B 19 -2.851 -7.631 3.028 1.00 0.00 C ATOM 407 C LEU B 19 -1.634 -7.544 2.109 1.00 0.00 C ATOM 408 O LEU B 19 -1.575 -6.723 1.197 1.00 0.00 O ATOM 409 CB LEU B 19 -4.114 -7.118 2.321 1.00 0.00 C ATOM 410 CG LEU B 19 -4.315 -5.611 2.350 1.00 0.00 C ATOM 411 CD1 LEU B 19 -4.893 -5.180 1.033 1.00 0.00 C ATOM 412 CD2 LEU B 19 -5.240 -5.207 3.492 1.00 0.00 C ATOM 0 H LEU B 19 -2.217 -5.944 4.095 1.00 0.00 H new ATOM 0 HA LEU B 19 -3.015 -8.677 3.286 1.00 0.00 H new ATOM 0 HB2 LEU B 19 -4.084 -7.443 1.281 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -4.983 -7.592 2.778 1.00 0.00 H new ATOM 0 HG LEU B 19 -3.355 -5.121 2.514 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -5.043 -4.100 1.038 1.00 0.00 H new ATOM 0 HD12 LEU B 19 -4.207 -5.447 0.229 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -5.849 -5.679 0.875 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -5.368 -4.125 3.491 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -6.210 -5.687 3.362 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -4.805 -5.520 4.441 1.00 0.00 H new ATOM 424 N PRO B 20 -0.647 -8.423 2.342 1.00 0.00 N ATOM 425 CA PRO B 20 0.593 -8.460 1.575 1.00 0.00 C ATOM 426 C PRO B 20 0.534 -9.414 0.391 1.00 0.00 C ATOM 427 O PRO B 20 1.433 -9.436 -0.449 1.00 0.00 O ATOM 428 CB PRO B 20 1.585 -8.971 2.608 1.00 0.00 C ATOM 429 CG PRO B 20 0.791 -9.916 3.452 1.00 0.00 C ATOM 430 CD PRO B 20 -0.644 -9.442 3.411 1.00 0.00 C ATOM 0 HA PRO B 20 0.837 -7.493 1.135 1.00 0.00 H new ATOM 0 HB2 PRO B 20 2.428 -9.474 2.134 1.00 0.00 H new ATOM 0 HB3 PRO B 20 1.994 -8.155 3.203 1.00 0.00 H new ATOM 0 HG2 PRO B 20 0.872 -10.934 3.072 1.00 0.00 H new ATOM 0 HG3 PRO B 20 1.165 -9.927 4.476 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -1.329 -10.259 3.187 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -0.954 -9.020 4.367 1.00 0.00 H new ATOM 438 N ASN B 21 -0.532 -10.196 0.324 1.00 0.00 N ATOM 439 CA ASN B 21 -0.620 -11.267 -0.661 1.00 0.00 C ATOM 440 C ASN B 21 -1.244 -10.760 -1.943 1.00 0.00 C ATOM 441 O ASN B 21 -1.539 -11.531 -2.851 1.00 0.00 O ATOM 442 CB ASN B 21 -1.422 -12.456 -0.125 1.00 0.00 C ATOM 443 CG ASN B 21 -0.808 -13.067 1.119 1.00 0.00 C ATOM 444 OD1 ASN B 21 0.398 -12.976 1.343 1.00 0.00 O ATOM 445 ND2 ASN B 21 -1.635 -13.704 1.930 1.00 0.00 N ATOM 0 H ASN B 21 -1.344 -10.112 0.935 1.00 0.00 H new ATOM 0 HA ASN B 21 0.395 -11.607 -0.868 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -2.438 -12.131 0.099 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -1.495 -13.218 -0.901 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -1.279 -14.143 2.779 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -2.629 -13.756 1.707 1.00 0.00 H new ATOM 452 N LEU B 22 -1.437 -9.458 -2.014 1.00 0.00 N ATOM 453 CA LEU B 22 -2.016 -8.850 -3.191 1.00 0.00 C ATOM 454 C LEU B 22 -1.003 -8.763 -4.307 1.00 0.00 C ATOM 455 O LEU B 22 0.194 -8.981 -4.113 1.00 0.00 O ATOM 456 CB LEU B 22 -2.518 -7.439 -2.898 1.00 0.00 C ATOM 457 CG LEU B 22 -3.694 -7.331 -1.940 1.00 0.00 C ATOM 458 CD1 LEU B 22 -4.297 -5.951 -2.023 1.00 0.00 C ATOM 459 CD2 LEU B 22 -4.746 -8.364 -2.236 1.00 0.00 C ATOM 0 H LEU B 22 -1.201 -8.802 -1.269 1.00 0.00 H new ATOM 0 HA LEU B 22 -2.852 -9.482 -3.491 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -1.690 -6.858 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -2.801 -6.973 -3.842 1.00 0.00 H new ATOM 0 HG LEU B 22 -3.321 -7.511 -0.932 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -5.139 -5.880 -1.334 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -3.545 -5.209 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -4.643 -5.766 -3.040 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -5.570 -8.256 -1.531 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -5.116 -8.225 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -4.315 -9.360 -2.140 1.00 0.00 H new ATOM 471 N ASN B 23 -1.502 -8.436 -5.474 1.00 0.00 N ATOM 472 CA ASN B 23 -0.646 -8.104 -6.597 1.00 0.00 C ATOM 473 C ASN B 23 -0.410 -6.607 -6.578 1.00 0.00 C ATOM 474 O ASN B 23 -1.224 -5.876 -6.009 1.00 0.00 O ATOM 475 CB ASN B 23 -1.288 -8.504 -7.931 1.00 0.00 C ATOM 476 CG ASN B 23 -1.487 -9.998 -8.071 1.00 0.00 C ATOM 477 OD1 ASN B 23 -0.710 -10.792 -7.548 1.00 0.00 O ATOM 478 ND2 ASN B 23 -2.541 -10.389 -8.770 1.00 0.00 N ATOM 0 H ASN B 23 -2.501 -8.391 -5.676 1.00 0.00 H new ATOM 0 HA ASN B 23 0.292 -8.652 -6.506 1.00 0.00 H new ATOM 0 HB2 ASN B 23 -2.252 -8.005 -8.027 1.00 0.00 H new ATOM 0 HB3 ASN B 23 -0.662 -8.149 -8.749 1.00 0.00 H new ATOM 0 HD21 ASN B 23 -2.733 -11.384 -8.891 1.00 0.00 H new ATOM 0 HD22 ASN B 23 -3.161 -9.696 -9.188 1.00 0.00 H new ATOM 485 N PRO B 24 0.685 -6.114 -7.165 1.00 0.00 N ATOM 486 CA PRO B 24 0.891 -4.673 -7.313 1.00 0.00 C ATOM 487 C PRO B 24 -0.319 -4.029 -7.972 1.00 0.00 C ATOM 488 O PRO B 24 -0.784 -2.965 -7.561 1.00 0.00 O ATOM 489 CB PRO B 24 2.118 -4.584 -8.222 1.00 0.00 C ATOM 490 CG PRO B 24 2.860 -5.850 -7.970 1.00 0.00 C ATOM 491 CD PRO B 24 1.811 -6.896 -7.708 1.00 0.00 C ATOM 0 HA PRO B 24 1.029 -4.157 -6.363 1.00 0.00 H new ATOM 0 HB2 PRO B 24 1.830 -4.494 -9.270 1.00 0.00 H new ATOM 0 HB3 PRO B 24 2.727 -3.712 -7.983 1.00 0.00 H new ATOM 0 HG2 PRO B 24 3.475 -6.120 -8.828 1.00 0.00 H new ATOM 0 HG3 PRO B 24 3.531 -5.747 -7.117 1.00 0.00 H new ATOM 0 HD2 PRO B 24 1.532 -7.424 -8.620 1.00 0.00 H new ATOM 0 HD3 PRO B 24 2.159 -7.647 -6.999 1.00 0.00 H new ATOM 499 N ASP B 25 -0.837 -4.727 -8.974 1.00 0.00 N ATOM 500 CA ASP B 25 -2.058 -4.340 -9.667 1.00 0.00 C ATOM 501 C ASP B 25 -3.217 -4.220 -8.683 1.00 0.00 C ATOM 502 O ASP B 25 -3.988 -3.266 -8.731 1.00 0.00 O ATOM 503 CB ASP B 25 -2.409 -5.386 -10.727 1.00 0.00 C ATOM 504 CG ASP B 25 -1.223 -5.774 -11.584 1.00 0.00 C ATOM 505 OD1 ASP B 25 -0.397 -6.592 -11.121 1.00 0.00 O ATOM 506 OD2 ASP B 25 -1.113 -5.274 -12.721 1.00 0.00 O ATOM 0 H ASP B 25 -0.418 -5.585 -9.332 1.00 0.00 H new ATOM 0 HA ASP B 25 -1.890 -3.374 -10.142 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -2.803 -6.276 -10.236 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -3.202 -4.997 -11.366 1.00 0.00 H new ATOM 511 N GLN B 26 -3.318 -5.188 -7.777 1.00 0.00 N ATOM 512 CA GLN B 26 -4.409 -5.223 -6.809 1.00 0.00 C ATOM 513 C GLN B 26 -4.308 -4.072 -5.813 1.00 0.00 C ATOM 514 O GLN B 26 -5.304 -3.415 -5.532 1.00 0.00 O ATOM 515 CB GLN B 26 -4.459 -6.573 -6.082 1.00 0.00 C ATOM 516 CG GLN B 26 -5.054 -7.692 -6.927 1.00 0.00 C ATOM 517 CD GLN B 26 -5.175 -9.009 -6.180 1.00 0.00 C ATOM 518 OE1 GLN B 26 -6.169 -9.267 -5.510 1.00 0.00 O ATOM 519 NE2 GLN B 26 -4.182 -9.870 -6.319 1.00 0.00 N ATOM 0 H GLN B 26 -2.656 -5.960 -7.693 1.00 0.00 H new ATOM 0 HA GLN B 26 -5.341 -5.102 -7.361 1.00 0.00 H new ATOM 0 HB2 GLN B 26 -3.450 -6.853 -5.780 1.00 0.00 H new ATOM 0 HB3 GLN B 26 -5.046 -6.465 -5.170 1.00 0.00 H new ATOM 0 HG2 GLN B 26 -6.041 -7.389 -7.277 1.00 0.00 H new ATOM 0 HG3 GLN B 26 -4.434 -7.839 -7.811 1.00 0.00 H new ATOM 0 HE21 GLN B 26 -3.369 -9.624 -6.884 1.00 0.00 H new ATOM 0 HE22 GLN B 26 -4.229 -10.781 -5.862 1.00 0.00 H new ATOM 528 N LEU B 27 -3.111 -3.820 -5.278 1.00 0.00 N ATOM 529 CA LEU B 27 -2.905 -2.656 -4.418 1.00 0.00 C ATOM 530 C LEU B 27 -3.185 -1.377 -5.187 1.00 0.00 C ATOM 531 O LEU B 27 -3.814 -0.458 -4.667 1.00 0.00 O ATOM 532 CB LEU B 27 -1.481 -2.618 -3.847 1.00 0.00 C ATOM 533 CG LEU B 27 -1.155 -3.711 -2.839 1.00 0.00 C ATOM 534 CD1 LEU B 27 0.312 -3.672 -2.470 1.00 0.00 C ATOM 535 CD2 LEU B 27 -2.010 -3.542 -1.601 1.00 0.00 C ATOM 0 H LEU B 27 -2.282 -4.397 -5.423 1.00 0.00 H new ATOM 0 HA LEU B 27 -3.601 -2.738 -3.583 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -0.774 -2.686 -4.674 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -1.323 -1.650 -3.372 1.00 0.00 H new ATOM 0 HG LEU B 27 -1.371 -4.679 -3.291 1.00 0.00 H new ATOM 0 HD11 LEU B 27 0.527 -4.460 -1.749 1.00 0.00 H new ATOM 0 HD12 LEU B 27 0.916 -3.824 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU B 27 0.551 -2.703 -2.031 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -1.771 -4.328 -0.884 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -1.812 -2.569 -1.152 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -3.063 -3.608 -1.874 1.00 0.00 H new ATOM 547 N CYS B 28 -2.725 -1.336 -6.429 1.00 0.00 N ATOM 548 CA CYS B 28 -2.974 -0.203 -7.304 1.00 0.00 C ATOM 549 C CYS B 28 -4.472 0.048 -7.419 1.00 0.00 C ATOM 550 O CYS B 28 -4.941 1.164 -7.211 1.00 0.00 O ATOM 551 CB CYS B 28 -2.374 -0.475 -8.686 1.00 0.00 C ATOM 552 SG CYS B 28 -2.393 0.956 -9.815 1.00 0.00 S ATOM 0 H CYS B 28 -2.173 -2.081 -6.855 1.00 0.00 H new ATOM 0 HA CYS B 28 -2.503 0.685 -6.883 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -1.344 -0.809 -8.561 1.00 0.00 H new ATOM 0 HB3 CYS B 28 -2.921 -1.295 -9.150 1.00 0.00 H new ATOM 557 N ALA B 29 -5.215 -1.013 -7.718 1.00 0.00 N ATOM 558 CA ALA B 29 -6.663 -0.939 -7.857 1.00 0.00 C ATOM 559 C ALA B 29 -7.336 -0.565 -6.538 1.00 0.00 C ATOM 560 O ALA B 29 -8.177 0.332 -6.494 1.00 0.00 O ATOM 561 CB ALA B 29 -7.206 -2.267 -8.365 1.00 0.00 C ATOM 0 H ALA B 29 -4.830 -1.945 -7.870 1.00 0.00 H new ATOM 0 HA ALA B 29 -6.890 -0.155 -8.579 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -8.289 -2.202 -8.466 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.764 -2.494 -9.335 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -6.954 -3.057 -7.658 1.00 0.00 H new ATOM 567 N PHE B 30 -6.947 -1.247 -5.466 1.00 0.00 N ATOM 568 CA PHE B 30 -7.551 -1.049 -4.158 1.00 0.00 C ATOM 569 C PHE B 30 -7.337 0.380 -3.661 1.00 0.00 C ATOM 570 O PHE B 30 -8.292 1.063 -3.288 1.00 0.00 O ATOM 571 CB PHE B 30 -6.978 -2.083 -3.179 1.00 0.00 C ATOM 572 CG PHE B 30 -6.935 -1.639 -1.749 1.00 0.00 C ATOM 573 CD1 PHE B 30 -8.095 -1.488 -1.010 1.00 0.00 C ATOM 574 CD2 PHE B 30 -5.719 -1.380 -1.144 1.00 0.00 C ATOM 575 CE1 PHE B 30 -8.041 -1.082 0.308 1.00 0.00 C ATOM 576 CE2 PHE B 30 -5.656 -0.974 0.174 1.00 0.00 C ATOM 577 CZ PHE B 30 -6.821 -0.825 0.903 1.00 0.00 C ATOM 0 H PHE B 30 -6.207 -1.949 -5.481 1.00 0.00 H new ATOM 0 HA PHE B 30 -8.629 -1.195 -4.232 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -7.574 -2.993 -3.244 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -5.967 -2.341 -3.495 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -9.052 -1.690 -1.469 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -4.807 -1.497 -1.710 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -8.953 -0.965 0.875 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -4.700 -0.773 0.634 1.00 0.00 H new ATOM 0 HZ PHE B 30 -6.778 -0.509 1.935 1.00 0.00 H new ATOM 587 N ILE B 31 -6.094 0.838 -3.686 1.00 0.00 N ATOM 588 CA ILE B 31 -5.765 2.176 -3.216 1.00 0.00 C ATOM 589 C ILE B 31 -6.410 3.231 -4.106 1.00 0.00 C ATOM 590 O ILE B 31 -6.865 4.277 -3.635 1.00 0.00 O ATOM 591 CB ILE B 31 -4.238 2.381 -3.156 1.00 0.00 C ATOM 592 CG1 ILE B 31 -3.625 1.384 -2.171 1.00 0.00 C ATOM 593 CG2 ILE B 31 -3.901 3.809 -2.752 1.00 0.00 C ATOM 594 CD1 ILE B 31 -2.122 1.276 -2.269 1.00 0.00 C ATOM 0 H ILE B 31 -5.296 0.302 -4.027 1.00 0.00 H new ATOM 0 HA ILE B 31 -6.162 2.285 -2.207 1.00 0.00 H new ATOM 0 HB ILE B 31 -3.819 2.206 -4.147 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -3.893 1.678 -1.156 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -4.063 0.401 -2.344 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -2.818 3.931 -2.716 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -4.320 4.502 -3.481 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -4.323 4.018 -1.769 1.00 0.00 H new ATOM 0 HD11 ILE B 31 -1.761 0.550 -1.540 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -1.845 0.951 -3.272 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -1.673 2.248 -2.066 1.00 0.00 H new ATOM 606 N HIS B 32 -6.475 2.925 -5.390 1.00 0.00 N ATOM 607 CA HIS B 32 -7.118 3.800 -6.358 1.00 0.00 C ATOM 608 C HIS B 32 -8.597 3.949 -6.016 1.00 0.00 C ATOM 609 O HIS B 32 -9.115 5.061 -5.955 1.00 0.00 O ATOM 610 CB HIS B 32 -6.955 3.237 -7.777 1.00 0.00 C ATOM 611 CG HIS B 32 -7.302 4.195 -8.880 1.00 0.00 C ATOM 612 ND1 HIS B 32 -6.915 4.001 -10.189 1.00 0.00 N ATOM 613 CD2 HIS B 32 -8.001 5.354 -8.869 1.00 0.00 C ATOM 614 CE1 HIS B 32 -7.360 4.998 -10.930 1.00 0.00 C ATOM 615 NE2 HIS B 32 -8.023 5.833 -10.153 1.00 0.00 N ATOM 0 H HIS B 32 -6.087 2.070 -5.790 1.00 0.00 H new ATOM 0 HA HIS B 32 -6.643 4.780 -6.319 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -5.922 2.914 -7.908 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -7.581 2.350 -7.875 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -8.458 5.817 -8.007 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -7.207 5.111 -11.993 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -8.477 6.694 -10.458 1.00 0.00 H new ATOM 624 N SER B 33 -9.261 2.827 -5.760 1.00 0.00 N ATOM 625 CA SER B 33 -10.690 2.836 -5.478 1.00 0.00 C ATOM 626 C SER B 33 -11.009 3.501 -4.135 1.00 0.00 C ATOM 627 O SER B 33 -12.139 3.917 -3.908 1.00 0.00 O ATOM 628 CB SER B 33 -11.255 1.414 -5.530 1.00 0.00 C ATOM 629 OG SER B 33 -10.517 0.522 -4.710 1.00 0.00 O ATOM 0 H SER B 33 -8.832 1.902 -5.742 1.00 0.00 H new ATOM 0 HA SER B 33 -11.172 3.434 -6.252 1.00 0.00 H new ATOM 0 HB2 SER B 33 -12.297 1.425 -5.209 1.00 0.00 H new ATOM 0 HB3 SER B 33 -11.243 1.056 -6.559 1.00 0.00 H new ATOM 0 HG SER B 33 -9.832 1.021 -4.218 1.00 0.00 H new ATOM 635 N ILE B 34 -10.018 3.609 -3.252 1.00 0.00 N ATOM 636 CA ILE B 34 -10.209 4.322 -1.989 1.00 0.00 C ATOM 637 C ILE B 34 -10.346 5.812 -2.244 1.00 0.00 C ATOM 638 O ILE B 34 -11.195 6.482 -1.667 1.00 0.00 O ATOM 639 CB ILE B 34 -9.036 4.107 -1.009 1.00 0.00 C ATOM 640 CG1 ILE B 34 -8.889 2.624 -0.658 1.00 0.00 C ATOM 641 CG2 ILE B 34 -9.240 4.941 0.255 1.00 0.00 C ATOM 642 CD1 ILE B 34 -10.101 2.039 0.041 1.00 0.00 C ATOM 0 H ILE B 34 -9.085 3.218 -3.384 1.00 0.00 H new ATOM 0 HA ILE B 34 -11.117 3.919 -1.539 1.00 0.00 H new ATOM 0 HB ILE B 34 -8.117 4.434 -1.495 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -8.701 2.061 -1.572 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -8.015 2.496 -0.019 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -8.405 4.779 0.937 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -9.292 5.997 -0.010 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -10.169 4.643 0.742 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -9.923 0.986 0.258 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -10.278 2.576 0.973 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -10.974 2.134 -0.604 1.00 0.00 H new ATOM 654 N HIS B 35 -9.494 6.326 -3.108 1.00 0.00 N ATOM 655 CA HIS B 35 -9.505 7.740 -3.426 1.00 0.00 C ATOM 656 C HIS B 35 -10.626 8.042 -4.409 1.00 0.00 C ATOM 657 O HIS B 35 -11.209 9.126 -4.394 1.00 0.00 O ATOM 658 CB HIS B 35 -8.156 8.149 -4.008 1.00 0.00 C ATOM 659 CG HIS B 35 -7.977 9.633 -4.129 1.00 0.00 C ATOM 660 ND1 HIS B 35 -8.086 10.314 -5.322 1.00 0.00 N ATOM 661 CD2 HIS B 35 -7.691 10.569 -3.191 1.00 0.00 C ATOM 662 CE1 HIS B 35 -7.875 11.600 -5.113 1.00 0.00 C ATOM 663 NE2 HIS B 35 -7.635 11.781 -3.830 1.00 0.00 N ATOM 0 H HIS B 35 -8.785 5.785 -3.603 1.00 0.00 H new ATOM 0 HA HIS B 35 -9.680 8.313 -2.515 1.00 0.00 H new ATOM 0 HB2 HIS B 35 -7.362 7.746 -3.379 1.00 0.00 H new ATOM 0 HB3 HIS B 35 -8.043 7.697 -4.993 1.00 0.00 H new ATOM 0 HD2 HIS B 35 -7.536 10.393 -2.137 1.00 0.00 H new ATOM 0 HE1 HIS B 35 -7.896 12.374 -5.866 1.00 0.00 H new ATOM 0 HE2 HIS B 35 -7.439 12.677 -3.384 1.00 0.00 H new ATOM 672 N ASP B 36 -10.914 7.071 -5.256 1.00 0.00 N ATOM 673 CA ASP B 36 -11.980 7.192 -6.241 1.00 0.00 C ATOM 674 C ASP B 36 -13.346 7.128 -5.558 1.00 0.00 C ATOM 675 O ASP B 36 -14.215 7.966 -5.807 1.00 0.00 O ATOM 676 CB ASP B 36 -11.847 6.085 -7.286 1.00 0.00 C ATOM 677 CG ASP B 36 -12.783 6.268 -8.458 1.00 0.00 C ATOM 678 OD1 ASP B 36 -13.726 5.466 -8.599 1.00 0.00 O ATOM 679 OD2 ASP B 36 -12.566 7.202 -9.257 1.00 0.00 O ATOM 0 H ASP B 36 -10.420 6.179 -5.283 1.00 0.00 H new ATOM 0 HA ASP B 36 -11.895 8.157 -6.740 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -10.820 6.056 -7.649 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -12.046 5.122 -6.815 1.00 0.00 H new ATOM 684 N ASP B 37 -13.528 6.133 -4.695 1.00 0.00 N ATOM 685 CA ASP B 37 -14.729 6.016 -3.895 1.00 0.00 C ATOM 686 C ASP B 37 -14.381 6.038 -2.408 1.00 0.00 C ATOM 687 O ASP B 37 -14.322 4.992 -1.758 1.00 0.00 O ATOM 688 CB ASP B 37 -15.463 4.722 -4.228 1.00 0.00 C ATOM 689 CG ASP B 37 -16.544 4.919 -5.271 1.00 0.00 C ATOM 690 OD1 ASP B 37 -16.448 4.319 -6.359 1.00 0.00 O ATOM 691 OD2 ASP B 37 -17.499 5.681 -5.010 1.00 0.00 O ATOM 0 H ASP B 37 -12.846 5.391 -4.535 1.00 0.00 H new ATOM 0 HA ASP B 37 -15.376 6.863 -4.123 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -14.746 3.984 -4.588 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -15.909 4.317 -3.320 1.00 0.00 H new ATOM 696 N PRO B 38 -14.168 7.236 -1.840 1.00 0.00 N ATOM 697 CA PRO B 38 -13.706 7.379 -0.456 1.00 0.00 C ATOM 698 C PRO B 38 -14.800 7.101 0.561 1.00 0.00 C ATOM 699 O PRO B 38 -14.541 6.965 1.758 1.00 0.00 O ATOM 700 CB PRO B 38 -13.267 8.835 -0.395 1.00 0.00 C ATOM 701 CG PRO B 38 -14.150 9.528 -1.373 1.00 0.00 C ATOM 702 CD PRO B 38 -14.362 8.546 -2.494 1.00 0.00 C ATOM 0 HA PRO B 38 -12.919 6.666 -0.209 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.386 9.245 0.608 