USER MOD reduce.3.24.130724 H: found=0, std=0, add=1195, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1198 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 163 THR OG1 : rot -170:sc= 0 USER MOD Set 1.2: A 173 MET CE :methyl 146:sc= -0.0835 (180deg=-0.772) USER MOD Set 2.1: A 139 CYS SG : rot -160:sc= 0.047 USER MOD Set 2.2: A 161 HIS : no HE2:sc= -10.4! C(o=-12!,f=-17!) USER MOD Set 2.3: A 164 CYS SG : rot 144:sc= -1.42! USER MOD Set 2.4: A 172 CYS SG : rot 180:sc= -0.303 USER MOD Set 3.1: A 132 TYR OH : rot -14:sc= -0.0421 USER MOD Set 3.2: A 134 SER OG : rot -7:sc= 0.226! USER MOD Set 4.1: A 16 GLN : amide:sc= -0.816 X(o=-1.4,f=-1.2) USER MOD Set 4.2: A 60 MET CE :methyl 152:sc= -0.603 (180deg=-2.3) USER MOD Set 5.1: A 28 LYS NZ :NH3+ 165:sc= -3.71! (180deg=-1.4!) USER MOD Set 5.2: A 29 HIS : no HE2:sc= -2.86! C(o=-6.6!,f=-2.3!) USER MOD Single : A 7 ASN : amide:sc= -0.849 K(o=-0.85,f=-0.01) USER MOD Single : A 12 MET CE :methyl 159:sc= -1.93 (180deg=-3.56!) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.0127 USER MOD Single : A 19 MET CE :methyl 172:sc= 0 (180deg=-0.122) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -2.56! K(o=-2.6!,f=-0.23) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= -0.0287 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.773 K(o=-0.77,f=-1.8) USER MOD Single : A 56 GLN : amide:sc= -0.0209 K(o=-0.021,f=-1.7!) USER MOD Single : A 59 ASN : amide:sc= -0.0791 K(o=-0.079,f=-2.2!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.0497 K(o=-0.05,f=-2.2!) USER MOD Single : A 75 ASN : amide:sc= -1.55! K(o=-1.6!,f=-0.02) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -0.489 K(o=-0.49,f=-4.2!) USER MOD Single : A 82 THR OG1 : rot -47:sc= 0.973 USER MOD Single : A 87 LYS NZ :NH3+ 158:sc= -1.27 (180deg=-1.84) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl 147:sc= -6.61! (180deg=-10.5!) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 103 HIS : no HD1:sc= -1.04 K(o=-1,f=-2.3) USER MOD Single : A 107 ASN : amide:sc= -0.0174 K(o=-0.017,f=-2!) USER MOD Single : A 108 LYS NZ :NH3+ 141:sc= 1.23 (180deg=0.311) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -0.903 K(o=-0.9,f=-0.038) USER MOD Single : A 121 GLN : amide:sc= -0.0137 K(o=-0.014,f=-1.9!) USER MOD Single : A 125 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.17) USER MOD Single : A 126 ASN : amide:sc= -2.56! C(o=-2.6!,f=-4!) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= -0.451 USER MOD Single : A 141 CYS SG : rot 180:sc= 0 USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 152 HIS : no HE2:sc= -1.91 K(o=-1.9,f=-7.2!) USER MOD Single : A 154 GLN : amide:sc= -0.0674 X(o=-0.067,f=-0.077) USER MOD Single : A 155 GLN : amide:sc= 0.114 X(o=0.11,f=-0.21) USER MOD Single : A 156 LYS NZ :NH3+ -153:sc= -0.935 (180deg=-1.64) USER MOD Single : A 158 GLN : amide:sc= -1.16! K(o=-1.2!,f=0) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 165 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.122 X(o=-0.12,f=-0.29) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 HIS : no HD1:sc= -0.681 K(o=-0.68,f=-0.14) USER MOD Single : A 179 GLN : amide:sc= -1.89! K(o=-1.9!,f=-0.065) USER MOD ----------------------------------------------------------------- ATOM 42 N GLY A 3 17.523 4.277 5.904 1.00 0.00 N ATOM 43 CA GLY A 3 16.070 4.104 5.942 1.00 0.00 C ATOM 44 C GLY A 3 15.459 4.143 4.545 1.00 0.00 C ATOM 45 O GLY A 3 15.236 5.217 3.986 1.00 0.00 O ATOM 0 HA2 GLY A 3 15.829 3.153 6.418 1.00 0.00 H new ATOM 0 HA3 GLY A 3 15.626 4.889 6.555 1.00 0.00 H new ATOM 49 N ILE A 4 15.173 2.970 3.991 1.00 0.00 N ATOM 50 CA ILE A 4 14.573 2.898 2.667 1.00 0.00 C ATOM 51 C ILE A 4 13.116 3.345 2.733 1.00 0.00 C ATOM 52 O ILE A 4 12.627 4.040 1.846 1.00 0.00 O ATOM 53 CB ILE A 4 14.658 1.464 2.133 1.00 0.00 C ATOM 54 CG1 ILE A 4 14.170 1.419 0.673 1.00 0.00 C ATOM 55 CG2 ILE A 4 13.782 0.548 2.987 1.00 0.00 C ATOM 56 CD1 ILE A 4 15.121 2.222 -0.231 1.00 0.00 C ATOM 0 H ILE A 4 15.345 2.067 4.433 1.00 0.00 H new ATOM 0 HA ILE A 4 15.117 3.560 1.993 1.00 0.00 H new ATOM 0 HB ILE A 4 15.694 1.128 2.178 1.00 0.00 H new ATOM 0 HG12 ILE A 4 14.118 0.385 0.331 1.00 0.00 H new ATOM 0 HG13 ILE A 4 13.162 1.828 0.606 1.00 0.00 H new ATOM 0 HG21 ILE A 4 13.843 -0.472 2.607 1.00 0.00 H new ATOM 0 HG22 ILE A 4 14.130 0.571 4.020 1.00 0.00 H new ATOM 0 HG23 ILE A 4 12.748 0.890 2.944 1.00 0.00 H new ATOM 0 HD11 ILE A 4 14.765 2.182 -1.260 1.00 0.00 H new ATOM 0 HD12 ILE A 4 15.151 3.259 0.103 1.00 0.00 H new ATOM 0 HD13 ILE A 4 16.122 1.794 -0.177 1.00 0.00 H new ATOM 68 N ILE A 5 12.436 2.944 3.802 1.00 0.00 N ATOM 69 CA ILE A 5 11.034 3.310 3.996 1.00 0.00 C ATOM 70 C ILE A 5 10.904 4.819 4.182 1.00 0.00 C ATOM 71 O ILE A 5 10.013 5.447 3.608 1.00 0.00 O ATOM 72 CB ILE A 5 10.457 2.593 5.233 1.00 0.00 C ATOM 73 CG1 ILE A 5 10.851 1.092 5.228 1.00 0.00 C ATOM 74 CG2 ILE A 5 8.931 2.729 5.243 1.00 0.00 C ATOM 75 CD1 ILE A 5 10.025 0.313 4.191 1.00 0.00 C ATOM 0 H ILE A 5 12.829 2.368 4.546 1.00 0.00 H new ATOM 0 HA ILE A 5 10.476 3.004 3.111 1.00 0.00 H new ATOM 0 HB ILE A 5 10.870 3.057 6.129 1.00 0.00 H new ATOM 0 HG12 ILE A 5 11.913 0.991 5.004 1.00 0.00 H new ATOM 0 HG13 ILE A 5 10.693 0.667 6.219 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.526 2.221 6.118 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.660 3.784 5.278 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.520 2.278 4.340 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.319 -0.737 4.206 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.965 0.397 4.433 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.204 0.726 3.198 1.00 0.00 H new ATOM 87 N PHE A 6 11.788 5.398 4.982 1.00 0.00 N ATOM 88 CA PHE A 6 11.746 6.836 5.226 1.00 0.00 C ATOM 89 C PHE A 6 12.130 7.612 3.965 1.00 0.00 C ATOM 90 O PHE A 6 11.665 8.726 3.751 1.00 0.00 O ATOM 91 CB PHE A 6 12.691 7.203 6.371 1.00 0.00 C ATOM 92 CG PHE A 6 12.305 6.426 7.608 1.00 0.00 C ATOM 93 CD1 PHE A 6 12.742 5.107 7.770 1.00 0.00 C ATOM 94 CD2 PHE A 6 11.509 7.027 8.590 1.00 0.00 C ATOM 95 CE1 PHE A 6 12.383 4.387 8.915 1.00 0.00 C ATOM 96 CE2 PHE A 6 11.150 6.305 9.736 1.00 0.00 C ATOM 97 CZ PHE A 6 11.587 4.986 9.898 1.00 0.00 C ATOM 0 H PHE A 6 12.535 4.903 5.469 1.00 0.00 H new ATOM 0 HA PHE A 6 10.727 7.106 5.502 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.721 6.978 6.094 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.641 8.274 6.570 1.00 0.00 H new ATOM 0 HD1 PHE A 6 13.356 4.644 7.012 1.00 0.00 H new ATOM 0 HD2 PHE A 6 11.172 8.045 8.465 1.00 0.00 H new ATOM 0 HE1 PHE A 6 12.720 3.369 9.040 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.536 6.767 10.495 1.00 0.00 H new ATOM 0 HZ PHE A 6 11.310 4.430 10.782 1.00 0.00 H new ATOM 107 N ASN A 7 12.983 7.019 3.138 1.00 0.00 N ATOM 108 CA ASN A 7 13.417 7.675 1.903 1.00 0.00 C ATOM 109 C ASN A 7 12.236 7.892 0.948 1.00 0.00 C ATOM 110 O ASN A 7 12.095 8.960 0.350 1.00 0.00 O ATOM 111 CB ASN A 7 14.483 6.824 1.210 1.00 0.00 C ATOM 112 CG ASN A 7 15.144 7.624 0.094 1.00 0.00 C ATOM 113 OD1 ASN A 7 15.747 8.666 0.349 1.00 0.00 O ATOM 114 ND2 ASN A 7 15.068 7.196 -1.137 1.00 0.00 N ATOM 0 H ASN A 7 13.386 6.095 3.294 1.00 0.00 H new ATOM 0 HA ASN A 7 13.833 8.648 2.165 1.00 0.00 H new ATOM 0 HB2 ASN A 7 15.233 6.506 1.934 1.00 0.00 H new ATOM 0 HB3 ASN A 7 14.030 5.920 0.802 1.00 0.00 H new ATOM 0 HD21 ASN A 7 15.509 7.725 -1.889 1.00 0.00 H new ATOM 0 HD22 ASN A 7 14.568 6.332 -1.347 1.00 0.00 H new ATOM 121 N VAL A 8 11.398 6.869 0.807 1.00 0.00 N ATOM 122 CA VAL A 8 10.237 6.961 -0.086 1.00 0.00 C ATOM 123 C VAL A 8 9.175 7.889 0.509 1.00 0.00 C ATOM 124 O VAL A 8 8.451 8.570 -0.218 1.00 0.00 O ATOM 125 CB VAL A 8 9.637 5.563 -0.330 1.00 0.00 C ATOM 126 CG1 VAL A 8 8.562 5.640 -1.430 1.00 0.00 C ATOM 127 CG2 VAL A 8 10.742 4.595 -0.774 1.00 0.00 C ATOM 0 H VAL A 8 11.495 5.976 1.291 1.00 0.00 H new ATOM 0 HA VAL A 8 10.569 7.374 -1.039 1.00 0.00 H new ATOM 0 HB VAL A 8 9.186 5.205 0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 8 8.142 4.648 -1.598 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.771 6.322 -1.118 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.012 6.004 -2.354 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.313 3.608 -0.945 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.196 4.959 -1.696 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.503 4.530 0.004 1.00 0.00 H new ATOM 137 N LEU A 9 9.099 7.913 1.833 1.00 0.00 N ATOM 138 CA LEU A 9 8.135 8.763 2.536 1.00 0.00 C ATOM 139 C LEU A 9 8.499 10.238 2.358 1.00 0.00 C ATOM 140 O LEU A 9 7.679 11.040 1.912 1.00 0.00 O ATOM 141 CB LEU A 9 8.134 8.373 4.025 1.00 0.00 C ATOM 142 CG LEU A 9 7.302 9.354 4.874 1.00 0.00 C ATOM 143 CD1 LEU A 9 5.971 9.664 4.194 1.00 0.00 C ATOM 144 CD2 LEU A 9 7.023 8.711 6.240 1.00 0.00 C ATOM 0 H LEU A 9 9.692 7.354 2.446 1.00 0.00 H new ATOM 0 HA LEU A 9 7.137 8.617 2.122 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.733 7.366 4.136 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.159 8.351 4.395 1.00 0.00 H new ATOM 0 HG LEU A 9 7.862 10.282 4.990 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.400 10.358 4.811 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.157 10.114 3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.404 8.742 4.066 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.435 9.395 6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.469 7.783 6.099 1.00 0.00 H new ATOM 0 HD23 LEU A 9 7.967 8.497 6.741 1.00 0.00 H new ATOM 156 N GLU A 10 9.726 10.589 2.685 1.00 0.00 N ATOM 157 CA GLU A 10 10.168 11.975 2.538 1.00 0.00 C ATOM 158 C GLU A 10 9.709 12.540 1.190 1.00 0.00 C ATOM 159 O GLU A 10 9.425 13.729 1.066 1.00 0.00 O ATOM 160 CB GLU A 10 11.694 12.050 2.637 1.00 0.00 C ATOM 161 CG GLU A 10 12.143 13.513 2.567 1.00 0.00 C ATOM 162 CD GLU A 10 13.656 13.603 2.730 1.00 0.00 C ATOM 163 OE1 GLU A 10 14.287 12.561 2.803 1.00 0.00 O ATOM 164 OE2 GLU A 10 14.162 14.712 2.780 1.00 0.00 O ATOM 0 H GLU A 10 10.432 9.949 3.050 1.00 0.00 H new ATOM 0 HA GLU A 10 9.726 12.569 3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.030 11.600 3.571 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.149 11.480 1.827 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.845 13.948 1.613 1.00 0.00 H new ATOM 0 HG3 GLU A 10 11.650 14.091 3.349 1.00 0.00 H new ATOM 171 N ASP A 11 9.653 11.673 0.189 1.00 0.00 N ATOM 172 CA ASP A 11 9.242 12.087 -1.149 1.00 0.00 C ATOM 173 C ASP A 11 7.748 12.380 -1.198 1.00 0.00 C ATOM 174 O ASP A 11 7.294 13.205 -1.994 1.00 0.00 O ATOM 175 CB ASP A 11 9.586 10.996 -2.163 1.00 0.00 C ATOM 176 CG ASP A 11 9.530 11.561 -3.578 1.00 0.00 C ATOM 177 OD1 ASP A 11 9.269 12.745 -3.712 1.00 0.00 O ATOM 178 OD2 ASP A 11 9.750 10.801 -4.507 1.00 0.00 O ATOM 0 H ASP A 11 9.885 10.683 0.275 1.00 0.00 H new ATOM 0 HA ASP A 11 9.780 13.001 -1.400 1.00 0.00 H new ATOM 0 HB2 ASP A 11 10.581 10.600 -1.960 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.887 10.165 -2.067 1.00 0.00 H new ATOM 183 N MET A 12 6.990 11.704 -0.354 1.00 0.00 N ATOM 184 CA MET A 12 5.548 11.902 -0.320 1.00 0.00 C ATOM 185 C MET A 12 5.192 13.216 0.365 1.00 0.00 C ATOM 186 O MET A 12 4.477 14.042 -0.201 1.00 0.00 O ATOM 187 CB MET A 12 4.875 10.728 0.418 1.00 0.00 C ATOM 188 CG MET A 12 4.606 9.555 -0.555 1.00 0.00 C ATOM 189 SD MET A 12 2.835 9.500 -0.967 1.00 0.00 S ATOM 190 CE MET A 12 2.726 11.077 -1.847 1.00 0.00 C ATOM 0 H MET A 12 7.343 11.018 0.313 1.00 0.00 H new ATOM 0 HA MET A 12 5.185 11.942 -1.347 1.00 0.00 H new ATOM 0 HB2 MET A 12 5.513 10.391 1.235 1.00 0.00 H new ATOM 0 HB3 MET A 12 3.937 11.061 0.863 1.00 0.00 H new ATOM 0 HG2 MET A 12 5.197 9.679 -1.462 1.00 0.00 H new ATOM 0 HG3 MET A 12 4.914 8.614 -0.100 1.00 0.00 H new ATOM 0 HE1 MET A 12 1.848 11.073 -2.493 1.00 0.00 H new ATOM 0 HE2 MET A 12 2.643 11.891 -1.127 1.00 0.00 H new ATOM 0 HE3 MET A 12 3.621 11.218 -2.453 1.00 0.00 H new ATOM 200 N VAL A 13 5.684 13.409 1.579 1.00 0.00 N ATOM 201 CA VAL A 13 5.394 14.635 2.314 1.00 0.00 C ATOM 202 C VAL A 13 5.859 15.854 1.523 1.00 0.00 C ATOM 203 O VAL A 13 5.143 16.850 1.425 1.00 0.00 O ATOM 204 CB VAL A 13 6.089 14.595 3.672 1.00 0.00 C ATOM 205 CG1 VAL A 13 5.529 13.428 4.498 1.00 0.00 C ATOM 206 CG2 VAL A 13 7.593 14.398 3.458 1.00 0.00 C ATOM 0 H VAL A 13 6.279 12.743 2.073 1.00 0.00 H new ATOM 0 HA VAL A 13 4.317 14.711 2.463 1.00 0.00 H new ATOM 0 HB VAL A 13 5.914 15.530 4.205 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.025 13.398 5.468 1.00 0.00 H new ATOM 0 HG12 VAL A 13 4.457 13.565 4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.707 12.491 3.971 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.097 14.368 4.424 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.766 13.460 2.930 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.988 15.225 2.868 1.00 0.00 H new ATOM 216 N VAL A 14 7.057 15.771 0.962 1.00 0.00 N ATOM 217 CA VAL A 14 7.597 16.878 0.183 1.00 0.00 C ATOM 218 C VAL A 14 6.613 17.297 -0.908 1.00 0.00 C ATOM 219 O VAL A 14 6.601 18.452 -1.335 1.00 0.00 O ATOM 220 CB VAL A 14 8.941 16.470 -0.447 1.00 0.00 C ATOM 221 CG1 VAL A 14 9.341 17.485 -1.528 1.00 0.00 C ATOM 222 CG2 VAL A 14 10.025 16.436 0.641 1.00 0.00 C ATOM 0 H VAL A 14 7.669 14.958 1.030 1.00 0.00 H new ATOM 0 HA VAL A 14 7.757 17.726 0.849 1.00 0.00 H new ATOM 0 HB VAL A 14 8.839 15.483 -0.899 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.293 