USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=19 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 21 ASN : amide:sc= 0 X(o=-1.4,f=-1.6) USER MOD Set 1.2: C 52 ASN : amide:sc= -1.41 K(o=-1.4,f=-9.3!) USER MOD Set 2.1: B 23 ASN : amide:sc= 0.16 K(o=0.3,f=-0.35) USER MOD Set 2.2: B 55 GLN : amide:sc= 0.144 X(o=0.3,f=-0.011) USER MOD Set 3.1: B 21 ASN : amide:sc= 0.18 K(o=-2,f=-2.9) USER MOD Set 3.2: B 52 ASN : amide:sc= -2.15! C(o=-2!,f=-11!) USER MOD Set 4.1: A 19 SER OG : rot 90:sc= -0.769 USER MOD Set 4.2: A 20 SER OG : rot 180:sc= 0.00316 USER MOD Single : A 10 GLN : amide:sc= -1.34! K(o=-1.3!,f=-0.57) USER MOD Single : A 14 ASN : amide:sc= -5.35! C(o=-5.4!,f=-3.3!) USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 22 ASN : amide:sc= -1.97! K(o=-2!,f=0) USER MOD Single : A 28 SER OG : rot 180:sc= -0.0825 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= -0.871 USER MOD Single : B 26 GLN : amide:sc= -0.804 K(o=-0.8,f=-4.6!) USER MOD Single : B 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 33 SER OG : rot 24:sc= -0.0711 USER MOD Single : B 35 HIS : no HE2:sc= -7.73! C(o=-7.7!,f=-5.8!) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= -0.18 K(o=-0.18,f=-1.5!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -0.0321 X(o=-0.032,f=0) USER MOD Single : B 49 LYS NZ :NH3+ 173:sc= 1.24 (180deg=1.16) USER MOD Single : B 50 LYS NZ :NH3+ -167:sc= -0.0194 (180deg=-0.198) USER MOD Single : C 18 TYR OH : rot 30:sc= 0 USER MOD Single : C 23 ASN : amide:sc= -0.332 K(o=-0.33,f=-8.5!) USER MOD Single : C 26 GLN : amide:sc= -1.84! K(o=-1.8!,f=-0.5) USER MOD Single : C 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 33 SER OG : rot 160:sc= -0.137 USER MOD Single : C 35 HIS : no HE2:sc= 1.27 K(o=1.3,f=-5!) USER MOD Single : C 39 SER OG : rot 180:sc= 0 USER MOD Single : C 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 41 SER OG : rot -104:sc= -0.081 USER MOD Single : C 43 ASN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : C 49 LYS NZ :NH3+ -161:sc= -0.035 (180deg=-0.323) USER MOD Single : C 50 LYS NZ :NH3+ -169:sc= 1.29 (180deg=1.18) USER MOD Single : C 55 GLN : amide:sc= -0.0953 K(o=-0.095,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 10 15.662 -11.716 1.050 1.00 0.00 N ATOM 2 CA GLN A 10 15.472 -10.287 0.727 1.00 0.00 C ATOM 3 C GLN A 10 14.343 -9.708 1.542 1.00 0.00 C ATOM 4 O GLN A 10 13.646 -10.421 2.262 1.00 0.00 O ATOM 5 CB GLN A 10 15.174 -10.091 -0.755 1.00 0.00 C ATOM 6 CG GLN A 10 13.984 -10.891 -1.236 1.00 0.00 C ATOM 7 CD GLN A 10 13.687 -10.686 -2.709 1.00 0.00 C ATOM 8 OE1 GLN A 10 14.586 -10.424 -3.506 1.00 0.00 O ATOM 9 NE2 GLN A 10 12.421 -10.807 -3.082 1.00 0.00 N ATOM 0 HA GLN A 10 16.400 -9.769 0.970 1.00 0.00 H new ATOM 0 HB2 GLN A 10 14.993 -9.033 -0.945 1.00 0.00 H new ATOM 0 HB3 GLN A 10 16.052 -10.374 -1.336 1.00 0.00 H new ATOM 0 HG2 GLN A 10 14.167 -11.950 -1.052 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.107 -10.613 -0.652 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.704 -11.025 -2.390 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.164 -10.682 -4.061 1.00 0.00 H new ATOM 18 N ARG A 11 14.153 -8.416 1.403 1.00 0.00 N ATOM 19 CA ARG A 11 13.118 -7.722 2.145 1.00 0.00 C ATOM 20 C ARG A 11 12.087 -7.126 1.201 1.00 0.00 C ATOM 21 O ARG A 11 12.416 -6.609 0.135 1.00 0.00 O ATOM 22 CB ARG A 11 13.712 -6.641 3.043 1.00 0.00 C ATOM 23 CG ARG A 11 14.370 -5.537 2.268 1.00 0.00 C ATOM 24 CD ARG A 11 14.810 -4.399 3.173 1.00 0.00 C ATOM 25 NE ARG A 11 15.646 -4.868 4.281 1.00 0.00 N ATOM 26 CZ ARG A 11 16.517 -4.102 4.937 1.00 0.00 C ATOM 27 NH1 ARG A 11 16.707 -2.842 4.568 1.00 0.00 N ATOM 28 NH2 ARG A 11 17.206 -4.602 5.954 1.00 0.00 N ATOM 0 H ARG A 11 14.701 -7.821 0.782 1.00 0.00 H new ATOM 0 HA ARG A 11 12.620 -8.452 2.783 1.00 0.00 H new ATOM 0 HB2 ARG A 11 12.924 -6.220 3.667 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.443 -7.093 3.714 1.00 0.00 H new ATOM 0 HG2 ARG A 11 15.234 -5.932 1.734 1.00 0.00 H new ATOM 0 HG3 ARG A 11 13.678 -5.157 1.517 1.00 0.00 H new ATOM 0 HD2 ARG A 11 15.363 -3.664 2.588 1.00 0.00 H new ATOM 0 HD3 ARG A 11 13.931 -3.893 3.572 1.00 0.00 H new ATOM 0 HE ARG A 11 15.556 -5.842 4.568 1.00 0.00 H new ATOM 0 HH11 ARG A 11 16.186 -2.457 3.780 1.00 0.00 H new ATOM 0 HH12 ARG A 11 17.374 -2.258 5.072 1.00 0.00 H new ATOM 0 HH21 ARG A 11 17.069 -5.573 6.234 1.00 0.00 H new ATOM 0 HH22 ARG A 11 17.873 -4.015 6.456 1.00 0.00 H new ATOM 42 N LEU A 12 10.841 -7.223 1.612 1.00 0.00 N ATOM 43 CA LEU A 12 9.712 -6.751 0.845 1.00 0.00 C ATOM 44 C LEU A 12 8.861 -5.863 1.709 1.00 0.00 C ATOM 45 O LEU A 12 9.147 -5.676 2.888 1.00 0.00 O ATOM 46 CB LEU A 12 8.847 -7.918 0.335 1.00 0.00 C ATOM 47 CG LEU A 12 9.454 -8.796 -0.760 1.00 0.00 C ATOM 48 CD1 LEU A 12 10.094 -7.934 -1.822 1.00 0.00 C ATOM 49 CD2 LEU A 12 10.458 -9.787 -0.192 1.00 0.00 C ATOM 0 H LEU A 12 10.581 -7.640 2.506 1.00 0.00 H new ATOM 0 HA LEU A 12 10.096 -6.203 -0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.601 -8.555 1.184 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.909 -7.508 -0.039 1.00 0.00 H new ATOM 0 HG LEU A 12 8.649 -9.374 -1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 12 10.523 -8.570 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.341 -7.282 -2.264 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.881 -7.328 -1.373 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.868 -10.393 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.265 -9.245 0.301 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.961 -10.434 0.531 1.00 0.00 H new ATOM 61 N ALA A 13 7.814 -5.319 1.123 1.00 0.00 N ATOM 62 CA ALA A 13 6.881 -4.517 1.869 1.00 0.00 C ATOM 63 C ALA A 13 5.478 -5.050 1.717 1.00 0.00 C ATOM 64 O ALA A 13 4.939 -5.123 0.614 1.00 0.00 O ATOM 65 CB ALA A 13 6.939 -3.070 1.443 1.00 0.00 C ATOM 0 H ALA A 13 7.593 -5.421 0.133 1.00 0.00 H new ATOM 0 HA ALA A 13 7.165 -4.573 2.920 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.223 -2.490 2.025 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.943 -2.681 1.612 1.00 0.00 H new ATOM 0 HB3 ALA A 13 6.693 -2.992 0.384 1.00 0.00 H new ATOM 71 N ASN A 14 4.913 -5.437 2.833 1.00 0.00 N ATOM 72 CA ASN A 14 3.541 -5.880 2.891 1.00 0.00 C ATOM 73 C ASN A 14 2.652 -4.650 2.955 1.00 0.00 C ATOM 74 O ASN A 14 3.077 -3.605 3.451 1.00 0.00 O ATOM 75 CB ASN A 14 3.327 -6.752 4.129 1.00 0.00 C ATOM 76 CG ASN A 14 4.022 -8.108 4.058 1.00 0.00 C ATOM 77 OD1 ASN A 14 3.583 -9.069 4.687 1.00 0.00 O ATOM 78 ND2 ASN A 14 5.101 -8.202 3.296 1.00 0.00 N ATOM 0 H ASN A 14 5.394 -5.454 3.732 1.00 0.00 H new ATOM 0 HA ASN A 14 3.296 -6.473 2.010 1.00 0.00 H new ATOM 0 HB2 ASN A 14 3.688 -6.215 5.006 1.00 0.00 H new ATOM 0 HB3 ASN A 14 2.258 -6.910 4.270 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.594 -9.091 3.218 1.00 0.00 H new ATOM 0 HD22 ASN A 14 5.439 -7.385 2.787 1.00 0.00 H new ATOM 85 N PHE A 15 1.440 -4.749 2.451 1.00 0.00 N ATOM 86 CA PHE A 15 0.552 -3.603 2.448 1.00 0.00 C ATOM 87 C PHE A 15 -0.542 -3.787 3.483 1.00 0.00 C ATOM 88 O PHE A 15 -1.433 -4.617 3.321 1.00 0.00 O ATOM 89 CB PHE A 15 -0.066 -3.399 1.065 1.00 0.00 C ATOM 90 CG PHE A 15 -0.635 -2.023 0.861 1.00 0.00 C ATOM 91 CD1 PHE A 15 -1.986 -1.779 1.054 1.00 0.00 C ATOM 92 CD2 PHE A 15 0.182 -0.973 0.469 1.00 0.00 C ATOM 93 CE1 PHE A 15 -2.509 -0.514 0.862 1.00 0.00 C ATOM 94 CE2 PHE A 15 -0.336 0.293 0.277 1.00 0.00 C ATOM 95 CZ PHE A 15 -1.684 0.522 0.473 1.00 0.00 C ATOM 0 H PHE A 15 1.050 -5.598 2.043 1.00 0.00 H new ATOM 0 HA PHE A 15 1.136 -2.717 2.699 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.693 -3.586 0.305 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.855 -4.136 0.916 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.637 -2.586 1.358 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.236 -1.147 0.312 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.563 -0.336 1.016 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.312 1.102 -0.026 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.092 1.511 0.322 1.00 0.00 H new ATOM 105 N LEU A 16 -0.461 -3.025 4.554 1.00 0.00 N ATOM 106 CA LEU A 16 -1.468 -3.079 5.594 1.00 0.00 C ATOM 107 C LEU A 16 -2.241 -1.778 5.587 1.00 0.00 C ATOM 108 O LEU A 16 -1.778 -0.776 5.044 1.00 0.00 O ATOM 109 CB LEU A 16 -0.844 -3.333 6.980 1.00 0.00 C ATOM 110 CG LEU A 16 -0.286 -2.102 7.709 1.00 0.00 C ATOM 111 CD1 LEU A 16 0.340 -2.499 9.038 1.00 0.00 C ATOM 112 CD2 LEU A 16 0.729 -1.392 6.856 1.00 0.00 C ATOM 0 H LEU A 16 0.293 -2.360 4.727 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.140 -3.913 5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.599 -3.795 7.616 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.038 -4.058 6.865 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.117 -1.423 7.903 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.729 -1.611 9.537 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.414 -2.969 9.669 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.154 -3.201 8.861 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.111 -0.523 7.392 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.552 -2.070 6.630 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.260 -1.068 5.927 1.00 0.00 H new ATOM 124 N VAL A 17 -3.411 -1.788 6.165 1.00 0.00 N ATOM 125 CA VAL A 17 -4.219 -0.602 6.194 1.00 0.00 C ATOM 126 C VAL A 17 -5.114 -0.562 7.420 1.00 0.00 C ATOM 127 O VAL A 17 -5.812 -1.528 7.734 1.00 0.00 O ATOM 128 CB VAL A 17 -5.061 -0.473 4.904 1.00 0.00 C ATOM 129 CG1 VAL A 17 -5.702 -1.783 4.512 1.00 0.00 C ATOM 130 CG2 VAL A 17 -6.121 0.588 5.069 1.00 0.00 C ATOM 0 H VAL A 17 -3.824 -2.602 6.621 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.540 0.249 6.250 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.380 -0.183 4.104 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.284 -1.645 3.601 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.927 -2.530 4.339 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -6.359 -2.121 5.314 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.704 0.665 4.151 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.779 0.320 5.896 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.647 1.547 5.279 1.00 0.00 H new ATOM 140 N HIS A 18 -5.056 0.557 8.124 1.00 0.00 N ATOM 141 CA HIS A 18 -5.988 0.831 9.196 1.00 0.00 C ATOM 142 C HIS A 18 -7.321 1.192 8.553 1.00 0.00 C ATOM 143 O HIS A 18 -7.476 2.293 8.019 1.00 0.00 O ATOM 144 CB HIS A 18 -5.487 1.975 10.082 1.00 0.00 C ATOM 145 CG HIS A 18 -6.284 2.146 11.339 1.00 0.00 C ATOM 146 ND1 HIS A 18 -7.155 3.193 11.545 1.00 0.00 N ATOM 147 CD2 HIS A 18 -6.340 1.390 12.461 1.00 0.00 C ATOM 148 CE1 HIS A 18 -7.712 3.073 12.735 1.00 0.00 C ATOM 149 NE2 HIS A 18 -7.236 1.987 13.310 1.00 0.00 N ATOM 0 H HIS A 18 -4.367 1.292 7.968 1.00 0.00 H new ATOM 0 HA HIS A 18 -6.094 -0.043 9.839 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -4.445 1.793 10.343 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -5.515 2.904 9.513 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -5.782 0.485 12.652 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -8.435 3.750 13.165 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -7.493 1.646 14.236 1.00 0.00 H new ATOM 158 N SER A 19 -8.254 0.253 8.633 1.00 0.00 N ATOM 159 CA SER A 19 -9.476 0.212 7.819 1.00 0.00 C ATOM 160 C SER A 19 -10.104 1.570 7.471 1.00 0.00 C ATOM 161 O SER A 19 -10.552 1.761 6.341 1.00 0.00 O ATOM 162 CB SER A 19 -10.511 -0.663 8.524 1.00 0.00 C ATOM 163 OG SER A 19 -10.663 -0.281 9.882 1.00 0.00 O ATOM 0 H SER A 19 -8.185 -0.529 9.285 1.00 0.00 H new ATOM 0 HA SER A 19 -9.166 -0.201 6.859 1.00 0.00 H new ATOM 0 HB2 SER A 19 -11.469 -0.583 8.011 1.00 0.00 H new ATOM 0 HB3 SER A 19 -10.206 -1.708 8.469 1.00 0.00 H new ATOM 0 HG SER A 19 -11.363 0.401 9.954 1.00 0.00 H new ATOM 169 