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -12.216 8.945 -0.661 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -15.098 9.810 -0.914 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -13.687 10.445 -1.738 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -15.359 8.637 -2.925 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.649 8.701 -3.304 1.00 0.00 H new ATOM 710 N SER B 39 -16.026 7.034 0.085 1.00 0.00 N ATOM 711 CA SER B 39 -17.146 6.677 0.938 1.00 0.00 C ATOM 712 C SER B 39 -17.280 5.159 1.002 1.00 0.00 C ATOM 713 O SER B 39 -17.566 4.595 2.060 1.00 0.00 O ATOM 714 CB SER B 39 -18.447 7.309 0.432 1.00 0.00 C ATOM 715 OG SER B 39 -19.475 7.217 1.406 1.00 0.00 O ATOM 0 H SER B 39 -16.275 7.221 -0.886 1.00 0.00 H new ATOM 0 HA SER B 39 -16.956 7.063 1.940 1.00 0.00 H new ATOM 0 HB2 SER B 39 -18.273 8.355 0.181 1.00 0.00 H new ATOM 0 HB3 SER B 39 -18.764 6.810 -0.484 1.00 0.00 H new ATOM 0 HG SER B 39 -20.293 7.629 1.058 1.00 0.00 H new ATOM 721 N GLN B 40 -17.033 4.499 -0.128 1.00 0.00 N ATOM 722 CA GLN B 40 -17.140 3.052 -0.207 1.00 0.00 C ATOM 723 C GLN B 40 -15.908 2.371 0.375 1.00 0.00 C ATOM 724 O GLN B 40 -15.874 1.149 0.463 1.00 0.00 O ATOM 725 CB GLN B 40 -17.318 2.586 -1.653 1.00 0.00 C ATOM 726 CG GLN B 40 -18.448 3.259 -2.398 1.00 0.00 C ATOM 727 CD GLN B 40 -18.792 2.543 -3.691 1.00 0.00 C ATOM 728 OE1 GLN B 40 -18.639 1.328 -3.801 1.00 0.00 O ATOM 729 NE2 GLN B 40 -19.256 3.286 -4.679 1.00 0.00 N ATOM 0 H GLN B 40 -16.757 4.949 -1.001 1.00 0.00 H new ATOM 0 HA GLN B 40 -18.018 2.772 0.376 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -16.388 2.762 -2.194 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -17.490 1.510 -1.655 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -19.331 3.295 -1.759 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -18.172 4.290 -2.619 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -19.370 4.292 -4.551 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -19.501 2.854 -5.570 1.00 0.00 H new ATOM 738 N SER B 41 -14.890 3.164 0.728 1.00 0.00 N ATOM 739 CA SER B 41 -13.601 2.648 1.205 1.00 0.00 C ATOM 740 C SER B 41 -13.759 1.471 2.173 1.00 0.00 C ATOM 741 O SER B 41 -12.999 0.505 2.108 1.00 0.00 O ATOM 742 CB SER B 41 -12.808 3.773 1.874 1.00 0.00 C ATOM 743 OG SER B 41 -13.543 4.355 2.937 1.00 0.00 O ATOM 0 H SER B 41 -14.936 4.182 0.691 1.00 0.00 H new ATOM 0 HA SER B 41 -13.060 2.276 0.335 1.00 0.00 H new ATOM 0 HB2 SER B 41 -11.864 3.381 2.253 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.563 4.537 1.136 1.00 0.00 H new ATOM 0 HG SER B 41 -13.923 5.209 2.643 1.00 0.00 H new ATOM 749 N ALA B 42 -14.760 1.560 3.048 1.00 0.00 N ATOM 750 CA ALA B 42 -15.077 0.498 4.001 1.00 0.00 C ATOM 751 C ALA B 42 -15.239 -0.852 3.307 1.00 0.00 C ATOM 752 O ALA B 42 -14.809 -1.887 3.816 1.00 0.00 O ATOM 753 CB ALA B 42 -16.357 0.842 4.735 1.00 0.00 C ATOM 0 H ALA B 42 -15.374 2.371 3.116 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.248 0.420 4.704 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.593 0.050 5.446 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.228 1.783 5.270 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -17.172 0.941 4.018 1.00 0.00 H new ATOM 759 N ASN B 43 -15.871 -0.836 2.151 1.00 0.00 N ATOM 760 CA ASN B 43 -16.086 -2.050 1.378 1.00 0.00 C ATOM 761 C ASN B 43 -14.868 -2.365 0.515 1.00 0.00 C ATOM 762 O ASN B 43 -14.511 -3.527 0.340 1.00 0.00 O ATOM 763 CB ASN B 43 -17.329 -1.922 0.497 1.00 0.00 C ATOM 764 CG ASN B 43 -17.687 -3.227 -0.190 1.00 0.00 C ATOM 765 OD1 ASN B 43 -17.228 -3.513 -1.297 1.00 0.00 O ATOM 766 ND2 ASN B 43 -18.514 -4.030 0.464 1.00 0.00 N ATOM 0 H ASN B 43 -16.248 0.009 1.721 1.00 0.00 H new ATOM 0 HA ASN B 43 -16.239 -2.869 2.081 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -18.171 -1.592 1.106 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -17.160 -1.152 -0.256 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -18.792 -4.921 0.052 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -18.873 -3.757 1.379 1.00 0.00 H new ATOM 773 N LEU B 44 -14.219 -1.331 -0.013 1.00 0.00 N ATOM 774 CA LEU B 44 -13.046 -1.528 -0.859 1.00 0.00 C ATOM 775 C LEU B 44 -11.919 -2.231 -0.104 1.00 0.00 C ATOM 776 O LEU B 44 -11.243 -3.093 -0.664 1.00 0.00 O ATOM 777 CB LEU B 44 -12.537 -0.208 -1.458 1.00 0.00 C ATOM 778 CG LEU B 44 -13.310 0.327 -2.678 1.00 0.00 C ATOM 779 CD1 LEU B 44 -13.724 -0.802 -3.605 1.00 0.00 C ATOM 780 CD2 LEU B 44 -14.522 1.127 -2.258 1.00 0.00 C ATOM 0 H LEU B 44 -14.483 -0.356 0.128 1.00 0.00 H new ATOM 0 HA LEU B 44 -13.365 -2.170 -1.681 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -12.558 0.553 -0.678 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.494 -0.341 -1.745 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.635 0.989 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -14.268 -0.393 -4.457 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.836 -1.326 -3.959 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -14.366 -1.499 -3.066 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -15.044 1.489 -3.144 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -15.192 0.494 -1.676 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -14.206 1.975 -1.651 1.00 0.00 H new ATOM 792 N LEU B 45 -11.717 -1.894 1.170 1.00 0.00 N ATOM 793 CA LEU B 45 -10.665 -2.556 1.933 1.00 0.00 C ATOM 794 C LEU B 45 -11.186 -3.871 2.502 1.00 0.00 C ATOM 795 O LEU B 45 -10.411 -4.736 2.904 1.00 0.00 O ATOM 796 CB LEU B 45 -10.088 -1.658 3.042 1.00 0.00 C ATOM 797 CG LEU B 45 -10.713 -1.800 4.431 1.00 0.00 C ATOM 798 CD1 LEU B 45 -9.701 -1.427 5.499 1.00 0.00 C ATOM 799 CD2 LEU B 45 -11.941 -0.923 4.566 1.00 0.00 C ATOM 0 H LEU B 45 -12.250 -1.190 1.680 1.00 0.00 H new ATOM 0 HA LEU B 45 -9.841 -2.765 1.250 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -9.021 -1.863 3.126 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -10.189 -0.619 2.727 1.00 0.00 H new ATOM 0 HG LEU B 45 -11.013 -2.840 4.562 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -10.156 -1.532 6.484 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -8.836 -2.087 5.427 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -9.383 -0.395 5.354 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -12.366 -1.043 5.563 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -11.662 0.120 4.413 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -12.680 -1.214 3.819 1.00 0.00 H new ATOM 811 N ALA B 46 -12.508 -4.014 2.520 1.00 0.00 N ATOM 812 CA ALA B 46 -13.140 -5.276 2.885 1.00 0.00 C ATOM 813 C ALA B 46 -12.791 -6.331 1.854 1.00 0.00 C ATOM 814 O ALA B 46 -12.458 -7.472 2.182 1.00 0.00 O ATOM 815 CB ALA B 46 -14.649 -5.116 2.961 1.00 0.00 C ATOM 0 H ALA B 46 -13.163 -3.268 2.285 1.00 0.00 H new ATOM 0 HA ALA B 46 -12.773 -5.582 3.865 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -15.103 -6.069 3.235 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -14.898 -4.366 3.712 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.030 -4.798 1.991 1.00 0.00 H new ATOM 821 N GLU B 47 -12.878 -5.924 0.597 1.00 0.00 N ATOM 822 CA GLU B 47 -12.504 -6.767 -0.523 1.00 0.00 C ATOM 823 C GLU B 47 -11.057 -7.165 -0.409 1.00 0.00 C ATOM 824 O GLU B 47 -10.720 -8.333 -0.536 1.00 0.00 O ATOM 825 CB GLU B 47 -12.714 -6.021 -1.832 1.00 0.00 C ATOM 826 CG GLU B 47 -14.129 -5.541 -2.015 1.00 0.00 C ATOM 827 CD GLU B 47 -15.101 -6.669 -2.284 1.00 0.00 C ATOM 828 OE1 GLU B 47 -15.630 -7.254 -1.315 1.00 0.00 O ATOM 829 OE2 GLU B 47 -15.348 -6.970 -3.473 1.00 0.00 O ATOM 0 H GLU B 47 -13.211 -4.998 0.327 1.00 0.00 H new ATOM 0 HA GLU B 47 -13.130 -7.660 -0.509 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -12.039 -5.166 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -12.447 -6.674 -2.663 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -14.443 -5.002 -1.121 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -14.163 -4.833 -2.843 1.00 0.00 H new ATOM 836 N ALA B 48 -10.211 -6.181 -0.151 1.00 0.00 N ATOM 837 CA ALA B 48 -8.776 -6.405 -0.052 1.00 0.00 C ATOM 838 C ALA B 48 -8.436 -7.503 0.952 1.00 0.00 C ATOM 839 O ALA B 48 -7.503 -8.277 0.737 1.00 0.00 O ATOM 840 CB ALA B 48 -8.058 -5.129 0.311 1.00 0.00 C ATOM 0 H ALA B 48 -10.495 -5.212 -0.005 1.00 0.00 H new ATOM 0 HA ALA B 48 -8.437 -6.736 -1.033 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -6.987 -5.321 0.379 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -8.244 -4.376 -0.455 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -8.424 -4.766 1.272 1.00 0.00 H new ATOM 846 N LYS B 49 -9.203 -7.570 2.039 1.00 0.00 N ATOM 847 CA LYS B 49 -9.015 -8.607 3.053 1.00 0.00 C ATOM 848 C LYS B 49 -9.275 -9.989 2.456 1.00 0.00 C ATOM 849 O LYS B 49 -8.610 -10.967 2.799 1.00 0.00 O ATOM 850 CB LYS B 49 -9.959 -8.389 4.236 1.00 0.00 C ATOM 851 CG LYS B 49 -9.825 -7.042 4.920 1.00 0.00 C ATOM 852 CD LYS B 49 -10.964 -6.834 5.902 1.00 0.00 C ATOM 853 CE LYS B 49 -11.139 -5.374 6.275 1.00 0.00 C ATOM 854 NZ LYS B 49 -12.309 -5.176 7.168 1.00 0.00 N ATOM 0 H LYS B 49 -9.961 -6.918 2.240 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.984 -8.547 3.402 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -10.986 -8.503 3.889 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -9.783 -9.173 4.972 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -8.870 -6.985 5.443 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.828 -6.246 4.175 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -11.890 -7.210 5.467 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.776 -7.418 6.803 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -10.237 -5.013 6.770 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -11.266 -4.779 5.370 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -12.399 -4.167 7.403 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -13.172 -5.498 6.686 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -12.176 -5.725 8.041 1.00 0.00 H new ATOM 868 N LYS B 50 -10.253 -10.059 1.561 1.00 0.00 N ATOM 869 CA LYS B 50 -10.582 -11.298 0.881 1.00 0.00 C ATOM 870 C LYS B 50 -9.639 -11.511 -0.296 1.00 0.00 C ATOM 871 O LYS B 50 -9.379 -12.639 -0.710 1.00 0.00 O ATOM 872 CB LYS B 50 -12.031 -11.247 0.399 1.00 0.00 C ATOM 873 CG LYS B 50 -13.055 -11.195 1.525 1.00 0.00 C ATOM 874 CD LYS B 50 -12.986 -12.438 2.401 1.00 0.00 C ATOM 875 CE LYS B 50 -14.099 -12.463 3.437 1.00 0.00 C ATOM 876 NZ LYS B 50 -14.016 -11.324 4.392 1.00 0.00 N ATOM 0 H LYS B 50 -10.833 -9.265 1.291 1.00 0.00 H new ATOM 0 HA LYS B 50 -10.468 -12.132 1.573 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -12.161 -10.372 -0.238 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -12.229 -12.123 -0.219 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -12.881 -10.309 2.135 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -14.056 -11.101 1.104 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -13.053 -13.328 1.775 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -12.020 -12.474 2.905 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -15.063 -12.438 2.930 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -14.054 -13.401 3.991 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -14.755 -11.424 5.117 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -13.081 -11.321 4.848 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -14.154 -10.430 3.879 1.00 0.00 H new ATOM 890 N LEU B 51 -9.127 -10.408 -0.820 1.00 0.00 N ATOM 891 CA LEU B 51 -8.179 -10.424 -1.913 1.00 0.00 C ATOM 892 C LEU B 51 -6.875 -11.100 -1.486 1.00 0.00 C ATOM 893 O LEU B 51 -6.452 -12.079 -2.107 1.00 0.00 O ATOM 894 CB LEU B 51 -7.902 -8.994 -2.368 1.00 0.00 C ATOM 895 CG LEU B 51 -8.559 -8.544 -3.671 1.00 0.00 C ATOM 896 CD1 LEU B 51 -10.082 -8.521 -3.558 1.00 0.00 C ATOM 897 CD2 LEU B 51 -8.032 -7.175 -4.085 1.00 0.00 C ATOM 0 H LEU B 51 -9.362 -9.471 -0.493 1.00 0.00 H new ATOM 0 HA LEU B 51 -8.604 -10.992 -2.740 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -8.222 -8.318 -1.575 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.824 -8.874 -2.473 1.00 0.00 H new ATOM 0 HG LEU B 51 -8.299 -9.270 -4.441 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -10.512 -8.196 -4.505 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -10.444 -9.521 -3.319 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -10.378 -7.830 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -8.509 -6.867 -5.015 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -8.256 -6.448 -3.305 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.953 -7.229 -4.231 1.00 0.00 H new ATOM 909 N ASN B 52 -6.228 -10.580 -0.431 1.00 0.00 N ATOM 910 CA ASN B 52 -5.010 -11.211 0.094 1.00 0.00 C ATOM 911 C ASN B 52 -5.282 -12.639 0.570 1.00 0.00 C ATOM 912 O ASN B 52 -4.364 -13.450 0.668 1.00 0.00 O ATOM 913 CB ASN B 52 -4.399 -10.397 1.243 1.00 0.00 C ATOM 914 CG ASN B 52 -5.180 -10.495 2.546 1.00 0.00 C ATOM 915 OD1 ASN B 52 -6.065 -9.689 2.814 1.00 0.00 O ATOM 916 ND2 ASN B 52 -4.844 -11.471 3.379 1.00 0.00 N ATOM 0 H ASN B 52 -6.522 -9.740 0.067 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.296 -11.242 -0.729 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -3.378 -10.738 1.415 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -4.339 -9.351 0.943 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -5.326 -11.568 4.273 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -4.103 -12.125 3.126 1.00 0.00 H new ATOM 923 N ASP B 53 -6.538 -12.934 0.875 1.00 0.00 N ATOM 924 CA ASP B 53 -6.921 -14.266 1.331 1.00 0.00 C ATOM 925 C ASP B 53 -7.018 -15.231 0.152 1.00 0.00 C ATOM 926 O ASP B 53 -6.653 -16.402 0.260 1.00 0.00 O ATOM 927 CB ASP B 53 -8.256 -14.202 2.078 1.00 0.00 C ATOM 928 CG ASP B 53 -8.703 -15.553 2.601 1.00 0.00 C ATOM 929 OD1 ASP B 53 -8.223 -15.971 3.676 1.00 0.00 O ATOM 930 OD2 ASP B 53 -9.552 -16.196 1.951 1.00 0.00 O ATOM 0 H ASP B 53 -7.310 -12.270 0.815 1.00 0.00 H new ATOM 0 HA ASP B 53 -6.153 -14.634 2.012 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -8.167 -13.506 2.912 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -9.021 -13.804 1.411 1.00 0.00 H new ATOM 935 N ALA B 54 -7.488 -14.725 -0.979 1.00 0.00 N ATOM 936 CA ALA B 54 -7.644 -15.537 -2.179 1.00 0.00 C ATOM 937 C ALA B 54 -6.296 -15.862 -2.811 1.00 0.00 C ATOM 938 O ALA B 54 -6.125 -16.916 -3.424 1.00 0.00 O ATOM 939 CB ALA B 54 -8.537 -14.824 -3.181 1.00 0.00 C ATOM 0 H ALA B 54 -7.769 -13.751 -1.092 1.00 0.00 H new ATOM 0 HA ALA B 54 -8.112 -16.478 -1.889 1.00 0.00 H new ATOM 0 HB1 ALA B 54 -8.646 -15.440 -4.074 1.00 0.00 H new ATOM 0 HB2 ALA B 54 -9.517 -14.652 -2.737 1.00 0.00 H new ATOM 0 HB3 ALA B 54 -8.089 -13.868 -3.452 1.00 0.00 H new ATOM 945 N GLN B 55 -5.339 -14.959 -2.652 1.00 0.00 N ATOM 946 CA GLN B 55 -4.019 -15.138 -3.242 1.00 0.00 C ATOM 947 C GLN B 55 -3.044 -15.716 -2.213 1.00 0.00 C ATOM 948 O GLN B 55 -1.828 -15.717 -2.410 1.00 0.00 O ATOM 949 CB GLN B 55 -3.505 -13.803 -3.792 1.00 0.00 C ATOM 950 CG GLN B 55 -2.325 -13.936 -4.744 1.00 0.00 C ATOM 951 CD GLN B 55 -2.669 -14.711 -5.999 1.00 0.00 C ATOM 952 OE1 GLN B 55 -3.808 -14.687 -6.467 1.00 0.00 O ATOM 953 NE2 GLN B 55 -1.691 -15.408 -6.552 1.00 0.00 N ATOM 0 H GLN B 55 -5.451 -14.096 -2.120 1.00 0.00 H new ATOM 0 HA GLN B 55 -4.095 -15.846 -4.067 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -4.320 -13.297 -4.310 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -3.214 -13.166 -2.957 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -1.973 -12.942 -5.021 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -1.503 -14.433 -4.229 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -0.761 -15.402 -6.134 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -1.867 -15.952 -7.397 1.00 0.00 H new ATOM 962 N ALA B 56 -3.591 -16.213 -1.117 1.00 0.00 N ATOM 963 CA ALA B 56 -2.799 -16.842 -0.082 1.00 0.00 C ATOM 964 C ALA B 56 -2.439 -18.265 -0.492 1.00 0.00 C ATOM 965 O ALA B 56 -3.362 -19.097 -0.629 1.00 0.00 O ATOM 966 CB ALA B 56 -3.580 -16.836 1.215 1.00 0.00 C ATOM 0 H ALA B 56 -4.592 -16.191 -0.923 1.00 0.00 H new ATOM 0 HA ALA B 56 -1.872 -16.287 0.061 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.988 -17.309 1.998 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.804 -15.808 1.500 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.511 -17.387 1.082 1.00 0.00 H new TER 972 ALA B 56 ATOM 973 N GLY C 13 14.361 -3.125 9.276 1.00 0.00 N ATOM 974 CA GLY C 13 13.837 -4.393 8.710 1.00 0.00 C ATOM 975 C GLY C 13 12.702 -4.954 9.540 1.00 0.00 C ATOM 976 O GLY C 13 12.882 -5.923 10.280 1.00 0.00 O ATOM 0 HA2 GLY C 13 13.491 -4.220 7.691 1.00 0.00 H new ATOM 0 HA3 GLY C 13 14.642 -5.126 8.653 1.00 0.00 H new ATOM 980 N GLY C 14 11.535 -4.339 9.426 1.00 0.00 N ATOM 981 CA GLY C 14 10.384 -4.782 10.184 1.00 0.00 C ATOM 982 C GLY C 14 9.635 -3.632 10.814 1.00 0.00 C ATOM 983 O GLY C 14 8.715 -3.838 11.604 1.00 0.00 O ATOM 0 H GLY C 14 11.364 -3.537 8.819 1.00 0.00 H new ATOM 0 HA2 GLY C 14 9.711 -5.335 9.529 1.00 0.00 H new ATOM 0 HA3 GLY C 14 10.708 -5.472 10.963 1.00 0.00 H new ATOM 987 N GLU C 15 10.032 -2.419 10.469 1.00 0.00 N ATOM 988 CA GLU C 15 9.363 -1.230 10.957 1.00 0.00 C ATOM 989 C GLU C 15 8.097 -0.959 10.165 1.00 0.00 C ATOM 990 O GLU C 15 7.950 -1.406 9.023 1.00 0.00 O ATOM 991 CB GLU C 15 10.284 -0.006 10.896 1.00 0.00 C ATOM 992 CG