17.190 -1.970 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.575 17.513 -2.303 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.440 18.474 -1.080 1.00 0.00 H new ATOM 0 HG21 VAL A 14 10.978 16.147 0.197 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.119 17.424 1.092 1.00 0.00 H new ATOM 0 HG23 VAL A 14 9.748 15.713 1.408 1.00 0.00 H new ATOM 232 N ALA A 15 5.801 16.353 -1.361 1.00 0.00 N ATOM 233 CA ALA A 15 4.827 16.635 -2.412 1.00 0.00 C ATOM 234 C ALA A 15 3.537 17.220 -1.833 1.00 0.00 C ATOM 235 O ALA A 15 2.717 17.775 -2.565 1.00 0.00 O ATOM 236 CB ALA A 15 4.503 15.348 -3.174 1.00 0.00 C ATOM 0 H ALA A 15 5.795 15.391 -1.022 1.00 0.00 H new ATOM 0 HA ALA A 15 5.264 17.370 -3.088 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.776 15.562 -3.957 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.414 14.952 -3.623 1.00 0.00 H new ATOM 0 HB3 ALA A 15 4.088 14.612 -2.485 1.00 0.00 H new ATOM 242 N GLN A 16 3.346 17.064 -0.521 1.00 0.00 N ATOM 243 CA GLN A 16 2.123 17.557 0.134 1.00 0.00 C ATOM 244 C GLN A 16 2.309 18.935 0.780 1.00 0.00 C ATOM 245 O GLN A 16 1.493 19.834 0.576 1.00 0.00 O ATOM 246 CB GLN A 16 1.692 16.565 1.220 1.00 0.00 C ATOM 247 CG GLN A 16 1.392 15.194 0.588 1.00 0.00 C ATOM 248 CD GLN A 16 0.422 14.408 1.470 1.00 0.00 C ATOM 249 OE1 GLN A 16 0.843 13.736 2.411 1.00 0.00 O ATOM 250 NE2 GLN A 16 -0.857 14.455 1.219 1.00 0.00 N ATOM 0 H GLN A 16 4.010 16.608 0.105 1.00 0.00 H new ATOM 0 HA GLN A 16 1.363 17.651 -0.642 1.00 0.00 H new ATOM 0 HB2 GLN A 16 2.479 16.466 1.968 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.808 16.939 1.736 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.964 15.329 -0.405 1.00 0.00 H new ATOM 0 HG3 GLN A 16 2.318 14.633 0.463 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.203 15.013 0.438 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -1.511 13.934 1.803 1.00 0.00 H new ATOM 259 N CYS A 17 3.360 19.086 1.586 1.00 0.00 N ATOM 260 CA CYS A 17 3.607 20.362 2.289 1.00 0.00 C ATOM 261 C CYS A 17 5.032 20.883 2.057 1.00 0.00 C ATOM 262 O CYS A 17 5.313 22.056 2.306 1.00 0.00 O ATOM 263 CB CYS A 17 3.361 20.163 3.798 1.00 0.00 C ATOM 264 SG CYS A 17 1.667 20.665 4.213 1.00 0.00 S ATOM 0 H CYS A 17 4.049 18.358 1.772 1.00 0.00 H new ATOM 0 HA CYS A 17 2.920 21.107 1.888 1.00 0.00 H new ATOM 0 HB2 CYS A 17 3.517 19.118 4.067 1.00 0.00 H new ATOM 0 HB3 CYS A 17 4.076 20.751 4.374 1.00 0.00 H new ATOM 0 HG CYS A 17 1.463 20.494 5.485 1.00 0.00 H new ATOM 270 N GLY A 18 5.925 20.018 1.579 1.00 0.00 N ATOM 271 CA GLY A 18 7.316 20.428 1.319 1.00 0.00 C ATOM 272 C GLY A 18 8.295 19.705 2.242 1.00 0.00 C ATOM 273 O GLY A 18 7.903 18.861 3.042 1.00 0.00 O ATOM 0 H GLY A 18 5.721 19.042 1.365 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.570 20.217 0.280 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.411 21.505 1.458 1.00 0.00 H new ATOM 277 N MET A 19 9.572 20.035 2.102 1.00 0.00 N ATOM 278 CA MET A 19 10.617 19.405 2.911 1.00 0.00 C ATOM 279 C MET A 19 10.676 20.018 4.316 1.00 0.00 C ATOM 280 O MET A 19 11.110 19.366 5.265 1.00 0.00 O ATOM 281 CB MET A 19 11.989 19.560 2.210 1.00 0.00 C ATOM 282 CG MET A 19 11.978 20.808 1.320 1.00 0.00 C ATOM 283 SD MET A 19 13.678 21.353 1.024 1.00 0.00 S ATOM 284 CE MET A 19 14.149 20.021 -0.107 1.00 0.00 C ATOM 0 H MET A 19 9.912 20.732 1.440 1.00 0.00 H new ATOM 0 HA MET A 19 10.377 18.347 3.013 1.00 0.00 H new ATOM 0 HB2 MET A 19 12.781 19.640 2.954 1.00 0.00 H new ATOM 0 HB3 MET A 19 12.203 18.676 1.610 1.00 0.00 H new ATOM 0 HG2 MET A 19 11.485 20.588 0.373 1.00 0.00 H new ATOM 0 HG3 MET A 19 11.408 21.604 1.799 1.00 0.00 H new ATOM 0 HE1 MET A 19 15.129 20.235 -0.533 1.00 0.00 H new ATOM 0 HE2 MET A 19 14.188 19.078 0.438 1.00 0.00 H new ATOM 0 HE3 MET A 19 13.414 19.947 -0.908 1.00 0.00 H new ATOM 294 N SER A 20 10.252 21.270 4.440 1.00 0.00 N ATOM 295 CA SER A 20 10.280 21.947 5.736 1.00 0.00 C ATOM 296 C SER A 20 9.416 21.211 6.763 1.00 0.00 C ATOM 297 O SER A 20 9.769 21.142 7.939 1.00 0.00 O ATOM 298 CB SER A 20 9.797 23.388 5.590 1.00 0.00 C ATOM 299 OG SER A 20 10.581 24.050 4.604 1.00 0.00 O ATOM 0 H SER A 20 9.889 21.833 3.671 1.00 0.00 H new ATOM 0 HA SER A 20 11.310 21.947 6.092 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.745 23.404 5.305 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.877 23.909 6.544 1.00 0.00 H new ATOM 0 HG SER A 20 10.272 24.975 4.507 1.00 0.00 H new ATOM 305 N VAL A 21 8.291 20.661 6.318 1.00 0.00 N ATOM 306 CA VAL A 21 7.407 19.933 7.228 1.00 0.00 C ATOM 307 C VAL A 21 8.069 18.632 7.676 1.00 0.00 C ATOM 308 O VAL A 21 7.956 18.228 8.833 1.00 0.00 O ATOM 309 CB VAL A 21 6.057 19.628 6.527 1.00 0.00 C ATOM 310 CG1 VAL A 21 6.161 18.330 5.701 1.00 0.00 C ATOM 311 CG2 VAL A 21 4.955 19.465 7.580 1.00 0.00 C ATOM 0 H VAL A 21 7.971 20.702 5.350 1.00 0.00 H new ATOM 0 HA VAL A 21 7.219 20.552 8.105 1.00 0.00 H new ATOM 0 HB VAL A 21 5.816 20.457 5.862 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.206 18.130 5.216 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.937 18.442 4.943 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.414 17.499 6.359 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.008 19.251 7.085 1.00 0.00 H new ATOM 0 HG22 VAL A 21 5.209 18.642 8.248 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.863 20.386 8.156 1.00 0.00 H new ATOM 321 N TRP A 22 8.748 17.981 6.742 1.00 0.00 N ATOM 322 CA TRP A 22 9.414 16.724 7.027 1.00 0.00 C ATOM 323 C TRP A 22 10.548 16.918 8.013 1.00 0.00 C ATOM 324 O TRP A 22 10.725 16.122 8.920 1.00 0.00 O ATOM 325 CB TRP A 22 9.971 16.122 5.741 1.00 0.00 C ATOM 326 CG TRP A 22 10.539 14.780 6.040 1.00 0.00 C ATOM 327 CD1 TRP A 22 11.842 14.448 5.930 1.00 0.00 C ATOM 328 CD2 TRP A 22 9.847 13.591 6.504 1.00 0.00 C ATOM 329 NE1 TRP A 22 11.994 13.124 6.299 1.00 0.00 N ATOM 330 CE2 TRP A 22 10.790 12.554 6.661 1.00 0.00 C ATOM 331 CE3 TRP A 22 8.501 13.315 6.800 1.00 0.00 C ATOM 332 CZ2 TRP A 22 10.416 11.288 7.098 1.00 0.00 C ATOM 333 CZ3 TRP A 22 8.118 12.045 7.240 1.00 0.00 C ATOM 334 CH2 TRP A 22 9.076 11.029 7.390 1.00 0.00 C ATOM 0 H TRP A 22 8.851 18.305 5.780 1.00 0.00 H new ATOM 0 HA TRP A 22 8.678 16.049 7.464 1.00 0.00 H new ATOM 0 HB2 TRP A 22 9.183 16.039 4.992 1.00 0.00 H new ATOM 0 HB3 TRP A 22 10.740 16.772 5.324 1.00 0.00 H new ATOM 0 HD1 TRP A 22 12.635 15.107 5.607 1.00 0.00 H new ATOM 0 HE1 TRP A 22 12.886 12.629 6.303 1.00 0.00 H new ATOM 0 HE3 TRP A 22 7.757 14.090 6.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 11.157 10.511 7.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 7.081 11.844 7.466 1.00 0.00 H new ATOM 0 HH2 TRP A 22 8.776 10.049 7.731 1.00 0.00 H new ATOM 345 N ASN A 23 11.310 17.977 7.825 1.00 0.00 N ATOM 346 CA ASN A 23 12.431 18.259 8.708 1.00 0.00 C ATOM 347 C ASN A 23 11.944 18.784 10.050 1.00 0.00 C ATOM 348 O ASN A 23 12.614 18.629 11.068 1.00 0.00 O ATOM 349 CB ASN A 23 13.357 19.291 8.062 1.00 0.00 C ATOM 350 CG ASN A 23 13.962 18.721 6.783 1.00 0.00 C ATOM 351 OD1 ASN A 23 14.787 19.371 6.143 1.00 0.00 O ATOM 352 ND2 ASN A 23 13.596 17.537 6.372 1.00 0.00 N ATOM 0 H ASN A 23 11.177 18.655 7.074 1.00 0.00 H new ATOM 0 HA ASN A 23 12.977 17.330 8.873 1.00 0.00 H new ATOM 0 HB2 ASN A 23 12.800 20.201 7.837 1.00 0.00 H new ATOM 0 HB3 ASN A 23 14.150 19.566 8.758 1.00 0.00 H new ATOM 0 HD21 ASN A 23 13.995 17.148 5.517 1.00 0.00 H new ATOM 0 HD22 ASN A 23 12.912 17.001 6.906 1.00 0.00 H new ATOM 359 N GLU A 24 10.791 19.432 10.043 1.00 0.00 N ATOM 360 CA GLU A 24 10.240 20.012 11.268 1.00 0.00 C ATOM 361 C GLU A 24 9.786 18.934 12.260 1.00 0.00 C ATOM 362 O GLU A 24 10.315 18.843 13.368 1.00 0.00 O ATOM 363 CB GLU A 24 9.049 20.936 10.907 1.00 0.00 C ATOM 364 CG GLU A 24 9.520 22.396 10.826 1.00 0.00 C ATOM 365 CD GLU A 24 8.341 23.306 10.497 1.00 0.00 C ATOM 366 OE1 GLU A 24 7.266 22.784 10.249 1.00 0.00 O ATOM 367 OE2 GLU A 24 8.531 24.511 10.498 1.00 0.00 O ATOM 0 H GLU A 24 10.217 19.572 9.211 1.00 0.00 H new ATOM 0 HA GLU A 24 11.028 20.588 11.753 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.618 20.631 9.953 1.00 0.00 H new ATOM 0 HB3 GLU A 24 8.264 20.840 11.657 1.00 0.00 H new ATOM 0 HG2 GLU A 24 9.968 22.695 11.773 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.292 22.496 10.063 1.00 0.00 H new ATOM 374 N LEU A 25 8.801 18.138 11.872 1.00 0.00 N ATOM 375 CA LEU A 25 8.291 17.100 12.754 1.00 0.00 C ATOM 376 C LEU A 25 9.335 15.996 12.958 1.00 0.00 C ATOM 377 O LEU A 25 9.284 15.258 13.941 1.00 0.00 O ATOM 378 CB LEU A 25 6.938 16.559 12.188 1.00 0.00 C ATOM 379 CG LEU A 25 7.097 15.217 11.414 1.00 0.00 C ATOM 380 CD1 LEU A 25 8.223 15.312 10.349 1.00 0.00 C ATOM 381 CD2 LEU A 25 7.375 14.051 12.404 1.00 0.00 C ATOM 0 H LEU A 25 8.343 18.190 10.962 1.00 0.00 H new ATOM 0 HA LEU A 25 8.095 17.517 13.742 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.237 16.417 13.010 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.503 17.306 11.524 1.00 0.00 H new ATOM 0 HG LEU A 25 6.162 15.015 10.892 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.310 14.360 9.825 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.982 16.099 9.634 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.169 15.544 10.839 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.484 13.120 11.848 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.293 14.253 12.956 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.544 13.961 13.103 1.00 0.00 H new ATOM 393 N LEU A 26 10.290 15.907 12.042 1.00 0.00 N ATOM 394 CA LEU A 26 11.349 14.903 12.153 1.00 0.00 C ATOM 395 C LEU A 26 12.321 15.291 13.263 1.00 0.00 C ATOM 396 O LEU A 26 12.788 14.441 14.017 1.00 0.00 O ATOM 397 CB LEU A 26 12.091 14.782 10.815 1.00 0.00 C ATOM 398 CG LEU A 26 13.344 13.908 10.958 1.00 0.00 C ATOM 399 CD1 LEU A 26 12.944 12.505 11.424 1.00 0.00 C ATOM 400 CD2 LEU A 26 14.039 13.817 9.596 1.00 0.00 C ATOM 0 H LEU A 26 10.357 16.509 11.221 1.00 0.00 H new ATOM 0 HA LEU A 26 10.905 13.939 12.399 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.427 14.352 10.065 1.00 0.00 H new ATOM 0 HB3 LEU A 26 12.373 15.773 10.461 1.00 0.00 H new ATOM 0 HG LEU A 26 14.020 14.347 11.692 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.836 11.887 11.525 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.438 12.572 12.387 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.272 12.056 10.692 1.00 0.00 H new ATOM 0 HD21 LEU A 26 14.932 13.198 9.684 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.359 13.372 8.870 1.00 0.00 H new ATOM 0 HD23 LEU A 26 14.321 14.816 9.264 1.00 0.00 H new ATOM 412 N GLU A 27 12.610 16.580 13.362 1.00 0.00 N ATOM 413 CA GLU A 27 13.518 17.072 14.393 1.00 0.00 C ATOM 414 C GLU A 27 12.816 17.107 15.748 1.00 0.00 C ATOM 415 O GLU A 27 13.442 16.902 16.788 1.00 0.00 O ATOM 416 CB GLU A 27 14.014 18.476 14.033 1.00 0.00 C ATOM 417 CG GLU A 27 15.048 18.383 12.910 1.00 0.00 C ATOM 418 CD GLU A 27 15.534 19.777 12.531 1.00 0.00 C ATOM 419 OE1 GLU A 27 14.921 20.737 12.968 1.00 0.00 O ATOM 420 OE2 GLU A 27 16.513 19.866 11.807 1.00 0.00 O ATOM 0 H GLU A 27 12.233 17.301 12.747 1.00 0.00 H new ATOM 0 HA GLU A 27 14.370 16.395 14.453 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.177 19.099 13.719 1.00 0.00 H new ATOM 0 HB3 GLU A 27 14.455 18.952 14.909 1.00 0.00 H new ATOM 0 HG2 GLU A 27 15.890 17.770 13.230 1.00 0.00 H new ATOM 0 HG3 GLU A 27 14.610 17.893 12.041 1.00 0.00 H new ATOM 427 N LYS A 28 11.516 17.374 15.729 1.00 0.00 N ATOM 428 CA LYS A 28 10.739 17.441 16.963 1.00 0.00 C ATOM 429 C LYS A 28 10.489 16.045 17.539 1.00 0.00 C ATOM 430 O LYS A 28 10.606 15.833 18.746 1.00 0.00 O ATOM 431 CB LYS A 28 9.397 18.124 16.690 1.00 0.00 C ATOM 432 CG LYS A 28 8.654 18.338 18.014 1.00 0.00 C ATOM 433 CD LYS A 28 7.422 19.232 17.790 1.00 0.00 C ATOM 434 CE LYS A 28 6.282 18.411 17.174 1.00 0.00 C ATOM 435 NZ LYS A 28 5.987 17.236 18.042 1.00 0.00 N ATOM 0 H LYS A 28 10.979 17.547 14.879 1.00 0.00 H new ATOM 0 HA LYS A 28 11.310 18.016 17.691 1.00 0.00 H new ATOM 0 HB2 LYS A 28 9.558 19.080 16.192 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.795 17.512 16.018 1.00 0.00 H new ATOM 0 HG2 LYS A 28 8.346 17.377 18.426 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.320 18.799 18.743 1.00 0.00 H new ATOM 0 HD2 LYS A 28 7.099 19.664 18.737 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.680 20.062 17.132 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.391 19.030 17.067 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.560 18.077 16.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 5.069 16.828 17.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 6.732 16.520 17.