N SER A 20 -10.148 2.503 8.413 1.00 0.00 N ATOM 170 CA SER A 20 -10.953 3.703 8.228 1.00 0.00 C ATOM 171 C SER A 20 -10.382 4.661 7.170 1.00 0.00 C ATOM 172 O SER A 20 -11.074 5.003 6.212 1.00 0.00 O ATOM 173 CB SER A 20 -11.078 4.429 9.563 1.00 0.00 C ATOM 174 OG SER A 20 -11.281 3.507 10.623 1.00 0.00 O ATOM 0 H SER A 20 -9.645 2.455 9.299 1.00 0.00 H new ATOM 0 HA SER A 20 -11.929 3.383 7.864 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.176 5.012 9.750 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.910 5.132 9.523 1.00 0.00 H new ATOM 0 HG SER A 20 -11.357 3.994 11.470 1.00 0.00 H new ATOM 180 N ASN A 21 -9.134 5.095 7.328 1.00 0.00 N ATOM 181 CA ASN A 21 -8.568 6.079 6.399 1.00 0.00 C ATOM 182 C ASN A 21 -7.136 5.756 5.967 1.00 0.00 C ATOM 183 O ASN A 21 -6.734 6.061 4.845 1.00 0.00 O ATOM 184 CB ASN A 21 -8.619 7.480 7.027 1.00 0.00 C ATOM 185 CG ASN A 21 -7.969 8.547 6.158 1.00 0.00 C ATOM 186 OD1 ASN A 21 -6.778 8.838 6.295 1.00 0.00 O ATOM 187 ND2 ASN A 21 -8.744 9.143 5.265 1.00 0.00 N ATOM 0 H ASN A 21 -8.505 4.792 8.071 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.181 6.043 5.498 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -9.659 7.752 7.210 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.121 7.456 7.996 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -8.360 9.870 4.661 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -9.725 8.875 5.181 1.00 0.00 H new ATOM 194 N ASN A 22 -6.374 5.127 6.847 1.00 0.00 N ATOM 195 CA ASN A 22 -4.920 5.098 6.697 1.00 0.00 C ATOM 196 C ASN A 22 -4.414 3.800 6.077 1.00 0.00 C ATOM 197 O ASN A 22 -4.332 2.779 6.751 1.00 0.00 O ATOM 198 CB ASN A 22 -4.251 5.307 8.062 1.00 0.00 C ATOM 199 CG ASN A 22 -4.534 6.674 8.664 1.00 0.00 C ATOM 200 OD1 ASN A 22 -5.557 6.878 9.320 1.00 0.00 O ATOM 201 ND2 ASN A 22 -3.619 7.609 8.480 1.00 0.00 N ATOM 0 H ASN A 22 -6.729 4.633 7.666 1.00 0.00 H new ATOM 0 HA ASN A 22 -4.656 5.907 6.016 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -4.596 4.535 8.750 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -3.174 5.180 7.955 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -3.747 8.535 8.887 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -2.784 7.404 7.931 1.00 0.00 H new ATOM 208 N PHE A 23 -4.077 3.843 4.792 1.00 0.00 N ATOM 209 CA PHE A 23 -3.382 2.748 4.150 1.00 0.00 C ATOM 210 C PHE A 23 -1.883 2.952 4.288 1.00 0.00 C ATOM 211 O PHE A 23 -1.385 4.062 4.103 1.00 0.00 O ATOM 212 CB PHE A 23 -3.782 2.626 2.671 1.00 0.00 C ATOM 213 CG PHE A 23 -3.992 3.936 1.936 1.00 0.00 C ATOM 214 CD1 PHE A 23 -3.054 4.417 1.018 1.00 0.00 C ATOM 215 CD2 PHE A 23 -5.142 4.684 2.154 1.00 0.00 C ATOM 216 CE1 PHE A 23 -3.269 5.608 0.351 1.00 0.00 C ATOM 217 CE2 PHE A 23 -5.353 5.874 1.488 1.00 0.00 C ATOM 218 CZ PHE A 23 -4.417 6.336 0.586 1.00 0.00 C ATOM 0 H PHE A 23 -4.278 4.632 4.177 1.00 0.00 H new ATOM 0 HA PHE A 23 -3.665 1.817 4.641 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.011 2.058 2.151 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.702 2.044 2.609 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -2.153 3.853 0.828 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -5.882 4.329 2.856 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.537 5.970 -0.356 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -6.251 6.444 1.673 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.583 7.267 0.064 1.00 0.00 H new ATOM 228 N GLY A 24 -1.166 1.897 4.637 1.00 0.00 N ATOM 229 CA GLY A 24 0.250 2.043 4.870 1.00 0.00 C ATOM 230 C GLY A 24 1.066 0.912 4.298 1.00 0.00 C ATOM 231 O GLY A 24 0.572 0.101 3.517 1.00 0.00 O ATOM 0 H GLY A 24 -1.535 0.954 4.761 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.588 2.983 4.434 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.430 2.106 5.943 1.00 0.00 H new ATOM 235 N ALA A 25 2.318 0.855 4.706 1.00 0.00 N ATOM 236 CA ALA A 25 3.239 -0.152 4.240 1.00 0.00 C ATOM 237 C ALA A 25 4.027 -0.683 5.409 1.00 0.00 C ATOM 238 O ALA A 25 3.999 -0.108 6.490 1.00 0.00 O ATOM 239 CB ALA A 25 4.153 0.416 3.161 1.00 0.00 C ATOM 0 H ALA A 25 2.723 1.511 5.374 1.00 0.00 H new ATOM 0 HA ALA A 25 2.684 -0.976 3.792 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.841 -0.359 2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.552 0.761 2.320 1.00 0.00 H new ATOM 0 HB3 ALA A 25 4.721 1.252 3.568 1.00 0.00 H new ATOM 245 N ILE A 26 4.677 -1.804 5.215 1.00 0.00 N ATOM 246 CA ILE A 26 5.453 -2.417 6.270 1.00 0.00 C ATOM 247 C ILE A 26 6.452 -3.403 5.687 1.00 0.00 C ATOM 248 O ILE A 26 6.101 -4.244 4.863 1.00 0.00 O ATOM 249 CB ILE A 26 4.525 -3.093 7.296 1.00 0.00 C ATOM 250 CG1 ILE A 26 5.326 -3.884 8.324 1.00 0.00 C ATOM 251 CG2 ILE A 26 3.509 -3.989 6.602 1.00 0.00 C ATOM 252 CD1 ILE A 26 4.517 -4.203 9.550 1.00 0.00 C ATOM 0 H ILE A 26 4.685 -2.314 4.332 1.00 0.00 H new ATOM 0 HA ILE A 26 6.015 -1.642 6.791 1.00 0.00 H new ATOM 0 HB ILE A 26 3.984 -2.307 7.823 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.679 -4.811 7.872 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.209 -3.313 8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 26 2.865 -4.455 7.348 1.00 0.00 H new ATOM 0 HG22 ILE A 26 2.902 -3.392 5.921 1.00 0.00 H new ATOM 0 HG23 ILE A 26 4.031 -4.763 6.039 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.129 -4.767 10.253 1.00 0.00 H new ATOM 0 HD12 ILE A 26 4.186 -3.276 10.019 1.00 0.00 H new ATOM 0 HD13 ILE A 26 3.648 -4.797 9.268 1.00 0.00 H new ATOM 264 N LEU A 27 7.697 -3.298 6.108 1.00 0.00 N ATOM 265 CA LEU A 27 8.752 -4.102 5.531 1.00 0.00 C ATOM 266 C LEU A 27 8.873 -5.436 6.225 1.00 0.00 C ATOM 267 O LEU A 27 8.471 -5.603 7.374 1.00 0.00 O ATOM 268 CB LEU A 27 10.093 -3.385 5.568 1.00 0.00 C ATOM 269 CG LEU A 27 10.245 -2.213 4.601 1.00 0.00 C ATOM 270 CD1 LEU A 27 11.658 -1.710 4.647 1.00 0.00 C ATOM 271 CD2 LEU A 27 9.915 -2.611 3.174 1.00 0.00 C ATOM 0 H LEU A 27 8.001 -2.664 6.847 1.00 0.00 H new ATOM 0 HA LEU A 27 8.478 -4.271 4.490 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.261 -3.020 6.581 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.878 -4.111 5.356 1.00 0.00 H new ATOM 0 HG LEU A 27 9.546 -1.436 4.910 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.769 -0.873 3.957 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.894 -1.380 5.659 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.339 -2.511 4.358 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.036 -1.749 2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.587 -3.407 2.854 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.885 -2.964 3.124 1.00 0.00 H new ATOM 283 N SER A 28 9.382 -6.392 5.486 1.00 0.00 N ATOM 284 CA SER A 28 9.493 -7.753 5.954 1.00 0.00 C ATOM 285 C SER A 28 10.681 -8.439 5.297 1.00 0.00 C ATOM 286 O SER A 28 10.744 -8.549 4.071 1.00 0.00 O ATOM 287 CB SER A 28 8.205 -8.503 5.632 1.00 0.00 C ATOM 288 OG SER A 28 7.081 -7.848 6.202 1.00 0.00 O ATOM 0 H SER A 28 9.732 -6.248 4.539 1.00 0.00 H new ATOM 0 HA SER A 28 9.650 -7.753 7.033 1.00 0.00 H new ATOM 0 HB2 SER A 28 8.081 -8.573 4.551 1.00 0.00 H new ATOM 0 HB3 SER A 28 8.268 -9.523 6.012 1.00 0.00 H new ATOM 0 HG SER A 28 6.266 -8.345 5.981 1.00 0.00 H new ATOM 294 N SER A 29 11.624 -8.881 6.105 1.00 0.00 N ATOM 295 CA SER A 29 12.810 -9.543 5.594 1.00 0.00 C ATOM 296 C SER A 29 12.703 -11.051 5.782 1.00 0.00 C ATOM 297 O SER A 29 12.640 -11.807 4.812 1.00 0.00 O ATOM 298 CB SER A 29 14.050 -9.002 6.301 1.00 0.00 C ATOM 299 OG SER A 29 14.088 -7.586 6.238 1.00 0.00 O ATOM 0 H SER A 29 11.593 -8.794 7.121 1.00 0.00 H new ATOM 0 HA SER A 29 12.895 -9.339 4.527 1.00 0.00 H new ATOM 0 HB2 SER A 29 14.050 -9.324 7.342 1.00 0.00 H new ATOM 0 HB3 SER A 29 14.947 -9.415 5.839 1.00 0.00 H new ATOM 0 HG SER A 29 14.889 -7.259 6.698 1.00 0.00 H new ATOM 305 N THR A 30 12.672 -11.484 7.030 1.00 0.00 N ATOM 306 CA THR A 30 12.550 -12.894 7.340 1.00 0.00 C ATOM 307 C THR A 30 11.300 -13.153 8.171 1.00 0.00 C ATOM 308 O THR A 30 10.215 -13.313 7.574 1.00 0.00 O ATOM 309 CB THR A 30 13.801 -13.405 8.083 1.00 0.00 C ATOM 310 OG1 THR A 30 14.195 -12.456 9.087 1.00 0.00 O ATOM 311 CG2 THR A 30 14.952 -13.633 7.114 1.00 0.00 C ATOM 0 H THR A 30 12.730 -10.875 7.847 1.00 0.00 H new ATOM 0 HA THR A 30 12.464 -13.439 6.400 1.00 0.00 H new ATOM 0 HB THR A 30 13.553 -14.355 8.556 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.989 -12.787 9.556 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.823 -13.993 7.662 1.00 0.00 H new ATOM 0 HG22 THR A 30 14.660 -14.374 6.370 1.00 0.00 H new ATOM 0 HG23 THR A 30 15.199 -12.696 6.616 1.00 0.00 H new TER 319 THR A 30 ATOM 320 N GLY B 13 -15.526 1.054 14.042 1.00 0.00 N ATOM 321 CA GLY B 13 -14.423 0.187 14.517 1.00 0.00 C ATOM 322 C GLY B 13 -13.119 0.511 13.827 1.00 0.00 C ATOM 323 O GLY B 13 -12.890 1.653 13.426 1.00 0.00 O ATOM 0 HA2 GLY B 13 -14.304 0.307 15.594 1.00 0.00 H new ATOM 0 HA3 GLY B 13 -14.679 -0.857 14.339 1.00 0.00 H new ATOM 327 N GLY B 14 -12.267 -0.490 13.682 1.00 0.00 N ATOM 328 CA GLY B 14 -10.994 -0.288 13.032 1.00 0.00 C ATOM 329 C GLY B 14 -10.110 -1.510 13.121 1.00 0.00 C ATOM 330 O GLY B 14 -9.786 -1.971 14.218 1.00 0.00 O ATOM 0 H GLY B 14 -12.437 -1.443 14.005 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -11.158 -0.036 11.984 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.485 0.561 13.488 1.00 0.00 H new ATOM 334 N GLU B 15 -9.743 -2.052 11.973 1.00 0.00 N ATOM 335 CA GLU B 15 -8.841 -3.181 11.914 1.00 0.00 C ATOM 336 C GLU B 15 -7.719 -2.878 10.932 1.00 0.00 C ATOM 337 O GLU B 15 -7.910 -2.131 9.973 1.00 0.00 O ATOM 338 CB GLU B 15 -9.606 -4.432 11.485 1.00 0.00 C ATOM 339 CG GLU B 15 -10.155 -4.354 10.070 1.00 0.00 C ATOM 340 CD GLU B 15 -11.049 -5.526 9.719 1.00 0.00 C ATOM 341 OE1 GLU B 15 -12.267 -5.440 9.976 1.00 0.00 O ATOM 342 OE2 GLU B 15 -10.545 -6.535 9.184 1.00 0.00 O ATOM 0 H GLU B 15 -10.062 -1.722 11.062 1.00 0.00 H new ATOM 0 HA GLU B 15 -8.410 -3.360 12.899 1.00 0.00 H new ATOM 0 HB2 GLU B 15 -8.946 -5.296 11.563 1.00 0.00 H new ATOM 0 HB3 GLU B 15 -10.431 -4.598 12.177 1.00 0.00 H new ATOM 0 HG2 GLU B 15 -10.717 -3.427 9.954 1.00 0.00 H new ATOM 0 HG3 GLU B 15 -9.325 -4.313 9.365 1.00 0.00 H new ATOM 349 N ILE B 16 -6.544 -3.417 11.191 1.00 0.00 N ATOM 350 CA ILE B 16 -5.428 -3.267 10.279 1.00 0.00 C ATOM 351 C ILE B 16 -5.308 -4.495 9.408 1.00 0.00 C ATOM 352 O ILE B 16 -4.829 -5.540 9.849 1.00 0.00 O ATOM 353 CB ILE B 16 -4.117 -3.023 11.045 1.00 0.00 C ATOM 354 CG1 ILE B 16 -4.215 -1.675 11.753 1.00 0.00 C ATOM 355 CG2 ILE B 16 -2.904 -3.075 10.113 1.00 0.00 C ATOM 356 CD1 ILE B 16 -3.075 -1.393 12.690 1.00 0.00 C ATOM 0 H ILE B 16 -6.337 -3.964 12.027 1.00 0.00 H new ATOM 0 HA ILE B 16 -5.613 -2.398 9.648 1.00 0.00 H new ATOM 0 HB ILE B 16 -3.975 -3.814 11.781 1.00 0.00 H new ATOM 0 HG12 ILE B 16 -4.260 -0.885 11.003 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -5.150 -1.637 12.312 1.00 0.00 H new ATOM 0 HG21 ILE B 16 -1.995 -2.898 10.688 1.00 0.00 H new ATOM 0 HG22 ILE B 16 -2.850 -4.056 9.641 1.00 0.00 H new ATOM 0 HG23 ILE B 16 -3.002 -2.308 9.345 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -3.218 -0.417 13.154 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -3.041 -2.161 13.463 1.00 0.00 H new ATOM 0 HD13 ILE B 16 -2.138 -1.397 12.134 1.00 0.00 H new ATOM 368 N VAL B 17 -5.767 -4.383 8.177 1.00 0.00 N ATOM 369 CA VAL B 17 -5.720 -5.513 7.285 1.00 0.00 C ATOM 370 C VAL B 17 -4.417 -5.568 6.519 1.00 0.00 C ATOM 371 O VAL B 17 -4.062 -4.673 5.757 1.00 0.00 O ATOM 372 CB VAL B 17 -6.932 -5.617 6.337 1.00 0.00 C ATOM 373 CG1 VAL B 17 -8.094 -6.242 7.078 1.00 0.00 C ATOM 374 CG2 VAL B 17 -7.351 -4.282 5.771 1.00 0.00 C ATOM 0 H VAL B 17 -6.170 -3.534 7.781 1.00 0.00 H new ATOM 0 HA VAL B 17 -5.775 -6.389 7.931 1.00 0.00 H new ATOM 0 HB VAL B 17 -6.632 -6.240 5.494 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.953 -6.317 6.411 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -7.813 -7.238 7.422 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -8.354 -5.622 7.936 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -8.208 -4.419 5.112 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -7.624 -3.611 6.585 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -6.524 -3.851 5.207 1.00 0.00 H new ATOM 384 N TYR B 18 -3.697 -6.621 6.816 1.00 0.00 N ATOM 385 CA TYR B 18 -2.434 -6.959 6.194 1.00 0.00 C ATOM 386 C TYR B 18 -2.683 -7.705 4.882 1.00 0.00 C ATOM 387 O TYR B 18 -3.046 -8.880 4.909 1.00 0.00 O ATOM 388 CB TYR B 18 -1.693 -7.881 7.164 1.00 0.00 C ATOM 389 CG TYR B 18 -0.241 -7.561 7.428 1.00 0.00 C ATOM 390 CD1 TYR B 18 0.144 -6.399 8.092 1.00 0.00 C ATOM 391 CD2 TYR B 18 0.747 -8.469 7.076 1.00 0.00 C ATOM 392 CE1 TYR B 18 1.457 -6.152 8.389 1.00 0.00 C ATOM 393 CE2 TYR B 18 2.071 -8.225 7.359 1.00 0.00 C ATOM 394 CZ TYR B 18 2.424 -7.070 8.018 1.00 0.00 C ATOM 395 OH TYR B 18 3.745 -6.843 8.318 1.00 0.00 O ATOM 0 H TYR B 18 -3.983 -7.295 7.526 1.00 0.00 H new ATOM 0 HA TYR B 18 -1.856 -6.060 5.978 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -2.223 -7.869 8.117 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -1.753 -8.899 6.779 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -0.608 -5.679 8.378 1.00 0.00 H new ATOM 0 HD2 TYR B 18 0.472 -9.383 6.571 1.00 0.00 H new ATOM 0 HE1 TYR B 18 1.736 -5.248 8.909 1.00 0.00 H new ATOM 0 HE2 TYR B 18 2.829 -8.936 7.066 1.00 0.00 H new ATOM 0 HH TYR B 18 4.289 -7.588 7.986 1.00 0.00 H new ATOM 405 N LEU B 19 -2.542 -7.032 3.744 1.00 0.00 N ATOM 406 CA LEU B 19 -2.640 -7.710 2.457 1.00 0.00 C ATOM 407 C LEU B 19 -1.255 -7.802 1.805 1.00 0.00 C ATOM 408 O LEU B 19 -0.872 -6.930 1.023 1.00 0.00 O ATOM 409 CB LEU B 19 -3.594 -6.967 1.499 1.00 0.00 C ATOM 410 CG LEU B 19 -4.989 -6.651 1.986 1.00 0.00 C ATOM 411 CD1 LEU B 19 -5.605 -7.879 2.566 1.00 0.00 C ATOM 412 CD2 LEU B 19 -4.996 -5.485 2.962 1.00 0.00 C ATOM 0 H LEU B 19 -2.362 -6.030 3.687 1.00 0.00 H new ATOM 0 HA LEU B 19 -3.036 -8.709 2.641 1.00 0.00 H new ATOM 0 HB2 LEU B 19 -3.118 -6.027 1.217 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -3.685 -7.563 0.591 1.00 0.00 H new ATOM 0 HG LEU B 19 -5.595 -6.333 1.137 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -6.611 -7.650 2.917 1.00 0.00 H new ATOM 0 HD12 LEU B 19 -5.655 -8.656 1.803 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -5.000 -8.229 3.402 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -6.018 -5.290 3.288 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -4.379 -5.731 3.827 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -4.596 -4.598 2.472 1.00 0.00 H new ATOM 424 N PRO B 20 -0.477 -8.854 2.118 1.00 0.00 N ATOM 425 CA PRO B 20 0.844 -9.065 1.522 1.00 0.00 C ATOM 426 C PRO B 20 0.815 -9.796 0.175 1.00 0.00 C ATOM 427 O PRO B 20 1.785 -9.741 -0.581 1.00 0.00 O ATOM 428 CB PRO B 20 1.548 -9.929 2.563 1.00 0.00 C ATOM 429 CG PRO B 20 0.461 -10.724 3.201 1.00 0.00 C ATOM 430 CD PRO B 20 -0.786 -9.880 3.135 1.00 0.00 C ATOM 0 HA PRO B 20 1.329 -8.115 1.299 1.00 0.00 H new ATOM 0 HB2 PRO B 20 2.292 -10.577 2.100 1.00 0.00 H new ATOM 0 HB3 PRO B 20 2.072 -9.316 3.297 1.00 0.00 H new ATOM 0 HG2 PRO B 20 0.316 -11.670 2.680 1.00 0.00 H new ATOM 0 HG3 PRO B 20 0.712 -10.964 4.234 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -1.654 -10.474 2.850 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -1.012 -9.428 4.101 1.00 0.00 H new ATOM 438 N ASN B 21 -0.283 -10.480 -0.125 1.00 0.00 N ATOM 439 CA ASN B 21 -0.337 -11.325 -1.318 1.00 0.00 C ATOM 440 C ASN B 21 -1.047 -10.644 -2.480 1.00 0.00 C ATOM 441 O ASN B 21 -1.230 -11.250 -3.534 1.00 0.00 O ATOM 442 CB ASN B 21 -1.026 -12.661 -1.019 1.00 0.00 C ATOM 443 CG ASN B 21 -0.264 -13.507 -0.019 1.00 0.00 C ATOM 444 OD1 ASN B 21 0.652 -14.244 -0.381 1.00 0.00 O ATOM 445 ND2 ASN B 21 -0.652 -13.424 1.243 1.00 0.00 N ATOM 0 H ASN B 21 -1.138 -10.469 0.431 1.00 0.00 H new ATOM 0 HA ASN B 21 0.698 -11.505 -1.609 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -2.028 -12.469 -0.636 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -1.141 -13.220 -1.947 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -0.187 -13.984 1.957 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -1.416 -12.800 1.502 1.00 0.00 H new ATOM 452 N LEU B 22 -1.440 -9.390 -2.304 1.00 0.00 N ATOM 453 CA LEU B 22 -2.128 -8.670 -3.368 1.00 0.00 C ATOM 454 C LEU B 22 -1.173 -8.334 -4.501 1.00 0.00 C ATOM 455 O LEU B 22 0.048 -8.312 -4.327 1.00 0.00 O ATOM 456 CB LEU B 22 -2.758 -7.377 -2.859 1.00 0.00 C ATOM 457 CG LEU B 22 -3.933 -7.535 -1.899 1.00 0.00 C ATOM 458 CD1 LEU B 22 -4.490 -6.173 -1.534 1.00 0.00 C ATOM 459 CD2 LEU B 22 -5.026 -8.393 -2.486 1.00 0.00 C ATOM 0 H LEU B 22 -1.297 -8.855 -1.447 1.00 0.00 H new ATOM 0 HA LEU B 22 -2.916 -9.329 -3.733 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -1.985 -6.791 -2.361 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -3.093 -6.797 -3.719 1.00 0.00 H new ATOM 0 HG LEU B 22 -3.562 -8.034 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -5.329 -6.295 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -3.712 -5.579 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -4.830 -5.665 -2.437 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -5.844 -8.480 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -5.394 -7.935 -3.404 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -4.631 -9.384 -2.708 1.00 0.00 H new ATOM 471 N ASN B 23 -1.744 -8.069 -5.658 1.00 0.00 N ATOM 472 CA ASN B 23 -0.962 -7.699 -6.828 1.00 0.00 C ATOM 473 C ASN B 23 -0.759 -6.193 -6.872 1.00 0.00 C ATOM 474 O ASN B 23 -1.621 -5.450 -6.401 1.00 0.00 O ATOM 475 CB ASN B 23 -1.661 -8.153 -8.111 1.00 0.00 C ATOM 476 CG ASN B 23 -1.796 -9.657 -8.210 1.00 0.00 C ATOM 477 OD1 ASN B 23 -0.942 -10.407 -7.735 1.00 0.00 O ATOM 478 ND2 ASN B 23 -2.874 -10.108 -8.826 1.00 0.00 N ATOM 0 H ASN B 23 -2.751 -8.102 -5.817 1.00 0.00 H new ATOM 0 HA ASN B 23 0.007 -8.194 -6.757 1.00 0.00 H new ATOM 0 HB2 ASN B 23 -2.652 -7.701 -8.158 1.00 0.00 H new ATOM 0 HB3 ASN B 23 -1.102 -7.786 -8.972 1.00 0.00 H new ATOM 0 HD21 ASN B 23 -3.024 -11.112 -8.923 1.00 0.00 H new ATOM 0 HD22 ASN B 23 -3.557 -9.452 -9.205 1.00 0.00 H new ATOM 485 N PRO B 24 0.374 -5.718 -7.418 1.00 0.00 N ATOM 486 CA PRO B 24 0.647 -4.281 -7.546 1.00 0.00 C ATOM 487 C PRO B 24 -0.532 -3.522 -8.151 1.00 0.00 C ATOM 488 O PRO B 24 -1.012 -2.533 -7.581 1.00 0.00 O ATOM 489 CB PRO B 24 1.854 -4.238 -8.482 1.00 0.00 C ATOM 490 CG PRO B 24 2.561 -5.525 -8.234 1.00 0.00 C ATOM 491 CD PRO B 24 1.487 -6.537 -7.937 1.00 0.00 C ATOM 0 HA PRO B 24 0.823 -3.806 -6.581 1.00 0.00 H new ATOM 0 HB2 PRO B 24 1.546 -4.148 -9.524 1.00 0.00 H new ATOM 0 HB3 PRO B 24 2.495 -3.384 -8.264 1.00 0.00 H new ATOM 0 HG2 PRO B 24 3.147 -5.822 -9.103 1.00 0.00 H new ATOM 0 HG3 PRO B 24 3.254 -5.435 -7.398 1.00 0.00 H new ATOM 0 HD2 PRO B 24 1.196 -7.088 -8.832 1.00 0.00 H new ATOM 0 HD3 PRO B 24 1.820 -7.272 -7.204 1.00 0.00 H new ATOM 499 N ASP B 25 -1.019 -4.025 -9.284 1.00 0.00 N ATOM 500 CA ASP B 25 -2.165 -3.435 -9.969 1.00 0.00 C ATOM 501 C ASP B 25 -3.381 -3.370 -9.054 1.00 0.00 C ATOM 502 O ASP B 25 -4.128 -2.399 -9.080 1.00 0.00 O ATOM 503 CB ASP B 25 -2.517 -4.240 -11.221 1.00 0.00 C ATOM 504 CG ASP B 25 -3.771 -3.731 -11.907 1.00 0.00 C ATOM 505 OD1 ASP B 25 -4.846 -4.333 -11.714 1.00 0.00 O ATOM 506 OD2 ASP B 25 -3.686 -2.720 -12.639 1.00 0.00 O ATOM 0 H ASP B 25 -0.633 -4.847 -9.749 1.00 0.00 H new ATOM 0 HA ASP B 25 -1.887 -2.421 -10.256 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -1.682 -4.200 -11.921 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -2.655 -5.286 -10.949 1.00 0.00 H new ATOM 511 N GLN B 26 -3.562 -4.398 -8.237 1.00 0.00 N ATOM 512 CA GLN B 26 -4.723 -4.481 -7.363 1.00 0.00 C ATOM 513 C GLN B 26 -4.627 -3.499 -6.206 1.00 0.00 C ATOM 514 O GLN B 26 -5.633 -2.933 -5.796 1.00 0.00 O ATOM 515 CB GLN B 26 -4.904 -5.908 -6.860 1.00 0.00 C ATOM 516 CG GLN B 26 -5.310 -6.861 -7.968 1.00 0.00 C ATOM 517 CD GLN B 26 -6.763 -6.705 -8.382 1.00 0.00 C ATOM 518 OE1 GLN B 26 -7.338 -5.618 -8.301 1.00 0.00 O ATOM 519 NE2 GLN B 26 -7.366 -7.791 -8.833 1.00 0.00 N ATOM 0 H GLN B 26 -2.919 -5.186 -8.161 1.00 0.00 H new ATOM 0 HA GLN B 26 -5.602 -4.204 -7.944 1.00 0.00 H new ATOM 0 HB2 GLN B 26 -3.973 -6.253 -6.410 1.00 0.00 H new ATOM 0 HB3 GLN B 26 -5.661 -5.921 -6.076 1.00 0.00 H new ATOM 0 HG2 GLN B 26 -4.671 -6.695 -8.835 1.00 0.00 H new ATOM 0 HG3 GLN B 26 -5.140 -7.886 -7.639 1.00 0.00 H new ATOM 0 HE21 GLN B 26 -6.856 -8.673 -8.885 1.00 0.00 H new ATOM 0 HE22 GLN B 26 -8.341 -7.747 -9.129 1.00 0.00 H new ATOM 528 N LEU B 27 -3.426 -3.283 -5.681 1.00 0.00 N ATOM 529 CA LEU B 27 -3.233 -2.238 -4.684 1.00 0.00 C ATOM 530 C LEU B 27 -3.566 -0.893 -5.302 1.00 0.00 C ATOM 531 O LEU B 27 -4.321 -0.104 -4.739 1.00 0.00 O ATOM 532 CB LEU B 27 -1.797 -2.221 -4.156 1.00 0.00 C ATOM 533 CG LEU B 27 -1.365 -3.472 -3.405 1.00 0.00 C ATOM 534 CD1 LEU B 27 0.126 -3.437 -3.142 1.00 0.00 C ATOM 535 CD2 LEU B 27 -2.121 -3.578 -2.101 1.00 0.00 C ATOM 0 H LEU B 27 -2.585 -3.807 -5.924 1.00 0.00 H new ATOM 0 HA LEU B 27 -3.895 -2.442 -3.842 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -1.120 -2.070 -4.997 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -1.681 -1.362 -3.495 1.00 0.00 H new ATOM 0 HG LEU B 27 -1.591 -4.345 -4.017 1.00 0.00 H new ATOM 0 HD11 LEU B 27 0.422 -4.338 -2.604 1.00 0.00 H new ATOM 0 HD12 LEU B 27 0.662 -3.388 -4.090 1.00 0.00 H new ATOM 0 HD13 LEU B 27 0.369 -2.560 -2.542 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -1.806 -4.476 -1.570 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -1.913 -2.702 -1.487 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -3.191 -3.633 -2.304 1.00 0.00 H new ATOM 547 N CYS B 28 -3.018 -0.665 -6.488 1.00 0.00 N ATOM 548 CA CYS B 28 -3.282 0.546 -7.248 1.00 0.00 C ATOM 549 C CYS B 28 -4.776 0.667 -7.553 1.00 0.00 C ATOM 550 O CYS B 28 -5.323 1.770 -7.625 1.00 0.00 O ATOM 551 CB CYS B 28 -2.470 0.515 -8.546 1.00 0.00 C ATOM 552 SG CYS B 28 -2.571 2.035 -9.547 1.00 0.00 S ATOM 0 H CYS B 28 -2.379 -1.314 -6.948 1.00 0.00 H new ATOM 0 HA CYS B 28 -2.985 1.414 -6.660 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -1.425 0.328 -8.300 1.00 0.00 H new ATOM 0 HB3 CYS B 28 -2.811 -0.325 -9.151 1.00 0.00 H new ATOM 557 N ALA B 29 -5.426 -0.484 -7.710 1.00 0.00 N ATOM 558 CA ALA B 29 -6.852 -0.547 -7.997 1.00 0.00 C ATOM 559 C ALA B 29 -7.682 -0.216 -6.761 1.00 0.00 C ATOM 560 O ALA B 29 -8.606 0.592 -6.826 1.00 0.00 O ATOM 561 CB ALA B 29 -7.217 -1.927 -8.530 1.00 0.00 C ATOM 0 H ALA B 29 -4.977 -1.397 -7.641 1.00 0.00 H new ATOM 0 HA ALA B 29 -7.078 0.200 -8.758 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -8.286 -1.964 -8.742 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.659 -2.123 -9.445 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -6.968 -2.682 -7.785 1.00 0.00 H new ATOM 567 N PHE B 30 -7.348 -0.836 -5.632 1.00 0.00 N ATOM 568 CA PHE B 30 -8.077 -0.601 -4.390 1.00 0.00 C ATOM 569 C PHE B 30 -7.906 0.830 -3.920 1.00 0.00 C ATOM 570 O PHE B 30 -8.882 1.500 -3.593 1.00 0.00 O ATOM 571 CB PHE B 30 -7.632 -1.565 -3.294 1.00 0.00 C ATOM 572 CG PHE B 30 -8.153 -2.955 -3.489 1.00 0.00 C ATOM 573 CD1 PHE B 30 -7.292 -4.035 -3.507 1.00 0.00 C ATOM 574 CD2 PHE B 30 -9.509 -3.175 -3.656 1.00 0.00 C ATOM 575 CE1 PHE B 30 -7.775 -5.316 -3.688 1.00 0.00 C ATOM 576 CE2 PHE B 30 -9.999 -4.451 -3.840 1.00 0.00 C ATOM 577 CZ PHE B 30 -9.132 -5.524 -3.855 1.00 0.00 C ATOM 0 H PHE B 30 -6.580 -1.502 -5.552 1.00 0.00 H new ATOM 0 HA PHE B 30 -9.133 -0.778 -4.597 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -6.543 -1.592 -3.263 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -7.969 -1.189 -2.328 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -6.232 -3.876 -3.378 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -10.191 -2.338 -3.642 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -7.094 -6.154 -3.699 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -11.059 -4.610 -3.972 1.00 0.00 H new ATOM 0 HZ PHE B 30 -9.512 -6.525 -3.997 1.00 0.00 H new ATOM 587 N ILE B 31 -6.666 1.298 -3.898 1.00 0.00 N ATOM 588 CA ILE B 31 -6.372 2.679 -3.530 1.00 0.00 C ATOM 589 C ILE B 31 -7.152 3.639 -4.427 1.00 0.00 C ATOM 590 O ILE B 31 -7.624 4.691 -3.990 1.00 0.00 O ATOM 591 CB ILE B 31 -4.856 2.965 -3.630 1.00 0.00 C ATOM 592 CG1 ILE B 31 -4.096 2.088 -2.630 1.00 0.00 C ATOM 593 CG2 ILE B 31 -4.564 4.438 -3.380 1.00 0.00 C ATOM 594 CD1 ILE B 31 -2.603 2.057 -2.863 1.00 0.00 C ATOM 0 H ILE B 31 -5.844 0.741 -4.131 1.00 0.00 H new ATOM 0 HA ILE B 31 -6.679 2.831 -2.495 1.00 0.00 H new ATOM 0 HB ILE B 31 -4.521 2.725 -4.639 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -4.290 2.451 -1.621 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -4.485 1.071 -2.683 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -3.491 4.614 -3.456 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -5.084 5.043 -4.122 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -4.907 4.713 -2.383 1.00 0.00 H new ATOM 0 HD11 ILE B 31 -2.132 1.417 -2.117 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -2.398 1.665 -3.859 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -2.201 3.067 -2.780 1.00 0.00 H new ATOM 606 N HIS B 32 -7.304 3.235 -5.674 1.00 0.00 N ATOM 607 CA HIS B 32 -8.081 3.976 -6.652 1.00 0.00 C ATOM 608 C HIS B 32 -9.549 4.012 -6.247 1.00 0.00 C ATOM 609 O HIS B 32 -10.158 5.079 -6.180 1.00 0.00 O ATOM 610 CB HIS B 32 -7.931 3.343 -8.038 1.00 0.00 C ATOM 611 CG HIS B 32 -8.500 4.161 -9.158 1.00 0.00 C ATOM 612 ND1 HIS B 32 -7.734 4.989 -9.946 1.00 0.00 N ATOM 613 CD2 HIS B 32 -9.763 4.259 -9.631 1.00 0.00 C ATOM 614 CE1 HIS B 32 -8.502 5.559 -10.855 1.00 0.00 C ATOM 615 NE2 HIS B 32 -9.739 5.132 -10.686 1.00 0.00 N ATOM 0 H HIS B 32 -6.889 2.378 -6.040 1.00 0.00 H new ATOM 0 HA HIS B 32 -7.705 4.998 -6.691 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -6.872 3.170 -8.232 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -8.418 2.368 -8.033 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -10.631 3.744 -9.247 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -8.173 6.258 -11.610 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -10.544 5.407 -11.248 1.00 0.00 H new ATOM 624 N SER B 33 -10.102 2.844 -5.964 1.00 0.00 N ATOM 625 CA SER B 33 -11.508 2.731 -5.615 1.00 0.00 C ATOM 626 C SER B 33 -11.809 3.321 -4.233 1.00 0.00 C ATOM 627 O SER B 33 -12.952 3.638 -3.939 1.00 0.00 O ATOM 628 CB SER B 33 -11.949 1.269 -5.701 1.00 0.00 C ATOM 629 OG SER B 33 -10.966 0.403 -5.157 1.00 0.00 O ATOM 0 H SER B 33 -9.596 1.958 -5.969 1.00 0.00 H new ATOM 0 HA SER B 33 -12.081 3.316 -6.334 1.00 0.00 H new ATOM 0 HB2 SER B 33 -12.889 1.138 -5.165 1.00 0.00 H new ATOM 0 HB3 SER B 33 -12.135 1.003 -6.742 1.00 0.00 H new ATOM 0 HG SER B 33 -10.411 0.898 -4.519 1.00 0.00 H new ATOM 635 N ILE B 34 -10.794 3.476 -3.385 1.00 0.00 N ATOM 636 CA ILE B 34 -10.999 4.121 -2.090 1.00 0.00 C ATOM 637 C ILE B 34 -11.282 5.594 -2.266 1.00 0.00 C ATOM 638 O ILE B 34 -12.304 6.094 -1.824 1.00 0.00 O ATOM 639 CB ILE B 34 -9.785 3.999 -1.151 1.00 0.00 C ATOM 640 CG1 ILE B 34 -9.501 2.530 -0.832 1.00 0.00 C ATOM 641 CG2 ILE B 34 -10.042 4.784 0.134 1.00 0.00 C ATOM 642 CD1 ILE B 34 -10.634 1.838 -0.096 1.00 0.00 C ATOM 0 H ILE B 34 -9.838 3.170 -3.566 1.00 0.00 H new ATOM 0 HA ILE B 34 -11.846 3.602 -1.641 1.00 0.00 H new ATOM 0 HB ILE B 34 -8.910 4.416 -1.650 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -9.304 1.997 -1.762 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -8.595 2.466 -0.229 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -9.179 4.694 0.794 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -10.206 5.834 -0.108 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -10.925 4.385 0.634 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -10.362 0.800 0.097 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -10.817 2.347 0.850 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -11.537 1.870 -0.706 1.00 0.00 H new ATOM 654 N HIS B 35 -10.362 6.287 -2.912 1.00 0.00 N ATOM 655 CA HIS B 35 -10.452 7.727 -3.012 1.00 0.00 C ATOM 656 C HIS B 35 -11.681 8.158 -3.770 1.00 0.00 C ATOM 657 O HIS B 35 -12.379 9.099 -3.400 1.00 0.00 O ATOM 658 CB HIS B 35 -9.205 8.316 -3.664 1.00 0.00 C ATOM 659 CG HIS B 35 -8.827 7.880 -5.049 1.00 0.00 C ATOM 660 ND1 HIS B 35 -7.706 7.130 -5.309 1.00 0.00 N ATOM 661 CD2 HIS B 35 -9.336 8.221 -6.256 1.00 0.00 C ATOM 662 CE1 HIS B 35 -7.538 7.034 -6.615 1.00 0.00 C ATOM 663 NE2 HIS B 35 -8.514 7.682 -7.213 1.00 0.00 N ATOM 0 H HIS B 35 -9.549 5.876 -3.372 1.00 0.00 H new ATOM 0 HA HIS B 35 -10.528 8.109 -1.994 1.00 0.00 H new ATOM 0 HB2 HIS B 35 -9.325 9.399 -3.683 1.00 0.00 H new ATOM 0 HB3 HIS B 35 -8.360 8.100 -3.010 1.00 0.00 H new ATOM 0 HD1 HIS B 35 -7.099 6.713 -4.604 1.00 0.00 H new ATOM 0 HD2 HIS B 35 -10.225 8.809 -6.433 1.00 0.00 H new ATOM 0 HE1 HIS B 35 -6.733 6.511 -7.110 1.00 0.00 H new ATOM 672 N ASP B 36 -11.917 7.451 -4.826 1.00 0.00 N ATOM 673 CA ASP B 36 -12.985 7.761 -5.744 1.00 0.00 C ATOM 674 C ASP B 36 -14.294 7.070 -5.355 1.00 0.00 C ATOM 675 O ASP B 36 -15.342 7.332 -5.946 1.00 0.00 O ATOM 676 CB ASP B 36 -12.514 7.368 -7.132 1.00 0.00 C ATOM 677 CG ASP B 36 -13.514 7.692 -8.224 1.00 0.00 C ATOM 678 OD1 ASP B 36 -14.138 6.753 -8.759 1.00 0.00 O ATOM 679 OD2 ASP B 36 -13.671 8.882 -8.558 1.00 0.00 O ATOM 0 H ASP B 36 -11.372 6.629 -5.087 1.00 0.00 H new ATOM 0 HA ASP B 36 -13.210 8.827 -5.716 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -11.575 7.879 -7.347 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -12.305 6.298 -7.147 1.00 0.00 H new ATOM 684 N ASP B 37 -14.243 6.208 -4.345 1.00 0.00 N ATOM 685 CA ASP B 37 -15.457 5.587 -3.816 1.00 0.00 C ATOM 686 C ASP B 37 -15.279 5.259 -2.331 1.00 0.00 C ATOM 687 O ASP B 37 -15.323 4.092 -1.931 1.00 0.00 O ATOM 688 CB ASP B 37 -15.807 4.312 -4.597 1.00 0.00 C ATOM 689 CG ASP B 37 -17.276 3.956 -4.482 1.00 0.00 C ATOM 690 OD1 ASP B 37 -17.975 4.544 -3.625 1.00 0.00 O ATOM 691 OD2 ASP B 37 -17.746 3.094 -5.259 1.00 0.00 O ATOM 0 H ASP B 37 -13.382 5.924 -3.878 1.00 0.00 H new ATOM 0 HA ASP B 37 -16.278 6.295 -3.930 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -15.549 4.449 -5.647 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -15.204 3.483 -4.226 1.00 0.00 H new ATOM 696 N PRO B 38 -15.091 6.287 -1.481 1.00 0.00 N ATOM 697 CA PRO B 38 -14.751 6.086 -0.073 1.00 0.00 C ATOM 698 C PRO B 38 -15.950 5.665 0.767 1.00 0.00 C ATOM 699 O PRO B 38 -15.805 5.292 1.932 1.00 0.00 O ATOM 700 CB PRO B 38 -14.231 7.455 0.354 1.00 0.00 C ATOM 701 CG PRO B 38 -14.990 8.415 -0.492 1.00 0.00 C ATOM 702 CD PRO B 38 -15.199 7.724 -1.817 1.00 0.00 C ATOM 0 HA PRO B 38 -14.030 5.280 0.067 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -14.406 7.634 1.415 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -13.157 7.542 0.189 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -15.944 8.672 -0.031 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.436 9.345 -0.620 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -16.172 7.964 -2.245 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -14.447 8.022 -2.548 1.00 0.00 H new ATOM 710 N SER B 39 -17.133 5.723 0.177 1.00 0.00 N ATOM 711 CA SER B 39 -18.329 5.230 0.835 1.00 0.00 C ATOM 712 C SER B 39 -18.323 3.706 0.810 1.00 0.00 C ATOM 713 O SER B 39 -18.669 3.048 1.792 1.00 0.00 O ATOM 714 CB SER B 39 -19.578 5.775 0.142 1.00 0.00 C ATOM 715 OG SER B 39 -20.760 5.369 0.810 1.00 0.00 O ATOM 0 H SER B 39 -17.289 6.106 -0.755 1.00 0.00 H new ATOM 0 HA SER B 39 -18.341 5.571 1.870 1.00 0.00 H new ATOM 0 HB2 SER B 39 -19.532 6.864 0.110 1.00 0.00 H new ATOM 0 HB3 SER B 39 -19.604 5.427 -0.891 1.00 0.00 H new ATOM 0 HG SER B 39 -21.541 5.734 0.344 1.00 0.00 H new ATOM 721 N GLN B 40 -17.897 3.153 -0.319 1.00 0.00 N ATOM 722 CA GLN B 40 -17.795 1.719 -0.489 1.00 0.00 C ATOM 723 C GLN B 40 -16.527 1.161 0.140 1.00 0.00 C ATOM 724 O GLN B 40 -16.310 -0.039 0.095 1.00 0.00 O ATOM 725 CB GLN B 40 -17.830 1.377 -1.961 1.00 0.00 C ATOM 726 CG GLN B 40 -19.086 1.868 -2.626 1.00 0.00 C ATOM 727 CD GLN B 40 -20.218 0.867 -2.566 1.00 0.00 C ATOM 728 OE1 GLN B 40 -19.995 -0.344 -2.534 1.00 0.00 O ATOM 729 NE2 GLN B 40 -21.442 1.362 -2.550 1.00 0.00 N ATOM 0 H GLN B 40 -17.614 3.690 -1.139 1.00 0.00 H new ATOM 0 HA GLN B 40 -18.644 1.263 0.019 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -16.963 1.816 -2.455 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -17.754 0.297 -2.084 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -19.403 2.796 -2.150 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -18.871 2.102 -3.669 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -21.584 2.372 -2.578 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -22.245 0.735 -2.510 1.00 0.00 H new ATOM 738 N SER B 41 -15.664 2.045 0.652 1.00 0.00 N ATOM 739 CA SER B 41 -14.395 1.656 1.282 1.00 0.00 C ATOM 740 C SER B 41 -14.528 0.379 2.121 1.00 0.00 C ATOM 741 O SER B 41 -13.670 -0.502 2.053 1.00 0.00 O ATOM 742 CB SER B 41 -13.885 2.806 2.154 1.00 0.00 C ATOM 743 OG SER B 41 -12.635 2.499 2.750 1.00 0.00 O ATOM 0 H SER B 41 -15.825 3.052 0.642 1.00 0.00 H new ATOM 0 HA SER B 41 -13.681 1.444 0.486 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.788 3.707 1.548 1.00 0.00 H new ATOM 0 HB3 SER B 41 -14.616 3.024 2.933 1.00 0.00 H new ATOM 0 HG SER B 41 -12.339 3.256 3.298 1.00 0.00 H new ATOM 749 N ALA B 42 -15.617 0.281 2.886 1.00 0.00 N ATOM 750 CA ALA B 42 -15.915 -0.904 3.695 1.00 0.00 C ATOM 751 C ALA B 42 -15.871 -2.183 2.860 1.00 0.00 C ATOM 752 O ALA B 42 -15.416 -3.233 3.311 1.00 0.00 O ATOM 753 CB ALA B 42 -17.290 -0.755 4.311 1.00 0.00 C ATOM 0 H ALA B 42 -16.317 1.019 2.963 1.00 0.00 H new ATOM 0 HA ALA B 42 -15.155 -0.983 4.472 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -17.516 -1.635 4.914 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -17.311 0.133 4.943 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -18.034 -0.656 3.521 1.00 0.00 H new ATOM 759 N ASN B 43 -16.357 -2.071 1.642 1.00 0.00 N ATOM 760 CA ASN B 43 -16.379 -3.175 0.695 1.00 0.00 C ATOM 761 C ASN B 43 -15.043 -3.288 -0.031 1.00 0.00 C ATOM 762 O ASN B 43 -14.553 -4.389 -0.266 1.00 0.00 O ATOM 763 CB ASN B 43 -17.507 -2.968 -0.321 1.00 0.00 C ATOM 764 CG ASN B 43 -17.602 -4.080 -1.351 1.00 0.00 C ATOM 765 OD1 ASN B 43 -18.284 -5.082 -1.134 1.00 0.00 O ATOM 766 ND2 ASN B 43 -16.940 -3.907 -2.486 1.00 0.00 N ATOM 0 H ASN B 43 -16.752 -1.205 1.274 1.00 0.00 H new ATOM 0 HA ASN B 43 -16.554 -4.099 1.245 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -18.456 -2.893 0.211 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -17.354 -2.019 -0.835 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -16.985 -4.618 -3.216 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -16.385 -3.063 -2.629 1.00 0.00 H new ATOM 773 N LEU B 44 -14.449 -2.145 -0.370 1.00 0.00 N ATOM 774 CA LEU B 44 -13.189 -2.135 -1.111 1.00 0.00 C ATOM 775 C LEU B 44 -12.075 -2.844 -0.344 1.00 0.00 C ATOM 776 O LEU B 44 -11.290 -3.584 -0.937 1.00 0.00 O ATOM 777 CB LEU B 44 -12.748 -0.708 -1.482 1.00 0.00 C ATOM 778 CG LEU B 44 -13.391 -0.108 -2.746 1.00 0.00 C ATOM 779 CD1 LEU B 44 -13.640 -1.184 -3.787 1.00 0.00 C ATOM 780 CD2 LEU B 44 -14.675 0.624 -2.423 1.00 0.00 C ATOM 0 H LEU B 44 -14.817 -1.220 -0.145 1.00 0.00 H new ATOM 0 HA LEU B 44 -13.374 -2.683 -2.035 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -12.968 -0.051 -0.640 