GLU C 15 10.946 0.239 9.549 1.00 0.00 C ATOM 993 CD GLU C 15 12.133 -0.670 9.279 1.00 0.00 C ATOM 994 OE1 GLU C 15 11.935 -1.787 8.761 1.00 0.00 O ATOM 995 OE2 GLU C 15 13.276 -0.277 9.591 1.00 0.00 O ATOM 0 H GLU C 15 10.820 -2.234 9.848 1.00 0.00 H new ATOM 0 HA GLU C 15 9.098 -1.411 11.999 1.00 0.00 H new ATOM 0 HB2 GLU C 15 9.706 0.878 11.165 1.00 0.00 H new ATOM 0 HB3 GLU C 15 11.063 -0.119 11.650 1.00 0.00 H new ATOM 0 HG2 GLU C 15 10.207 0.101 8.760 1.00 0.00 H new ATOM 0 HG3 GLU C 15 11.275 1.277 9.499 1.00 0.00 H new ATOM 1002 N ILE C 16 7.192 -0.224 10.783 1.00 0.00 N ATOM 1003 CA ILE C 16 5.937 0.140 10.145 1.00 0.00 C ATOM 1004 C ILE C 16 6.070 1.530 9.551 1.00 0.00 C ATOM 1005 O ILE C 16 6.435 2.475 10.252 1.00 0.00 O ATOM 1006 CB ILE C 16 4.750 0.117 11.131 1.00 0.00 C ATOM 1007 CG1 ILE C 16 4.707 -1.216 11.881 1.00 0.00 C ATOM 1008 CG2 ILE C 16 3.443 0.359 10.385 1.00 0.00 C ATOM 1009 CD1 ILE C 16 3.415 -1.456 12.633 1.00 0.00 C ATOM 0 H ILE C 16 7.302 0.135 11.731 1.00 0.00 H new ATOM 0 HA ILE C 16 5.732 -0.597 9.368 1.00 0.00 H new ATOM 0 HB ILE C 16 4.883 0.915 11.861 1.00 0.00 H new ATOM 0 HG12 ILE C 16 4.857 -2.027 11.169 1.00 0.00 H new ATOM 0 HG13 ILE C 16 5.538 -1.252 12.585 1.00 0.00 H new ATOM 0 HG21 ILE C 16 2.612 0.341 11.091 1.00 0.00 H new ATOM 0 HG22 ILE C 16 3.480 1.331 9.893 1.00 0.00 H new ATOM 0 HG23 ILE C 16 3.301 -0.421 9.637 1.00 0.00 H new ATOM 0 HD11 ILE C 16 3.462 -2.421 13.138 1.00 0.00 H new ATOM 0 HD12 ILE C 16 3.271 -0.667 13.371 1.00 0.00 H new ATOM 0 HD13 ILE C 16 2.580 -1.454 11.932 1.00 0.00 H new ATOM 1021 N VAL C 17 5.779 1.661 8.268 1.00 0.00 N ATOM 1022 CA VAL C 17 6.063 2.887 7.551 1.00 0.00 C ATOM 1023 C VAL C 17 4.816 3.381 6.814 1.00 0.00 C ATOM 1024 O VAL C 17 4.534 2.957 5.699 1.00 0.00 O ATOM 1025 CB VAL C 17 7.229 2.661 6.557 1.00 0.00 C ATOM 1026 CG1 VAL C 17 7.564 3.921 5.797 1.00 0.00 C ATOM 1027 CG2 VAL C 17 8.460 2.140 7.267 1.00 0.00 C ATOM 0 H VAL C 17 5.346 0.931 7.703 1.00 0.00 H new ATOM 0 HA VAL C 17 6.358 3.652 8.269 1.00 0.00 H new ATOM 0 HB VAL C 17 6.896 1.910 5.841 1.00 0.00 H new ATOM 0 HG11 VAL C 17 8.386 3.723 5.110 1.00 0.00 H new ATOM 0 HG12 VAL C 17 6.691 4.249 5.233 1.00 0.00 H new ATOM 0 HG13 VAL C 17 7.857 4.702 6.499 1.00 0.00 H new ATOM 0 HG21 VAL C 17 9.262 1.991 6.544 1.00 0.00 H new ATOM 0 HG22 VAL C 17 8.779 2.862 8.019 1.00 0.00 H new ATOM 0 HG23 VAL C 17 8.227 1.191 7.751 1.00 0.00 H new ATOM 1037 N TYR C 18 4.060 4.264 7.456 1.00 0.00 N ATOM 1038 CA TYR C 18 2.821 4.781 6.876 1.00 0.00 C ATOM 1039 C TYR C 18 3.083 5.951 5.937 1.00 0.00 C ATOM 1040 O TYR C 18 3.758 6.916 6.301 1.00 0.00 O ATOM 1041 CB TYR C 18 1.847 5.211 7.975 1.00 0.00 C ATOM 1042 CG TYR C 18 0.838 4.148 8.338 1.00 0.00 C ATOM 1043 CD1 TYR C 18 -0.505 4.311 8.020 1.00 0.00 C ATOM 1044 CD2 TYR C 18 1.223 2.981 8.983 1.00 0.00 C ATOM 1045 CE1 TYR C 18 -1.434 3.342 8.339 1.00 0.00 C ATOM 1046 CE2 TYR C 18 0.299 2.008 9.306 1.00 0.00 C ATOM 1047 CZ TYR C 18 -1.027 2.193 8.980 1.00 0.00 C ATOM 1048 OH TYR C 18 -1.948 1.227 9.299 1.00 0.00 O ATOM 0 H TYR C 18 4.281 4.638 8.379 1.00 0.00 H new ATOM 0 HA TYR C 18 2.376 3.972 6.297 1.00 0.00 H new ATOM 0 HB2 TYR C 18 2.414 5.481 8.866 1.00 0.00 H new ATOM 0 HB3 TYR C 18 1.318 6.107 7.650 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -0.827 5.210 7.515 1.00 0.00 H new ATOM 0 HD2 TYR C 18 2.262 2.832 9.236 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -2.475 3.484 8.087 1.00 0.00 H new ATOM 0 HE2 TYR C 18 0.613 1.107 9.811 1.00 0.00 H new ATOM 0 HH TYR C 18 -1.498 0.481 9.747 1.00 0.00 H new ATOM 1058 N LEU C 19 2.550 5.851 4.723 1.00 0.00 N ATOM 1059 CA LEU C 19 2.688 6.905 3.725 1.00 0.00 C ATOM 1060 C LEU C 19 1.320 7.318 3.193 1.00 0.00 C ATOM 1061 O LEU C 19 0.920 6.920 2.100 1.00 0.00 O ATOM 1062 CB LEU C 19 3.593 6.457 2.565 1.00 0.00 C ATOM 1063 CG LEU C 19 5.091 6.518 2.841 1.00 0.00 C ATOM 1064 CD1 LEU C 19 5.501 5.508 3.880 1.00 0.00 C ATOM 1065 CD2 LEU C 19 5.856 6.277 1.571 1.00 0.00 C ATOM 0 H LEU C 19 2.014 5.043 4.405 1.00 0.00 H new ATOM 0 HA LEU C 19 3.154 7.764 4.209 1.00 0.00 H new ATOM 0 HB2 LEU C 19 3.332 5.433 2.298 1.00 0.00 H new ATOM 0 HB3 LEU C 19 3.376 7.079 1.696 1.00 0.00 H new ATOM 0 HG LEU C 19 5.320 7.512 3.225 1.00 0.00 H new ATOM 0 HD11 LEU C 19 6.575 5.579 4.052 1.00 0.00 H new ATOM 0 HD12 LEU C 19 4.970 5.708 4.811 1.00 0.00 H new ATOM 0 HD13 LEU C 19 5.255 4.505 3.530 1.00 0.00 H new ATOM 0 HD21 LEU C 19 6.926 6.322 1.776 1.00 0.00 H new ATOM 0 HD22 LEU C 19 5.604 5.293 1.175 1.00 0.00 H new ATOM 0 HD23 LEU C 19 5.595 7.041 0.838 1.00 0.00 H new ATOM 1077 N PRO C 20 0.584 8.137 3.961 1.00 0.00 N ATOM 1078 CA PRO C 20 -0.769 8.552 3.595 1.00 0.00 C ATOM 1079 C PRO C 20 -0.789 9.645 2.529 1.00 0.00 C ATOM 1080 O PRO C 20 -1.841 9.952 1.966 1.00 0.00 O ATOM 1081 CB PRO C 20 -1.332 9.083 4.911 1.00 0.00 C ATOM 1082 CG PRO C 20 -0.144 9.602 5.645 1.00 0.00 C ATOM 1083 CD PRO C 20 1.014 8.724 5.248 1.00 0.00 C ATOM 0 HA PRO C 20 -1.341 7.732 3.160 1.00 0.00 H new ATOM 0 HB2 PRO C 20 -2.067 9.870 4.739 1.00 0.00 H new ATOM 0 HB3 PRO C 20 -1.833 8.296 5.474 1.00 0.00 H new ATOM 0 HG2 PRO C 20 0.050 10.643 5.385 1.00 0.00 H new ATOM 0 HG3 PRO C 20 -0.307 9.568 6.722 1.00 0.00 H new ATOM 0 HD2 PRO C 20 1.933 9.299 5.138 1.00 0.00 H new ATOM 0 HD3 PRO C 20 1.207 7.954 5.995 1.00 0.00 H new ATOM 1091 N ASN C 21 0.371 10.227 2.244 1.00 0.00 N ATOM 1092 CA ASN C 21 0.450 11.339 1.304 1.00 0.00 C ATOM 1093 C ASN C 21 0.692 10.833 -0.105 1.00 0.00 C ATOM 1094 O ASN C 21 0.536 11.575 -1.072 1.00 0.00 O ATOM 1095 CB ASN C 21 1.560 12.317 1.696 1.00 0.00 C ATOM 1096 CG ASN C 21 1.323 12.968 3.043 1.00 0.00 C ATOM 1097 OD1 ASN C 21 0.183 13.167 3.465 1.00 0.00 O ATOM 1098 ND2 ASN C 21 2.400 13.316 3.723 1.00 0.00 N ATOM 0 H ASN C 21 1.265 9.949 2.648 1.00 0.00 H new ATOM 0 HA ASN C 21 -0.504 11.864 1.337 1.00 0.00 H new ATOM 0 HB2 ASN C 21 2.513 11.788 1.716 1.00 0.00 H new ATOM 0 HB3 ASN C 21 1.641 13.091 0.933 1.00 0.00 H new ATOM 0 HD21 ASN C 21 2.305 13.767 4.633 1.00 0.00 H new ATOM 0 HD22 ASN C 21 3.327 13.134 3.338 1.00 0.00 H new ATOM 1105 N LEU C 22 1.073 9.568 -0.216 1.00 0.00 N ATOM 1106 CA LEU C 22 1.297 8.962 -1.515 1.00 0.00 C ATOM 1107 C LEU C 22 0.010 8.879 -2.302 1.00 0.00 C ATOM 1108 O LEU C 22 -0.970 8.282 -1.857 1.00 0.00 O ATOM 1109 CB LEU C 22 1.894 7.569 -1.385 1.00 0.00 C ATOM 1110 CG LEU C 22 3.378 7.510 -1.047 1.00 0.00 C ATOM 1111 CD1 LEU C 22 3.845 6.069 -1.083 1.00 0.00 C ATOM 1112 CD2 LEU C 22 4.182 8.357 -2.018 1.00 0.00 C ATOM 0 H LEU C 22 1.232 8.946 0.576 1.00 0.00 H new ATOM 0 HA LEU C 22 2.005 9.599 -2.045 1.00 0.00 H new ATOM 0 HB2 LEU C 22 1.344 7.030 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU C 22 1.733 7.037 -2.323 1.00 0.00 H new ATOM 0 HG LEU C 22 3.533 7.911 -0.045 1.00 0.00 H new ATOM 0 HD11 LEU C 22 4.907 6.025 -0.841 1.00 0.00 H new ATOM 0 HD12 LEU C 22 3.282 5.486 -0.354 1.00 0.00 H new ATOM 0 HD13 LEU C 22 3.682 5.659 -2.080 1.00 0.00 H new ATOM 0 HD21 LEU C 22 5.240 8.302 -1.760 1.00 0.00 H new ATOM 0 HD22 LEU C 22 4.036 7.985 -3.032 1.00 0.00 H new ATOM 0 HD23 LEU C 22 3.848 9.393 -1.960 1.00 0.00 H new ATOM 1124 N ASN C 23 0.018 9.489 -3.469 1.00 0.00 N ATOM 1125 CA ASN C 23 -1.118 9.405 -4.365 1.00 0.00 C ATOM 1126 C ASN C 23 -1.079 8.067 -5.090 1.00 0.00 C ATOM 1127 O ASN C 23 0.008 7.562 -5.388 1.00 0.00 O ATOM 1128 CB ASN C 23 -1.133 10.576 -5.362 1.00 0.00 C ATOM 1129 CG ASN C 23 0.137 10.684 -6.187 1.00 0.00 C ATOM 1130 OD1 ASN C 23 0.247 10.096 -7.264 1.00 0.00 O ATOM 1131 ND2 ASN C 23 1.103 11.446 -5.692 1.00 0.00 N ATOM 0 H ASN C 23 0.796 10.047 -3.819 1.00 0.00 H new ATOM 0 HA ASN C 23 -2.037 9.474 -3.783 1.00 0.00 H new ATOM 0 HB2 ASN C 23 -1.984 10.461 -6.033 1.00 0.00 H new ATOM 0 HB3 ASN C 23 -1.282 11.507 -4.815 1.00 0.00 H new ATOM 0 HD21 ASN C 23 1.976 11.562 -6.207 1.00 0.00 H new ATOM 0 HD22 ASN C 23 0.973 11.916 -4.796 1.00 0.00 H new ATOM 1138 N PRO C 24 -2.255 7.458 -5.336 1.00 0.00 N ATOM 1139 CA PRO C 24 -2.370 6.125 -5.945 1.00 0.00 C ATOM 1140 C PRO C 24 -1.384 5.886 -7.085 1.00 0.00 C ATOM 1141 O PRO C 24 -0.679 4.878 -7.099 1.00 0.00 O ATOM 1142 CB PRO C 24 -3.802 6.124 -6.467 1.00 0.00 C ATOM 1143 CG PRO C 24 -4.550 6.962 -5.491 1.00 0.00 C ATOM 1144 CD PRO C 24 -3.586 8.025 -5.025 1.00 0.00 C ATOM 0 HA PRO C 24 -2.143 5.333 -5.231 1.00 0.00 H new ATOM 0 HB2 PRO C 24 -3.859 6.539 -7.473 1.00 0.00 H new ATOM 0 HB3 PRO C 24 -4.207 5.113 -6.516 1.00 0.00 H new ATOM 0 HG2 PRO C 24 -5.429 7.410 -5.955 1.00 0.00 H new ATOM 0 HG3 PRO C 24 -4.903 6.362 -4.652 1.00 0.00 H new ATOM 0 HD2 PRO C 24 -3.750 8.969 -5.545 1.00 0.00 H new ATOM 0 HD3 PRO C 24 -3.696 8.225 -3.959 1.00 