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.954 17.539 19.036 1.00 0.00 H new ATOM 449 N HIS A 29 10.129 15.103 16.669 1.00 0.00 N ATOM 450 CA HIS A 29 9.845 13.732 17.104 1.00 0.00 C ATOM 451 C HIS A 29 11.112 12.876 17.130 1.00 0.00 C ATOM 452 O HIS A 29 11.053 11.684 17.434 1.00 0.00 O ATOM 453 CB HIS A 29 8.821 13.092 16.165 1.00 0.00 C ATOM 454 CG HIS A 29 7.477 13.736 16.373 1.00 0.00 C ATOM 455 ND1 HIS A 29 7.126 14.930 15.764 1.00 0.00 N ATOM 456 CD2 HIS A 29 6.387 13.362 17.119 1.00 0.00 C ATOM 457 CE1 HIS A 29 5.871 15.231 16.152 1.00 0.00 C ATOM 458 NE2 HIS A 29 5.375 14.306 16.979 1.00 0.00 N ATOM 0 H HIS A 29 10.027 15.259 15.666 1.00 0.00 H new ATOM 0 HA HIS A 29 9.445 13.781 18.117 1.00 0.00 H new ATOM 0 HB2 HIS A 29 9.137 13.212 15.129 1.00 0.00 H new ATOM 0 HB3 HIS A 29 8.756 12.021 16.356 1.00 0.00 H new ATOM 0 HD1 HIS A 29 7.711 15.481 15.136 1.00 0.00 H new ATOM 0 HD2 HIS A 29 6.325 12.469 17.724 1.00 0.00 H new ATOM 0 HE1 HIS A 29 5.332 16.111 15.834 1.00 0.00 H new ATOM 565 N TYR A 36 17.889 7.795 9.839 1.00 0.00 N ATOM 566 CA TYR A 36 17.084 6.591 9.639 1.00 0.00 C ATOM 567 C TYR A 36 17.842 5.607 8.749 1.00 0.00 C ATOM 568 O TYR A 36 18.124 5.896 7.587 1.00 0.00 O ATOM 569 CB TYR A 36 15.735 6.966 8.992 1.00 0.00 C ATOM 570 CG TYR A 36 15.912 8.184 8.112 1.00 0.00 C ATOM 571 CD1 TYR A 36 16.302 8.037 6.776 1.00 0.00 C ATOM 572 CD2 TYR A 36 15.684 9.462 8.637 1.00 0.00 C ATOM 573 CE1 TYR A 36 16.464 9.166 5.965 1.00 0.00 C ATOM 574 CE2 TYR A 36 15.846 10.592 7.826 1.00 0.00 C ATOM 575 CZ TYR A 36 16.236 10.444 6.489 1.00 0.00 C ATOM 576 OH TYR A 36 16.395 11.557 5.690 1.00 0.00 O ATOM 0 HA TYR A 36 16.892 6.120 10.603 1.00 0.00 H new ATOM 0 HB2 TYR A 36 15.359 6.130 8.401 1.00 0.00 H new ATOM 0 HB3 TYR A 36 14.994 7.169 9.765 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.478 7.052 6.371 1.00 0.00 H new ATOM 0 HD2 TYR A 36 15.383 9.576 9.668 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.765 9.051 4.934 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.670 11.577 8.231 1.00 0.00 H new ATOM 0 HH TYR A 36 16.196 12.364 6.210 1.00 0.00 H new ATOM 586 N VAL A 37 18.182 4.447 9.311 1.00 0.00 N ATOM 587 CA VAL A 37 18.924 3.425 8.567 1.00 0.00 C ATOM 588 C VAL A 37 17.996 2.306 8.101 1.00 0.00 C ATOM 589 O VAL A 37 17.069 1.917 8.812 1.00 0.00 O ATOM 590 CB VAL A 37 20.019 2.838 9.456 1.00 0.00 C ATOM 591 CG1 VAL A 37 20.983 2.010 8.606 1.00 0.00 C ATOM 592 CG2 VAL A 37 20.786 3.976 10.140 1.00 0.00 C ATOM 0 H VAL A 37 17.958 4.191 10.273 1.00 0.00 H new ATOM 0 HA VAL A 37 19.369 3.895 7.690 1.00 0.00 H new ATOM 0 HB VAL A 37 19.566 2.198 10.213 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.763 1.593 9.243 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.437 1.200 8.122 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.437 2.646 7.846 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.568 3.558 10.775 1.00 0.00 H new ATOM 0 HG22 VAL A 37 21.237 4.617 9.383 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.099 4.563 10.750 1.00 0.00 H new ATOM 602 N SER A 38 18.255 1.791 6.901 1.00 0.00 N ATOM 603 CA SER A 38 17.440 0.713 6.346 1.00 0.00 C ATOM 604 C SER A 38 17.818 -0.625 6.975 1.00 0.00 C ATOM 605 O SER A 38 16.966 -1.488 7.182 1.00 0.00 O ATOM 606 CB SER A 38 17.633 0.641 4.832 1.00 0.00 C ATOM 607 OG SER A 38 18.946 0.169 4.549 1.00 0.00 O ATOM 0 H SER A 38 19.017 2.100 6.298 1.00 0.00 H new ATOM 0 HA SER A 38 16.394 0.922 6.569 1.00 0.00 H new ATOM 0 HB2 SER A 38 16.891 -0.025 4.390 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.484 1.625 4.387 1.00 0.00 H new ATOM 0 HG SER A 38 19.074 0.120 3.579 1.00 0.00 H new ATOM 702 N SER A 45 9.444 2.402 15.131 1.00 0.00 N ATOM 703 CA SER A 45 8.456 2.984 16.033 1.00 0.00 C ATOM 704 C SER A 45 8.220 4.455 15.700 1.00 0.00 C ATOM 705 O SER A 45 7.099 4.950 15.801 1.00 0.00 O ATOM 706 CB SER A 45 8.934 2.858 17.479 1.00 0.00 C ATOM 707 OG SER A 45 10.035 3.734 17.688 1.00 0.00 O ATOM 0 HA SER A 45 7.518 2.443 15.910 1.00 0.00 H new ATOM 0 HB2 SER A 45 8.123 3.104 18.165 1.00 0.00 H new ATOM 0 HB3 SER A 45 9.228 1.830 17.689 1.00 0.00 H new ATOM 0 HG SER A 45 10.343 3.657 18.615 1.00 0.00 H new ATOM 713 N GLU A 46 9.284 5.146 15.305 1.00 0.00 N ATOM 714 CA GLU A 46 9.178 6.560 14.961 1.00 0.00 C ATOM 715 C GLU A 46 8.296 6.752 13.730 1.00 0.00 C ATOM 716 O GLU A 46 7.637 7.778 13.583 1.00 0.00 O ATOM 717 CB GLU A 46 10.568 7.141 14.689 1.00 0.00 C ATOM 718 CG GLU A 46 11.338 7.264 16.006 1.00 0.00 C ATOM 719 CD GLU A 46 12.756 7.758 15.737 1.00 0.00 C ATOM 720 OE1 GLU A 46 13.122 7.841 14.576 1.00 0.00 O ATOM 721 OE2 GLU A 46 13.454 8.047 16.695 1.00 0.00 O ATOM 0 H GLU A 46 10.222 4.755 15.215 1.00 0.00 H new ATOM 0 HA GLU A 46 8.725 7.082 15.803 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.112 6.500 13.996 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.479 8.119 14.215 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.824 7.955 16.674 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.370 6.298 16.510 1.00 0.00 H new ATOM 728 N LEU A 47 8.291 5.759 12.848 1.00 0.00 N ATOM 729 CA LEU A 47 7.484 5.841 11.634 1.00 0.00 C ATOM 730 C LEU A 47 6.016 6.059 11.985 1.00 0.00 C ATOM 731 O LEU A 47 5.334 6.863 11.355 1.00 0.00 O ATOM 732 CB LEU A 47 7.629 4.559 10.806 1.00 0.00 C ATOM 733 CG LEU A 47 6.972 4.753 9.420 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.877 5.603 8.511 1.00 0.00 C ATOM 735 CD2 LEU A 47 6.748 3.381 8.773 1.00 0.00 C ATOM 0 H LEU A 47 8.829 4.898 12.947 1.00 0.00 H new ATOM 0 HA LEU A 47 7.840 6.687 11.046 1.00 0.00 H new ATOM 0 HB2 LEU A 47 8.683 4.309 10.687 1.00 0.00 H new ATOM 0 HB3 LEU A 47 7.161 3.724 11.327 1.00 0.00 H new ATOM 0 HG LEU A 47 6.019 5.267 9.548 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.400 5.730 7.539 1.00 0.00 H new ATOM 0 HD12 LEU A 47 8.037 6.580 8.967 1.00 0.00 H new ATOM 0 HD13 LEU A 47 8.836 5.102 8.382 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.285 3.511 7.795 1.00 0.00 H new ATOM 0 HD22 LEU A 47 7.705 2.873 8.656 1.00 0.00 H new ATOM 0 HD23 LEU A 47 6.094 2.782 9.407 1.00 0.00 H new ATOM 747 N PHE A 48 5.535 5.338 12.993 1.00 0.00 N ATOM 748 CA PHE A 48 4.143 5.468 13.411 1.00 0.00 C ATOM 749 C PHE A 48 3.879 6.865 13.965 1.00 0.00 C ATOM 750 O PHE A 48 2.930 7.532 13.557 1.00 0.00 O ATOM 751 CB PHE A 48 3.810 4.418 14.471 1.00 0.00 C ATOM 752 CG PHE A 48 2.320 4.416 14.724 1.00 0.00 C ATOM 753 CD1 PHE A 48 1.443 4.000 13.714 1.00 0.00 C ATOM 754 CD2 PHE A 48 1.814 4.828 15.964 1.00 0.00 C ATOM 755 CE1 PHE A 48 0.062 3.998 13.944 1.00 0.00 C ATOM 756 CE2 PHE A 48 0.433 4.825 16.193 1.00 0.00 C ATOM 757 CZ PHE A 48 -0.443 4.411 15.183 1.00 0.00 C ATOM 0 H PHE A 48 6.081 4.665 13.530 1.00 0.00 H new ATOM 0 HA PHE A 48 3.506 5.310 12.540 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.135 3.432 14.137 1.00 0.00 H new ATOM 0 HB3 PHE A 48 4.347 4.635 15.395 1.00 0.00 H new ATOM 0 HD1 PHE A 48 1.832 3.681 12.758 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.490 5.148 16.743 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.614 3.678 13.165 1.00 0.00 H new ATOM 0 HE2 PHE A 48 0.044 5.142 17.149 1.00 0.00 H new ATOM 0 HZ PHE A 48 -1.509 4.410 15.359 1.00 0.00 H new ATOM 767 N SER A 49 4.726 7.306 14.888 1.00 0.00 N ATOM 768 CA SER A 49 4.569 8.632 15.474 1.00 0.00 C ATOM 769 C SER A 49 4.545 9.688 14.373 1.00 0.00 C ATOM 770 O SER A 49 3.860 10.705 14.481 1.00 0.00 O ATOM 771 CB SER A 49 5.721 8.919 16.435 1.00 0.00 C ATOM 772 OG SER A 49 5.816 7.862 17.382 1.00 0.00 O ATOM 0 H SER A 49 5.519 6.772 15.243 1.00 0.00 H new ATOM 0 HA SER A 49 3.628 8.665 16.024 1.00 0.00 H new ATOM 0 HB2 SER A 49 6.656 9.013 15.883 1.00 0.00 H new ATOM 0 HB3 SER A 49 5.556 9.867 16.946 1.00 0.00 H new ATOM 0 HG SER A 49 6.555 8.042 18.000 1.00 0.00 H new ATOM 778 N ILE A 50 5.312 9.435 13.320 1.00 0.00 N ATOM 779 CA ILE A 50 5.396 10.357 12.195 1.00 0.00 C ATOM 780 C ILE A 50 4.138 10.287 11.326 1.00 0.00 C ATOM 781 O ILE A 50 3.700 11.295 10.771 1.00 0.00 O ATOM 782 CB ILE A 50 6.630 10.014 11.343 1.00 0.00 C ATOM 783 CG1 ILE A 50 7.910 10.348 12.130 1.00 0.00 C ATOM 784 CG2 ILE A 50 6.603 10.822 10.039 1.00 0.00 C ATOM 785 CD1 ILE A 50 9.092 9.574 11.540 1.00 0.00 C ATOM 0 H ILE A 50 5.886 8.597 13.222 1.00 0.00 H new ATOM 0 HA ILE A 50 5.483 11.370 12.588 1.00 0.00 H new ATOM 0 HB ILE A 50 6.617 8.950 11.106 1.00 0.00 H new ATOM 0 HG12 ILE A 50 8.106 11.419 12.087 1.00 0.00 H new ATOM 0 HG13 ILE A 50 7.781 10.089 13.181 1.00 0.00 H new ATOM 0 HG21 ILE A 50 7.479 10.575 9.440 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.700 10.579 9.479 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.610 11.887 10.271 1.00 0.00 H new ATOM 0 HD11 ILE A 50 9.998 9.812 12.098 1.00 0.00 H new ATOM 0 HD12 ILE A 50 8.895 8.504 11.606 1.00 0.00 H new ATOM 0 HD13 ILE A 50 9.226 9.855 10.495 1.00 0.00 H new ATOM 797 N VAL A 51 3.574 9.095 11.202 1.00 0.00 N ATOM 798 CA VAL A 51 2.380 8.909 10.384 1.00 0.00 C ATOM 799 C VAL A 51 1.156 9.561 11.032 1.00 0.00 C ATOM 800 O VAL A 51 0.317 10.130 10.342 1.00 0.00 O ATOM 801 CB VAL A 51 2.129 7.404 10.165 1.00 0.00 C ATOM 802 CG1 VAL A 51 0.701 7.173 9.626 1.00 0.00 C ATOM 803 CG2 VAL A 51 3.150 6.861 9.154 1.00 0.00 C ATOM 0 H VAL A 51 3.919 8.247 11.652 1.00 0.00 H new ATOM 0 HA VAL A 51 2.545 9.393 9.421 1.00 0.00 H new ATOM 0 HB VAL A 51 2.236 6.884 11.117 1.00 0.00 H new ATOM 0 HG11 VAL A 51 0.537 6.106 9.476 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.025 7.554 10.344 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.581 7.696 8.677 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.975 5.797 8.997 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.042 7.390 8.207 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.159 7.010 9.540 1.00 0.00 H new ATOM 813 N GLN A 52 1.049 9.463 12.350 1.00 0.00 N ATOM 814 CA GLN A 52 -0.093 10.045 13.050 1.00 0.00 C ATOM 815 C GLN A 52 0.020 11.570 13.123 1.00 0.00 C ATOM 816 O GLN A 52 -0.979 12.278 13.002 1.00 0.00 O ATOM 817 CB GLN A 52 -0.191 9.470 14.463 1.00 0.00 C ATOM 818 CG GLN A 52 1.109 9.737 15.211 1.00 0.00 C ATOM 819 CD GLN A 52 1.101 9.006 16.549 1.00 0.00 C ATOM 820 OE1 GLN A 52 0.693 7.847 16.622 1.00 0.00 O ATOM 821 NE2 GLN A 52 1.528 9.619 17.619 1.00 0.00 N ATOM 0 H GLN A 52 1.727 8.994 12.951 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.993 9.793 12.490 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -1.028 9.923 14.994 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -0.384 8.398 14.418 1.00 0.00 H new ATOM 0 HG2 GLN A 52 1.957 9.406 14.612 1.00 0.00 H new ATOM 0 HG3 GLN A 52 1.231 10.808 15.373 1.00 0.00 H new ATOM 0 HE21 GLN A 52 1.866 10.579 17.556 1.00 0.00 H new ATOM 0 HE22 GLN A 52 1.524 9.138 18.518 1.00 0.00 H new ATOM 830 N ASP A 53 1.239 12.071 13.324 1.00 0.00 N ATOM 831 CA ASP A 53 1.457 13.518 13.413 1.00 0.00 C ATOM 832 C ASP A 53 1.310 14.171 12.047 1.00 0.00 C ATOM 833 O ASP A 53 0.491 15.070 11.867 1.00 0.00 O ATOM 834 CB ASP A 53 2.849 13.811 13.979 1.00 0.00 C ATOM 835 CG ASP A 53 2.931 15.262 14.439 1.00 0.00 C ATOM 836 OD1 ASP A 53 2.457 15.546 15.527 1.00 0.00 O ATOM 837 OD2 ASP A 53 3.468 16.068 13.698 1.00 0.00 O ATOM 0 H ASP A 53 2.082 11.506 13.427 1.00 0.00 H new ATOM 0 HA ASP A 53 0.703 13.934 14.082 1.00 0.00 H new ATOM 0 HB2 ASP A 53 3.058 13.144 14.815 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.607 13.618 13.220 1.00 0.00 H new ATOM 842 N VAL A 54 2.093 13.716 11.080 1.00 0.00 N ATOM 843 CA VAL A 54 2.013 14.275 9.741 1.00 0.00 C ATOM 844 C VAL A 54 0.548 14.360 9.299 1.00 0.00 C ATOM 845 O VAL A 54 0.164 15.255 8.547 1.00 0.00 O ATOM 846 CB VAL A 54 2.823 13.404 8.761 1.00 0.00 C ATOM 847 CG1 VAL A 54 2.008 12.160 8.369 1.00 0.00 C ATOM 848 CG2 VAL A 54 3.165 14.226 7.500 1.00 0.00 C ATOM 0 H VAL A 54 2.781 12.972 11.195 1.00 0.00 H new ATOM 0 HA VAL A 54 2.435 15.280 9.744 1.00 0.00 H new ATOM 0 HB VAL A 54 3.746 13.084 9.244 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.587 11.549 7.676 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.780 11.578 9.262 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.079 12.470 7.890 1.00 0.00 H new ATOM 0 HG21 VAL A 54 3.738 13.609 6.808 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.244 14.553 7.018 1.00 0.00 H new ATOM 0 HG23 VAL A 54 3.755 15.098 7.783 1.00 0.00 H new ATOM 858 N ALA A 55 -0.261 13.427 9.790 1.00 0.00 N ATOM 859 CA ALA A 55 -1.681 13.400 9.465 1.00 0.00 C ATOM 860 C ALA A 55 -2.406 14.571 10.127 1.00 0.00 C ATOM 861 O ALA A 55 -3.364 15.111 9.573 1.00 0.00 O ATOM 862 CB ALA A 55 -2.292 12.076 9.942 1.00 0.00 C ATOM 0 H ALA A 55 0.043 12.680 10.414 1.00 0.00 H new ATOM 0 HA ALA A 55 -1.795 13.487 8.384 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.354 12.057 9.698 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.791 11.245 9.446 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -2.165 11.985 11.021 1.00 0.00 H new ATOM 868 N GLN A 56 -1.949 14.955 11.315 1.00 0.00 N ATOM 869 CA GLN A 56 -2.571 16.061 12.039 1.00 0.00 C ATOM 870 C GLN A 56 -2.369 17.381 11.303 1.00 0.00 C ATOM 871 O GLN A 56 -3.325 18.124 11.080 1.00 0.00 O ATOM 872 CB GLN A 56 -1.982 16.169 13.444 1.00 0.00 C ATOM 873 CG GLN A 56 -2.469 14.996 14.296 1.00 0.00 C ATOM 874 CD GLN A 56 -1.746 14.990 15.638 1.00 0.00 C ATOM 875 OE1 GLN A 56 -0.694 15.613 15.780 1.00 0.00 O ATOM 876 NE2 GLN A 56 -2.250 14.319 16.638 1.00 0.00 N ATOM 0 H GLN A 56 -1.159 14.523 11.794 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.640 15.858 12.105 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -0.893 16.168 13.394 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.279 17.112 13.902 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -3.545 15.073 14.454 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.290 14.057 13.773 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -3.122 13.803 16.518 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -1.772 14.310 17.539 1.00 0.00 H new ATOM 885 N ARG A 57 -1.128 17.675 10.925 1.00 0.00 N ATOM 886 CA ARG A 57 -0.852 18.921 10.217 1.00 0.00 C ATOM 887 C ARG