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.666 -0.706 -1.614 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.689 0.617 -3.157 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -14.095 -0.737 -4.671 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.694 -1.650 -4.062 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -14.311 -1.939 -3.377 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -15.100 1.034 -3.339 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -15.385 -0.069 -1.972 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -14.466 1.435 -1.725 1.00 0.00 H new ATOM 792 N LEU B 45 -12.002 -2.652 0.973 1.00 0.00 N ATOM 793 CA LEU B 45 -10.947 -3.307 1.736 1.00 0.00 C ATOM 794 C LEU B 45 -11.369 -4.733 2.082 1.00 0.00 C ATOM 795 O LEU B 45 -10.534 -5.587 2.374 1.00 0.00 O ATOM 796 CB LEU B 45 -10.568 -2.523 3.003 1.00 0.00 C ATOM 797 CG LEU B 45 -11.326 -2.896 4.280 1.00 0.00 C ATOM 798 CD1 LEU B 45 -10.530 -2.487 5.505 1.00 0.00 C ATOM 799 CD2 LEU B 45 -12.688 -2.239 4.317 1.00 0.00 C ATOM 0 H LEU B 45 -12.638 -2.069 1.516 1.00 0.00 H new ATOM 0 HA LEU B 45 -10.054 -3.337 1.111 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -9.502 -2.660 3.185 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -10.724 -1.462 2.809 1.00 0.00 H new ATOM 0 HG LEU B 45 -11.462 -3.977 4.282 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -11.082 -2.759 6.405 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -9.568 -2.999 5.501 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -10.368 -1.409 5.490 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -13.204 -2.522 5.235 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -12.570 -1.156 4.286 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -13.273 -2.565 3.457 1.00 0.00 H new ATOM 811 N ALA B 46 -12.675 -4.980 2.026 1.00 0.00 N ATOM 812 CA ALA B 46 -13.222 -6.316 2.232 1.00 0.00 C ATOM 813 C ALA B 46 -12.721 -7.252 1.148 1.00 0.00 C ATOM 814 O ALA B 46 -12.340 -8.397 1.406 1.00 0.00 O ATOM 815 CB ALA B 46 -14.741 -6.267 2.206 1.00 0.00 C ATOM 0 H ALA B 46 -13.378 -4.265 1.838 1.00 0.00 H new ATOM 0 HA ALA B 46 -12.895 -6.685 3.204 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -15.140 -7.269 2.361 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -15.097 -5.608 2.998 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.076 -5.888 1.241 1.00 0.00 H new ATOM 821 N GLU B 47 -12.728 -6.734 -0.070 1.00 0.00 N ATOM 822 CA GLU B 47 -12.262 -7.461 -1.237 1.00 0.00 C ATOM 823 C GLU B 47 -10.797 -7.785 -1.114 1.00 0.00 C ATOM 824 O GLU B 47 -10.378 -8.901 -1.383 1.00 0.00 O ATOM 825 CB GLU B 47 -12.496 -6.622 -2.477 1.00 0.00 C ATOM 826 CG GLU B 47 -13.954 -6.296 -2.660 1.00 0.00 C ATOM 827 CD GLU B 47 -14.234 -5.544 -3.939 1.00 0.00 C ATOM 828 OE1 GLU B 47 -14.235 -4.299 -3.922 1.00 0.00 O ATOM 829 OE2 GLU B 47 -14.443 -6.203 -4.980 1.00 0.00 O ATOM 0 H GLU B 47 -13.059 -5.792 -0.276 1.00 0.00 H new ATOM 0 HA GLU B 47 -12.817 -8.396 -1.312 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -11.922 -5.698 -2.405 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -12.130 -7.157 -3.353 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -14.531 -7.221 -2.655 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -14.297 -5.702 -1.813 1.00 0.00 H new ATOM 836 N ALA B 48 -10.029 -6.793 -0.706 1.00 0.00 N ATOM 837 CA ALA B 48 -8.596 -6.971 -0.495 1.00 0.00 C ATOM 838 C ALA B 48 -8.328 -8.155 0.426 1.00 0.00 C ATOM 839 O ALA B 48 -7.437 -8.967 0.170 1.00 0.00 O ATOM 840 CB ALA B 48 -7.981 -5.705 0.075 1.00 0.00 C ATOM 0 H ALA B 48 -10.370 -5.851 -0.512 1.00 0.00 H new ATOM 0 HA ALA B 48 -8.133 -7.177 -1.460 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -6.912 -5.856 0.226 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -8.136 -4.880 -0.620 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -8.452 -5.469 1.029 1.00 0.00 H new ATOM 846 N LYS B 49 -9.126 -8.256 1.484 1.00 0.00 N ATOM 847 CA LYS B 49 -9.009 -9.348 2.444 1.00 0.00 C ATOM 848 C LYS B 49 -9.288 -10.696 1.776 1.00 0.00 C ATOM 849 O LYS B 49 -8.613 -11.689 2.048 1.00 0.00 O ATOM 850 CB LYS B 49 -9.980 -9.131 3.610 1.00 0.00 C ATOM 851 CG LYS B 49 -9.744 -7.847 4.388 1.00 0.00 C ATOM 852 CD LYS B 49 -10.840 -7.610 5.420 1.00 0.00 C ATOM 853 CE LYS B 49 -10.796 -8.648 6.530 1.00 0.00 C ATOM 854 NZ LYS B 49 -11.746 -8.332 7.627 1.00 0.00 N ATOM 0 H LYS B 49 -9.867 -7.589 1.699 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.988 -9.358 2.825 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -10.999 -9.126 3.223 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -9.903 -9.976 4.294 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -8.777 -7.896 4.888 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.704 -7.004 3.698 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.729 -6.614 5.848 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -11.814 -7.640 4.931 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -11.032 -9.629 6.118 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -9.785 -8.706 6.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -11.771 -9.122 8.303 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -11.437 -7.467 8.115 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -12.697 -8.185 7.232 1.00 0.00 H new ATOM 868 N LYS B 50 -10.286 -10.724 0.898 1.00 0.00 N ATOM 869 CA LYS B 50 -10.649 -11.947 0.191 1.00 0.00 C ATOM 870 C LYS B 50 -9.620 -12.265 -0.890 1.00 0.00 C ATOM 871 O LYS B 50 -9.247 -13.422 -1.090 1.00 0.00 O ATOM 872 CB LYS B 50 -12.041 -11.803 -0.433 1.00 0.00 C ATOM 873 CG LYS B 50 -12.534 -13.060 -1.136 1.00 0.00 C ATOM 874 CD LYS B 50 -13.902 -12.854 -1.771 1.00 0.00 C ATOM 875 CE LYS B 50 -14.988 -12.632 -0.728 1.00 0.00 C ATOM 876 NZ LYS B 50 -15.180 -13.823 0.142 1.00 0.00 N ATOM 0 H LYS B 50 -10.858 -9.914 0.659 1.00 0.00 H new ATOM 0 HA LYS B 50 -10.666 -12.769 0.907 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -12.752 -11.532 0.347 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -12.025 -10.981 -1.149 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -11.817 -13.352 -1.904 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -12.586 -13.880 -0.420 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -13.864 -11.997 -2.443 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -14.155 -13.724 -2.378 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -14.728 -11.772 -0.112 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -15.927 -12.394 -1.228 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -16.061 -13.718 0.684 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -15.235 -14.678 -0.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -14.378 -13.906 0.798 1.00 0.00 H new ATOM 890 N LEU B 51 -9.161 -11.221 -1.570 1.00 0.00 N ATOM 891 CA LEU B 51 -8.179 -11.347 -2.628 1.00 0.00 C ATOM 892 C LEU B 51 -6.881 -11.934 -2.096 1.00 0.00 C ATOM 893 O LEU B 51 -6.367 -12.911 -2.638 1.00 0.00 O ATOM 894 CB LEU B 51 -7.909 -9.976 -3.245 1.00 0.00 C ATOM 895 CG LEU B 51 -8.538 -9.722 -4.611 1.00 0.00 C ATOM 896 CD1 LEU B 51 -10.048 -9.531 -4.495 1.00 0.00 C ATOM 897 CD2 LEU B 51 -7.883 -8.518 -5.268 1.00 0.00 C ATOM 0 H LEU B 51 -9.464 -10.262 -1.399 1.00 0.00 H new ATOM 0 HA LEU B 51 -8.576 -12.020 -3.388 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -8.267 -9.212 -2.555 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.830 -9.846 -3.334 1.00 0.00 H new ATOM 0 HG LEU B 51 -8.368 -10.596 -5.239 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -10.469 -9.352 -5.484 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -10.496 -10.428 -4.067 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -10.258 -8.677 -3.851 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -8.338 -8.343 -6.243 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -8.024 -7.639 -4.639 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.817 -8.707 -5.394 1.00 0.00 H new ATOM 909 N ASN B 52 -6.352 -11.326 -1.036 1.00 0.00 N ATOM 910 CA ASN B 52 -5.148 -11.822 -0.383 1.00 0.00 C ATOM 911 C ASN B 52 -5.263 -13.302 -0.038 1.00 0.00 C ATOM 912 O ASN B 52 -4.330 -14.067 -0.255 1.00 0.00 O ATOM 913 CB ASN B 52 -4.864 -11.020 0.885 1.00 0.00 C ATOM 914 CG ASN B 52 -3.678 -11.565 1.650 1.00 0.00 C ATOM 915 OD1 ASN B 52 -2.537 -11.254 1.329 1.00 0.00 O ATOM 916 ND2 ASN B 52 -3.933 -12.370 2.672 1.00 0.00 N ATOM 0 H ASN B 52 -6.743 -10.485 -0.611 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.323 -11.700 -1.084 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -4.677 -9.979 0.621 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -5.745 -11.033 1.526 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -3.165 -12.754 3.223 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -4.897 -12.605 2.908 1.00 0.00 H new ATOM 923 N ASP B 53 -6.417 -13.697 0.488 1.00 0.00 N ATOM 924 CA ASP B 53 -6.651 -15.086 0.873 1.00 0.00 C ATOM 925 C ASP B 53 -6.627 -16.001 -0.348 1.00 0.00 C ATOM 926 O ASP B 53 -6.148 -17.134 -0.283 1.00 0.00 O ATOM 927 CB ASP B 53 -7.994 -15.220 1.590 1.00 0.00 C ATOM 928 CG ASP B 53 -8.279 -16.642 2.029 1.00 0.00 C ATOM 929 OD1 ASP B 53 -7.932 -16.994 3.175 1.00 0.00 O ATOM 930 OD2 ASP B 53 -8.852 -17.415 1.230 1.00 0.00 O ATOM 0 H ASP B 53 -7.207 -13.075 0.658 1.00 0.00 H new ATOM 0 HA ASP B 53 -5.851 -15.386 1.550 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -8.004 -14.565 2.462 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -8.791 -14.881 0.928 1.00 0.00 H new ATOM 935 N ALA B 54 -7.134 -15.492 -1.462 1.00 0.00 N ATOM 936 CA ALA B 54 -7.185 -16.254 -2.702 1.00 0.00 C ATOM 937 C ALA B 54 -5.811 -16.324 -3.358 1.00 0.00 C ATOM 938 O ALA B 54 -5.594 -17.095 -4.291 1.00 0.00 O ATOM 939 CB ALA B 54 -8.201 -15.638 -3.654 1.00 0.00 C ATOM 0 H ALA B 54 -7.518 -14.550 -1.532 1.00 0.00 H new ATOM 0 HA ALA B 54 -7.496 -17.272 -2.466 1.00 0.00 H new ATOM 0 HB1 ALA B 54 -8.231 -16.216 -4.578 1.00 0.00 H new ATOM 0 HB2 ALA B 54 -9.187 -15.646 -3.189 1.00 0.00 H new ATOM 0 HB3 ALA B 54 -7.914 -14.611 -3.878 1.00 0.00 H new ATOM 945 N GLN B 55 -4.887 -15.512 -2.868 1.00 0.00 N ATOM 946 CA GLN B 55 -3.528 -15.502 -3.389 1.00 0.00 C ATOM 947 C GLN B 55 -2.536 -15.937 -2.319 1.00 0.00 C ATOM 948 O GLN B 55 -1.329 -15.737 -2.458 1.00 0.00 O ATOM 949 CB GLN B 55 -3.157 -14.112 -3.907 1.00 0.00 C ATOM 950 CG GLN B 55 -3.985 -13.657 -5.097 1.00 0.00 C ATOM 951 CD GLN B 55 -3.453 -12.381 -5.714 1.00 0.00 C ATOM 952 OE1 GLN B 55 -3.845 -11.276 -5.336 1.00 0.00 O ATOM 953 NE2 GLN B 55 -2.556 -12.525 -6.676 1.00 0.00 N ATOM 0 H GLN B 55 -5.053 -14.851 -2.110 1.00 0.00 H new ATOM 0 HA GLN B 55 -3.483 -16.209 -4.217 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -3.274 -13.391 -3.098 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -2.104 -14.109 -4.187 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -3.997 -14.445 -5.851 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -5.017 -13.502 -4.781 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -2.258 -13.458 -6.960 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -2.163 -11.703 -7.134 1.00 0.00 H new ATOM 962 N ALA B 56 -3.052 -16.519 -1.249 1.00 0.00 N ATOM 963 CA ALA B 56 -2.229 -17.003 -0.165 1.00 0.00 C ATOM 964 C ALA B 56 -1.912 -18.478 -0.366 1.00 0.00 C ATOM 965 O ALA B 56 -0.827 -18.790 -0.893 1.00 0.00 O ATOM 966 CB ALA B 56 -2.964 -16.784 1.140 1.00 0.00 C ATOM 0 H ALA B 56 -4.052 -16.667 -1.112 1.00 0.00 H new ATOM 0 HA ALA B 56 -1.285 -16.458 -0.142 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.353 -17.146 1.967 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.161 -15.720 1.272 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -3.908 -17.328 1.122 1.00 0.00 H new TER 972 ALA B 56 ATOM 973 N GLY C 13 14.318 -2.899 8.740 1.00 0.00 N ATOM 974 CA GLY C 13 13.726 -3.961 7.891 1.00 0.00 C ATOM 975 C GLY