0.00 H new ATOM 1152 N ASP C 25 -1.326 6.829 -8.019 1.00 0.00 N ATOM 1153 CA ASP C 25 -0.452 6.718 -9.189 1.00 0.00 C ATOM 1154 C ASP C 25 1.009 6.470 -8.801 1.00 0.00 C ATOM 1155 O ASP C 25 1.689 5.649 -9.419 1.00 0.00 O ATOM 1156 CB ASP C 25 -0.552 7.984 -10.043 1.00 0.00 C ATOM 1157 CG ASP C 25 0.403 7.968 -11.221 1.00 0.00 C ATOM 1158 OD1 ASP C 25 1.484 8.590 -11.124 1.00 0.00 O ATOM 1159 OD2 ASP C 25 0.078 7.336 -12.249 1.00 0.00 O ATOM 0 H ASP C 25 -1.877 7.687 -7.991 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.791 5.856 -9.764 1.00 0.00 H new ATOM 0 HB2 ASP C 25 -1.573 8.092 -10.409 1.00 0.00 H new ATOM 0 HB3 ASP C 25 -0.343 8.855 -9.422 1.00 0.00 H new ATOM 1164 N GLN C 26 1.483 7.161 -7.770 1.00 0.00 N ATOM 1165 CA GLN C 26 2.880 7.048 -7.358 1.00 0.00 C ATOM 1166 C GLN C 26 3.166 5.711 -6.691 1.00 0.00 C ATOM 1167 O GLN C 26 4.055 4.975 -7.121 1.00 0.00 O ATOM 1168 CB GLN C 26 3.272 8.183 -6.412 1.00 0.00 C ATOM 1169 CG GLN C 26 3.365 9.545 -7.080 1.00 0.00 C ATOM 1170 CD GLN C 26 4.418 9.611 -8.175 1.00 0.00 C ATOM 1171 OE1 GLN C 26 4.702 8.625 -8.857 1.00 0.00 O ATOM 1172 NE2 GLN C 26 5.010 10.780 -8.343 1.00 0.00 N ATOM 0 H GLN C 26 0.925 7.802 -7.206 1.00 0.00 H new ATOM 0 HA GLN C 26 3.479 7.117 -8.266 1.00 0.00 H new ATOM 0 HB2 GLN C 26 2.543 8.236 -5.604 1.00 0.00 H new ATOM 0 HB3 GLN C 26 4.234 7.947 -5.958 1.00 0.00 H new ATOM 0 HG2 GLN C 26 2.394 9.800 -7.504 1.00 0.00 H new ATOM 0 HG3 GLN C 26 3.590 10.297 -6.324 1.00 0.00 H new ATOM 0 HE21 GLN C 26 4.747 11.573 -7.758 1.00 0.00 H new ATOM 0 HE22 GLN C 26 5.730 10.889 -9.057 1.00 0.00 H new ATOM 1181 N LEU C 27 2.411 5.390 -5.646 1.00 0.00 N ATOM 1182 CA LEU C 27 2.641 4.154 -4.905 1.00 0.00 C ATOM 1183 C LEU C 27 2.372 2.936 -5.787 1.00 0.00 C ATOM 1184 O LEU C 27 2.918 1.860 -5.556 1.00 0.00 O ATOM 1185 CB LEU C 27 1.807 4.125 -3.611 1.00 0.00 C ATOM 1186 CG LEU C 27 0.324 4.490 -3.744 1.00 0.00 C ATOM 1187 CD1 LEU C 27 -0.476 3.329 -4.304 1.00 0.00 C ATOM 1188 CD2 LEU C 27 -0.236 4.939 -2.398 1.00 0.00 C ATOM 0 H LEU C 27 1.642 5.961 -5.295 1.00 0.00 H new ATOM 0 HA LEU C 27 3.690 4.117 -4.612 1.00 0.00 H new ATOM 0 HB2 LEU C 27 1.875 3.125 -3.184 1.00 0.00 H new ATOM 0 HB3 LEU C 27 2.264 4.809 -2.896 1.00 0.00 H new ATOM 0 HG LEU C 27 0.239 5.320 -4.446 1.00 0.00 H new ATOM 0 HD11 LEU C 27 -1.524 3.616 -4.388 1.00 0.00 H new ATOM 0 HD12 LEU C 27 -0.093 3.065 -5.289 1.00 0.00 H new ATOM 0 HD13 LEU C 27 -0.387 2.471 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU C 27 -1.290 5.195 -2.509 1.00 0.00 H new ATOM 0 HD22 LEU C 27 -0.133 4.131 -1.673 1.00 0.00 H new ATOM 0 HD23 LEU C 27 0.314 5.812 -2.048 1.00 0.00 H new ATOM 1200 N CYS C 28 1.557 3.135 -6.817 1.00 0.00 N ATOM 1201 CA CYS C 28 1.269 2.099 -7.801 1.00 0.00 C ATOM 1202 C CYS C 28 2.558 1.606 -8.455 1.00 0.00 C ATOM 1203 O CYS C 28 2.706 0.419 -8.751 1.00 0.00 O ATOM 1204 CB CYS C 28 0.318 2.654 -8.866 1.00 0.00 C ATOM 1205 SG CYS C 28 -0.222 1.443 -10.115 1.00 0.00 S ATOM 0 H CYS C 28 1.078 4.018 -6.993 1.00 0.00 H new ATOM 0 HA CYS C 28 0.796 1.256 -7.297 1.00 0.00 H new ATOM 0 HB2 CYS C 28 -0.563 3.060 -8.370 1.00 0.00 H new ATOM 0 HB3 CYS C 28 0.809 3.484 -9.374 1.00 0.00 H new ATOM 1210 N ALA C 29 3.495 2.526 -8.654 1.00 0.00 N ATOM 1211 CA ALA C 29 4.761 2.205 -9.294 1.00 0.00 C ATOM 1212 C ALA C 29 5.731 1.560 -8.310 1.00 0.00 C ATOM 1213 O ALA C 29 6.378 0.567 -8.631 1.00 0.00 O ATOM 1214 CB ALA C 29 5.375 3.458 -9.899 1.00 0.00 C ATOM 0 H ALA C 29 3.399 3.504 -8.379 1.00 0.00 H new ATOM 0 HA ALA C 29 4.565 1.486 -10.089 1.00 0.00 H new ATOM 0 HB1 ALA C 29 6.322 3.205 -10.375 1.00 0.00 H new ATOM 0 HB2 ALA C 29 4.695 3.874 -10.642 1.00 0.00 H new ATOM 0 HB3 ALA C 29 5.549 4.194 -9.114 1.00 0.00 H new ATOM 1220 N PHE C 30 5.817 2.118 -7.108 1.00 0.00 N ATOM 1221 CA PHE C 30 6.768 1.634 -6.107 1.00 0.00 C ATOM 1222 C PHE C 30 6.438 0.217 -5.663 1.00 0.00 C ATOM 1223 O PHE C 30 7.335 -0.590 -5.430 1.00 0.00 O ATOM 1224 CB PHE C 30 6.811 2.568 -4.901 1.00 0.00 C ATOM 1225 CG PHE C 30 7.307 3.940 -5.242 1.00 0.00 C ATOM 1226 CD1 PHE C 30 6.529 5.054 -4.992 1.00 0.00 C ATOM 1227 CD2 PHE C 30 8.550 4.110 -5.829 1.00 0.00 C ATOM 1228 CE1 PHE C 30 6.981 6.315 -5.319 1.00 0.00 C ATOM 1229 CE2 PHE C 30 9.008 5.370 -6.157 1.00 0.00 C ATOM 1230 CZ PHE C 30 8.223 6.474 -5.902 1.00 0.00 C ATOM 0 H PHE C 30 5.243 2.903 -6.801 1.00 0.00 H new ATOM 0 HA PHE C 30 7.753 1.621 -6.574 1.00 0.00 H new ATOM 0 HB2 PHE C 30 5.812 2.645 -4.472 1.00 0.00 H new ATOM 0 HB3 PHE C 30 7.454 2.135 -4.135 1.00 0.00 H new ATOM 0 HD1 PHE C 30 5.557 4.936 -4.536 1.00 0.00 H new ATOM 0 HD2 PHE C 30 9.167 3.247 -6.032 1.00 0.00 H new ATOM 0 HE1 PHE C 30 6.364 7.178 -5.119 1.00 0.00 H new ATOM 0 HE2 PHE C 30 9.980 5.491 -6.613 1.00 0.00 H new ATOM 0 HZ PHE C 30 8.578 7.461 -6.158 1.00 0.00 H new ATOM 1240 N ILE C 31 5.153 -0.086 -5.555 1.00 0.00 N ATOM 1241 CA ILE C 31 4.718 -1.433 -5.216 1.00 0.00 C ATOM 1242 C ILE C 31 5.170 -2.417 -6.294 1.00 0.00 C ATOM 1243 O ILE C 31 5.684 -3.499 -5.996 1.00 0.00 O ATOM 1244 CB ILE C 31 3.187 -1.499 -5.056 1.00 0.00 C ATOM 1245 CG1 ILE C 31 2.748 -0.660 -3.853 1.00 0.00 C ATOM 1246 CG2 ILE C 31 2.728 -2.939 -4.901 1.00 0.00 C ATOM 1247 CD1 ILE C 31 1.246 -0.517 -3.725 1.00 0.00 C ATOM 0 H ILE C 31 4.394 0.581 -5.697 1.00 0.00 H new ATOM 0 HA ILE C 31 5.173 -1.705 -4.264 1.00 0.00 H new ATOM 0 HB ILE C 31 2.723 -1.090 -5.954 1.00 0.00 H new ATOM 0 HG12 ILE C 31 3.140 -1.114 -2.943 1.00 0.00 H new ATOM 0 HG13 ILE C 31 3.193 0.332 -3.931 1.00 0.00 H new ATOM 0 HG21 ILE C 31 1.644 -2.965 -4.789 1.00 0.00 H new ATOM 0 HG22 ILE C 31 3.016 -3.510 -5.784 1.00 0.00 H new ATOM 0 HG23 ILE C 31 3.194 -3.377 -4.018 1.00 0.00 H new ATOM 0 HD11 ILE C 31 1.012 0.090 -2.850 1.00 0.00 H new ATOM 0 HD12 ILE C 31 0.849 -0.035 -4.618 1.00 0.00 H new ATOM 0 HD13 ILE C 31 0.795 -1.503 -3.614 1.00 0.00 H new ATOM 1259 N HIS C 32 5.000 -2.016 -7.546 1.00 0.00 N ATOM 1260 CA HIS C 32 5.434 -2.823 -8.680 1.00 0.00 C ATOM 1261 C HIS C 32 6.957 -2.948 -8.669 1.00 0.00 C ATOM 1262 O HIS C 32 7.515 -3.968 -9.068 1.00 0.00 O ATOM 1263 CB HIS C 32 4.962 -2.175 -9.986 1.00 0.00 C ATOM 1264 CG HIS C 32 4.972 -3.091 -11.174 1.00 0.00 C ATOM 1265 ND1 HIS C 32 3.819 -3.522 -11.797 1.00 0.00 N ATOM 1266 CD2 HIS C 32 5.998 -3.638 -11.873 1.00 0.00 C ATOM 1267 CE1 HIS C 32 4.134 -4.293 -12.821 1.00 0.00 C ATOM 1268 NE2 HIS C 32 5.449 -4.378 -12.888 1.00 0.00 N ATOM 0 H HIS C 32 4.562 -1.132 -7.804 1.00 0.00 H new ATOM 0 HA HIS C 32 4.999 -3.819 -8.605 1.00 0.00 H new ATOM 0 HB2 HIS C 32 3.950 -1.796 -9.844 1.00 0.00 H new ATOM 0 HB3 HIS C 32 5.597 -1.315 -10.201 1.00 0.00 H new ATOM 0 HD2 HIS C 32 7.051 -3.514 -11.668 1.00 0.00 H new ATOM 0 HE1 HIS C 32 3.435 -4.772 -13.490 1.00 0.00 H new ATOM 0 HE2 HIS C 32 5.973 -4.909 -13.583 1.00 0.00 H new ATOM 1277 N SER C 33 7.611 -1.898 -8.187 1.00 0.00 N ATOM 1278 CA SER C 33 9.063 -1.843 -8.117 1.00 0.00 C ATOM 1279 C SER C 33 9.600 -2.851 -7.094 1.00 0.00 C ATOM 1280 O SER C 33 10.667 -3.435 -7.294 1.00 0.00 O ATOM 1281 CB SER C 33 9.501 -0.415 -7.762 1.00 0.00 C ATOM 1282 OG SER C 33 10.885 -0.209 -7.988 1.00 0.00 O ATOM 0 H SER C 33 7.148 -1.061 -7.834 1.00 0.00 H new ATOM 0 HA SER C 33 9.477 -2.111 -9.089 1.00 0.00 H new ATOM 0 HB2 SER C 33 8.928 0.297 -8.355 1.00 0.00 H new ATOM 0 HB3 SER C 33 9.272 -0.216 -6.715 1.00 0.00 H new ATOM 0 HG SER C 33 11.122 0.712 -7.751 1.00 0.00 H new ATOM 1288 N ILE C 34 8.857 -3.062 -6.003 1.00 0.00 N ATOM 1289 CA ILE C 34 9.237 -4.061 -5.000 1.00 0.00 C ATOM 1290 C ILE C 34 9.197 -5.451 -5.614 1.00 0.00 C ATOM 1291 O ILE C 34 10.060 -6.284 -5.369 1.00 0.00 O ATOM 1292 CB ILE C 34 8.297 -4.059 -3.773 1.00 0.00 C ATOM 1293 CG1 ILE C 34 8.181 -2.654 -3.172 1.00 0.00 C ATOM 1294 CG2 ILE C 34 8.801 -5.053 -2.725 1.00 0.00 C ATOM 1295 CD1 ILE C 34 9.466 -2.136 -2.572 1.00 0.00 C ATOM 0 H ILE C 34 7.995 -2.558 -5.793 1.00 0.00 H new ATOM 0 HA ILE C 34 10.242 -3.801 -4.669 1.00 0.00 H new ATOM 0 HB ILE C 34 7.303 -4.365 -4.100 1.00 0.00 H new ATOM 0 HG12 ILE C 34 7.850 -1.964 -3.948 1.00 0.00 H new ATOM 0 HG13 ILE C 34 7.409 -2.662 -2.402 1.00 0.00 H new ATOM 0 HG21 ILE C 34 8.132 -5.045 -1.864 1.00 0.00 H new ATOM 0 HG22 ILE C 34 8.826 -6.054 -3.155 1.00 0.00 H new ATOM 0 HG23 ILE C 34 9.805 -4.770 -2.408 1.00 0.00 H new ATOM 0 HD11 ILE C 34 9.302 -1.137 -2.168 1.00 0.00 H new ATOM 0 HD12 ILE C 34 9.789 -2.803 -1.772 1.00 0.00 H new ATOM 0 HD13 ILE C 34 10.236 -2.094 -3.342 1.00 0.00 H new ATOM 1307 N HIS C 35 8.177 -5.682 -6.421 1.00 0.00 N ATOM 1308 CA HIS C 35 7.988 -6.968 -7.076 1.00 0.00 C ATOM 1309 C HIS C 35 9.049 -7.165 -8.160 1.00 0.00 C ATOM 1310 O HIS C 35 9.380 -8.291 -8.531 1.00 