A 57 -1.448 18.876 8.815 1.00 0.00 C ATOM 888 O ARG A 57 -2.027 19.856 8.346 1.00 0.00 O ATOM 889 CB ARG A 57 0.656 19.182 10.144 1.00 0.00 C ATOM 890 CG ARG A 57 1.379 17.974 9.535 1.00 0.00 C ATOM 891 CD ARG A 57 2.840 17.989 9.980 1.00 0.00 C ATOM 892 NE ARG A 57 3.398 19.334 9.826 1.00 0.00 N ATOM 893 CZ ARG A 57 4.367 19.780 10.625 1.00 0.00 C ATOM 894 NH1 ARG A 57 4.846 19.013 11.566 1.00 0.00 N ATOM 895 NH2 ARG A 57 4.839 20.986 10.465 1.00 0.00 N ATOM 0 H ARG A 57 -0.314 17.083 11.092 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.315 19.738 10.770 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.849 20.070 9.543 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.046 19.382 11.142 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.899 17.049 9.853 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.317 18.008 8.447 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.915 17.673 11.020 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.416 17.278 9.388 1.00 0.00 H new ATOM 0 HE ARG A 57 3.037 19.943 9.091 1.00 0.00 H new ATOM 0 HH11 ARG A 57 4.479 18.070 11.691 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.588 19.357 12.176 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.466 21.586 9.729 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.581 21.329 11.076 1.00 0.00 H new ATOM 909 N LEU A 58 -1.319 17.728 8.157 1.00 0.00 N ATOM 910 CA LEU A 58 -1.871 17.570 6.813 1.00 0.00 C ATOM 911 C LEU A 58 -3.402 17.558 6.883 1.00 0.00 C ATOM 912 O LEU A 58 -4.085 17.623 5.860 1.00 0.00 O ATOM 913 CB LEU A 58 -1.371 16.266 6.173 1.00 0.00 C ATOM 914 CG LEU A 58 0.127 16.373 5.830 1.00 0.00 C ATOM 915 CD1 LEU A 58 0.616 15.019 5.301 1.00 0.00 C ATOM 916 CD2 LEU A 58 0.354 17.457 4.748 1.00 0.00 C ATOM 0 H LEU A 58 -0.844 16.903 8.525 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.540 18.408 6.199 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.535 15.433 6.856 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.943 16.055 5.269 1.00 0.00 H new ATOM 0 HG LEU A 58 0.681 16.649 6.727 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.676 15.086 5.056 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.468 14.255 6.064 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.053 14.753 4.407 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.417 17.522 4.515 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.199 17.193 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.004 18.420 5.119 1.00 0.00 H new ATOM 928 N ASN A 59 -3.924 17.478 8.106 1.00 0.00 N ATOM 929 CA ASN A 59 -5.373 17.460 8.330 1.00 0.00 C ATOM 930 C ASN A 59 -6.013 16.244 7.666 1.00 0.00 C ATOM 931 O ASN A 59 -6.938 16.370 6.862 1.00 0.00 O ATOM 932 CB ASN A 59 -6.008 18.738 7.792 1.00 0.00 C ATOM 933 CG ASN A 59 -7.398 18.928 8.392 1.00 0.00 C ATOM 934 OD1 ASN A 59 -7.740 18.283 9.383 1.00 0.00 O ATOM 935 ND2 ASN A 59 -8.223 19.778 7.846 1.00 0.00 N ATOM 0 H ASN A 59 -3.367 17.424 8.959 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.547 17.399 9.404 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.379 19.595 8.034 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.076 18.689 6.705 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.154 19.910 8.240 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.937 20.311 7.025 1.00 0.00 H new ATOM 942 N MET A 60 -5.512 15.071 8.021 1.00 0.00 N ATOM 943 CA MET A 60 -6.026 13.809 7.476 1.00 0.00 C ATOM 944 C MET A 60 -6.090 12.753 8.575 1.00 0.00 C ATOM 945 O MET A 60 -5.299 12.787 9.510 1.00 0.00 O ATOM 946 CB MET A 60 -5.104 13.311 6.349 1.00 0.00 C ATOM 947 CG MET A 60 -4.755 14.471 5.406 1.00 0.00 C ATOM 948 SD MET A 60 -4.431 13.820 3.747 1.00 0.00 S ATOM 949 CE MET A 60 -2.662 13.508 3.960 1.00 0.00 C ATOM 0 H MET A 60 -4.747 14.959 8.686 1.00 0.00 H new ATOM 0 HA MET A 60 -7.027 13.981 7.080 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.193 12.889 6.773 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.595 12.513 5.792 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.576 15.188 5.374 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.880 15.005 5.777 1.00 0.00 H new ATOM 0 HE1 MET A 60 -2.355 12.691 3.307 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.101 14.407 3.705 1.00 0.00 H new ATOM 0 HE3 MET A 60 -2.462 13.238 4.997 1.00 0.00 H new ATOM 959 N PRO A 61 -7.004 11.811 8.486 1.00 0.00 N ATOM 960 CA PRO A 61 -7.122 10.735 9.502 1.00 0.00 C ATOM 961 C PRO A 61 -5.995 9.706 9.350 1.00 0.00 C ATOM 962 O PRO A 61 -5.680 9.271 8.243 1.00 0.00 O ATOM 963 CB PRO A 61 -8.493 10.121 9.217 1.00 0.00 C ATOM 964 CG PRO A 61 -8.724 10.351 7.765 1.00 0.00 C ATOM 965 CD PRO A 61 -8.023 11.670 7.422 1.00 0.00 C ATOM 0 HA PRO A 61 -7.035 11.102 10.525 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.506 9.057 9.455 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -9.269 10.592 9.820 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.320 9.530 7.172 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.790 10.409 7.545 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.567 11.636 6.433 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -8.721 12.507 7.423 1.00 0.00 H new ATOM 973 N ILE A 62 -5.385 9.348 10.468 1.00 0.00 N ATOM 974 CA ILE A 62 -4.277 8.397 10.468 1.00 0.00 C ATOM 975 C ILE A 62 -4.565 7.170 9.591 1.00 0.00 C ATOM 976 O ILE A 62 -3.657 6.637 8.958 1.00 0.00 O ATOM 977 CB ILE A 62 -3.992 7.947 11.901 1.00 0.00 C ATOM 978 CG1 ILE A 62 -2.701 7.128 11.932 1.00 0.00 C ATOM 979 CG2 ILE A 62 -5.151 7.093 12.412 1.00 0.00 C ATOM 980 CD1 ILE A 62 -2.350 6.773 13.382 1.00 0.00 C ATOM 0 H ILE A 62 -5.637 9.701 11.391 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.407 8.903 10.049 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.882 8.824 12.539 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.822 6.218 11.344 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.888 7.695 11.479 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.945 6.774 13.434 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -6.070 7.678 12.393 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -5.266 6.217 11.774 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -1.430 6.189 13.401 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.211 7.688 13.957 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.159 6.189 13.820 1.00 0.00 H new ATOM 992 N GLN A 63 -5.819 6.717 9.567 1.00 0.00 N ATOM 993 CA GLN A 63 -6.182 5.536 8.765 1.00 0.00 C ATOM 994 C GLN A 63 -6.012 5.793 7.266 1.00 0.00 C ATOM 995 O GLN A 63 -5.698 4.876 6.507 1.00 0.00 O ATOM 996 CB GLN A 63 -7.628 5.127 9.051 1.00 0.00 C ATOM 997 CG GLN A 63 -8.511 6.370 9.126 1.00 0.00 C ATOM 998 CD GLN A 63 -9.979 5.977 9.001 1.00 0.00 C ATOM 999 OE1 GLN A 63 -10.589 5.536 9.975 1.00 0.00 O ATOM 1000 NE2 GLN A 63 -10.587 6.111 7.855 1.00 0.00 N ATOM 0 H GLN A 63 -6.592 7.138 10.082 1.00 0.00 H new ATOM 0 HA GLN A 63 -5.507 4.729 9.050 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -7.989 4.460 8.268 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -7.681 4.575 9.989 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -8.344 6.888 10.070 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -8.243 7.065 8.330 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -10.081 6.477 7.049 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -11.569 5.850 7.765 1.00 0.00 H new ATOM 1009 N ASP A 64 -6.218 7.030 6.842 1.00 0.00 N ATOM 1010 CA ASP A 64 -6.073 7.367 5.422 1.00 0.00 C ATOM 1011 C ASP A 64 -4.613 7.629 5.079 1.00 0.00 C ATOM 1012 O ASP A 64 -4.153 7.303 3.987 1.00 0.00 O ATOM 1013 CB ASP A 64 -6.892 8.602 5.085 1.00 0.00 C ATOM 1014 CG ASP A 64 -6.701 8.971 3.619 1.00 0.00 C ATOM 1015 OD1 ASP A 64 -6.075 8.200 2.911 1.00 0.00 O ATOM 1016 OD2 ASP A 64 -7.183 10.021 3.224 1.00 0.00 O ATOM 0 H ASP A 64 -6.482 7.810 7.444 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.433 6.520 4.838 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.947 8.415 5.287 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -6.588 9.434 5.720 1.00 0.00 H new ATOM 1021 N VAL A 65 -3.893 8.224 6.019 1.00 0.00 N ATOM 1022 CA VAL A 65 -2.484 8.532 5.808 1.00 0.00 C ATOM 1023 C VAL A 65 -1.658 7.256 5.702 1.00 0.00 C ATOM 1024 O VAL A 65 -0.804 7.138 4.827 1.00 0.00 O ATOM 1025 CB VAL A 65 -1.965 9.402 6.959 1.00 0.00 C ATOM 1026 CG1 VAL A 65 -0.468 9.670 6.772 1.00 0.00 C ATOM 1027 CG2 VAL A 65 -2.724 10.739 6.970 1.00 0.00 C ATOM 0 H VAL A 65 -4.257 8.502 6.930 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.386 9.079 4.870 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.123 8.881 7.903 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.104 10.289 7.592 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.073 8.724 6.763 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.306 10.189 5.827 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.357 11.359 7.788 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -2.565 11.255 6.023 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.789 10.552 7.107 1.00 0.00 H new ATOM 1037 N VAL A 66 -1.912 6.303 6.588 1.00 0.00 N ATOM 1038 CA VAL A 66 -1.175 5.047 6.556 1.00 0.00 C ATOM 1039 C VAL A 66 -1.433 4.330 5.238 1.00 0.00 C ATOM 1040 O VAL A 66 -0.531 3.722 4.661 1.00 0.00 O ATOM 1041 CB VAL A 66 -1.595 4.154 7.721 1.00 0.00 C ATOM 1042 CG1 VAL A 66 -3.103 3.923 7.664 1.00 0.00 C ATOM 1043 CG2 VAL A 66 -0.871 2.806 7.624 1.00 0.00 C ATOM 0 H VAL A 66 -2.611 6.372 7.327 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.111 5.264 6.646 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.333 4.639 8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.405 3.286 8.495 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.621 4.880 7.734 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.362 3.438 6.722 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.172 2.170 8.457 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.131 2.320 6.684 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.206 2.968 7.663 1.00 0.00 H new ATOM 1053 N LYS A 67 -2.673 4.414 4.762 1.00 0.00 N ATOM 1054 CA LYS A 67 -3.040 3.777 3.504 1.00 0.00 C ATOM 1055 C LYS A 67 -2.285 4.418 2.343 1.00 0.00 C ATOM 1056 O LYS A 67 -1.523 3.753 1.643 1.00 0.00 O ATOM 1057 CB LYS A 67 -4.548 3.906 3.269 1.00 0.00 C ATOM 1058 CG LYS A 67 -4.912 3.288 1.909 1.00 0.00 C ATOM 1059 CD LYS A 67 -6.422 2.974 1.861 1.00 0.00 C ATOM 1060 CE LYS A 67 -6.686 1.580 2.446 1.00 0.00 C ATOM 1061 NZ LYS A 67 -8.140 1.266 2.345 1.00 0.00 N ATOM 0 H LYS A 67 -3.433 4.913 5.225 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.773 2.722 3.561 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.095 3.403 4.067 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.842 4.955 3.293 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.649 3.976 1.105 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.337 2.376 1.749 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.976 3.725 2.424 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.779 3.019 0.832 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.103 0.832 1.908 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.367 1.545 3.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.320 0.321 2.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.686 1.974 2.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -8.430 1.283 1.347 1.00 0.00 H new ATOM 1075 N ALA A 68 -2.506 5.716 2.143 1.00 0.00 N ATOM 1076 CA ALA A 68 -1.843 6.436 1.061 1.00 0.00 C ATOM 1077 C ALA A 68 -0.335 6.212 1.108 1.00 0.00 C ATOM 1078 O ALA A 68 0.319 6.090 0.072 1.00 0.00 O ATOM 1079 CB ALA A 68 -2.137 7.932 1.177 1.00 0.00 C ATOM 0 H ALA A 68 -3.133 6.285 2.711 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.225 6.058 0.113 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.639 8.465 0.367 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.212 8.097 1.113 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.769 8.302 2.134 1.00 0.00 H new ATOM 1085 N PHE A 69 0.210 6.167 2.318 1.00 0.00 N ATOM 1086 CA PHE A 69 1.642 5.964 2.499 1.00 0.00 C ATOM 1087 C PHE A 69 2.098 4.671 1.822 1.00 0.00 C ATOM 1088 O PHE A 69 3.139 4.642 1.177 1.00 0.00 O ATOM 1089 CB PHE A 69 1.977 5.922 4.009 1.00 0.00 C ATOM 1090 CG PHE A 69 2.267 7.325 4.523 1.00 0.00 C ATOM 1091 CD1 PHE A 69 1.590 8.436 3.986 1.00 0.00 C ATOM 1092 CD2 PHE A 69 3.220 7.513 5.535 1.00 0.00 C ATOM 1093 CE1 PHE A 69 1.870 9.721 4.460 1.00 0.00 C ATOM 1094 CE2 PHE A 69 3.494 8.802 6.007 1.00 0.00 C ATOM 1095 CZ PHE A 69 2.819 9.904 5.468 1.00 0.00 C ATOM 0 H PHE A 69 -0.316 6.268 3.186 1.00 0.00 H new ATOM 0 HA PHE A 69 2.172 6.796 2.035 1.00 0.00 H new ATOM 0 HB2 PHE A 69 1.143 5.490 4.562 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.840 5.279 4.180 1.00 0.00 H new ATOM 0 HD1 PHE A 69 0.854 8.296 3.208 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.742 6.663 5.950 1.00 0.00 H new ATOM 0 HE1 PHE A 69 1.352 10.573 4.046 1.00 0.00 H new ATOM 0 HE2 PHE A 69 4.226 8.947 6.787 1.00 0.00 H new ATOM 0 HZ PHE A 69 3.033 10.898 5.833 1.00 0.00 H new ATOM 1105 N GLY A 70 1.314 3.609 1.974 1.00 0.00 N ATOM 1106 CA GLY A 70 1.659 2.326 1.369 1.00 0.00 C ATOM 1107 C GLY A 70 1.628 2.407 -0.158 1.00 0.00 C ATOM 1108 O GLY A 70 2.601 2.069 -0.828 1.00 0.00 O ATOM 0 H GLY A 70 0.443 3.609 2.505 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.652 