C 13 12.652 -4.733 8.625 1.00 0.00 C ATOM 976 O GLY C 13 12.900 -5.826 9.134 1.00 0.00 O ATOM 0 HA2 GLY C 13 13.302 -3.514 6.992 1.00 0.00 H new ATOM 0 HA3 GLY C 13 14.509 -4.646 7.567 1.00 0.00 H new ATOM 980 N GLY C 14 11.457 -4.169 8.673 1.00 0.00 N ATOM 981 CA GLY C 14 10.375 -4.770 9.433 1.00 0.00 C ATOM 982 C GLY C 14 9.661 -3.747 10.278 1.00 0.00 C ATOM 983 O GLY C 14 8.986 -4.080 11.253 1.00 0.00 O ATOM 0 H GLY C 14 11.213 -3.300 8.197 1.00 0.00 H new ATOM 0 HA2 GLY C 14 9.666 -5.239 8.751 1.00 0.00 H new ATOM 0 HA3 GLY C 14 10.772 -5.559 10.072 1.00 0.00 H new ATOM 987 N GLU C 15 9.844 -2.495 9.912 1.00 0.00 N ATOM 988 CA GLU C 15 9.142 -1.396 10.526 1.00 0.00 C ATOM 989 C GLU C 15 7.901 -1.067 9.718 1.00 0.00 C ATOM 990 O GLU C 15 7.758 -1.507 8.572 1.00 0.00 O ATOM 991 CB GLU C 15 10.053 -0.168 10.620 1.00 0.00 C ATOM 992 CG GLU C 15 10.677 0.278 9.304 1.00 0.00 C ATOM 993 CD GLU C 15 11.762 -0.657 8.791 1.00 0.00 C ATOM 994 OE1 GLU C 15 12.935 -0.501 9.187 1.00 0.00 O ATOM 995 OE2 GLU C 15 11.447 -1.558 7.989 1.00 0.00 O ATOM 0 H GLU C 15 10.490 -2.214 9.174 1.00 0.00 H new ATOM 0 HA GLU C 15 8.846 -1.684 11.535 1.00 0.00 H new ATOM 0 HB2 GLU C 15 9.477 0.661 11.030 1.00 0.00 H new ATOM 0 HB3 GLU C 15 10.853 -0.382 11.329 1.00 0.00 H new ATOM 0 HG2 GLU C 15 9.894 0.359 8.550 1.00 0.00 H new ATOM 0 HG3 GLU C 15 11.100 1.274 9.432 1.00 0.00 H new ATOM 1002 N ILE C 16 7.013 -0.296 10.312 1.00 0.00 N ATOM 1003 CA ILE C 16 5.777 0.071 9.646 1.00 0.00 C ATOM 1004 C ILE C 16 5.937 1.428 8.984 1.00 0.00 C ATOM 1005 O ILE C 16 6.408 2.381 9.607 1.00 0.00 O ATOM 1006 CB ILE C 16 4.576 0.110 10.612 1.00 0.00 C ATOM 1007 CG1 ILE C 16 4.590 -1.115 11.535 1.00 0.00 C ATOM 1008 CG2 ILE C 16 3.278 0.170 9.819 1.00 0.00 C ATOM 1009 CD1 ILE C 16 3.264 -1.387 12.217 1.00 0.00 C ATOM 0 H ILE C 16 7.122 0.088 11.251 1.00 0.00 H new ATOM 0 HA ILE C 16 5.572 -0.696 8.899 1.00 0.00 H new ATOM 0 HB ILE C 16 4.649 1.003 11.233 1.00 0.00 H new ATOM 0 HG12 ILE C 16 4.875 -1.992 10.954 1.00 0.00 H new ATOM 0 HG13 ILE C 16 5.357 -0.975 12.297 1.00 0.00 H new ATOM 0 HG21 ILE C 16 2.433 0.197 10.506 1.00 0.00 H new ATOM 0 HG22 ILE C 16 3.271 1.067 9.200 1.00 0.00 H new ATOM 0 HG23 ILE C 16 3.200 -0.711 9.182 1.00 0.00 H new ATOM 0 HD11 ILE C 16 3.355 -2.268 12.852 1.00 0.00 H new ATOM 0 HD12 ILE C 16 2.986 -0.528 12.827 1.00 0.00 H new ATOM 0 HD13 ILE C 16 2.496 -1.561 11.463 1.00 0.00 H new ATOM 1021 N VAL C 17 5.557 1.514 7.721 1.00 0.00 N ATOM 1022 CA VAL C 17 5.776 2.713 6.943 1.00 0.00 C ATOM 1023 C VAL C 17 4.437 3.189 6.373 1.00 0.00 C ATOM 1024 O VAL C 17 4.060 2.830 5.264 1.00 0.00 O ATOM 1025 CB VAL C 17 6.796 2.407 5.810 1.00 0.00 C ATOM 1026 CG1 VAL C 17 7.238 3.649 5.067 1.00 0.00 C ATOM 1027 CG2 VAL C 17 8.006 1.686 6.364 1.00 0.00 C ATOM 0 H VAL C 17 5.093 0.761 7.213 1.00 0.00 H new ATOM 0 HA VAL C 17 6.186 3.506 7.568 1.00 0.00 H new ATOM 0 HB VAL C 17 6.280 1.766 5.095 1.00 0.00 H new ATOM 0 HG11 VAL C 17 7.949 3.373 4.288 1.00 0.00 H new ATOM 0 HG12 VAL C 17 6.371 4.129 4.613 1.00 0.00 H new ATOM 0 HG13 VAL C 17 7.712 4.340 5.764 1.00 0.00 H new ATOM 0 HG21 VAL C 17 8.708 1.480 5.556 1.00 0.00 H new ATOM 0 HG22 VAL C 17 8.489 2.311 7.115 1.00 0.00 H new ATOM 0 HG23 VAL C 17 7.693 0.747 6.820 1.00 0.00 H new ATOM 1037 N TYR C 18 3.717 3.996 7.152 1.00 0.00 N ATOM 1038 CA TYR C 18 2.362 4.418 6.789 1.00 0.00 C ATOM 1039 C TYR C 18 2.372 5.638 5.883 1.00 0.00 C ATOM 1040 O TYR C 18 2.760 6.735 6.299 1.00 0.00 O ATOM 1041 CB TYR C 18 1.536 4.713 8.042 1.00 0.00 C ATOM 1042 CG TYR C 18 0.543 3.628 8.381 1.00 0.00 C ATOM 1043 CD1 TYR C 18 0.908 2.542 9.161 1.00 0.00 C ATOM 1044 CD2 TYR C 18 -0.762 3.691 7.915 1.00 0.00 C ATOM 1045 CE1 TYR C 18 -0.001 1.548 9.469 1.00 0.00 C ATOM 1046 CE2 TYR C 18 -1.676 2.702 8.220 1.00 0.00 C ATOM 1047 CZ TYR C 18 -1.292 1.634 8.997 1.00 0.00 C ATOM 1048 OH TYR C 18 -2.201 0.649 9.305 1.00 0.00 O ATOM 0 H TYR C 18 4.049 4.372 8.040 1.00 0.00 H new ATOM 0 HA TYR C 18 1.906 3.594 6.241 1.00 0.00 H new ATOM 0 HB2 TYR C 18 2.210 4.853 8.887 1.00 0.00 H new ATOM 0 HB3 TYR C 18 1.001 5.652 7.902 1.00 0.00 H new ATOM 0 HD1 TYR C 18 1.919 2.472 9.534 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -1.068 4.527 7.304 1.00 0.00 H new ATOM 0 HE1 TYR C 18 0.299 0.708 10.077 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -2.689 2.767 7.850 1.00 0.00 H new ATOM 0 HH TYR C 18 -1.979 0.260 10.176 1.00 0.00 H new ATOM 1058 N LEU C 19 1.941 5.440 4.642 1.00 0.00 N ATOM 1059 CA LEU C 19 1.935 6.505 3.644 1.00 0.00 C ATOM 1060 C LEU C 19 0.553 6.659 3.006 1.00 0.00 C ATOM 1061 O LEU C 19 0.355 6.313 1.842 1.00 0.00 O ATOM 1062 CB LEU C 19 2.988 6.230 2.556 1.00 0.00 C ATOM 1063 CG LEU C 19 4.436 6.536 2.937 1.00 0.00 C ATOM 1064 CD1 LEU C 19 4.907 5.660 4.067 1.00 0.00 C ATOM 1065 CD2 LEU C 19 5.335 6.344 1.748 1.00 0.00 C ATOM 0 H LEU C 19 1.589 4.546 4.301 1.00 0.00 H new ATOM 0 HA LEU C 19 2.183 7.437 4.152 1.00 0.00 H new ATOM 0 HB2 LEU C 19 2.922 5.180 2.270 1.00 0.00 H new ATOM 0 HB3 LEU C 19 2.733 6.817 1.674 1.00 0.00 H new ATOM 0 HG LEU C 19 4.478 7.574 3.268 1.00 0.00 H new ATOM 0 HD11 LEU C 19 5.941 5.905 4.311 1.00 0.00 H new ATOM 0 HD12 LEU C 19 4.278 5.825 4.942 1.00 0.00 H new ATOM 0 HD13 LEU C 19 4.844 4.614 3.767 1.00 0.00 H new ATOM 0 HD21 LEU C 19 6.364 6.565 2.031 1.00 0.00 H new ATOM 0 HD22 LEU C 19 5.267 5.312 1.403 1.00 0.00 H new ATOM 0 HD23 LEU C 19 5.027 7.016 0.947 1.00 0.00 H new ATOM 1077 N PRO C 20 -0.423 7.195 3.761 1.00 0.00 N ATOM 1078 CA PRO C 20 -1.776 7.405 3.266 1.00 0.00 C ATOM 1079 C PRO C 20 -1.955 8.782 2.630 1.00 0.00 C ATOM 1080 O PRO C 20 -3.046 9.137 2.184 1.00 0.00 O ATOM 1081 CB PRO C 20 -2.608 7.287 4.538 1.00 0.00 C ATOM 1082 CG PRO C 20 -1.723 7.804 5.626 1.00 0.00 C ATOM 1083 CD PRO C 20 -0.293 7.631 5.161 1.00 0.00 C ATOM 0 HA PRO C 20 -2.052 6.701 2.481 1.00 0.00 H new ATOM 0 HB2 PRO C 20 -3.526 7.870 4.465 1.00 0.00 H new ATOM 0 HB3 PRO C 20 -2.901 6.254 4.724 1.00 0.00 H new ATOM 0 HG2 PRO C 20 -1.937 8.853 5.830 1.00 0.00 H new ATOM 0 HG3 PRO C 20 -1.895 7.258 6.554 1.00 0.00 H new ATOM 0 HD2 PRO C 20 0.267 8.563 5.238 1.00 0.00 H new ATOM 0 HD3 PRO C 20 0.235 6.891 5.762 1.00 0.00 H new ATOM 1091 N ASN C 21 -0.877 9.555 2.601 1.00 0.00 N ATOM 1092 CA ASN C 21 -0.906 10.890 2.023 1.00 0.00 C ATOM 1093 C ASN C 21 -0.356 10.860 0.608 1.00 0.00 C ATOM 1094 O ASN C 21 -0.370 11.868 -0.093 1.00 0.00 O ATOM 1095 CB ASN C 21 -0.098 11.872 2.876 1.00 0.00 C ATOM 1096 CG ASN C 21 -0.653 12.026 4.278 1.00 0.00 C ATOM 1097 OD1 ASN C 21 -0.278 11.292 5.191 1.00 0.00 O ATOM 1098 ND2 ASN C 21 -1.551 12.980 4.462 1.00 0.00 N ATOM 0 H ASN C 21 0.031 9.278 2.973 1.00 0.00 H new ATOM 0 HA ASN C 21 -1.942 11.227 1.997 1.00 0.00 H new ATOM 0 HB2 ASN C 21 0.935 11.530 2.935 1.00 0.00 H new ATOM 0 HB3 ASN C 21 -0.084 12.846 2.386 1.00 0.00 H new ATOM 0 HD21 ASN C 21 -1.957 13.127 5.386 1.00 0.00 H new ATOM 0 HD22 ASN C 21 -1.837 13.569 3.680 1.00 0.00 H new ATOM 1105 N LEU C 22 0.150 9.700 0.205 1.00 0.00 N ATOM 1106 CA LEU C 22 0.618 9.504 -1.153 1.00 0.00 C ATOM 1107 C LEU C 22 -0.511 9.656 -2.154 1.00 0.00 C ATOM 1108 O LEU C 22 -1.627 9.177 -1.939 1.00 0.00 O ATOM 1109 CB LEU C 22 1.255 8.126 -1.317 1.00 0.00 C ATOM 1110 CG LEU C 22 2.672 7.982 -0.773 1.00 0.00 C ATOM 1111 CD1 LEU C 22 3.190 6.577 -1.028 1.00 0.00 C ATOM 1112 CD2 LEU C 22 3.589 9.010 -1.409 1.00 0.00 C ATOM 0 H LEU C 22 0.245 8.881 0.805 1.00 0.00 H new ATOM 0 HA LEU C 22 1.367 10.272 -1.348 1.00 0.00 H new ATOM 0 HB2 LEU C 22 0.620 7.391 -0.822 1.00 0.00 H new ATOM 0 HB3 LEU C 22 1.266 7.875 -2.378 1.00 0.00 H new ATOM 0 HG LEU C 22 2.654 8.156 0.303 1.00 0.00 H new ATOM 0 HD11 LEU C 22 4.203 6.486 -0.635 1.00 0.00 H new ATOM 0 HD12 LEU C 22 2.542 5.855 -0.532 1.00 0.00 H new ATOM 0 HD13 LEU C 22 3.198 6.381 -2.100 1.00 0.00 H new ATOM 0 HD21 LEU C 22 4.597 8.894 -1.010 1.00 0.00 H new ATOM 0 HD22 LEU C 22 3.607 8.863 -2.489 1.00 0.00 H new ATOM 0 HD23 LEU C 22 3.223 10.012 -1.185 1.00 0.00 H new ATOM 1124 N ASN C 23 -0.211 10.333 -3.243 1.00 0.00 N ATOM 1125 CA ASN C 23 -1.141 10.457 -4.344 1.00 0.00 C ATOM 1126 C ASN C 23 -1.083 9.198 -5.206 1.00 0.00 C ATOM 1127 O ASN C 23 0.004 8.723 -5.547 1.00 0.00 O ATOM 1128 CB ASN C 23 -0.847 11.720 -5.171 1.00 0.00 C ATOM 1129 CG ASN C 23 0.587 11.816 -5.667 1.00 0.00 C ATOM 1130 OD1 ASN C 23 1.520 11.324 -5.033 1.00 0.00 O ATOM 1131 ND2 ASN C 23 0.775 12.469 -6.803 1.00 0.00 N ATOM 0 H ASN C 23 0.679 10.810 -3.389 1.00 0.00 H new ATOM 0 HA ASN C 23 -2.152 10.560 -3.949 1.00 0.00 H new ATOM 0 HB2 ASN C 23 -1.519 11.745 -6.029 1.00 0.00 H new ATOM 0 HB3 ASN C 23 -1.070 12.598 -4.565 1.00 0.00 H new ATOM 0 HD21 ASN C 23 1.717 12.577 -7.179 1.00 0.00 H new ATOM 0 HD22 ASN C 23 -0.022 12.864 -7.302 1.00 0.00 H new ATOM 1138 N PRO C 24 -2.259 8.627 -5.528 1.00 0.00 N ATOM 1139 CA PRO C 24 -2.388 7.328 -6.214 1.00 0.00 C ATOM 1140 C PRO C 24 -1.406 7.126 -7.362 1.00 0.00 C ATOM 1141 O PRO C 24 -0.739 6.094 -7.440 1.00 0.00 O ATOM 1142 CB PRO C 24 -3.813 7.382 -6.747 1.00 0.00 C ATOM 1143 CG PRO C 24 -4.546 8.162 -5.717 1.00 0.00 C ATOM 1144 CD PRO C 24 -3.582 9.214 -5.239 1.00 0.00 C ATOM 0 HA PRO C 24 -2.172 6.499 -5.539 1.00 0.00 H new ATOM 0 HB2 PRO C 24 -3.857 7.866 -7.723 1.00 0.00 H new ATOM 0 HB3 PRO C 24 -4.233 6.384 -6.867 1.00 0.00 H new ATOM 0 HG2 PRO C 24 -5.444 8.616 -6.136 1.00 0.00 H new ATOM 0 HG3 PRO C 24 -4.866 7.522 -4.895 1.00 0.00 H new ATOM 0 HD2 PRO C 24 -3.725 10.158 -5.764 1.00 0.00 H new ATOM 0 HD3 PRO C 24 -3.706 9.419 -4.176 1.00 0.00 H new ATOM 1152 N ASP C 25 -1.315 8.120 -8.235 1.00 0.00 N ATOM 1153 CA ASP C 25 -0.460 8.046 -9.420 1.00 0.00 C ATOM 1154 C ASP C 25 0.986 7.723 -9.048 1.00 0.00 C ATOM 1155 O ASP C 25 1.658 6.959 -9.741 1.00 0.00 O ATOM 1156 CB ASP C 25 -0.522 9.369 -10.189 1.00 0.00 C ATOM 1157 CG ASP C 25 0.277 9.345 -11.477 1.00 0.00 C ATOM 1158 OD1 ASP C 25 1.447 9.781 -11.468 1.00 0.00 O ATOM 1159 OD2 ASP C 25 -0.268 8.910 -12.513 1.00 0.00 O ATOM 0 H ASP C 25 -1.827 8.997 -8.146 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.829 7.239 -10.053 1.00 0.00 H new ATOM 0 HB2 ASP C 25 -1.562 9.601 -10.418 1.00 0.00 H new ATOM 0 HB3 ASP C 25 -0.149 10.171 -9.552 1.00 0.00 H new ATOM 1164 N GLN C 26 1.446 8.276 -7.932 1.00 0.00 N ATOM 1165 CA GLN C 26 2.823 8.077 -7.499 1.00 0.00 C ATOM 1166 C GLN C 26 2.993 6.754 -6.762 1.00 0.00 C ATOM 1167 O GLN C 26 3.890 5.977 -7.087 1.00 0.00 O ATOM 1168 CB GLN C 26 3.290 9.231 -6.616 1.00 0.00 C ATOM 1169 CG GLN C 26 3.496 10.530 -7.374 1.00 0.00 C ATOM 1170 CD GLN C 26 4.578 10.421 -8.433 1.00 0.00 C ATOM 1171 OE1 GLN C 26 4.306 10.079 -9.584 1.00 0.00 O ATOM 1172 NE2 GLN C 26 5.809 10.720 -8.054 1.00 0.00 N ATOM 0 H GLN C 26 0.888 8.864 -7.313 1.00 0.00 H new ATOM 0 HA GLN C 26 3.442 8.048 -8.396 1.00 0.00 H new ATOM 0 HB2 GLN C 26 2.557 9.393 -5.826 1.00 0.00 H new ATOM 0 HB3 GLN C 26 4.225 8.951 -6.130 1.00 0.00 H new ATOM 0 HG2 GLN C 26 2.559 10.824 -7.846 1.00 0.00 H new ATOM 0 HG3 GLN C 26 3.759 11.320 -6.670 1.00 0.00 H new ATOM 0 HE21 GLN C 26 5.992 10.999 -7.090 1.00 0.00 H new ATOM 0 HE22 GLN C 26 6.575 10.672 -8.725 1.00 0.00 H new ATOM 1181 N LEU C 27 2.130 6.480 -5.781 1.00 0.00 N ATOM 1182 CA LEU C 27 2.250 5.241 -5.009 1.00 0.00 C ATOM 1183 C LEU C 27 2.040 4.022 -5.906 1.00 0.00 C ATOM 1184 O LEU C 27 2.525 2.931 -5.612 1.00 0.00 O ATOM 1185 CB LEU C 27 1.305 5.223 -3.783 1.00 0.00 C ATOM 1186 CG LEU C 27 -0.193 5.481 -4.027 1.00 0.00 C ATOM 1187 CD1 LEU C 27 -0.856 4.300 -4.716 1.00 0.00 C ATOM 1188 CD2 LEU C 27 -0.900 5.794 -2.707 1.00 0.00 C ATOM 0 H LEU C 27 1.356 7.085 -5.506 1.00 0.00 H new ATOM 0 HA LEU C 27 3.265 5.196 -4.615 1.00 0.00 H new ATOM 0 HB2 LEU C 27 1.403 4.251 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU C 27 1.662 5.970 -3.074 1.00 0.00 H new ATOM 0 HG LEU C 27 -0.280 6.343 -4.688 1.00 0.00 H new