0.00 O ATOM 1311 CB HIS C 35 6.583 -7.035 -7.682 1.00 0.00 C ATOM 1312 CG HIS C 35 6.091 -8.424 -7.958 1.00 0.00 C ATOM 1313 ND1 HIS C 35 5.150 -9.054 -7.174 1.00 0.00 N ATOM 1314 CD2 HIS C 35 6.388 -9.293 -8.951 1.00 0.00 C ATOM 1315 CE1 HIS C 35 4.890 -10.246 -7.673 1.00 0.00 C ATOM 1316 NE2 HIS C 35 5.628 -10.417 -8.753 1.00 0.00 N ATOM 0 H HIS C 35 7.460 -4.991 -6.641 1.00 0.00 H new ATOM 0 HA HIS C 35 8.093 -7.766 -6.341 1.00 0.00 H new ATOM 0 HB2 HIS C 35 5.885 -6.544 -7.004 1.00 0.00 H new ATOM 0 HB3 HIS C 35 6.575 -6.469 -8.613 1.00 0.00 H new ATOM 0 HD2 HIS C 35 7.094 -9.131 -9.752 1.00 0.00 H new ATOM 0 HE1 HIS C 35 4.191 -10.962 -7.266 1.00 0.00 H new ATOM 0 HE2 HIS C 35 5.633 -11.249 -9.344 1.00 0.00 H new ATOM 1325 N ASP C 36 9.582 -6.053 -8.651 1.00 0.00 N ATOM 1326 CA ASP C 36 10.606 -6.072 -9.692 1.00 0.00 C ATOM 1327 C ASP C 36 11.994 -6.274 -9.098 1.00 0.00 C ATOM 1328 O ASP C 36 12.867 -6.890 -9.711 1.00 0.00 O ATOM 1329 CB ASP C 36 10.559 -4.767 -10.493 1.00 0.00 C ATOM 1330 CG ASP C 36 11.705 -4.637 -11.477 1.00 0.00 C ATOM 1331 OD1 ASP C 36 11.637 -5.253 -12.561 1.00 0.00 O ATOM 1332 OD2 ASP C 36 12.668 -3.897 -11.180 1.00 0.00 O ATOM 0 H ASP C 36 9.320 -5.117 -8.342 1.00 0.00 H new ATOM 0 HA ASP C 36 10.400 -6.911 -10.357 1.00 0.00 H new ATOM 0 HB2 ASP C 36 9.614 -4.713 -11.034 1.00 0.00 H new ATOM 0 HB3 ASP C 36 10.581 -3.923 -9.804 1.00 0.00 H new ATOM 1337 N ASP C 37 12.182 -5.769 -7.894 1.00 0.00 N ATOM 1338 CA ASP C 37 13.468 -5.851 -7.217 1.00 0.00 C ATOM 1339 C ASP C 37 13.256 -5.859 -5.708 1.00 0.00 C ATOM 1340 O ASP C 37 13.437 -4.842 -5.039 1.00 0.00 O ATOM 1341 CB ASP C 37 14.367 -4.675 -7.609 1.00 0.00 C ATOM 1342 CG ASP C 37 15.840 -5.004 -7.467 1.00 0.00 C ATOM 1343 OD1 ASP C 37 16.237 -5.582 -6.431 1.00 0.00 O ATOM 1344 OD2 ASP C 37 16.610 -4.685 -8.397 1.00 0.00 O ATOM 0 H ASP C 37 11.456 -5.293 -7.358 1.00 0.00 H new ATOM 0 HA ASP C 37 13.959 -6.775 -7.521 1.00 0.00 H new ATOM 0 HB2 ASP C 37 14.159 -4.389 -8.640 1.00 0.00 H new ATOM 0 HB3 ASP C 37 14.128 -3.814 -6.985 1.00 0.00 H new ATOM 1349 N PRO C 38 12.851 -7.014 -5.159 1.00 0.00 N ATOM 1350 CA PRO C 38 12.541 -7.164 -3.731 1.00 0.00 C ATOM 1351 C PRO C 38 13.721 -6.843 -2.817 1.00 0.00 C ATOM 1352 O PRO C 38 13.538 -6.540 -1.640 1.00 0.00 O ATOM 1353 CB PRO C 38 12.155 -8.639 -3.595 1.00 0.00 C ATOM 1354 CG PRO C 38 12.715 -9.300 -4.807 1.00 0.00 C ATOM 1355 CD PRO C 38 12.636 -8.269 -5.892 1.00 0.00 C ATOM 0 HA PRO C 38 11.759 -6.468 -3.427 1.00 0.00 H new ATOM 0 HB2 PRO C 38 12.567 -9.072 -2.684 1.00 0.00 H new ATOM 0 HB3 PRO C 38 11.073 -8.760 -3.544 1.00 0.00 H new ATOM 0 HG2 PRO C 38 13.744 -9.618 -4.641 1.00 0.00 H new ATOM 0 HG3 PRO C 38 12.144 -10.191 -5.069 1.00 0.00 H new ATOM 0 HD2 PRO C 38 13.396 -8.427 -6.657 1.00 0.00 H new ATOM 0 HD3 PRO C 38 11.669 -8.284 -6.395 1.00 0.00 H new ATOM 1363 N SER C 39 14.929 -6.905 -3.360 1.00 0.00 N ATOM 1364 CA SER C 39 16.125 -6.595 -2.593 1.00 0.00 C ATOM 1365 C SER C 39 16.159 -5.106 -2.255 1.00 0.00 C ATOM 1366 O SER C 39 16.673 -4.700 -1.212 1.00 0.00 O ATOM 1367 CB SER C 39 17.366 -6.987 -3.393 1.00 0.00 C ATOM 1368 OG SER C 39 17.246 -8.313 -3.887 1.00 0.00 O ATOM 0 H SER C 39 15.106 -7.168 -4.330 1.00 0.00 H new ATOM 0 HA SER C 39 16.111 -7.162 -1.662 1.00 0.00 H new ATOM 0 HB2 SER C 39 17.503 -6.295 -4.224 1.00 0.00 H new ATOM 0 HB3 SER C 39 18.252 -6.907 -2.763 1.00 0.00 H new ATOM 0 HG SER C 39 18.049 -8.546 -4.398 1.00 0.00 H new ATOM 1374 N GLN C 40 15.576 -4.308 -3.139 1.00 0.00 N ATOM 1375 CA GLN C 40 15.524 -2.866 -2.981 1.00 0.00 C ATOM 1376 C GLN C 40 14.354 -2.439 -2.107 1.00 0.00 C ATOM 1377 O GLN C 40 14.140 -1.251 -1.923 1.00 0.00 O ATOM 1378 CB GLN C 40 15.397 -2.213 -4.350 1.00 0.00 C ATOM 1379 CG GLN C 40 16.564 -2.504 -5.258 1.00 0.00 C ATOM 1380 CD GLN C 40 17.718 -1.543 -5.057 1.00 0.00 C ATOM 1381 OE1 GLN C 40 17.905 -0.992 -3.970 1.00 0.00 O ATOM 1382 NE2 GLN C 40 18.503 -1.338 -6.098 1.00 0.00 N ATOM 0 H GLN C 40 15.125 -4.647 -3.989 1.00 0.00 H new ATOM 0 HA GLN C 40 16.444 -2.546 -2.492 1.00 0.00 H new ATOM 0 HB2 GLN C 40 14.480 -2.559 -4.826 1.00 0.00 H new ATOM 0 HB3 GLN C 40 15.304 -1.134 -4.223 1.00 0.00 H new ATOM 0 HG2 GLN C 40 16.910 -3.522 -5.082 1.00 0.00 H new ATOM 0 HG3 GLN C 40 16.233 -2.455 -6.295 1.00 0.00 H new ATOM 0 HE21 GLN C 40 18.314 -1.813 -6.980 1.00 0.00 H new ATOM 0 HE22 GLN C 40 19.298 -0.704 -6.020 1.00 0.00 H new ATOM 1391 N SER C 41 13.599 -3.412 -1.596 1.00 0.00 N ATOM 1392 CA SER C 41 12.364 -3.156 -0.841 1.00 0.00 C ATOM 1393 C SER C 41 12.467 -1.937 0.087 1.00 0.00 C ATOM 1394 O SER C 41 11.763 -0.947 -0.104 1.00 0.00 O ATOM 1395 CB SER C 41 11.986 -4.399 -0.034 1.00 0.00 C ATOM 1396 OG SER C 41 13.093 -4.874 0.714 1.00 0.00 O ATOM 0 H SER C 41 13.824 -4.402 -1.692 1.00 0.00 H new ATOM 0 HA SER C 41 11.586 -2.929 -1.570 1.00 0.00 H new ATOM 0 HB2 SER C 41 11.162 -4.163 0.639 1.00 0.00 H new ATOM 0 HB3 SER C 41 11.634 -5.181 -0.707 1.00 0.00 H new ATOM 0 HG SER C 41 13.062 -5.852 0.759 1.00 0.00 H new ATOM 1402 N ALA C 42 13.336 -2.022 1.087 1.00 0.00 N ATOM 1403 CA ALA C 42 13.563 -0.928 2.026 1.00 0.00 C ATOM 1404 C ALA C 42 13.949 0.373 1.331 1.00 0.00 C ATOM 1405 O ALA C 42 13.484 1.448 1.701 1.00 0.00 O ATOM 1406 CB ALA C 42 14.645 -1.327 3.004 1.00 0.00 C ATOM 0 H ALA C 42 13.903 -2.850 1.271 1.00 0.00 H new ATOM 0 HA ALA C 42 12.624 -0.743 2.548 1.00 0.00 H new ATOM 0 HB1 ALA C 42 14.818 -0.513 3.707 1.00 0.00 H new ATOM 0 HB2 ALA C 42 14.332 -2.217 3.549 1.00 0.00 H new ATOM 0 HB3 ALA C 42 15.566 -1.539 2.461 1.00 0.00 H new ATOM 1412 N ASN C 43 14.805 0.272 0.333 1.00 0.00 N ATOM 1413 CA ASN C 43 15.264 1.442 -0.411 1.00 0.00 C ATOM 1414 C ASN C 43 14.132 2.046 -1.247 1.00 0.00 C ATOM 1415 O ASN C 43 14.045 3.262 -1.406 1.00 0.00 O ATOM 1416 CB ASN C 43 16.438 1.045 -1.299 1.00 0.00 C ATOM 1417 CG ASN C 43 16.953 2.182 -2.163 1.00 0.00 C ATOM 1418 OD1 ASN C 43 16.943 3.346 -1.761 1.00 0.00 O ATOM 1419 ND2 ASN C 43 17.405 1.850 -3.361 1.00 0.00 N ATOM 0 H ASN C 43 15.202 -0.611 0.013 1.00 0.00 H new ATOM 0 HA ASN C 43 15.588 2.205 0.297 1.00 0.00 H new ATOM 0 HB2 ASN C 43 17.251 0.679 -0.672 1.00 0.00 H new ATOM 0 HB3 ASN C 43 16.134 0.219 -1.942 1.00 0.00 H new ATOM 0 HD21 ASN C 43 17.762 2.570 -3.989 1.00 0.00 H new ATOM 0 HD22 ASN C 43 17.396 0.874 -3.657 1.00 0.00 H new ATOM 1426 N LEU C 44 13.261 1.191 -1.765 1.00 0.00 N ATOM 1427 CA LEU C 44 12.094 1.639 -2.513 1.00 0.00 C ATOM 1428 C LEU C 44 11.041 2.168 -1.548 1.00 0.00 C ATOM 1429 O LEU C 44 10.176 2.959 -1.920 1.00 0.00 O ATOM 1430 CB LEU C 44 11.526 0.491 -3.359 1.00 0.00 C ATOM 1431 CG LEU C 44 12.175 0.264 -4.739 1.00 0.00 C ATOM 1432 CD1 LEU C 44 13.589 0.821 -4.803 1.00 0.00 C ATOM 1433 CD2 LEU C 44 12.192 -1.220 -5.074 1.00 0.00 C ATOM 0 H LEU C 44 13.341 0.178 -1.680 1.00 0.00 H new ATOM 0 HA LEU C 44 12.389 2.442 -3.189 1.00 0.00 H new ATOM 0 HB2 LEU C 44 11.615 -0.431 -2.785 1.00 0.00 H new ATOM 0 HB3 LEU C 44 10.462 0.672 -3.509 1.00 0.00 H new ATOM 0 HG LEU C 44 11.572 0.800 -5.473 1.00 0.00 H new ATOM 0 HD11 LEU C 44 14.007 0.639 -5.793 1.00 0.00 H new ATOM 0 HD12 LEU C 44 13.567 1.894 -4.610 1.00 0.00 H new ATOM 0 HD13 LEU C 44 14.208 0.330 -4.052 1.00 0.00 H new ATOM 0 HD21 LEU C 44 12.653 -1.367 -6.051 1.00 0.00 H new ATOM 0 HD22 LEU C 44 12.765 -1.757 -4.318 1.00 0.00 H new ATOM 0 HD23 LEU C 44 11.171 -1.600 -5.094 1.00 0.00 H new ATOM 1445 N LEU C 45 11.148 1.743 -0.293 1.00 0.00 N ATOM 1446 CA LEU C 45 10.301 2.222 0.757 1.00 0.00 C ATOM 1447 C LEU C 45 10.798 3.620 1.131 1.00 0.00 C ATOM 1448 O LEU C 45 10.018 4.552 1.330 1.00 0.00 O ATOM 1449 CB LEU C 45 10.389 1.213 1.928 1.00 0.00 C ATOM 1450 CG LEU C 45 9.745 1.620 3.234 1.00 0.00 C ATOM 1451 CD1 LEU C 45 10.703 2.532 3.962 1.00 0.00 C ATOM 1452 CD2 LEU C 45 8.421 2.288 2.962 1.00 0.00 C ATOM 0 H LEU C 45 11.834 1.052 0.011 1.00 0.00 H new ATOM 0 HA LEU C 45 9.253 2.300 0.469 1.00 0.00 H new ATOM 0 HB2 LEU C 45 9.935 0.277 1.603 1.00 0.00 H new ATOM 0 HB3 LEU C 45 11.442 1.007 2.119 1.00 0.00 H new ATOM 0 HG LEU C 45 9.542 0.752 3.861 1.00 0.00 H new ATOM 0 HD11 LEU C 45 10.262 2.841 4.910 1.00 0.00 H new ATOM 0 HD12 LEU C 45 11.637 2.002 4.152 1.00 0.00 H new ATOM 0 HD13 LEU C 45 10.903 3.412 3.351 1.00 0.00 H new ATOM 0 HD21 LEU C 45 7.960 2.580 3.906 1.00 0.00 H new ATOM 0 HD22 LEU C 45 8.580 3.174 2.347 1.00 0.00 H new ATOM 0 HD23 LEU C 45 7.765 1.594 2.437 1.00 0.00 H new ATOM 1464 N ALA C 46 12.122 3.741 1.189 1.00 0.00 N ATOM 1465 CA ALA C 46 12.791 5.010 1.438 1.00 0.00 C ATOM 1466 C ALA C 46 12.458 6.016 0.340 1.00 0.00 C ATOM 1467 O ALA C 46 12.206 7.191 0.612 1.00 0.00 O ATOM 1468 CB ALA C 46 14.297 4.786 1.520 1.00 0.00 C ATOM 