2.021 1.699 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.961 1.561 1.709 1.00 0.00 H new ATOM 1112 N GLN A 71 0.502 2.860 -0.701 1.00 0.00 N ATOM 1113 CA GLN A 71 0.355 2.978 -2.148 1.00 0.00 C ATOM 1114 C GLN A 71 1.612 3.581 -2.778 1.00 0.00 C ATOM 1115 O GLN A 71 2.129 3.069 -3.771 1.00 0.00 O ATOM 1116 CB GLN A 71 -0.856 3.866 -2.472 1.00 0.00 C ATOM 1117 CG GLN A 71 -2.142 3.048 -2.367 1.00 0.00 C ATOM 1118 CD GLN A 71 -3.352 3.977 -2.349 1.00 0.00 C ATOM 1119 OE1 GLN A 71 -3.211 5.176 -2.111 1.00 0.00 O ATOM 1120 NE2 GLN A 71 -4.540 3.491 -2.588 1.00 0.00 N ATOM 0 H GLN A 71 -0.316 3.149 -0.166 1.00 0.00 H new ATOM 0 HA GLN A 71 0.205 1.980 -2.561 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.894 4.710 -1.783 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -0.758 4.278 -3.476 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -2.214 2.360 -3.209 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -2.125 2.443 -1.461 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -4.654 2.497 -2.785 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -5.354 4.106 -2.578 1.00 0.00 H new ATOM 1129 N PHE A 72 2.084 4.672 -2.199 1.00 0.00 N ATOM 1130 CA PHE A 72 3.267 5.355 -2.708 1.00 0.00 C ATOM 1131 C PHE A 72 4.543 4.567 -2.395 1.00 0.00 C ATOM 1132 O PHE A 72 5.442 4.473 -3.229 1.00 0.00 O ATOM 1133 CB PHE A 72 3.343 6.749 -2.072 1.00 0.00 C ATOM 1134 CG PHE A 72 3.973 7.727 -3.038 1.00 0.00 C ATOM 1135 CD1 PHE A 72 5.362 7.753 -3.202 1.00 0.00 C ATOM 1136 CD2 PHE A 72 3.165 8.606 -3.765 1.00 0.00 C ATOM 1137 CE1 PHE A 72 5.942 8.659 -4.095 1.00 0.00 C ATOM 1138 CE2 PHE A 72 3.745 9.512 -4.658 1.00 0.00 C ATOM 1139 CZ PHE A 72 5.132 9.538 -4.823 1.00 0.00 C ATOM 0 H PHE A 72 1.668 5.106 -1.375 1.00 0.00 H new ATOM 0 HA PHE A 72 3.188 5.438 -3.792 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.344 7.088 -1.799 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.927 6.707 -1.153 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.986 7.074 -2.639 1.00 0.00 H new ATOM 0 HD2 PHE A 72 2.093 8.585 -3.637 1.00 0.00 H new ATOM 0 HE1 PHE A 72 7.014 8.681 -4.223 1.00 0.00 H new ATOM 0 HE2 PHE A 72 3.121 10.191 -5.220 1.00 0.00 H new ATOM 0 HZ PHE A 72 5.580 10.237 -5.513 1.00 0.00 H new ATOM 1149 N LEU A 73 4.620 4.012 -1.191 1.00 0.00 N ATOM 1150 CA LEU A 73 5.799 3.252 -0.798 1.00 0.00 C ATOM 1151 C LEU A 73 6.139 2.211 -1.857 1.00 0.00 C ATOM 1152 O LEU A 73 7.307 1.998 -2.179 1.00 0.00 O ATOM 1153 CB LEU A 73 5.569 2.557 0.556 1.00 0.00 C ATOM 1154 CG LEU A 73 6.930 2.339 1.262 1.00 0.00 C ATOM 1155 CD1 LEU A 73 7.296 3.588 2.081 1.00 0.00 C ATOM 1156 CD2 LEU A 73 6.843 1.126 2.195 1.00 0.00 C ATOM 0 H LEU A 73 3.891 4.072 -0.480 1.00 0.00 H new ATOM 0 HA LEU A 73 6.633 3.947 -0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 73 4.915 3.164 1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.068 1.601 0.406 1.00 0.00 H new ATOM 0 HG LEU A 73 7.697 2.161 0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.254 3.431 2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 73 7.368 4.450 1.418 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.526 3.770 2.831 1.00 0.00 H new ATOM 0 HD21 LEU A 73 7.803 0.977 2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.072 1.299 2.946 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.592 0.238 1.615 1.00 0.00 H new ATOM 1168 N PHE A 74 5.112 1.573 -2.396 1.00 0.00 N ATOM 1169 CA PHE A 74 5.308 0.561 -3.421 1.00 0.00 C ATOM 1170 C PHE A 74 5.919 1.176 -4.675 1.00 0.00 C ATOM 1171 O PHE A 74 6.833 0.611 -5.274 1.00 0.00 O ATOM 1172 CB PHE A 74 3.968 -0.083 -3.775 1.00 0.00 C ATOM 1173 CG PHE A 74 4.213 -1.317 -4.600 1.00 0.00 C ATOM 1174 CD1 PHE A 74 4.379 -1.211 -5.985 1.00 0.00 C ATOM 1175 CD2 PHE A 74 4.280 -2.567 -3.979 1.00 0.00 C ATOM 1176 CE1 PHE A 74 4.611 -2.359 -6.749 1.00 0.00 C ATOM 1177 CE2 PHE A 74 4.513 -3.712 -4.741 1.00 0.00 C ATOM 1178 CZ PHE A 74 4.679 -3.611 -6.127 1.00 0.00 C ATOM 0 H PHE A 74 4.138 1.737 -2.142 1.00 0.00 H new ATOM 0 HA PHE A 74 5.989 -0.195 -3.032 1.00 0.00 H new ATOM 0 HB2 PHE A 74 3.424 -0.341 -2.866 1.00 0.00 H new ATOM 0 HB3 PHE A 74 3.348 0.622 -4.329 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.328 -0.244 -6.463 1.00 0.00 H new ATOM 0 HD2 PHE A 74 4.151 -2.647 -2.910 1.00 0.00 H new ATOM 0 HE1 PHE A 74 4.738 -2.280 -7.819 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.565 -4.678 -4.261 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.859 -4.498 -6.716 1.00 0.00 H new ATOM 1188 N ASN A 75 5.401 2.330 -5.072 1.00 0.00 N ATOM 1189 CA ASN A 75 5.889 3.013 -6.265 1.00 0.00 C ATOM 1190 C ASN A 75 7.392 3.295 -6.171 1.00 0.00 C ATOM 1191 O ASN A 75 8.153 2.955 -7.078 1.00 0.00 O ATOM 1192 CB ASN A 75 5.125 4.335 -6.447 1.00 0.00 C ATOM 1193 CG ASN A 75 3.767 4.076 -7.098 1.00 0.00 C ATOM 1194 OD1 ASN A 75 3.071 5.016 -7.482 1.00 0.00 O ATOM 1195 ND2 ASN A 75 3.347 2.849 -7.243 1.00 0.00 N ATOM 0 H ASN A 75 4.644 2.813 -4.588 1.00 0.00 H new ATOM 0 HA ASN A 75 5.720 2.363 -7.124 1.00 0.00 H new ATOM 0 HB2 ASN A 75 4.986 4.819 -5.480 1.00 0.00 H new ATOM 0 HB3 ASN A 75 5.708 5.018 -7.065 1.00 0.00 H new ATOM 0 HD21 ASN A 75 2.441 2.668 -7.675 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.925 2.071 -6.924 1.00 0.00 H new ATOM 1202 N GLY A 76 7.810 3.932 -5.083 1.00 0.00 N ATOM 1203 CA GLY A 76 9.221 4.267 -4.901 1.00 0.00 C ATOM 1204 C GLY A 76 10.084 3.019 -4.752 1.00 0.00 C ATOM 1205 O GLY A 76 11.160 2.926 -5.342 1.00 0.00 O ATOM 0 H GLY A 76 7.200 4.225 -4.320 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.569 4.850 -5.754 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.335 4.895 -4.017 1.00 0.00 H new ATOM 1209 N LEU A 77 9.612 2.065 -3.962 1.00 0.00 N ATOM 1210 CA LEU A 77 10.360 0.830 -3.747 1.00 0.00 C ATOM 1211 C LEU A 77 10.657 0.145 -5.078 1.00 0.00 C ATOM 1212 O LEU A 77 11.808 -0.167 -5.384 1.00 0.00 O ATOM 1213 CB LEU A 77 9.555 -0.119 -2.843 1.00 0.00 C ATOM 1214 CG LEU A 77 9.750 0.263 -1.362 1.00 0.00 C ATOM 1215 CD1 LEU A 77 8.787 -0.562 -0.501 1.00 0.00 C ATOM 1216 CD2 LEU A 77 11.211 -0.020 -0.923 1.00 0.00 C ATOM 0 H LEU A 77 8.724 2.119 -3.463 1.00 0.00 H new ATOM 0 HA LEU A 77 11.305 1.077 -3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.497 -0.070 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.876 -1.148 -3.006 1.00 0.00 H new ATOM 0 HG LEU A 77 9.545 1.326 -1.235 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.919 -0.297 0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.760 -0.353 -0.801 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.996 -1.623 -0.636 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.336 0.254 0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 77 11.430 -1.080 -1.049 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.895 0.567 -1.535 1.00 0.00 H new ATOM 1228 N ALA A 78 9.615 -0.087 -5.862 1.00 0.00 N ATOM 1229 CA ALA A 78 9.773 -0.739 -7.155 1.00 0.00 C ATOM 1230 C ALA A 78 10.946 -0.136 -7.923 1.00 0.00 C ATOM 1231 O ALA A 78 11.694 -0.848 -8.593 1.00 0.00 O ATOM 1232 CB ALA A 78 8.491 -0.581 -7.973 1.00 0.00 C ATOM 0 H ALA A 78 8.655 0.165 -5.628 1.00 0.00 H new ATOM 0 HA ALA A 78 9.973 -1.797 -6.987 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.613 -1.070 -8.939 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.659 -1.038 -7.438 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.285 0.478 -8.126 1.00 0.00 H new ATOM 1238 N SER A 79 11.094 1.179 -7.828 1.00 0.00 N ATOM 1239 CA SER A 79 12.173 1.873 -8.527 1.00 0.00 C ATOM 1240 C SER A 79 13.538 1.478 -7.966 1.00 0.00 C ATOM 1241 O SER A 79 14.553 1.587 -8.653 1.00 0.00 O ATOM 1242 CB SER A 79 11.987 3.383 -8.400 1.00 0.00 C ATOM 1243 OG SER A 79 12.922 4.045 -9.244 1.00 0.00 O ATOM 0 H SER A 79 10.486 1.785 -7.278 1.00 0.00 H new ATOM 0 HA SER A 79 12.136 1.584 -9.577 1.00 0.00 H new ATOM 0 HB2 SER A 79 10.970 3.660 -8.677 1.00 0.00 H new ATOM 0 HB3 SER A 79 12.131 3.693 -7.365 1.00 0.00 H new ATOM 0 HG SER A 79 12.804 5.015 -9.166 1.00 0.00 H new ATOM 1249 N ARG A 80 13.559 1.024 -6.715 1.00 0.00 N ATOM 1250 CA ARG A 80 14.815 0.622 -6.073 1.00 0.00 C ATOM 1251 C ARG A 80 15.045 -0.876 -6.234 1.00 0.00 C ATOM 1252 O ARG A 80 16.186 -1.334 -6.295 1.00 0.00 O ATOM 1253 CB ARG A 80 14.777 0.975 -4.580 1.00 0.00 C ATOM 1254 CG ARG A 80 14.493 2.478 -4.400 1.00 0.00 C ATOM 1255 CD ARG A 80 15.782 3.287 -4.598 1.00 0.00 C ATOM 1256 NE ARG A 80 15.557 4.685 -4.246 1.00 0.00 N ATOM 1257 CZ ARG A 80 16.574 5.522 -4.073 1.00 0.00 C ATOM 1258 NH1 ARG A 80 17.800 5.099 -4.216 1.00 0.00 N ATOM 1259 NH2 ARG A 80 16.347 6.769 -3.759 1.00 0.00 N ATOM 0 H ARG A 80 12.731 0.925 -6.128 1.00 0.00 H new ATOM 0 HA ARG A 80 15.633 1.158 -6.554 1.00 0.00 H new ATOM 0 HB2 ARG A 80 14.007 0.389 -4.079 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.728 0.718 -4.113 1.00 0.00 H new ATOM 0 HG2 ARG A 80 13.738 2.801 -5.117 1.00 0.00 H new ATOM 0 HG3 ARG A 80 14.088 2.663 -3.405 1.00 0.00 H new ATOM 0 HD2 ARG A 80 16.579 2.872 -3.981 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.111 3.214 -5.635 1.00 0.00 H new ATOM 0 HE ARG A 80 14.602 5.025 -4.131 1.00 0.00 H new ATOM 0 HH11 ARG A 80 17.978 4.125 -4.461 1.00 0.00 H new ATOM 0 HH12 ARG A 80 18.580 5.742 -4.083 1.00 0.00 H new ATOM 0 HH21 ARG A 80 15.389 7.100 -3.647 1.00 0.00 H new ATOM 0 HH22 ARG A 80 17.128 7.412 -3.626 1.00 0.00 H new ATOM 1273 N HIS A 81 13.951 -1.636 -6.294 1.00 0.00 N ATOM 1274 CA HIS A 81 14.036 -3.094 -6.441 1.00 0.00 C ATOM 1275 C HIS A 81 13.304 -3.550 -7.707 1.00 0.00 C ATOM 1276 O HIS A 81 12.780 -4.662 -7.770 1.00 0.00 O ATOM 1277 CB HIS A 81 13.422 -3.771 -5.204 1.00 0.00 C ATOM 1278 CG HIS A 81 14.444 -3.826 -4.096 1.00 0.00 C ATOM 1279 ND1 HIS A 81 15.390 -2.828 -3.912 1.00 0.00 N ATOM 1280 CD2 HIS A 81 14.678 -4.750 -3.111 1.00 0.00 C ATOM 1281 CE1 HIS A 81 16.142 -3.176 -2.850 1.00 0.00 C ATOM 1282 NE2 HIS A 81 15.749 -4.340 -2.325 1.00 0.00 N ATOM 0 H HIS A 81 13.000 -1.271 -6.244 1.00 0.00 H new ATOM 0 HA HIS A 81 15.084 -3.380 -6.528 1.00 0.00 H new ATOM 0 HB2 HIS A 81 12.543 -3.218 -4.874 1.00 0.00 H new ATOM 0 HB3 HIS A 81 13.090 -4.778 -5.456 1.00 0.00 H new ATOM 0 HD2 HIS A 81 14.115 -5.660 -2.967 1.00 0.00 H new ATOM 0 HE1 HIS A 81 16.963 -2.586 -2.469 1.00 0.00 H new ATOM 0 HE2 HIS A 81 16.149 -4.824 -1.521 1.00 0.00 H new ATOM 1291 N THR A 82 13.277 -2.679 -8.706 1.00 0.00 N ATOM 1292 CA THR A 82 12.614 -2.986 -9.967 1.00 0.00 C ATOM 1293 C THR A 82 12.988 -4.388 -10.457 1.00 0.00 C ATOM 1294 O THR A 82 12.152 -5.112 -10.991 1.00 0.00 O ATOM 1295 CB THR A 82 13.029 -1.950 -11.025 1.00 0.00 C ATOM 1296 OG1 THR A 82 13.203 -0.684 -10.403 1.00 0.00 O ATOM 1297 CG2 THR A 82 11.945 -1.843 -12.098 1.00 0.00 C ATOM 0 H THR A 82 13.706 -1.754 -8.669 1.00 0.00 H new ATOM 0 HA THR A 82 11.536 -2.951 -9.808 1.00 0.00 H new ATOM 0 HB THR A 82 13.965 -2.264 -11.488 1.00 0.00 H new ATOM 0 HG1 THR A 82 12.441 -0.502 -9.814 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.244 -1.108 -12.845 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.810 -2.813 -12.577 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.007 -1.532 -11.638 1.00 0.00 H new ATOM 1305 N ASP A 83 14.253 -4.751 -10.280 1.00 0.00 N ATOM 1306 CA ASP A 83 14.742 -6.057 -10.719 1.00 0.00 C ATOM 1307 C ASP A 83 13.975 -7.189 -10.054 1.00 0.00 C ATOM 1308 O ASP A 83 13.677 -8.198 -10.686 1.00 0.00 O ATOM 1309 CB ASP A 83 16.231 -6.190 -10.391 1.00 0.00 C ATOM 1310 CG ASP A 83 16.793 -7.455 -11.029 1.00 0.00 C ATOM 1311 OD1 ASP A 83 16.068 -8.093 -11.772 1.00 0.00 O ATOM 1312 OD2 ASP A 83 17.944 -7.766 -10.765 1.00 0.00 O ATOM 0 H ASP A 83 14.959 -4.163 -9.837 1.00 0.00 H new ATOM 0 HA ASP A 83 14.590 -6.127 -11.796 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.772 -5.317 -10.756 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.373 -6.224 -9.311 1.00 0.00 H new ATOM 1317 N VAL A 84 13.659 -7.025 -8.781 1.00 0.00 N ATOM 1318 CA VAL A 84 12.925 -8.051 -8.057 1.00 0.00 C ATOM 1319 C VAL A 84 11.462 -8.048 -8.473 1.00 0.00 C ATOM 1320 O VAL A 84 10.873 -9.096 -8.730 1.00 0.00 O ATOM 1321 CB VAL A 84 13.023 -7.799 -6.554 1.00 0.00 C ATOM 1322 CG1 VAL A 84 12.220 -8.860 -5.809 1.00 0.00 C ATOM 1323 CG2 VAL A 84 14.490 -7.871 -6.121 1.00 0.00 C ATOM 0 H VAL A 84 13.896 -6.200 -8.231 1.00 0.00 H new ATOM 0 HA VAL A 84 13.362 -9.021 -8.294 1.00 0.00 H new ATOM 0 HB VAL A 84 12.624 -6.812 -6.322 1.00 0.00 H new ATOM 0 HG11 VAL A 84 12.289 -8.682 -4.736 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.176 -8.810 -6.119 1.00 0.00 H new ATOM 0 HG13 VAL A 84 12.620 -9.847 -6.039 1.00 0.00 H new ATOM 0 HG21 VAL A 84 14.562 -7.691 -5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.889 -8.859 -6.351 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.065 -7.114 -6.655 1.00 0.00 H new ATOM 1333 N VAL A 85 10.879 -6.862 -8.522 1.00 0.00 N ATOM 1334 CA VAL A 85 9.478 -6.723 -8.891 1.00 0.00 C ATOM 1335 C VAL A 85 9.224 -7.195 -10.323 1.00 0.00 C ATOM 1336 O VAL A 85 8.316 -7.974 -10.562 1.00 0.00 O ATOM 1337 CB VAL A 85 9.055 -5.259 -8.762 1.00 0.00 C ATOM 1338 CG1 VAL A 85 7.562 -5.127 -9.066 1.00 0.00 C ATOM 1339 CG2 VAL A 85 9.329 -4.769 -7.338 1.00 0.00 C ATOM 0 H VAL A 85 11.352 -5.983 -8.312 1.00 0.00 H new ATOM 0 HA VAL A 85 8.892 -7.347 -8.216 1.00 0.00 H new ATOM 0 HB VAL A 85 9.624 -4.657 -9.470 1.00 0.00 H new ATOM 0 HG11 VAL A 85 7.263 -4.083 -8.973 