ATOM 0 HD11 LEU C 27 -1.913 4.516 -4.873 1.00 0.00 H new ATOM 0 HD12 LEU C 27 -0.375 4.123 -5.678 1.00 0.00 H new ATOM 0 HD13 LEU C 27 -0.756 3.412 -4.092 1.00 0.00 H new ATOM 0 HD21 LEU C 27 -1.958 5.974 -2.895 1.00 0.00 H new ATOM 0 HD22 LEU C 27 -0.791 4.949 -2.027 1.00 0.00 H new ATOM 0 HD23 LEU C 27 -0.455 6.682 -2.258 1.00 0.00 H new ATOM 1200 N CYS C 28 1.339 4.233 -7.015 1.00 0.00 N ATOM 1201 CA CYS C 28 1.121 3.191 -8.009 1.00 0.00 C ATOM 1202 C CYS C 28 2.456 2.744 -8.602 1.00 0.00 C ATOM 1203 O CYS C 28 2.657 1.565 -8.904 1.00 0.00 O ATOM 1204 CB CYS C 28 0.202 3.722 -9.113 1.00 0.00 C ATOM 1205 SG CYS C 28 -0.453 2.449 -10.243 1.00 0.00 S ATOM 0 H CYS C 28 0.908 5.128 -7.249 1.00 0.00 H new ATOM 0 HA CYS C 28 0.648 2.332 -7.533 1.00 0.00 H new ATOM 0 HB2 CYS C 28 -0.636 4.242 -8.649 1.00 0.00 H new ATOM 0 HB3 CYS C 28 0.750 4.460 -9.699 1.00 0.00 H new ATOM 1210 N ALA C 29 3.375 3.695 -8.734 1.00 0.00 N ATOM 1211 CA ALA C 29 4.690 3.422 -9.290 1.00 0.00 C ATOM 1212 C ALA C 29 5.599 2.783 -8.250 1.00 0.00 C ATOM 1213 O ALA C 29 6.358 1.870 -8.561 1.00 0.00 O ATOM 1214 CB ALA C 29 5.314 4.703 -9.821 1.00 0.00 C ATOM 0 H ALA C 29 3.229 4.667 -8.461 1.00 0.00 H new ATOM 0 HA ALA C 29 4.571 2.719 -10.115 1.00 0.00 H new ATOM 0 HB1 ALA C 29 6.298 4.484 -10.234 1.00 0.00 H new ATOM 0 HB2 ALA C 29 4.678 5.122 -10.601 1.00 0.00 H new ATOM 0 HB3 ALA C 29 5.414 5.423 -9.009 1.00 0.00 H new ATOM 1220 N PHE C 30 5.511 3.255 -7.010 1.00 0.00 N ATOM 1221 CA PHE C 30 6.352 2.736 -5.935 1.00 0.00 C ATOM 1222 C PHE C 30 6.039 1.275 -5.634 1.00 0.00 C ATOM 1223 O PHE C 30 6.945 0.484 -5.378 1.00 0.00 O ATOM 1224 CB PHE C 30 6.207 3.585 -4.674 1.00 0.00 C ATOM 1225 CG PHE C 30 6.894 4.914 -4.779 1.00 0.00 C ATOM 1226 CD1 PHE C 30 8.253 5.020 -4.537 1.00 0.00 C ATOM 1227 CD2 PHE C 30 6.189 6.052 -5.127 1.00 0.00 C ATOM 1228 CE1 PHE C 30 8.895 6.238 -4.641 1.00 0.00 C ATOM 1229 CE2 PHE C 30 6.825 7.273 -5.232 1.00 0.00 C ATOM 1230 CZ PHE C 30 8.180 7.366 -4.988 1.00 0.00 C ATOM 0 H PHE C 30 4.868 3.994 -6.725 1.00 0.00 H new ATOM 0 HA PHE C 30 7.386 2.792 -6.274 1.00 0.00 H new ATOM 0 HB2 PHE C 30 5.148 3.745 -4.470 1.00 0.00 H new ATOM 0 HB3 PHE C 30 6.616 3.037 -3.825 1.00 0.00 H new ATOM 0 HD1 PHE C 30 8.817 4.140 -4.264 1.00 0.00 H new ATOM 0 HD2 PHE C 30 5.128 5.985 -5.319 1.00 0.00 H new ATOM 0 HE1 PHE C 30 9.956 6.308 -4.451 1.00 0.00 H new ATOM 0 HE2 PHE C 30 6.263 8.154 -5.505 1.00 0.00 H new ATOM 0 HZ PHE C 30 8.680 8.320 -5.068 1.00 0.00 H new ATOM 1240 N ILE C 31 4.763 0.915 -5.678 1.00 0.00 N ATOM 1241 CA ILE C 31 4.368 -0.475 -5.495 1.00 0.00 C ATOM 1242 C ILE C 31 4.958 -1.340 -6.608 1.00 0.00 C ATOM 1243 O ILE C 31 5.543 -2.396 -6.351 1.00 0.00 O ATOM 1244 CB ILE C 31 2.833 -0.632 -5.464 1.00 0.00 C ATOM 1245 CG1 ILE C 31 2.251 0.091 -4.245 1.00 0.00 C ATOM 1246 CG2 ILE C 31 2.448 -2.103 -5.446 1.00 0.00 C ATOM 1247 CD1 ILE C 31 0.743 -0.001 -4.140 1.00 0.00 C ATOM 0 H ILE C 31 3.989 1.560 -5.837 1.00 0.00 H new ATOM 0 HA ILE C 31 4.757 -0.806 -4.532 1.00 0.00 H new ATOM 0 HB ILE C 31 2.419 -0.181 -6.366 1.00 0.00 H new ATOM 0 HG12 ILE C 31 2.695 -0.326 -3.341 1.00 0.00 H new ATOM 0 HG13 ILE C 31 2.539 1.141 -4.286 1.00 0.00 H new ATOM 0 HG21 ILE C 31 1.362 -2.195 -5.424 1.00 0.00 H new ATOM 0 HG22 ILE C 31 2.836 -2.591 -6.340 1.00 0.00 H new ATOM 0 HG23 ILE C 31 2.870 -2.579 -4.561 1.00 0.00 H new ATOM 0 HD11 ILE C 31 0.407 0.535 -3.252 1.00 0.00 H new ATOM 0 HD12 ILE C 31 0.289 0.443 -5.026 1.00 0.00 H new ATOM 0 HD13 ILE C 31 0.447 -1.047 -4.066 1.00 0.00 H new ATOM 1259 N HIS C 32 4.820 -0.872 -7.844 1.00 0.00 N ATOM 1260 CA HIS C 32 5.411 -1.552 -8.995 1.00 0.00 C ATOM 1261 C HIS C 32 6.932 -1.614 -8.853 1.00 0.00 C ATOM 1262 O HIS C 32 7.568 -2.589 -9.254 1.00 0.00 O ATOM 1263 CB HIS C 32 5.026 -0.827 -10.292 1.00 0.00 C ATOM 1264 CG HIS C 32 5.539 -1.481 -11.542 1.00 0.00 C ATOM 1265 ND1 HIS C 32 4.864 -2.490 -12.195 1.00 0.00 N ATOM 1266 CD2 HIS C 32 6.661 -1.255 -12.268 1.00 0.00 C ATOM 1267 CE1 HIS C 32 5.548 -2.857 -13.261 1.00 0.00 C ATOM 1268 NE2 HIS C 32 6.640 -2.123 -13.330 1.00 0.00 N ATOM 0 H HIS C 32 4.304 -0.024 -8.076 1.00 0.00 H new ATOM 0 HA HIS C 32 5.025 -2.571 -9.035 1.00 0.00 H new ATOM 0 HB2 HIS C 32 3.939 -0.763 -10.349 1.00 0.00 H new ATOM 0 HB3 HIS C 32 5.404 0.194 -10.249 1.00 0.00 H new ATOM 0 HD2 HIS C 32 7.429 -0.527 -12.051 1.00 0.00 H new ATOM 0 HE1 HIS C 32 5.261 -3.629 -13.960 1.00 0.00 H new ATOM 0 HE2 HIS C 32 7.354 -2.189 -14.055 1.00 0.00 H new ATOM 1277 N SER C 33 7.497 -0.570 -8.263 1.00 0.00 N ATOM 1278 CA SER C 33 8.933 -0.469 -8.067 1.00 0.00 C ATOM 1279 C SER C 33 9.434 -1.557 -7.115 1.00 0.00 C ATOM 1280 O SER C 33 10.522 -2.092 -7.302 1.00 0.00 O ATOM 1281 CB SER C 33 9.286 0.922 -7.531 1.00 0.00 C ATOM 1282 OG SER C 33 10.678 1.178 -7.614 1.00 0.00 O ATOM 0 H SER C 33 6.972 0.229 -7.908 1.00 0.00 H new ATOM 0 HA SER C 33 9.427 -0.615 -9.028 1.00 0.00 H new ATOM 0 HB2 SER C 33 8.742 1.679 -8.097 1.00 0.00 H new ATOM 0 HB3 SER C 33 8.962 1.005 -6.494 1.00 0.00 H new ATOM 0 HG SER C 33 10.836 2.145 -7.577 1.00 0.00 H new ATOM 1288 N ILE C 34 8.638 -1.887 -6.100 1.00 0.00 N ATOM 1289 CA ILE C 34 9.000 -2.956 -5.171 1.00 0.00 C ATOM 1290 C ILE C 34 8.936 -4.303 -5.880 1.00 0.00 C ATOM 1291 O ILE C 34 9.742 -5.197 -5.630 1.00 0.00 O ATOM 1292 CB ILE C 34 8.064 -3.003 -3.944 1.00 0.00 C ATOM 1293 CG1 ILE C 34 7.997 -1.638 -3.249 1.00 0.00 C ATOM 1294 CG2 ILE C 34 8.530 -4.081 -2.971 1.00 0.00 C ATOM 1295 CD1 ILE C 34 9.330 -1.144 -2.730 1.00 0.00 C ATOM 0 H ILE C 34 7.746 -1.434 -5.901 1.00 0.00 H new ATOM 0 HA ILE C 34 10.013 -2.749 -4.825 1.00 0.00 H new ATOM 0 HB ILE C 34 7.059 -3.251 -4.287 1.00 0.00 H new ATOM 0 HG12 ILE C 34 7.597 -0.905 -3.949 1.00 0.00 H new ATOM 0 HG13 ILE C 34 7.295 -1.700 -2.417 1.00 0.00 H new ATOM 0 HG21 ILE C 34 7.863 -4.106 -2.109 1.00 0.00 H new ATOM 0 HG22 ILE C 34 8.516 -5.051 -3.469 1.00 0.00 H new ATOM 0 HG23 ILE C 34 9.544 -3.858 -2.639 1.00 0.00 H new ATOM 0 HD11 ILE C 34 9.197 -0.173 -2.252 1.00 0.00 H new ATOM 0 HD12 ILE C 34 9.724 -1.855 -2.004 1.00 0.00 H new ATOM 0 HD13 ILE C 34 10.030 -1.048 -3.560 1.00 0.00 H new ATOM 1307 N HIS C 35 7.955 -4.435 -6.758 1.00 0.00 N ATOM 1308 CA HIS C 35 7.783 -5.642 -7.558 1.00 0.00 C ATOM 1309 C HIS C 35 9.008 -5.906 -8.429 1.00 0.00 C ATOM 1310 O HIS C 35 9.514 -7.030 -8.482 1.00 0.00 O ATOM 1311 CB HIS C 35 6.535 -5.512 -8.441 1.00 0.00 C ATOM 1312 CG HIS C 35 6.364 -6.629 -9.429 1.00 0.00 C ATOM 1313 ND1 HIS C 35 6.783 -6.544 -10.739 1.00 0.00 N ATOM 1314 CD2 HIS C 35 5.820 -7.860 -9.290 1.00 0.00 C ATOM 1315 CE1 HIS C 35 6.502 -7.672 -11.361 1.00 0.00 C ATOM 1316 NE2 HIS C 35 5.919 -8.491 -10.505 1.00 0.00 N ATOM 0 H HIS C 35 7.257 -3.713 -6.938 1.00 0.00 H new ATOM 0 HA HIS C 35 7.661 -6.484 -6.877 1.00 0.00 H new ATOM 0 HB2 HIS C 35 5.653 -5.469 -7.801 1.00 0.00 H new ATOM 0 HB3 HIS C 35 6.583 -4.567 -8.982 1.00 0.00 H new ATOM 0 HD1 HIS C 35 7.239 -5.735 -11.161 1.00 0.00 H new ATOM 0 HD2 HIS C 35 5.388 -8.270 -8.389 1.00 0.00 H new ATOM 0 HE1 HIS C 35 6.713 -7.890 -12.397 1.00 0.00 H new ATOM 1325 N ASP C 36 9.475 -4.871 -9.110 1.00 0.00 N ATOM 1326 CA ASP C 36 10.565 -5.014 -10.069 1.00 0.00 C ATOM 1327 C ASP C 36 11.930 -4.905 -9.412 1.00 0.00 C ATOM 1328 O ASP C 36 12.912 -5.458 -9.908 1.00 0.00 O ATOM 1329 CB ASP C 36 10.431 -3.986 -11.192 1.00 0.00 C ATOM 1330 CG ASP C 36 9.459 -4.431 -12.264 1.00 0.00 C ATOM 1331 OD1 ASP C 36 8.276 -4.687 -11.942 1.00 0.00 O ATOM 1332 OD2 ASP C 36 9.876 -4.539 -13.437 1.00 0.00 O ATOM 0 H ASP C 36 9.117 -3.920 -9.018 1.00 0.00 H new ATOM 0 HA ASP C 36 10.489 -6.016 -10.491 1.00 0.00 H new ATOM 0 HB2 ASP C 36 10.098 -3.036 -10.774 1.00 0.00 H new ATOM 0 HB3 ASP C 36 11.409 -3.812 -11.641 1.00 0.00 H new ATOM 1337 N ASP C 37 11.994 -4.217 -8.290 1.00 0.00 N ATOM 1338 CA ASP C 37 13.248 -4.076 -7.566 1.00 0.00 C ATOM 1339 C ASP C 37 13.017 -4.205 -6.067 1.00 0.00 C ATOM 1340 O ASP C 37 13.030 -3.217 -5.331 1.00 0.00 O ATOM 1341 CB ASP C 37 13.924 -2.740 -7.872 1.00 0.00 C ATOM 1342 CG ASP C 37 15.419 -2.798 -7.625 1.00 0.00 C ATOM 1343 OD1 ASP C 37 16.187 -2.418 -8.537 1.00 0.00 O ATOM 1344 OD2 ASP C 37 15.838 -3.243 -6.536 1.00 0.00 O ATOM 0 H ASP C 37 11.198 -3.747 -7.859 1.00 0.00 H new ATOM 0 HA ASP C 37 13.909 -4.877 -7.898 1.00 0.00 H new ATOM 0 HB2 ASP C 37 13.737 -2.467 -8.911 1.00 0.00 H new ATOM 0 HB3 ASP C 37 13.483 -1.959 -7.253 1.00 0.00 H new ATOM 1349 N PRO C 38 12.792 -5.439 -5.599 1.00 0.00 N ATOM 1350 CA PRO C 38 12.613 -5.730 -4.173 1.00 0.00 C ATOM 1351 C PRO C 38 13.895 -5.523 -3.366 1.00 0.00 C ATOM 1352 O PRO C 38 13.897 -5.640 -2.141 1.00 0.00 O ATOM 1353 CB PRO C 38 12.213 -7.205 -4.164 1.00 0.00 C ATOM 1354 CG PRO C 38 12.787 -7.757 -5.420 1.00 0.00 C ATOM 1355 CD PRO C 38 12.656 -6.651 -6.425 1.00 0.00 C ATOM 0 HA PRO C 38 11.880 -5.068 -3.713 1.00 0.00 H new ATOM 0 HB2 PRO C 38 12.610 -7.718 -3.288 1.00 0.00 H new ATOM 0 HB3 PRO C 38 11.130 -7.322 -4.138 1.00 0.00 H new ATOM 0 HG2 PRO C 38 13.829 -8.046 -5.284 1.00 0.00 H new ATOM 0 HG3 PRO C 38 12.249 -8.649 -5.742 1.00 0.00 H new ATOM 0 HD2 PRO C 38 13.430 -6.707 -7.191 1.00 0.00 H new ATOM 0 HD3 PRO C 38 11.696 -6.684 -6.939 1.00 0.00 H new ATOM 1363 N SER C 39 14.983 -5.218 -4.055 1.00 0.00 N ATOM 1364 CA SER C 39 16.246 -4.950 -3.396 1.00 0.00 C ATOM 1365 C SER C 39 16.271 -3.511 -2.884 1.00 0.00 C ATOM 1366 O SER C 39 16.725 -3.238 -1.770 1.00 0.00 O ATOM 1367 CB SER C 39 17.399 -5.201 -4.368 1.00 0.00 C ATOM 1368 OG SER C 39 17.319 -6.508 -4.921 1.00 0.00 O ATOM 0 H SER C 39 15.014 -5.150 -5.072 1.00 0.00 H new ATOM 0 HA SER C 39 16.360 -5.619 -2.543 1.00 0.00 H new ATOM 0 HB2 SER C 39 17.374 -4.461 -5.168 1.00 0.00 H new ATOM 0 HB3 SER C 39 18.350 -5.078 -3.850 1.00 0.00 H new ATOM 0 HG SER C 39 18.065 -6.647 -5.541 1.00 0.00 H new ATOM 1374 N GLN C 40 15.756 -2.596 -3.697 1.00 0.00 N ATOM 1375 CA GLN C 40 15.642 -1.194 -3.325 1.00 0.00 C ATOM 1376 C GLN C 40 14.401 -0.947 -2.479 1.00 0.00 C ATOM 1377 O GLN C 40 14.118 0.193 -2.134 1.00 0.00 O ATOM 1378 CB GLN C 40 15.568 -0.333 -4.580 1.00 0.00 C ATOM 1379 CG GLN C 40 16.746 -0.522 -5.503 1.00 0.00 C ATOM 1380 CD GLN C 40 17.978 0.234 -5.049 1.00 0.00 C ATOM 1381 OE1 GLN C 40 18.799 -0.286 -4.291 1.00 0.00 O ATOM 1382 NE2 GLN C 40 18.113 1.469 -5.504 1.00 0.00 N ATOM 0 H GLN C 40 15.406 -2.807 -4.632 1.00 0.00 H new ATOM 0 HA GLN C 40 16.522 -0.929 -2.739 1.00 0.00 H new ATOM 0 HB2 GLN C 40 14.651 -0.568 -5.120 1.00 0.00 H new ATOM 0 HB3 GLN C 40 15.507 0.716 -4.290 1.00 0.00 H new ATOM 0 HG2 GLN C 40 16.982 -1.584 -5.570 1.00 0.00 H new ATOM 0 HG3 GLN C 40 16.472 -0.192 -6.505 1.00 0.00 H new ATOM 0 HE21 GLN C 40 17.410 1.862 -6.130 1.00 0.00 H new ATOM 0 HE22 GLN C 40 18.920 2.029 -5.229 1.00 0.00 H new ATOM 1391 N SER C 41 13.664 -2.016 -2.183 1.00 0.00 N ATOM 1392 CA SER C 41 12.376 -1.934 -1.484 1.00 0.00 C ATOM 1393 C SER C 41 12.363 -0.886 -0.364 1.00 0.00 C ATOM 1394 O SER C 41 11.696 0.139 -0.487 1.00 0.00 O ATOM 1395 CB SER C 41 11.999 -3.305 -0.922 1.00 0.00 C ATOM 1396 OG SER C 41 13.060 -3.852 -0.158 1.00 0.00 O ATOM 0 H SER C 41 13.941 -2.968 -2.421 1.00 0.00 H new ATOM 0 HA SER C 41 11.638 -1.615 -2.220 1.00 0.00 H new ATOM 0 HB2 SER C 41 11.108 -3.214 -0.300 1.00 0.00 H new ATOM 0 HB3 SER C 41 11.750 -3.981 -1.740 1.00 0.00 H new ATOM 0 HG SER C 41 13.510 -4.551 -0.677 1.00 0.00 H new ATOM 1402 N ALA C 42 13.092 -1.150 0.716 1.00 0.00 N ATOM 1403 CA ALA C 42 13.201 -0.221 1.837 1.00 0.00 C ATOM 1404 C ALA C 42 13.504 1.204 1.389 1.00 0.00 C ATOM 1405 O ALA C 42 12.954 2.164 1.927 1.00 0.00 O ATOM 1406 CB ALA C 42 14.284 -0.696 2.777 1.00 0.00 C ATOM 0 H ALA C 42 13.623 -2.012 0.839 1.00 0.00 H new ATOM 0 HA ALA C 42 12.235 -0.203 2.342 1.00 0.00 H new ATOM 0 HB1 ALA C 42 14.368 -0.004 3.615 1.00 0.00 H new ATOM 0 HB2 ALA C 42 14.032 -1.689 3.150 1.00 0.00 H new ATOM 