0 H ALA C 46 12.762 2.956 1.064 1.00 0.00 H new ATOM 0 HA ALA C 46 12.440 5.417 2.386 1.00 0.00 H new ATOM 0 HB1 ALA C 46 14.797 5.737 1.706 1.00 0.00 H new ATOM 0 HB2 ALA C 46 14.518 4.094 2.333 1.00 0.00 H new ATOM 0 HB3 ALA C 46 14.654 4.367 0.579 1.00 0.00 H new ATOM 1474 N GLU C 47 12.460 5.535 -0.898 1.00 0.00 N ATOM 1475 CA GLU C 47 12.094 6.346 -2.052 1.00 0.00 C ATOM 1476 C GLU C 47 10.678 6.895 -1.894 1.00 0.00 C ATOM 1477 O GLU C 47 10.440 8.095 -2.048 1.00 0.00 O ATOM 1478 CB GLU C 47 12.184 5.500 -3.323 1.00 0.00 C ATOM 1479 CG GLU C 47 11.872 6.265 -4.595 1.00 0.00 C ATOM 1480 CD GLU C 47 12.926 7.297 -4.933 1.00 0.00 C ATOM 1481 OE1 GLU C 47 12.889 8.409 -4.367 1.00 0.00 O ATOM 1482 OE2 GLU C 47 13.803 7.001 -5.771 1.00 0.00 O ATOM 0 H GLU C 47 12.715 4.575 -1.129 1.00 0.00 H new ATOM 0 HA GLU C 47 12.785 7.186 -2.124 1.00 0.00 H new ATOM 0 HB2 GLU C 47 13.188 5.082 -3.399 1.00 0.00 H new ATOM 0 HB3 GLU C 47 11.495 4.660 -3.238 1.00 0.00 H new ATOM 0 HG2 GLU C 47 11.780 5.562 -5.423 1.00 0.00 H new ATOM 0 HG3 GLU C 47 10.907 6.760 -4.488 1.00 0.00 H new ATOM 1489 N ALA C 48 9.743 6.005 -1.586 1.00 0.00 N ATOM 1490 CA ALA C 48 8.359 6.395 -1.359 1.00 0.00 C ATOM 1491 C ALA C 48 8.255 7.378 -0.200 1.00 0.00 C ATOM 1492 O ALA C 48 7.547 8.381 -0.295 1.00 0.00 O ATOM 1493 CB ALA C 48 7.496 5.173 -1.087 1.00 0.00 C ATOM 0 H ALA C 48 9.920 5.005 -1.488 1.00 0.00 H new ATOM 0 HA ALA C 48 7.996 6.886 -2.262 1.00 0.00 H new ATOM 0 HB1 ALA C 48 6.465 5.485 -0.920 1.00 0.00 H new ATOM 0 HB2 ALA C 48 7.537 4.501 -1.944 1.00 0.00 H new ATOM 0 HB3 ALA C 48 7.866 4.656 -0.202 1.00 0.00 H new ATOM 1499 N LYS C 49 8.947 7.080 0.900 1.00 0.00 N ATOM 1500 CA LYS C 49 8.929 7.944 2.075 1.00 0.00 C ATOM 1501 C LYS C 49 9.385 9.356 1.728 1.00 0.00 C ATOM 1502 O LYS C 49 8.850 10.333 2.255 1.00 0.00 O ATOM 1503 CB LYS C 49 9.805 7.358 3.185 1.00 0.00 C ATOM 1504 CG LYS C 49 9.029 6.940 4.417 1.00 0.00 C ATOM 1505 CD LYS C 49 8.224 8.092 5.001 1.00 0.00 C ATOM 1506 CE LYS C 49 7.588 7.712 6.329 1.00 0.00 C ATOM 1507 NZ LYS C 49 8.610 7.438 7.373 1.00 0.00 N ATOM 0 H LYS C 49 9.526 6.246 0.999 1.00 0.00 H new ATOM 0 HA LYS C 49 7.901 8.001 2.433 1.00 0.00 H new ATOM 0 HB2 LYS C 49 10.342 6.494 2.794 1.00 0.00 H new ATOM 0 HB3 LYS C 49 10.555 8.096 3.472 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.357 6.121 4.162 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.720 6.562 5.170 1.00 0.00 H new ATOM 0 HD2 LYS C 49 8.873 8.956 5.142 1.00 0.00 H new ATOM 0 HD3 LYS C 49 7.447 8.388 4.296 1.00 0.00 H new ATOM 0 HE2 LYS C 49 6.935 8.518 6.663 1.00 0.00 H new ATOM 0 HE3 LYS C 49 6.962 6.830 6.193 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 8.167 7.484 8.313 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 9.012 6.490 7.225 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 9.367 8.148 7.312 1.00 0.00 H new ATOM 1521 N LYS C 50 10.359 9.456 0.834 1.00 0.00 N ATOM 1522 CA LYS C 50 10.832 10.746 0.353 1.00 0.00 C ATOM 1523 C LYS C 50 9.687 11.506 -0.312 1.00 0.00 C ATOM 1524 O LYS C 50 9.464 12.685 -0.035 1.00 0.00 O ATOM 1525 CB LYS C 50 11.967 10.550 -0.648 1.00 0.00 C ATOM 1526 CG LYS C 50 12.627 11.846 -1.090 1.00 0.00 C ATOM 1527 CD LYS C 50 13.394 11.658 -2.384 1.00 0.00 C ATOM 1528 CE LYS C 50 12.448 11.530 -3.566 1.00 0.00 C ATOM 1529 NZ LYS C 50 13.140 11.066 -4.793 1.00 0.00 N ATOM 0 H LYS C 50 10.839 8.654 0.425 1.00 0.00 H new ATOM 0 HA LYS C 50 11.201 11.322 1.201 1.00 0.00 H new ATOM 0 HB2 LYS C 50 12.722 9.902 -0.204 1.00 0.00 H new ATOM 0 HB3 LYS C 50 11.579 10.033 -1.526 1.00 0.00 H new ATOM 0 HG2 LYS C 50 11.868 12.617 -1.223 1.00 0.00 H new ATOM 0 HG3 LYS C 50 13.304 12.197 -0.311 1.00 0.00 H new ATOM 0 HD2 LYS C 50 14.064 12.504 -2.540 1.00 0.00 H new ATOM 0 HD3 LYS C 50 14.017 10.767 -2.315 1.00 0.00 H new ATOM 0 HE2 LYS C 50 11.650 10.831 -3.316 1.00 0.00 H new ATOM 0 HE3 LYS C 50 11.979 12.495 -3.759 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 12.538 11.249 -5.621 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 14.039 11.577 -4.899 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 13.328 10.046 -4.721 1.00 0.00 H new ATOM 1543 N LEU C 51 8.966 10.813 -1.189 1.00 0.00 N ATOM 1544 CA LEU C 51 7.811 11.366 -1.873 1.00 0.00 C ATOM 1545 C LEU C 51 6.739 11.790 -0.876 1.00 0.00 C ATOM 1546 O LEU C 51 6.243 12.912 -0.930 1.00 0.00 O ATOM 1547 CB LEU C 51 7.260 10.303 -2.807 1.00 0.00 C ATOM 1548 CG LEU C 51 6.690 10.799 -4.125 1.00 0.00 C ATOM 1549 CD1 LEU C 51 6.496 9.615 -5.035 1.00 0.00 C ATOM 1550 CD2 LEU C 51 5.374 11.535 -3.921 1.00 0.00 C ATOM 0 H LEU C 51 9.171 9.847 -1.443 1.00 0.00 H new ATOM 0 HA LEU C 51 8.109 12.251 -2.435 1.00 0.00 H new ATOM 0 HB2 LEU C 51 8.057 9.591 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU C 51 6.479 9.755 -2.280 1.00 0.00 H new ATOM 0 HG LEU C 51 7.387 11.508 -4.573 1.00 0.00 H new ATOM 0 HD11 LEU C 51 6.087 9.951 -5.988 1.00 0.00 H new ATOM 0 HD12 LEU C 51 7.455 9.125 -5.205 1.00 0.00 H new ATOM 0 HD13 LEU C 51 5.805 8.910 -4.572 1.00 0.00 H new ATOM 0 HD21 LEU C 51 4.995 11.876 -4.884 1.00 0.00 H new ATOM 0 HD22 LEU C 51 4.649 10.863 -3.463 1.00 0.00 H new ATOM 0 HD23 LEU C 51 5.535 12.394 -3.270 1.00 0.00 H new ATOM 1562 N ASN C 52 6.378 10.875 0.022 1.00 0.00 N ATOM 1563 CA ASN C 52 5.410 11.158 1.079 1.00 0.00 C ATOM 1564 C ASN C 52 5.796 12.407 1.870 1.00 0.00 C ATOM 1565 O ASN C 52 4.930 13.178 2.280 1.00 0.00 O ATOM 1566 CB ASN C 52 5.299 9.958 2.023 1.00 0.00 C ATOM 1567 CG ASN C 52 4.321 10.191 3.160 1.00 0.00 C ATOM 1568 OD1 ASN C 52 3.124 9.954 3.019 1.00 0.00 O ATOM 1569 ND2 ASN C 52 4.827 10.637 4.300 1.00 0.00 N ATOM 0 H ASN C 52 6.745 9.924 0.038 1.00 0.00 H new ATOM 0 HA ASN C 52 4.444 11.342 0.608 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.986 9.082 1.454 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.283 9.735 2.436 1.00 0.00 H new ATOM 0 HD21 ASN C 52 4.216 10.796 5.102 1.00 0.00 H new ATOM 0 HD22 ASN C 52 5.827 10.822 4.376 1.00 0.00 H new ATOM 1576 N ASP C 53 7.094 12.600 2.076 1.00 0.00 N ATOM 1577 CA ASP C 53 7.595 13.761 2.809 1.00 0.00 C ATOM 1578 C ASP C 53 7.554 15.012 1.940 1.00 0.00 C ATOM 1579 O ASP C 53 7.300 16.111 2.422 1.00 0.00 O ATOM 1580 CB ASP C 53 9.023 13.502 3.302 1.00 0.00 C ATOM 1581 CG ASP C 53 9.689 14.748 3.856 1.00 0.00 C ATOM 1582 OD1 ASP C 53 10.500 15.359 3.134 1.00 0.00 O ATOM 1583 OD2 ASP C 53 9.406 15.121 5.016 1.00 0.00 O ATOM 0 H ASP C 53 7.822 11.966 1.745 1.00 0.00 H new ATOM 0 HA ASP C 53 6.949 13.925 3.671 1.00 0.00 H new ATOM 0 HB2 ASP C 53 9.002 12.733 4.074 1.00 0.00 H new ATOM 0 HB3 ASP C 53 9.621 13.111 2.479 1.00 0.00 H new ATOM 1588 N ALA C 54 7.793 14.826 0.658 1.00 0.00 N ATOM 1589 CA ALA C 54 7.788 15.919 -0.297 1.00 0.00 C ATOM 1590 C ALA C 54 6.371 16.415 -0.555 1.00 0.00 C ATOM 1591 O ALA C 54 6.132 17.616 -0.693 1.00 0.00 O ATOM 1592 CB ALA C 54 8.414 15.452 -1.590 1.00 0.00 C ATOM 0 H ALA C 54 7.996 13.915 0.247 1.00 0.00 H new ATOM 0 HA ALA C 54 8.364 16.747 0.116 1.00 0.00 H new ATOM 0 HB1 ALA C 54 8.413 16.270 -2.311 1.00 0.00 H new ATOM 0 HB2 ALA C 54 9.440 15.134 -1.404 1.00 0.00 H new ATOM 0 HB3 ALA C 54 7.842 14.615 -1.990 1.00 0.00 H new ATOM 1598 N GLN C 55 5.437 15.481 -0.616 1.00 0.00 N ATOM 1599 CA GLN C 55 4.040 15.806 -0.849 1.00 0.00 C ATOM 1600 C GLN C 55 3.332 16.032 0.489 1.00 0.00 C ATOM 1601 O GLN C 55 2.106 16.115 0.564 1.00 0.00 O ATOM 1602 CB GLN C 55 3.372 14.684 -1.662 1.00 0.00 C ATOM 1603 CG GLN C 55 1.998 15.045 -2.206 1.00 0.00 C ATOM 1604 CD GLN C 55 1.517 14.101 -3.293 1.00 0.00 C ATOM 1605 OE1 GLN C 55 1.862 12.920 -3.316 1.00 0.00 O ATOM 1606 NE2 GLN C 55 0.716 14.624 -4.207 1.00 0.00 N ATOM 0 H GLN C 55 5.623 14.484 -0.506 1.00 0.00 H new ATOM 0 HA GLN C 55 3.966 16.727 -1.428 1.00 0.00 H new ATOM 0 HB2 GLN C 55 4.022 14.417 -2.495 1.00 0.00 H new ATOM 0 HB3 GLN C 55 3.281 13.799 -1.033 1.00 0.00 H new ATOM 0 HG2 GLN C 55 1.278 15.042 -1.387 1.00 0.00 H new ATOM 0 HG3 GLN C 55 2.027 16.060 -2.602 1.00 0.00 H new ATOM 0 HE21 GLN C 55 0.454 15.608 -4.152 1.00 0.00 H new ATOM 0 HE22 GLN C 55 0.361 14.043 -4.966 1.00 0.00 H new ATOM 1615 N ALA C 56 4.127 16.141 1.546 1.00 0.00 N ATOM 1616 CA ALA C 56 3.607 16.385 2.879 1.00 0.00 C ATOM 1617 C ALA C 56 3.419 17.879 3.125 1.00 0.00 C ATOM 1618 O ALA C 56 4.407 18.553 3.485 1.00 0.00 O ATOM 1619 CB ALA C 56 4.550 15.794 3.908 1.00 0.00 C ATOM 0 H ALA C 56 5.143 16.063 1.501 1.00 0.00 H new ATOM 0 HA ALA C 56 2.632 15.906 2.968 1.00 0.00 H new ATOM 0 HB1 ALA C 56 4.158 15.978 4.908 1.00 0.00 H new ATOM 0 HB2 ALA C 56 4.639 14.720 3.745 1.00 0.00 H new ATOM 0 HB3 ALA C 56 5.531 16.259 3.811 1.00 0.00 H new TER 1625 ALA C 56