0 HB3 ALA C 42 15.235 -0.738 2.245 1.00 0.00 H new ATOM 1412 N ASN C 43 14.381 1.334 0.411 1.00 0.00 N ATOM 1413 CA ASN C 43 14.760 2.642 -0.110 1.00 0.00 C ATOM 1414 C ASN C 43 13.622 3.279 -0.909 1.00 0.00 C ATOM 1415 O ASN C 43 13.435 4.492 -0.867 1.00 0.00 O ATOM 1416 CB ASN C 43 16.022 2.523 -0.964 1.00 0.00 C ATOM 1417 CG ASN C 43 16.411 3.834 -1.628 1.00 0.00 C ATOM 1418 OD1 ASN C 43 17.122 4.652 -1.044 1.00 0.00 O ATOM 1419 ND2 ASN C 43 15.962 4.033 -2.857 1.00 0.00 N ATOM 0 H ASN C 43 14.848 0.549 -0.043 1.00 0.00 H new ATOM 0 HA ASN C 43 14.969 3.296 0.737 1.00 0.00 H new ATOM 0 HB2 ASN C 43 16.846 2.179 -0.339 1.00 0.00 H new ATOM 0 HB3 ASN C 43 15.865 1.765 -1.731 1.00 0.00 H new ATOM 0 HD21 ASN C 43 16.203 4.890 -3.356 1.00 0.00 H new ATOM 0 HD22 ASN C 43 15.375 3.330 -3.306 1.00 0.00 H new ATOM 1426 N LEU C 44 12.854 2.463 -1.624 1.00 0.00 N ATOM 1427 CA LEU C 44 11.682 2.954 -2.339 1.00 0.00 C ATOM 1428 C LEU C 44 10.624 3.375 -1.327 1.00 0.00 C ATOM 1429 O LEU C 44 9.848 4.299 -1.560 1.00 0.00 O ATOM 1430 CB LEU C 44 11.125 1.875 -3.284 1.00 0.00 C ATOM 1431 CG LEU C 44 11.860 1.675 -4.626 1.00 0.00 C ATOM 1432 CD1 LEU C 44 13.179 2.432 -4.683 1.00 0.00 C ATOM 1433 CD2 LEU C 44 12.101 0.196 -4.886 1.00 0.00 C ATOM 0 H LEU C 44 13.022 1.462 -1.723 1.00 0.00 H new ATOM 0 HA LEU C 44 11.967 3.812 -2.948 1.00 0.00 H new ATOM 0 HB2 LEU C 44 11.127 0.924 -2.751 1.00 0.00 H new ATOM 0 HB3 LEU C 44 10.085 2.118 -3.500 1.00 0.00 H new ATOM 0 HG LEU C 44 11.214 2.082 -5.404 1.00 0.00 H new ATOM 0 HD11 LEU C 44 13.657 2.258 -5.647 1.00 0.00 H new ATOM 0 HD12 LEU C 44 12.992 3.498 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU C 44 13.834 2.082 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU C 44 12.620 0.074 -5.837 1.00 0.00 H new ATOM 0 HD22 LEU C 44 12.710 -0.220 -4.084 1.00 0.00 H new ATOM 0 HD23 LEU C 44 11.145 -0.327 -4.925 1.00 0.00 H new ATOM 1445 N LEU C 45 10.632 2.693 -0.186 1.00 0.00 N ATOM 1446 CA LEU C 45 9.776 3.028 0.937 1.00 0.00 C ATOM 1447 C LEU C 45 10.227 4.337 1.583 1.00 0.00 C ATOM 1448 O LEU C 45 9.410 5.132 2.046 1.00 0.00 O ATOM 1449 CB LEU C 45 9.786 1.883 1.936 1.00 0.00 C ATOM 1450 CG LEU C 45 8.623 0.916 1.765 1.00 0.00 C ATOM 1451 CD1 LEU C 45 8.950 -0.174 0.765 1.00 0.00 C ATOM 1452 CD2 LEU C 45 8.216 0.361 3.098 1.00 0.00 C ATOM 0 H LEU C 45 11.237 1.889 -0.018 1.00 0.00 H new ATOM 0 HA LEU C 45 8.754 3.174 0.586 1.00 0.00 H new ATOM 0 HB2 LEU C 45 10.722 1.334 1.837 1.00 0.00 H new ATOM 0 HB3 LEU C 45 9.762 2.293 2.946 1.00 0.00 H new ATOM 0 HG LEU C 45 7.772 1.461 1.356 1.00 0.00 H new ATOM 0 HD11 LEU C 45 8.098 -0.846 0.668 1.00 0.00 H new ATOM 0 HD12 LEU C 45 9.170 0.275 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU C 45 9.818 -0.736 1.110 1.00 0.00 H new ATOM 0 HD21 LEU C 45 7.383 -0.330 2.966 1.00 0.00 H new ATOM 0 HD22 LEU C 45 9.058 -0.167 3.545 1.00 0.00 H new ATOM 0 HD23 LEU C 45 7.910 1.176 3.754 1.00 0.00 H new ATOM 1464 N ALA C 46 11.536 4.558 1.580 1.00 0.00 N ATOM 1465 CA ALA C 46 12.116 5.797 2.081 1.00 0.00 C ATOM 1466 C ALA C 46 11.829 6.945 1.120 1.00 0.00 C ATOM 1467 O ALA C 46 11.539 8.068 1.537 1.00 0.00 O ATOM 1468 CB ALA C 46 13.617 5.632 2.273 1.00 0.00 C ATOM 0 H ALA C 46 12.221 3.887 1.232 1.00 0.00 H new ATOM 0 HA ALA C 46 11.662 6.031 3.044 1.00 0.00 H new ATOM 0 HB1 ALA C 46 14.040 6.564 2.648 1.00 0.00 H new ATOM 0 HB2 ALA C 46 13.806 4.833 2.990 1.00 0.00 H new ATOM 0 HB3 ALA C 46 14.080 5.381 1.319 1.00 0.00 H new ATOM 1474 N GLU C 47 11.916 6.646 -0.170 1.00 0.00 N ATOM 1475 CA GLU C 47 11.635 7.617 -1.217 1.00 0.00 C ATOM 1476 C GLU C 47 10.174 8.051 -1.164 1.00 0.00 C ATOM 1477 O GLU C 47 9.862 9.243 -1.184 1.00 0.00 O ATOM 1478 CB GLU C 47 11.951 7.011 -2.585 1.00 0.00 C ATOM 1479 CG GLU C 47 11.739 7.968 -3.744 1.00 0.00 C ATOM 1480 CD GLU C 47 12.713 9.128 -3.726 1.00 0.00 C ATOM 1481 OE1 GLU C 47 13.923 8.897 -3.937 1.00 0.00 O ATOM 1482 OE2 GLU C 47 12.273 10.279 -3.515 1.00 0.00 O ATOM 0 H GLU C 47 12.183 5.725 -0.518 1.00 0.00 H new ATOM 0 HA GLU C 47 12.263 8.494 -1.059 1.00 0.00 H new ATOM 0 HB2 GLU C 47 12.987 6.672 -2.591 1.00 0.00 H new ATOM 0 HB3 GLU C 47 11.327 6.130 -2.735 1.00 0.00 H new ATOM 0 HG2 GLU C 47 11.844 7.425 -4.683 1.00 0.00 H new ATOM 0 HG3 GLU C 47 10.720 8.353 -3.711 1.00 0.00 H new ATOM 1489 N ALA C 48 9.284 7.071 -1.105 1.00 0.00 N ATOM 1490 CA ALA C 48 7.857 7.332 -0.990 1.00 0.00 C ATOM 1491 C ALA C 48 7.548 8.133 0.272 1.00 0.00 C ATOM 1492 O ALA C 48 6.700 9.024 0.250 1.00 0.00 O ATOM 1493 CB ALA C 48 7.076 6.025 -0.999 1.00 0.00 C ATOM 0 H ALA C 48 9.528 6.081 -1.135 1.00 0.00 H new ATOM 0 HA ALA C 48 7.550 7.927 -1.850 1.00 0.00 H new ATOM 0 HB1 ALA C 48 6.010 6.237 -0.912 1.00 0.00 H new ATOM 0 HB2 ALA C 48 7.265 5.494 -1.932 1.00 0.00 H new ATOM 0 HB3 ALA C 48 7.392 5.406 -0.159 1.00 0.00 H new ATOM 1499 N LYS C 49 8.229 7.803 1.371 1.00 0.00 N ATOM 1500 CA LYS C 49 8.058 8.517 2.631 1.00 0.00 C ATOM 1501 C LYS C 49 8.244 10.021 2.451 1.00 0.00 C ATOM 1502 O LYS C 49 7.488 10.816 3.011 1.00 0.00 O ATOM 1503 CB LYS C 49 9.043 7.987 3.669 1.00 0.00 C ATOM 1504 CG LYS C 49 8.365 7.395 4.882 1.00 0.00 C ATOM 1505 CD LYS C 49 9.377 6.955 5.925 1.00 0.00 C ATOM 1506 CE LYS C 49 8.707 6.601 7.244 1.00 0.00 C ATOM 1507 NZ LYS C 49 8.071 7.784 7.884 1.00 0.00 N ATOM 0 H LYS C 49 8.907 7.042 1.410 1.00 0.00 H new ATOM 0 HA LYS C 49 7.039 8.346 2.979 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.675 7.228 3.207 1.00 0.00 H new ATOM 0 HB3 LYS C 49 9.699 8.798 3.986 1.00 0.00 H new ATOM 0 HG2 LYS C 49 7.688 8.130 5.317 1.00 0.00 H new ATOM 0 HG3 LYS C 49 7.757 6.542 4.580 1.00 0.00 H new ATOM 0 HD2 LYS C 49 9.930 6.092 5.554 1.00 0.00 H new ATOM 0 HD3 LYS C 49 10.102 7.752 6.088 1.00 0.00 H new ATOM 0 HE2 LYS C 49 7.953 5.833 7.072 1.00 0.00 H new ATOM 0 HE3 LYS C 49 9.446 6.176 7.923 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 7.915 7.590 8.894 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 8.694 8.611 7.782 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 7.159 7.979 7.424 1.00 0.00 H new ATOM 1521 N LYS C 50 9.247 10.398 1.667 1.00 0.00 N ATOM 1522 CA LYS C 50 9.486 11.801 1.338 1.00 0.00 C ATOM 1523 C LYS C 50 8.238 12.417 0.717 1.00 0.00 C ATOM 1524 O LYS C 50 7.745 13.451 1.164 1.00 0.00 O ATOM 1525 CB LYS C 50 10.640 11.913 0.345 1.00 0.00 C ATOM 1526 CG LYS C 50 11.966 11.386 0.861 1.00 0.00 C ATOM 1527 CD LYS C 50 12.936 11.131 -0.283 1.00 0.00 C ATOM 1528 CE LYS C 50 13.144 12.370 -1.139 1.00 0.00 C ATOM 1529 NZ LYS C 50 13.943 12.072 -2.354 1.00 0.00 N ATOM 0 H LYS C 50 9.912 9.749 1.245 1.00 0.00 H new ATOM 0 HA LYS C 50 9.736 12.333 2.256 1.00 0.00 H new ATOM 0 HB2 LYS C 50 10.376 11.370 -0.563 1.00 0.00 H new ATOM 0 HB3 LYS C 50 10.763 12.960 0.066 1.00 0.00 H new ATOM 0 HG2 LYS C 50 12.400 12.104 1.557 1.00 0.00 H new ATOM 0 HG3 LYS C 50 11.803 10.462 1.416 1.00 0.00 H new ATOM 0 HD2 LYS C 50 13.894 10.804 0.120 1.00 0.00 H new ATOM 0 HD3 LYS C 50 12.558 10.320 -0.905 1.00 0.00 H new ATOM 0 HE2 LYS C 50 12.176 12.777 -1.431 1.00 0.00 H new ATOM 0 HE3 LYS C 50 13.648 13.137 -0.552 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 14.222 12.963 -2.813 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 14.795 11.538 -2.087 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 13.373 11.506 -3.014 1.00 0.00 H new ATOM 1543 N LEU C 51 7.738 11.746 -0.312 1.00 0.00 N ATOM 1544 CA LEU C 51 6.559 12.173 -1.046 1.00 0.00 C ATOM 1545 C LEU C 51 5.358 12.313 -0.116 1.00 0.00 C ATOM 1546 O LEU C 51 4.682 13.343 -0.103 1.00 0.00 O ATOM 1547 CB LEU C 51 6.270 11.123 -2.107 1.00 0.00 C ATOM 1548 CG LEU C 51 5.862 11.633 -3.480 1.00 0.00 C ATOM 1549 CD1 LEU C 51 5.909 10.474 -4.448 1.00 0.00 C ATOM 1550 CD2 LEU C 51 4.471 12.251 -3.452 1.00 0.00 C ATOM 0 H LEU C 51 8.146 10.880 -0.663 1.00 0.00 H new ATOM 0 HA LEU C 51 6.740 13.147 -1.501 1.00 0.00 H new ATOM 0 HB2 LEU C 51 7.160 10.504 -2.225 1.00 0.00 H new ATOM 0 HB3 LEU C 51 5.477 10.474 -1.736 1.00 0.00 H new ATOM 0 HG LEU C 51 6.552 12.416 -3.795 1.00 0.00 H new ATOM 0 HD11 LEU C 51 5.619 10.817 -5.441 1.00 0.00 H new ATOM 0 HD12 LEU C 51 6.921 10.071 -4.484 1.00 0.00 H new ATOM 0 HD13 LEU C 51 5.220 9.696 -4.118 1.00 0.00 H new ATOM 0 HD21 LEU C 51 4.210 12.605 -4.449 1.00 0.00 H new ATOM 0 HD22 LEU C 51 3.747 11.502 -3.132 1.00 0.00 H new ATOM 0 HD23 LEU C 51 4.459 13.089 -2.755 1.00 0.00 H new ATOM 1562 N ASN C 52 5.101 11.261 0.656 1.00 0.00 N ATOM 1563 CA ASN C 52 4.008 11.246 1.621 1.00 0.00 C ATOM 1564 C ASN C 52 4.101 12.424 2.577 1.00 0.00 C ATOM 1565 O ASN C 52 3.120 13.125 2.807 1.00 0.00 O ATOM 1566 CB ASN C 52 4.029 9.941 2.416 1.00 0.00 C ATOM 1567 CG ASN C 52 2.955 9.891 3.489 1.00 0.00 C ATOM 1568 OD1 ASN C 52 1.829 9.481 3.229 1.00 0.00 O ATOM 1569 ND2 ASN C 52 3.301 10.284 4.706 1.00 0.00 N ATOM 0 H ASN C 52 5.643 10.398 0.630 1.00 0.00 H new ATOM 0 HA ASN C 52 3.072 11.324 1.068 1.00 0.00 H new ATOM 0 HB2 ASN C 52 3.894 9.102 1.733 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.007 9.819 2.881 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.621 10.251 5.465 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.248 10.619 4.884 1.00 0.00 H new ATOM 1576 N ASP C 53 5.293 12.648 3.114 1.00 0.00 N ATOM 1577 CA ASP C 53 5.497 13.696 4.106 1.00 0.00 C ATOM 1578 C ASP C 53 5.402 15.068 3.460 1.00 0.00 C ATOM 1579 O ASP C 53 5.033 16.047 4.098 1.00 0.00 O ATOM 1580 CB ASP C 53 6.855 13.528 4.787 1.00 0.00 C ATOM 1581 CG ASP C 53 7.059 14.510 5.921 1.00 0.00 C ATOM 1582 OD1 ASP C 53 6.584 14.234 7.042 1.00 0.00 O ATOM 1583 OD2 ASP C 53 7.718 15.550 5.706 1.00 0.00 O ATOM 0 H ASP C 53 6.133 12.119 2.880 1.00 0.00 H new ATOM 0 HA ASP C 53 4.714 13.612 4.860 1.00 0.00 H new ATOM 0 HB2 ASP C 53 6.942 12.511 5.171 1.00 0.00 H new ATOM 0 HB3 ASP C 53 7.647 13.660 4.049 1.00 0.00 H new ATOM 1588 N ALA C 54 5.737 15.122 2.184 1.00 0.00 N ATOM 1589 CA ALA C 54 5.668 16.350 1.416 1.00 0.00 C ATOM 1590 C ALA C 54 4.225 16.790 1.213 1.00 0.00 C ATOM 1591 O ALA C 54 3.897 17.967 1.355 1.00 0.00 O ATOM 1592 CB ALA C 54 6.340 16.137 0.081 1.00 0.00 C ATOM 0 H ALA C 54 6.064 14.316 1.652 1.00 0.00 H new ATOM 0 HA ALA C 54 6.182 17.138 1.966 1.00 0.00 H new ATOM 0 HB1 ALA C 54 6.292 17.057 -0.502 1.00 0.00 H new ATOM 0 HB2 ALA C 54 7.383 15.862 0.238 1.00 0.00 H new ATOM 0 HB3 ALA C 54 5.831 15.338 -0.459 1.00 0.00 H new ATOM 1598 N GLN C 55 3.367 15.835 0.879 1.00 0.00 N ATOM 1599 CA GLN C 55 1.956 16.120 0.652 1.00 0.00 C ATOM 1600 C GLN C 55 1.177 16.059 1.958 1.00 0.00 C ATOM 1601 O GLN C 55 -0.041 16.244 1.978 1.00 0.00 O ATOM 1602 CB GLN C 55 1.365 15.137 -0.360 1.00 0.00 C ATOM 1603 CG GLN C 55 2.003 15.229 -1.735 1.00 0.00 C ATOM 1604 CD GLN C 55 1.322 14.343 -2.759 1.00 0.00 C ATOM 1605 OE1 GLN C 55 0.779 13.289 -2.432 1.00 0.00 O ATOM 1606 NE2 GLN C 55 1.341 14.772 -4.009 1.00 0.00 N ATOM 0 H GLN C 55 3.624 14.855 0.759 1.00 0.00 H new ATOM 0 HA GLN C 55 1.876 17.129 0.247 1.00 0.00 H new ATOM 0 HB2 GLN C 55 1.483 14.122 0.020 1.00 0.00 H new ATOM 0 HB3 GLN C 55 0.295 15.321 -0.451 1.00 0.00 H new ATOM 0 HG2 GLN C 55 1.970 16.263 -2.077 1.00 0.00 H new ATOM 0 HG3 GLN C 55 3.054 14.950 -1.662 1.00 0.00 H new ATOM 0 HE21 GLN C 55 1.802 15.652 -4.239 1.00 0.00 H new ATOM 0 HE22 GLN C 55 0.894 14.223 -4.743 1.00 0.00 H new ATOM 1615 N ALA C 56 1.887 15.798 3.044 1.00 0.00 N ATOM 1616 CA ALA C 56 1.277 15.723 4.358 1.00 0.00 C ATOM 1617 C ALA C 56 1.059 17.116 4.930 1.00 0.00 C ATOM 1618 O ALA C 56 2.003 17.671 5.535 1.00 0.00 O ATOM 1619 CB ALA C 56 2.147 14.893 5.281 1.00 0.00 C ATOM 0 H ALA C 56 2.894 15.634 3.038 1.00 0.00 H new ATOM 0 HA ALA C 56 0.303 15.243 4.268 1.00 0.00 H new ATOM 0 HB1 ALA C 56 1.685 14.840 6.267 1.00 0.00 H new ATOM 0 HB2 ALA C 56 2.252 13.887 4.875 1.00 0.00 H new ATOM 0 HB3 ALA C 56 3.131 15.355 5.366 1.00 0.00 H new TER 1625 ALA C 56