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.365 -5.472 -10.081 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.992 -5.732 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.027 -3.726 -7.248 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.762 -5.373 -6.630 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.393 -4.859 -7.121 1.00 0.00 H new ATOM 1349 N ASP A 86 10.025 -6.697 -11.265 1.00 0.00 N ATOM 1350 CA ASP A 86 9.862 -7.051 -12.687 1.00 0.00 C ATOM 1351 C ASP A 86 9.716 -8.565 -12.906 1.00 0.00 C ATOM 1352 O ASP A 86 9.363 -9.005 -14.001 1.00 0.00 O ATOM 1353 CB ASP A 86 11.062 -6.520 -13.499 1.00 0.00 C ATOM 1354 CG ASP A 86 12.257 -7.472 -13.391 1.00 0.00 C ATOM 1355 OD1 ASP A 86 12.245 -8.312 -12.510 1.00 0.00 O ATOM 1356 OD2 ASP A 86 13.165 -7.342 -14.195 1.00 0.00 O ATOM 0 H ASP A 86 10.791 -6.050 -11.077 1.00 0.00 H new ATOM 0 HA ASP A 86 8.939 -6.584 -13.031 1.00 0.00 H new ATOM 0 HB2 ASP A 86 10.777 -6.405 -14.545 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.344 -5.532 -13.135 1.00 0.00 H new ATOM 1361 N LYS A 87 10.003 -9.350 -11.883 1.00 0.00 N ATOM 1362 CA LYS A 87 9.913 -10.806 -12.005 1.00 0.00 C ATOM 1363 C LYS A 87 8.454 -11.276 -12.076 1.00 0.00 C ATOM 1364 O LYS A 87 8.181 -12.443 -12.361 1.00 0.00 O ATOM 1365 CB LYS A 87 10.612 -11.463 -10.816 1.00 0.00 C ATOM 1366 CG LYS A 87 12.052 -10.948 -10.733 1.00 0.00 C ATOM 1367 CD LYS A 87 12.699 -11.423 -9.427 1.00 0.00 C ATOM 1368 CE LYS A 87 12.647 -12.947 -9.348 1.00 0.00 C ATOM 1369 NZ LYS A 87 12.942 -13.528 -10.688 1.00 0.00 N ATOM 0 H LYS A 87 10.298 -9.015 -10.966 1.00 0.00 H new ATOM 0 HA LYS A 87 10.404 -11.100 -12.933 1.00 0.00 H new ATOM 0 HB2 LYS A 87 10.078 -11.236 -9.893 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.606 -12.547 -10.929 1.00 0.00 H new ATOM 0 HG2 LYS A 87 12.627 -11.308 -11.586 1.00 0.00 H new ATOM 0 HG3 LYS A 87 12.062 -9.859 -10.779 1.00 0.00 H new ATOM 0 HD2 LYS A 87 13.733 -11.082 -9.378 1.00 0.00 H new ATOM 0 HD3 LYS A 87 12.179 -10.988 -8.574 1.00 0.00 H new ATOM 0 HE2 LYS A 87 13.370 -13.308 -8.617 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.663 -13.270 -9.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.272 -14.508 -10.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 12.079 -13.517 -11.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 13.681 -12.965 -11.155 1.00 0.00 H new ATOM 1383 N PHE A 88 7.526 -10.367 -11.794 1.00 0.00 N ATOM 1384 CA PHE A 88 6.091 -10.698 -11.804 1.00 0.00 C ATOM 1385 C PHE A 88 5.431 -10.388 -13.159 1.00 0.00 C ATOM 1386 O PHE A 88 4.441 -11.014 -13.528 1.00 0.00 O ATOM 1387 CB PHE A 88 5.379 -9.898 -10.684 1.00 0.00 C ATOM 1388 CG PHE A 88 4.955 -8.514 -11.194 1.00 0.00 C ATOM 1389 CD1 PHE A 88 5.853 -7.727 -11.926 1.00 0.00 C ATOM 1390 CD2 PHE A 88 3.665 -8.032 -10.933 1.00 0.00 C ATOM 1391 CE1 PHE A 88 5.463 -6.471 -12.398 1.00 0.00 C ATOM 1392 CE2 PHE A 88 3.279 -6.775 -11.406 1.00 0.00 C ATOM 1393 CZ PHE A 88 4.178 -5.995 -12.140 1.00 0.00 C ATOM 0 H PHE A 88 7.733 -9.397 -11.556 1.00 0.00 H new ATOM 0 HA PHE A 88 5.993 -11.770 -11.632 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.504 -10.448 -10.337 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.045 -9.788 -9.829 1.00 0.00 H new ATOM 0 HD1 PHE A 88 6.850 -8.092 -12.126 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.969 -8.632 -10.366 1.00 0.00 H new ATOM 0 HE1 PHE A 88 6.158 -5.868 -12.964 1.00 0.00 H new ATOM 0 HE2 PHE A 88 2.285 -6.405 -11.204 1.00 0.00 H new ATOM 0 HZ PHE A 88 3.877 -5.025 -12.507 1.00 0.00 H new ATOM 1403 N ASP A 89 5.995 -9.444 -13.884 1.00 0.00 N ATOM 1404 CA ASP A 89 5.460 -9.054 -15.194 1.00 0.00 C ATOM 1405 C ASP A 89 3.932 -8.745 -15.131 1.00 0.00 C ATOM 1406 O ASP A 89 3.377 -8.170 -16.067 1.00 0.00 O ATOM 1407 CB ASP A 89 5.710 -10.172 -16.208 1.00 0.00 C ATOM 1408 CG ASP A 89 7.206 -10.325 -16.458 1.00 0.00 C ATOM 1409 OD1 ASP A 89 7.947 -9.441 -16.059 1.00 0.00 O ATOM 1410 OD2 ASP A 89 7.591 -11.323 -17.044 1.00 0.00 O ATOM 0 H ASP A 89 6.825 -8.926 -13.597 1.00 0.00 H new ATOM 0 HA ASP A 89 5.975 -8.144 -15.502 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.297 -11.110 -15.836 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.198 -9.947 -17.143 1.00 0.00 H new ATOM 1415 N ASP A 90 3.268 -9.145 -14.031 1.00 0.00 N ATOM 1416 CA ASP A 90 1.826 -8.920 -13.876 1.00 0.00 C ATOM 1417 C ASP A 90 1.406 -9.060 -12.404 1.00 0.00 C ATOM 1418 O ASP A 90 1.863 -9.958 -11.699 1.00 0.00 O ATOM 1419 CB ASP A 90 1.046 -9.924 -14.729 1.00 0.00 C ATOM 1420 CG ASP A 90 1.154 -9.553 -16.203 1.00 0.00 C ATOM 1421 OD1 ASP A 90 1.059 -8.375 -16.506 1.00 0.00 O ATOM 1422 OD2 ASP A 90 1.331 -10.453 -17.008 1.00 0.00 O ATOM 0 H ASP A 90 3.707 -9.622 -13.243 1.00 0.00 H new ATOM 0 HA ASP A 90 1.601 -7.906 -14.208 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.436 -10.929 -14.569 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.001 -9.936 -14.425 1.00 0.00 H new ATOM 1427 N PHE A 91 0.530 -8.158 -11.971 1.00 0.00 N ATOM 1428 CA PHE A 91 0.023 -8.131 -10.590 1.00 0.00 C ATOM 1429 C PHE A 91 -0.284 -9.524 -10.025 1.00 0.00 C ATOM 1430 O PHE A 91 -0.100 -9.762 -8.831 1.00 0.00 O ATOM 1431 CB PHE A 91 -1.250 -7.287 -10.560 1.00 0.00 C ATOM 1432 CG PHE A 91 -1.733 -7.132 -9.143 1.00 0.00 C ATOM 1433 CD1 PHE A 91 -1.187 -6.140 -8.328 1.00 0.00 C ATOM 1434 CD2 PHE A 91 -2.737 -7.971 -8.650 1.00 0.00 C ATOM 1435 CE1 PHE A 91 -1.644 -5.984 -7.014 1.00 0.00 C ATOM 1436 CE2 PHE A 91 -3.193 -7.819 -7.337 1.00 0.00 C ATOM 1437 CZ PHE A 91 -2.647 -6.823 -6.519 1.00 0.00 C ATOM 0 H PHE A 91 0.147 -7.421 -12.564 1.00 0.00 H new ATOM 0 HA PHE A 91 0.807 -7.706 -9.963 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -1.056 -6.307 -10.996 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.023 -7.759 -11.167 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -0.412 -5.493 -8.711 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.160 -8.737 -9.283 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.222 -5.216 -6.383 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.966 -8.469 -6.954 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.000 -6.703 -5.506 1.00 0.00 H new ATOM 1447 N THR A 92 -0.770 -10.427 -10.860 1.00 0.00 N ATOM 1448 CA THR A 92 -1.113 -11.771 -10.389 1.00 0.00 C ATOM 1449 C THR A 92 0.122 -12.542 -9.914 1.00 0.00 C ATOM 1450 O THR A 92 0.098 -13.180 -8.863 1.00 0.00 O ATOM 1451 CB THR A 92 -1.797 -12.559 -11.509 1.00 0.00 C ATOM 1452 OG1 THR A 92 -2.931 -11.836 -11.969 1.00 0.00 O ATOM 1453 CG2 THR A 92 -2.240 -13.925 -10.978 1.00 0.00 C ATOM 0 H THR A 92 -0.936 -10.265 -11.853 1.00 0.00 H new ATOM 0 HA THR A 92 -1.790 -11.656 -9.542 1.00 0.00 H new ATOM 0 HB THR A 92 -1.098 -12.702 -12.333 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.370 -12.338 -12.687 1.00 0.00 H new ATOM 0 HG21 THR A 92 -2.727 -14.485 -11.776 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.369 -14.478 -10.625 1.00 0.00 H new ATOM 0 HG23 THR A 92 -2.940 -13.786 -10.154 1.00 0.00 H new ATOM 1461 N SER A 93 1.183 -12.498 -10.700 1.00 0.00 N ATOM 1462 CA SER A 93 2.406 -13.224 -10.358 1.00 0.00 C ATOM 1463 C SER A 93 3.064 -12.678 -9.083 1.00 0.00 C ATOM 1464 O SER A 93 3.740 -13.418 -8.368 1.00 0.00 O ATOM 1465 CB SER A 93 3.395 -13.136 -11.511 1.00 0.00 C ATOM 1466 OG SER A 93 2.808 -13.697 -12.679 1.00 0.00 O ATOM 0 H SER A 93 1.229 -11.974 -11.574 1.00 0.00 H new ATOM 0 HA SER A 93 2.129 -14.262 -10.174 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.669 -12.097 -11.691 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.312 -13.668 -11.260 1.00 0.00 H new ATOM 0 HG SER A 93 3.443 -13.640 -13.424 1.00 0.00 H new ATOM 1472 N LEU A 94 2.884 -11.384 -8.814 1.00 0.00 N ATOM 1473 CA LEU A 94 3.498 -10.774 -7.629 1.00 0.00 C ATOM 1474 C LEU A 94 2.745 -11.138 -6.351 1.00 0.00 C ATOM 1475 O LEU A 94 3.340 -11.649 -5.413 1.00 0.00 O ATOM 1476 CB LEU A 94 3.557 -9.243 -7.785 1.00 0.00 C ATOM 1477 CG LEU A 94 4.062 -8.587 -6.470 1.00 0.00 C ATOM 1478 CD1 LEU A 94 5.061 -7.469 -6.800 1.00 0.00 C ATOM 1479 CD2 LEU A 94 2.876 -7.990 -5.682 1.00 0.00 C ATOM 0 H LEU A 94 2.330 -10.747 -9.386 1.00 0.00 H new ATOM 0 HA LEU A 94 4.511 -11.168 -7.545 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.220 -8.980 -8.609 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.569 -8.858 -8.036 1.00 0.00 H new ATOM 0 HG LEU A 94 4.549 -9.350 -5.863 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.413 -7.011 -5.876 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.908 -7.887 -7.344 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.572 -6.714 -7.415 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.243 -7.533 -4.763 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.379 -7.234 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.167 -8.781 -5.436 1.00 0.00 H new ATOM 1491 N VAL A 95 1.448 -10.854 -6.307 1.00 0.00 N ATOM 1492 CA VAL A 95 0.648 -11.146 -5.106 1.00 0.00 C ATOM 1493 C VAL A 95 1.095 -12.460 -4.435 1.00 0.00 C ATOM 1494 O VAL A 95 1.381 -12.485 -3.241 1.00 0.00 O ATOM 1495 CB VAL A 95 -0.846 -11.223 -5.477 1.00 0.00 C ATOM 1496 CG1 VAL A 95 -1.641 -11.858 -4.333 1.00 0.00 C ATOM 1497 CG2 VAL A 95 -1.385 -9.814 -5.732 1.00 0.00 C ATOM 0 H VAL A 95 0.927 -10.428 -7.073 1.00 0.00 H new ATOM 0 HA VAL A 95 0.804 -10.337 -4.392 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.953 -11.831 -6.375 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.695 -11.907 -4.606 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.267 -12.865 -4.145 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.527 -11.255 -3.432 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.441 -9.871 -5.994 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.266 -9.211 -4.832 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.832 -9.356 -6.552 1.00 0.00 H new ATOM 1507 N MET A 96 1.139 -13.541 -5.201 1.00 0.00 N ATOM 1508 CA MET A 96 1.541 -14.840 -4.639 1.00 0.00 C ATOM 1509 C MET A 96 3.060 -14.943 -4.495 1.00 0.00 C ATOM 1510 O MET A 96 3.566 -15.860 -3.848 1.00 0.00 O ATOM 1511 CB MET A 96 1.023 -15.999 -5.514 1.00 0.00 C ATOM 1512 CG MET A 96 1.321 -15.738 -7.017 1.00 0.00 C ATOM 1513 SD MET A 96 -0.173 -16.061 -8.000 1.00 0.00 S ATOM 1514 CE MET A 96 -1.221 -14.778 -7.263 1.00 0.00 C ATOM 0 H MET A 96 0.908 -13.555 -6.194 1.00 0.00 H new ATOM 0 HA MET A 96 1.096 -14.914 -3.647 1.00 0.00 H new ATOM 0 HB2 MET A 96 1.493 -16.932 -5.203 1.00 0.00 H new ATOM 0 HB3 MET A 96 -0.051 -16.118 -5.368 1.00 0.00 H new ATOM 0 HG2 MET A 96 1.647 -14.708 -7.160 1.00 0.00 H new ATOM 0 HG3 MET A 96 2.136 -16.379 -7.353 1.00 0.00 H new ATOM 0 HE1 MET A 96 -1.905 -14.390 -8.017 1.00 0.00 H new ATOM 0 HE2 MET A 96 -1.793 -15.204 -6.439 1.00 0.00 H new ATOM 0 HE3 MET A 96 -0.595 -13.968 -6.889 1.00 0.00 H new ATOM 1524 N GLY A 97 3.785 -14.009 -5.106 1.00 0.00 N ATOM 1525 CA GLY A 97 5.254 -14.029 -5.035 1.00 0.00 C ATOM 1526 C GLY A 97 5.771 -13.141 -3.903 1.00 0.00 C ATOM 1527 O GLY A 97 6.970 -13.111 -3.628 1.00 0.00 O ATOM 0 H GLY A 97 3.393 -13.239 -5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.598 -15.052 -4.883 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.670 -13.690 -5.984 1.00 0.00 H new ATOM 1531 N ILE A 98 4.863 -12.418 -3.259 1.00 0.00 N ATOM 1532 CA ILE A 98 5.244 -11.526 -2.171 1.00 0.00 C ATOM 1533 C ILE A 98 6.214 -12.213 -1.215 1.00 0.00 C ATOM 1534 O ILE A 98 7.430 -12.108 -1.374 1.00 0.00 O ATOM 1535 CB ILE A 98 4.001 -11.063 -1.413 1.00 0.00 C ATOM 1536 CG1 ILE A 98 3.124 -10.230 -2.353 1.00 0.00 C ATOM 1537 CG2 ILE A 98 4.421 -10.203 -0.222 1.00 0.00 C ATOM 1538 CD1 ILE A 98 1.771 -9.969 -1.696 1.00 0.00 C ATOM 0 H ILE A 98 3.865 -12.431 -3.469 1.00 0.00 H new ATOM 0 HA ILE A 98 5.745 -10.659 -2.601 1.00 0.00 H new ATOM 0 HB ILE A 98 3.444 -11.930 -1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 98 3.616 -9.285 -2.583 1.00 0.00 H new ATOM 0 HG13 ILE A 98 2.985 -10.755 -3.298 1.00 0.00 H new ATOM 0 HG21 ILE A 98 3.534 -9.873 0.319 1.00 0.00 H new ATOM 0 HG22 ILE A 98 5.055 -10.788 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 98 4.974 -9.334 -0.578 1.00 0.00 H new ATOM 0 HD11 ILE A 98 1.149 -9.376 -2.367 1.00 0.00 H new ATOM 0 HD12 ILE A 98 1.278 -10.919 -1.489 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.918 -9.425 -0.763 1.00 0.00 H new ATOM 1550 N HIS A 99 5.682 -12.914 -0.225 1.00 0.00 N ATOM 1551 CA HIS A 99 6.525 -13.602 0.741 1.00 0.00 C ATOM 1552 C HIS A 99 7.690 -14.300 0.042 1.00 0.00 C ATOM 1553 O HIS A 99 8.852 -14.146 0.421 1.00 0.00 O ATOM 1554 CB HIS A 99 5.697 -14.642 1.499 1.00 0.00 C ATOM 1555 CG HIS A 99 6.528 -15.240 2.600 1.00 0.00 C ATOM 1556 ND1 HIS A 99 6.993 -14.487 3.668 1.00 0.00 N ATOM 1557 CD2 HIS A 99 6.986 -16.516 2.813 1.00 0.00 C ATOM 1558 CE1 HIS A 99 7.696 -15.311 4.468 1.00 0.00 C ATOM 1559 NE2 HIS A 99 7.723 -16.559 3.992 1.00 0.00 N ATOM 0 H HIS A 99 4.680 -13.021 -0.070 1.00 0.00 H new ATOM 0 HA HIS A 99 6.923 -12.864 1.437 1.00 0.00 H new ATOM 0 HB2 HIS A 99 4.803 -14.177 1.915 1.00 0.00 H new ATOM 0 HB3 HIS A 99 5.362 -15.423 0.817 1.00 0.00 H new ATOM 0 HD2 HIS A 99 6.802 -17.359 2.164 1.00 0.00 H new ATOM 0 HE1 HIS A 99 8.179 -15.001 5.383 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.185 -17.369 4.405 1.00 0.00 H new ATOM 1568 N ASP A 100 7.348 -15.080 -0.966 1.00 0.00 N ATOM 1569 CA ASP A 100 8.322 -15.848 -1.733 1.00 0.00 C ATOM 1570 C ASP A 100 9.622 -15.080 -2.041 1.00 0.00 C ATOM 1571 O ASP A 100 10.527 -15.012 -1.218 1.00 0.00 O ATOM 1572 CB ASP A 100 7.686 -16.290 -3.048 1.00 0.00 C ATOM 1573 CG ASP A 100 8.664 -17.155 -3.835 1.00 0.00 C ATOM 1574 OD1 ASP A 100 9.723 -17.450 -3.306 1.00 0.00 O ATOM 1575 OD2 ASP A 100 8.341 -17.509 -4.957 1.00 0.00 O ATOM 0 H ASP A 100 6.385 -15.202 -1.280 1.00 0.00 H new ATOM 0 HA ASP A 100 8.601 -16.700 -1.113 1.00 0.00 H new ATOM 0 HB2 ASP A 100 6.772 -16.849 -2.849 1.00 0.00 H new ATOM 0 HB3 ASP A 100 7.404 -15.417 -3.637 1.00 0.00 H new ATOM 1580 N VAL A 101 9.714 -14.574 -3.274 1.00 0.00 N ATOM 1581 CA VAL A 101 10.920 -13.887 -3.759 1.00 0.00 C ATOM 1582 C VAL A 101 11.099 -12.463 -3.215 1.00 0.00 C ATOM 1583 O VAL A 101 12.196 -12.085 -2.805 1.00 0.00 O ATOM 1584 CB VAL A 101 10.865 -13.836 -5.300 1.00 0.00 C ATOM 1585 CG1 VAL A 101 10.359 -15.180 -5.836 1.00 0.00 C ATOM 1586 CG2 VAL A 101 9.909 -12.725 -5.762 1.00 0.00 C ATOM 0 H VAL A 101 8.962 -14.627 -3.961 1.00 0.00 H new ATOM 0 HA VAL A 101 11.775 -14.458 -3.395 1.00 0.00 H new ATOM 0 HB VAL A 101 11.866 -13.632 -5.681 1.00 0.00 H new ATOM 0 HG11 VAL A 101 10.319 -15.146 -6.925 1.00 0.00 H new ATOM 0 HG12 VAL A 101 11.036 -15.975 -5.522 1.00 0.00 H new ATOM 0 HG13 VAL A 101 9.362 -15.376 -5.443 1.00 0.00 H new ATOM 0 HG21 VAL A 101 9.880 -12.700 -6.851 1.00 0.00 H new ATOM 0 HG22 VAL A 101 8.909 -12.922 -5.376 1.00 0.00 H new ATOM 0 HG23 VAL A 101 10.260 -11.764 -5.386 1.00 0.00 H new ATOM 1596 N ILE A 102 10.051 -11.675 -3.269 1.00 0.00 N ATOM 1597 CA ILE A 102 10.131 -10.284 -2.839 1.00 0.00 C ATOM 1598 C ILE A 102 10.637 -10.133 -1.400 1.00 0.00 C ATOM 1599 O ILE A 102 11.517 -9.316 -1.140 1.00 0.00 O ATOM 1600 CB ILE A 102 8.754 -9.628 -3.008 1.00 0.00 C ATOM 1601 CG1 ILE A 102 8.482 -9.351 -4.530 1.00 0.00 C ATOM 1602 CG2 ILE A 102 8.702 -8.306 -2.223 1.00 0.00 C ATOM 1603 CD1 ILE A 102 7.160 -9.996 -4.950 1.00 0.00 C ATOM 0 H ILE A 102 9.132 -11.965 -3.604 1.00 0.00 H new ATOM 0 HA ILE A 102 10.864 -9.780 -3.468 1.00 0.00 H new ATOM 0 HB ILE A 102 7.989 -10.302 -2.622 1.00 0.00 H new ATOM 0 HG12 ILE A 102 8.446 -8.277 -4.712 1.00 0.00 H new ATOM 0 HG13 ILE A 102 9.298 -9.749 -5.132 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.721 -7.847 -2.348 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.878 -8.504 -1.166 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.470 -7.630 -2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.979 -9.799 -6.007 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.212 -11.072 -4.785 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.346 -9.577 -4.358 1.00 0.00 H new ATOM 1615 N HIS A 103 10.080 -10.888 -0.464 1.00 0.00 N ATOM 1616 CA HIS A 103 10.507 -10.763 0.932 1.00 0.00 C ATOM 1617 C HIS A 103 11.725 -11.640 1.228 1.00 0.00 C ATOM 1618 O HIS A 103 12.306 -11.558 2.309 1.00 0.00 O ATOM 1619 CB HIS A 103 9.351 -11.128 1.864 1.00 0.00 C ATOM 1620 CG HIS A 103 8.393 -9.959 1.949 1.00 0.00 C ATOM 1621 ND1 HIS A 103 7.026 -10.100 1.766 1.00 0.00 N ATOM 1622 CD2 HIS A 103 8.604 -8.622 2.180 1.00 0.00 C ATOM 1623 CE1 HIS A 103 6.474 -8.873 1.887 1.00 0.00 C ATOM 1624 NE2 HIS A 103 7.395 -7.934 2.138 1.00 0.00 N ATOM 0 H HIS A 103 9.349 -11.579 -0.633 1.00 0.00 H new ATOM 0 HA HIS A 103 10.797 -9.727 1.105 1.00 0.00 H new ATOM 0 HB2 HIS A 103 8.833 -12.012 1.492 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.731 -11.375 2.855 1.00 0.00 H new ATOM 0 HD2 HIS A 103 9.567 -8.170 2.367 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.417 -8.673 1.793 1.00 0.00 H new ATOM 0 HE2 HIS A 103 7.244 -6.934 2.270 1.00 0.00 H new ATOM 1632 N LEU A 104 12.118 -12.471 0.266 1.00 0.00 N ATOM 1633 CA LEU A 104 13.282 -13.339 0.460 1.00 0.00 C ATOM 1634 C LEU A 104 14.562 -12.610 0.042 1.00 0.00 C ATOM 1635 O LEU A 104 15.634 -12.852 0.594 1.00 0.00 O ATOM 1636 CB LEU A 104 13.115 -14.641 -0.354 1.00 0.00 C ATOM 1637 CG LEU A 104 14.464 -15.421 -0.423 1.00 0.00 C ATOM 1638 CD1 LEU A 104 14.197 -16.930 -0.328 1.00 0.00 C ATOM 1639 CD2 LEU A 104 15.181 -15.118 -1.755 1.00 0.00 C ATOM 0 H LEU A 104 11.659 -12.564 -0.640 1.00 0.00 H new ATOM 0 HA LEU A 104 13.358 -13.595 1.517 1.00 0.00 H new ATOM 0 HB2 LEU A 104 12.349 -15.267 0.104 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.773 -14.405 -1.362 1.00 0.00 H new ATOM 0 HG LEU A 104 15.094 -15.107 0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 104 15.142 -17.471 -0.377 1.00 0.00 H new ATOM 0 HD12 LEU A 104 13.700 -17.153 0.616 1.00 0.00 H new ATOM 0 HD13 LEU A 104 13.559 -17.239 -1.156 1.00 0.00 H new ATOM 0 HD21 LEU A 104 16.122 -15.667 -1.795 1.00 0.00 H new ATOM 0 HD22 LEU A 104 14.547 -15.424 -2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 104 15.381 -14.049 -1.825 1.00 0.00 H new ATOM 1651 N GLU A 105 14.437 -11.718 -0.941 1.00 0.00 N ATOM 1652 CA GLU A 105 15.593 -10.963 -1.429 1.00 0.00 C ATOM 1653 C GLU A 105 15.924 -9.800 -0.493 1.00 0.00 C ATOM 1654 O GLU A 105 17.075 -9.376 -0.410 1.00 0.00 O ATOM 1655 CB GLU A 105 15.312 -10.437 -2.842 1.00 0.00 C ATOM 1656 CG GLU A 105 16.581 -9.805 -3.427 1.00 0.00 C ATOM 1657 CD GLU A 105 17.642 -10.876 -3.653 1.00 0.00 C ATOM 1658 OE1 GLU A 105 17.270 -12.025 -3.820 1.00 0.00 O ATOM 1659 OE2 GLU A 105 18.812 -10.531 -3.654 1.00 0.00 O ATOM 0 H GLU A 105 13.558 -11.502 -1.411 1.00 0.00 H new ATOM 0 HA GLU A 105 16.453 -11.632 -1.456 1.00 0.00 H new ATOM 0 HB2 GLU A 105 14.973 -11.252 -3.482 1.00 0.00 H new ATOM 0 HB3 GLU A 105 14.509 -9.700 -2.812 1.00 0.00 H new ATOM 0 HG2 GLU A 105 16.348 -9.308 -4.369 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.962 -9.041 -2.749 1.00 0.00 H new ATOM 1666 N VAL A 106 14.921 -9.288 0.212 1.00 0.00 N ATOM 1667 CA VAL A 106 15.146 -8.177 1.136 1.00 0.00 C ATOM 1668 C VAL A 106 15.753 -8.691 2.440 1.00 0.00 C ATOM 1669 O VAL A 106 16.439 -7.956 3.152 1.00 0.00 O ATOM 1670 CB VAL A 106 13.826 -7.455 1.439 1.00 0.00 C ATOM 1671 CG1 VAL A 106 13.130 -7.054 0.127 1.00 0.00 C ATOM 1672 CG2 VAL A 106 12.913 -8.383 2.244 1.00 0.00 C ATOM 0 H VAL A 106 13.957 -9.617 0.165 1.00 0.00 H new ATOM 0 HA VAL A 106 15.836 -7.476 0.666 1.00 0.00 H new ATOM 0 HB VAL A 106 14.034 -6.555 2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 106 12.194 -6.542 0.353 1.00 0.00 H new ATOM 0 HG12 VAL A 106 13.780 -6.388 -0.441 1.00 0.00 H new ATOM 0 HG13 VAL A 106 12.922 -7.947 -0.462 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.975 -7.872 2.460 1.00 0.00 H new ATOM 0 HG22 VAL A 106 12.710 -9.285 1.666 1.00 0.00 H new ATOM 0 HG23 VAL A 106 13.403 -8.654 3.179 1.00 0.00 H new ATOM 1682 N ASN A 107 15.480 -9.956 2.750 1.00 0.00 N ATOM 1683 CA ASN A 107 15.985 -10.570 3.976 1.00 0.00 C ATOM 1684 C ASN A 107 17.508 -10.707 3.948 1.00 0.00 C ATOM 1685 O ASN A 107 18.185 -10.364 4.917 1.00 0.00 O ATOM 1686 CB ASN A 107 15.356 -11.953 4.159 1.00 0.00 C ATOM 1687 CG ASN A 107 15.551 -12.430 5.595 1.00 0.00 C ATOM 1688 OD1 ASN A 107 16.059 -11.687 6.434 1.00 0.00 O ATOM 1689 ND2 ASN A 107 15.174 -13.634 5.929 1.00 0.00 N ATOM 0 H ASN A 107 14.913 -10.575 2.171 1.00 0.00 H new ATOM 0 HA ASN A 107 15.715 -9.922 4.810 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.293 -11.912 3.922 1.00 0.00 H new ATOM 0 HB3 ASN A 107 15.810 -12.662 3.467 1.00 0.00 H new ATOM 0 HD21 ASN A 107 15.300 -13.961 6.887 1.00 0.00 H new ATOM 0 HD22 ASN A 107 14.753 -14.248 5.232 1.00 0.00 H new ATOM 1696 N LYS A 108 18.041 -11.223 2.843 1.00 0.00 N ATOM 1697 CA LYS A 108 19.485 -11.408 2.725 1.00 0.00 C ATOM 1698 C LYS A 108 20.193 -10.068 2.563 1.00 0.00 C ATOM 1699 O LYS A 108 21.369 -9.934 2.900 1.00 0.00 O ATOM 1700 CB LYS A 108 19.808 -12.319 1.531 1.00 0.00 C ATOM 1701 CG LYS A 108 19.344 -11.653 0.208 1.00 0.00 C ATOM 1702 CD LYS A 108 20.540 -11.003 -0.509 1.00 0.00 C ATOM 1703 CE LYS A 108 21.314 -12.065 -1.301 1.00 0.00 C ATOM 1704 NZ LYS A 108 20.600 -12.351 -2.577 1.00 0.00 N ATOM 0 H LYS A 108 17.504 -11.517 2.027 1.00 0.00 H new ATOM 0 HA LYS A 108 19.843 -11.879 3.641 1.00 0.00 H new ATOM 0 HB2 LYS A 108 20.880 -12.514 1.492 1.00 0.00 H new ATOM 0 HB3 LYS A 108 19.313 -13.282 1.655 1.00 0.00 H new ATOM 0 HG2 LYS A 108 18.883 -12.398 -0.441 1.00 0.00 H new ATOM 0 HG3 LYS A 108 18.584 -10.900 0.418 1.00 0.00 H new ATOM 0 HD2 LYS A 108 20.190 -10.219 -1.181 1.00 0.00 H new ATOM 0 HD3 LYS A 108 21.198 -10.529 0.219 1.00 0.00 H new ATOM 0 HE2 LYS A 108 22.325 -11.714 -1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 108 21.407 -12.977 -0.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 21.293 -12.481 -3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 20.035 -13.217 -2.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 19.973 -11.555 -2.810 1.00 0.00 H new ATOM 1835 N PRO A 116 7.078 -9.902 7.988 1.00 0.00 N ATOM 1836 CA PRO A 116 5.629 -10.192 8.192 1.00 0.00 C ATOM 1837 C PRO A 116 5.218 -11.543 7.596 1.00 0.00 C ATOM 1838 O PRO A 116 5.930 -12.109 6.766 1.00 0.00 O ATOM 1839 CB PRO A 116 4.927 -9.041 7.465 1.00 0.00 C ATOM 1840 CG PRO A 116 5.885 -7.886 7.526 1.00 0.00 C ATOM 1841 CD PRO A 116 7.301 -8.480 7.646 1.00 0.00 C ATOM 0 HA PRO A 116 5.370 -10.260 9.249 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.700 -9.309 6.433 1.00 0.00 H new ATOM 0 HB3 PRO A 116 3.981 -8.792 7.945 1.00 0.00 H new ATOM 0 HG2 PRO A 116 5.801 -7.268 6.632 1.00 0.00 H new ATOM 0 HG3 PRO A 116 5.662 -7.245 8.379 1.00 0.00 H new ATOM 0 HD2 PRO A 116 7.855 -8.378 6.713 1.00 0.00 H new ATOM 0 HD3 PRO A 116 7.880 -7.972 8.417 1.00 0.00 H new ATOM 1849 N HIS A 117 4.059 -12.045 8.024 1.00 0.00 N ATOM 1850 CA HIS A 117 3.550 -13.325 7.524 1.00 0.00 C ATOM 1851 C HIS A 117 2.521 -13.087 6.424 1.00 0.00 C ATOM 1852 O HIS A 117 1.536 -12.377 6.626 1.00 0.00 O ATOM 1853 CB HIS A 117 2.906 -14.113 8.666 1.00 0.00 C ATOM 1854 CG HIS A 117 3.914 -14.319 9.763 1.00 0.00 C ATOM 1855 ND1 HIS A 117 4.998 -15.172 9.619 1.00 0.00 N ATOM 1856 CD2 HIS A 117 4.016 -13.792 11.025 1.00 0.00 C ATOM 1857 CE1 HIS A 117 5.701 -15.130 10.768 1.00 0.00 C ATOM 1858 NE2 HIS A 117 5.144 -14.304 11.658 1.00 0.00 N ATOM 0 H HIS A 117 3.458 -11.590 8.711 1.00 0.00 H new ATOM 0 HA HIS A 117 4.383 -13.898 7.116 1.00 0.00 H new ATOM 0 HB2 HIS A 117 2.039 -13.575 9.050 1.00 0.00 H new ATOM 0 HB3 HIS A 117 2.548 -15.076 8.301 1.00 0.00 H new ATOM 0 HD2 HIS A 117 3.325 -13.086 11.461 1.00 0.00 H new ATOM 0 HE1 HIS A 117 6.604 -15.695 10.947 1.00 0.00 H new ATOM 0 HE2 HIS A 117 5.475 -14.094 12.600 1.00 0.00 H new ATOM 1867 N ILE A 118 2.760 -13.677 5.253 1.00 0.00 N ATOM 1868 CA ILE A 118 1.848 -13.513 4.120 1.00 0.00 C ATOM 1869 C ILE A 118 1.780 -14.793 3.290 1.00 0.00 C ATOM 1870 O ILE A 118 2.807 -15.339 2.888 1.00 0.00 O ATOM 1871 CB ILE A 118 2.326 -12.359 3.240 1.00 0.00 C ATOM 1872 CG1 ILE A 118 2.664 -11.155 4.127 1.00 0.00 C ATOM 1873 CG2 ILE A 118 1.219 -11.977 2.256 1.00 0.00 C ATOM 1874 CD1 ILE A 118 2.955 -9.934 3.251 1.00 0.00 C ATOM 0 H ILE A 118 3.570 -14.268 5.064 1.00 0.00 H new ATOM 0 HA ILE A 118 0.852 -13.295 4.506 1.00 0.00 H new ATOM 0 HB ILE A 118 3.213 -12.663 2.684 1.00 0.00 H new ATOM 0 HG12 ILE A 118 1.833 -10.942 4.800 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.529 -11.382 4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 118 1.559 -11.154 1.628 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.977 -12.836 1.630 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.331 -11.669 2.809 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.195 -9.080 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 118 3.800 -10.149 2.597 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.078 -9.702 2.647 1.00 0.00 H new ATOM 1886 N ASN A 119 0.555 -15.268 3.038 1.00 0.00 N ATOM 1887 CA ASN A 119 0.356 -16.494 2.252 1.00 0.00 C ATOM 1888 C ASN A 119 -0.668 -16.268 1.140 1.00 0.00 C ATOM 1889 O ASN A 119 -1.868 -16.178 1.396 1.00 0.00 O ATOM 1890 CB ASN A 119 -0.128 -17.622 3.166 1.00 0.00 C ATOM 1891 CG ASN A 119 -0.032 -18.958 2.438 1.00 0.00 C ATOM 1892 OD1 ASN A 119 -0.924 -19.798 2.562 1.00 0.00 O ATOM 1893 ND2 ASN A 119 1.002 -19.207 1.682 1.00 0.00 N ATOM 0 H ASN A 119 -0.306 -14.828 3.362 1.00 0.00 H new ATOM 0 HA ASN A 119 1.309 -16.768 1.799 1.00 0.00 H new ATOM 0 HB2 ASN A 119 0.474 -17.649 4.074 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.158 -17.438 3.471 1.00 0.00 H new ATOM 0 HD21 ASN A 119 1.073 -20.099 1.192 1.00 0.00 H new ATOM 0 HD22 ASN A 119 1.740 -18.510 1.581 1.00 0.00 H new ATOM 1900 N GLY A 120 -0.181 -16.186 -0.095 1.00 0.00 N ATOM 1901 CA GLY A 120 -1.049 -15.979 -1.250 1.00 0.00 C ATOM 1902 C GLY A 120 -1.502 -17.312 -1.822 1.00 0.00 C ATOM 1903 O GLY A 120 -0.684 -18.178 -2.129 1.00 0.00 O ATOM 0 H GLY A 120 0.811 -16.260 -0.322 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.917 -15.388 -0.958 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.518 -15.410 -2.014 1.00 0.00 H new ATOM 1907 N GLN A 121 -2.812 -17.470 -1.965 1.00 0.00 N ATOM 1908 CA GLN A 121 -3.384 -18.705 -2.508 1.00 0.00 C ATOM 1909 C GLN A 121 -4.299 -18.377 -3.682 1.00 0.00 C ATOM 1910 O GLN A 121 -5.132 -17.483 -3.589 1.00 0.00 O ATOM 1911 CB GLN A 121 -4.175 -19.421 -1.418 1.00 0.00 C ATOM 1912 CG GLN A 121 -4.723 -20.740 -1.962 1.00 0.00 C ATOM 1913 CD GLN A 121 -5.207 -21.617 -0.814 1.00 0.00 C ATOM 1914 OE1 GLN A 121 -5.025 -21.270 0.353 1.00 0.00 O ATOM 1915 NE2 GLN A 121 -5.818 -22.740 -1.075 1.00 0.00 N ATOM 0 H GLN A 121 -3.501 -16.761 -1.714 1.00 0.00 H new ATOM 0 HA GLN A 121 -2.580 -19.354 -2.855 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -3.536 -19.610 -0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -4.994 -18.789 -1.075 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -5.544 -20.545 -2.652 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -3.949 -21.260 -2.526 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -5.968 -23.026 -2.042 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -6.146 -23.332 -0.312 1.00 0.00 H new ATOM 1924 N LEU A 122 -4.128 -19.084 -4.799 1.00 0.00 N ATOM 1925 CA LEU A 122 -4.940 -18.822 -5.982 1.00 0.00 C ATOM 1926 C LEU A 122 -6.297 -19.527 -5.894 1.00 0.00 C ATOM 1927 O LEU A 122 -6.381 -20.706 -5.549 1.00 0.00 O ATOM 1928 CB LEU A 122 -4.171 -19.294 -7.244 1.00 0.00 C ATOM 1929 CG LEU A 122 -4.079 -18.159 -8.282 1.00 0.00 C ATOM 1930 CD1 LEU A 122 -3.161 -17.032 -7.760 1.00 0.00 C ATOM 1931 CD2 LEU A 122 -3.502 -18.724 -9.581 1.00 0.00 C ATOM 0 H LEU A 122 -3.443 -19.832 -4.907 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.129 -17.750 -6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.169 -19.620 -6.965 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.676 -20.155 -7.683 1.00 0.00 H new ATOM 0 HG LEU A 122 -5.073 -17.749 -8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.104 -16.236 -8.502 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.567 -16.633 -6.831 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.163 -17.431 -7.578 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.432 -17.929 -10.324 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.509 -19.132 -9.391 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.153 -19.514 -9.955 1.00 0.00 H new ATOM 1943 N LEU A 123 -7.347 -18.782 -6.220 1.00 0.00 N ATOM 1944 CA LEU A 123 -8.718 -19.309 -6.197 1.00 0.00 C ATOM 1945 C LEU A 123 -9.256 -19.385 -7.635 1.00 0.00 C ATOM 1946 O LEU A 123 -8.806 -18.636 -8.503 1.00 0.00 O ATOM 1947 CB LEU A 123 -9.628 -18.375 -5.344 1.00 0.00 C ATOM 1948 CG LEU A 123 -8.781 -17.580 -4.333 1.00 0.00 C ATOM 1949 CD1 LEU A 123 -9.661 -16.519 -3.632 1.00 0.00 C ATOM 1950 CD2 LEU A 123 -8.186 -18.541 -3.279 1.00 0.00 C ATOM 0 H LEU A 123 -7.280 -17.805 -6.506 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.717 -20.305 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -10.168 -17.688 -5.996 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.375 -18.967 -4.816 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.970 -17.080 -4.862 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -9.057 -15.959 -2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -10.069 -15.835 -4.376 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.478 -17.013 -3.107 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -7.588 -17.974 -2.566 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.994 -19.048 -2.752 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.556 -19.280 -3.775 1.00 0.00 H new ATOM 1962 N PRO A 124 -10.203 -20.260 -7.910 1.00 0.00 N ATOM 1963 CA PRO A 124 -10.780 -20.389 -9.277 1.00 0.00 C ATOM 1964 C PRO A 124 -11.127 -19.018 -9.863 1.00 0.00 C ATOM 1965 O PRO A 124 -11.122 -18.013 -9.152 1.00 0.00 O ATOM 1966 CB PRO A 124 -12.045 -21.269 -9.083 1.00 0.00 C ATOM 1967 CG PRO A 124 -12.192 -21.468 -7.594 1.00 0.00 C ATOM 1968 CD PRO A 124 -10.821 -21.203 -6.975 1.00 0.00 C ATOM 0 HA PRO A 124 -10.080 -20.834 -9.984 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.926 -20.782 -9.500 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -11.937 -22.225 -9.595 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -12.939 -20.787 -7.185 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -12.528 -22.481 -7.371 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -10.907 -20.779 -5.975 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -10.237 -22.119 -6.884 1.00 0.00 H new ATOM 1976 N ASN A 125 -11.413 -18.983 -11.160 1.00 0.00 N ATOM 1977 CA ASN A 125 -11.745 -17.725 -11.822 1.00 0.00 C ATOM 1978 C ASN A 125 -10.557 -16.778 -11.775 1.00 0.00 C ATOM 1979 O ASN A 125 -9.444 -17.148 -12.150 1.00 0.00 O ATOM 1980 CB ASN A 125 -12.961 -17.076 -11.148 1.00 0.00 C ATOM 1981 CG ASN A 125 -14.026 -18.132 -10.872 1.00 0.00 C ATOM 1982 OD1 ASN A 125 -14.332 -18.950 -11.740 1.00 0.00 O ATOM 1983 ND2 ASN A 125 -14.613 -18.163 -9.707 1.00 0.00 N ATOM 0 H ASN A 125 -11.422 -19.801 -11.769 1.00 0.00 H new ATOM 0 HA ASN A 125 -11.989 -17.933 -12.864 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -12.659 -16.599 -10.216 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -13.369 -16.294 -11.789 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -15.327 -18.866 -9.514 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -14.358 -17.485 -8.989 1.00 0.00 H new ATOM 1990 N ASN A 126 -10.795 -15.557 -11.316 1.00 0.00 N ATOM 1991 CA ASN A 126 -9.736 -14.558 -11.227 1.00 0.00 C ATOM 1992 C ASN A 126 -9.738 -13.890 -9.850 1.00 0.00 C ATOM 1993 O ASN A 126 -9.796 -12.665 -9.742 1.00 0.00 O ATOM 1994 CB ASN A 126 -9.933 -13.504 -12.318 1.00 0.00 C ATOM 1995 CG ASN A 126 -10.370 -14.170 -13.619 1.00 0.00 C ATOM 1996 OD1 ASN A 126 -10.011 -15.317 -13.881 1.00 0.00 O ATOM 1997 ND2 ASN A 126 -11.130 -13.512 -14.455 1.00 0.00 N ATOM 0 H ASN A 126 -11.709 -15.234 -11.000 1.00 0.00 H new ATOM 0 HA ASN A 126 -8.775 -15.053 -11.368 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.683 -12.779 -12.002 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -9.005 -12.955 -12.476 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.427 -13.950 -15.327 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -11.426 -12.561 -14.235 1.00 0.00 H new ATOM 2004 N GLN A 127 -9.663 -14.713 -8.797 1.00 0.00 N ATOM 2005 CA GLN A 127 -9.642 -14.204 -7.419 1.00 0.00 C ATOM 2006 C GLN A 127 -8.430 -14.759 -6.682 1.00 0.00 C ATOM 2007 O GLN A 127 -7.996 -15.881 -6.944 1.00 0.00 O ATOM 2008 CB GLN A 127 -10.924 -14.610 -6.692 1.00 0.00 C ATOM 2009 CG GLN A 127 -12.118 -13.922 -7.348 1.00 0.00 C ATOM 2010 CD GLN A 127 -13.411 -14.372 -6.680 1.00 0.00 C ATOM 2011 OE1 GLN A 127 -13.834 -13.784 -5.684 1.00 0.00 O ATOM 2012 NE2 GLN A 127 -14.066 -15.386 -7.170 1.00 0.00 N ATOM 0 H GLN A 127 -9.616 -15.729 -8.871 1.00 0.00 H new ATOM 0 HA GLN A 127 -9.578 -13.116 -7.443 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -11.049 -15.692 -6.728 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -10.862 -14.331 -5.640 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -12.014 -12.840 -7.266 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -12.146 -14.160 -8.411 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.713 -15.871 -7.995 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.932 -15.695 -6.729 1.00 0.00 H new ATOM 2021 N ILE A 128 -7.876 -13.962 -5.774 1.00 0.00 N ATOM 2022 CA ILE A 128 -6.694 -14.377 -5.015 1.00 0.00 C ATOM 2023 C ILE A 128 -6.919 -14.187 -3.521 1.00 0.00 C ATOM 2024 O ILE A 128 -7.286 -13.107 -3.077 1.00 0.00 O ATOM 2025 CB ILE A 128 -5.479 -13.549 -5.457 1.00 0.00 C ATOM 2026 CG1 ILE A 128 -5.387 -13.544 -6.993 1.00 0.00 C ATOM 2027 CG2 ILE A 128 -4.199 -14.158 -4.871 1.00 0.00 C ATOM 2028 CD1 ILE A 128 -4.320 -12.542 -7.441 1.00 0.00 C ATOM 0 H ILE A 128 -8.221 -13.030 -5.544 1.00 0.00 H new ATOM 0 HA ILE A 128 -6.512 -15.434 -5.210 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.592 -12.526 -5.097 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -5.138 -14.541 -7.356 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -6.352 -13.279 -7.424 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -3.338 -13.568 -5.186 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -4.261 -14.157 -3.783 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -4.087 -15.182 -5.227 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.257 -12.540 -8.529 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -4.588 -11.545 -7.091 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -3.355 -12.826 -7.022 1.00 0.00 H new ATOM 2040 N ALA A 129 -6.680 -15.241 -2.745 1.00 0.00 N ATOM 2041 CA ALA A 129 -6.843 -15.164 -1.292 1.00 0.00 C ATOM 2042 C ALA A 129 -5.494 -14.934 -0.637 1.00 0.00 C ATOM 2043 O ALA A 129 -4.642 -15.823 -0.610 1.00 0.00 O ATOM 2044 CB ALA A 129 -7.456 -16.457 -0.757 1.00 0.00 C ATOM 0 H ALA A 129 -6.376 -16.151 -3.091 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.509 -14.333 -1.058 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.571 -16.385 0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.432 -16.614 -1.216 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.803 -17.296 -0.997 1.00 0.00 H new ATOM 2050 N LEU A 130 -5.302 -13.734 -0.124 1.00 0.00 N ATOM 2051 CA LEU A 130 -4.057 -13.362 0.521 1.00 0.00 C ATOM 2052 C LEU A 130 -4.242 -13.277 2.033 1.00 0.00 C ATOM 2053 O LEU A 130 -4.931 -12.389 2.535 1.00 0.00 O ATOM 2054 CB LEU A 130 -3.624 -12.006 -0.021 1.00 0.00 C ATOM 2055 CG LEU A 130 -2.262 -11.576 0.593 1.00 0.00 C ATOM 2056 CD1 LEU A 130 -1.142 -11.731 -0.445 1.00 0.00 C ATOM 2057 CD2 LEU A 130 -2.350 -10.114 1.023 1.00 0.00 C ATOM 0 H LEU A 130 -6.002 -12.992 -0.142 1.00 0.00 H new ATOM 0 HA LEU A 130 -3.297 -14.115 0.313 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.540 -12.053 -1.107 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.384 -11.258 0.208 1.00 0.00 H new ATOM 0 HG LEU A 130 -2.040 -12.208 1.453 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -0.193 -11.427 -0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -1.079 -12.773 -0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -1.358 -11.103 -1.310 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -1.399 -9.804 1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -2.575 -9.493 0.156 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.140 -10.000 1.765 1.00 0.00 H new ATOM 2069 N ARG A 131 -3.617 -14.202 2.752 1.00 0.00 N ATOM 2070 CA ARG A 131 -3.713 -14.217 4.213 1.00 0.00 C ATOM 2071 C ARG A 131 -2.609 -13.357 4.824 1.00 0.00 C ATOM 2072 O ARG A 131 -1.490 -13.315 4.313 1.00 0.00 O ATOM 2073 CB ARG A 131 -3.592 -15.650 4.727 1.00 0.00 C ATOM 2074 CG ARG A 131 -3.945 -15.693 6.210 1.00 0.00 C ATOM 2075 CD ARG A 131 -3.712 -17.104 6.751 1.00 0.00 C ATOM 2076 NE ARG A 131 -4.763 -18.002 6.285 1.00 0.00 N ATOM 2077 CZ ARG A 131 -4.956 -19.186 6.857 1.00 0.00 C ATOM 2078 NH1 ARG A 131 -4.200 -19.562 7.852 1.00 0.00 N ATOM 2079 NH2 ARG A 131 -5.903 -19.973 6.423 1.00 0.00 N ATOM 0 H ARG A 131 -3.043 -14.946 2.355 1.00 0.00 H new ATOM 0 HA ARG A 131 -4.681 -13.810 4.504 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -4.257 -16.306 4.165 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.577 -16.018 4.573 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -3.336 -14.976 6.760 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -4.986 -15.404 6.355 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -2.739 -17.471 6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -3.696 -17.086 7.841 1.00 0.00 H new ATOM 0 HE ARG A 131 -5.359 -17.717 5.508 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -3.460 -18.947 8.191 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -4.349 -20.471 8.290 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -6.494 -19.679 5.645 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -6.052 -20.882 6.861 1.00 0.00 H new ATOM 2093 N TYR A 132 -2.931 -12.670 5.921 1.00 0.00 N ATOM 2094 CA TYR A 132 -1.953 -11.808 6.597 1.00 0.00 C ATOM 2095 C TYR A 132 -2.086 -11.931 8.111 1.00 0.00 C ATOM 2096 O TYR A 132 -3.158 -12.243 8.625 1.00 0.00 O ATOM 2097 CB TYR A 132 -2.171 -10.349 6.183 1.00 0.00 C ATOM 2098 CG TYR A 132 -1.165 -9.471 6.888 1.00 0.00 C ATOM 2099 CD1 TYR A 132 -1.392 -9.066 8.209 1.00 0.00 C ATOM 2100 CD2 TYR A 132 -0.006 -9.058 6.219 1.00 0.00 C ATOM 2101 CE1 TYR A 132 -0.458 -8.252 8.862 1.00 0.00 C ATOM 2102 CE2 TYR A 132 0.927 -8.244 6.872 1.00 0.00 C ATOM 2103 CZ TYR A 132 0.702 -7.841 8.194 1.00 0.00 C ATOM 2104 OH TYR A 132 1.624 -7.038 8.837 1.00 0.00 O ATOM 0 H TYR A 132 -3.852 -12.691 6.359 1.00 0.00 H new ATOM 0 HA TYR A 132 -0.952 -12.126 6.304 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -2.066 -10.246 5.103 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -3.184 -10.035 6.436 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -2.287 -9.381 8.724 1.00 0.00 H new ATOM 0 HD2 TYR A 132 0.168 -9.368 5.199 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -0.633 -7.941 9.881 1.00 0.00 H new ATOM 0 HE2 TYR A 132 1.821 -7.927 6.356 1.00 0.00 H new ATOM 0 HH TYR A 132 1.224 -6.667 9.651 1.00 0.00 H new ATOM 2114 N SER A 133 -0.989 -11.680 8.821 1.00 0.00 N ATOM 2115 CA SER A 133 -0.999 -11.763 10.276 1.00 0.00 C ATOM 2116 C SER A 133 0.174 -10.984 10.866 1.00 0.00 C ATOM 2117 O SER A 133 1.305 -11.096 10.392 1.00 0.00 O ATOM 2118 CB SER A 133 -0.911 -13.224 10.711 1.00 0.00 C ATOM 2119 OG SER A 133 0.455 -13.613 10.776 1.00 0.00 O ATOM 0 H SER A 133 -0.090 -11.420 8.415 1.00 0.00 H new ATOM 0 HA SER A 133 -1.929 -11.328 10.641 1.00 0.00 H new ATOM 0 HB2 SER A 133 -1.385 -13.355 11.684 1.00 0.00 H new ATOM 0 HB3 SER A 133 -1.449 -13.858 10.006 1.00 0.00 H new ATOM 0 HG SER A 133 0.515 -14.550 11.056 1.00 0.00 H new ATOM 2125 N SER A 134 -0.100 -10.201 11.908 1.00 0.00 N ATOM 2126 CA SER A 134 0.947 -9.416 12.558 1.00 0.00 C ATOM 2127 C SER A 134 0.393 -8.713 13.816 1.00 0.00 C ATOM 2128 O SER A 134 -0.686 -8.121 13.767 1.00 0.00 O ATOM 2129 CB SER A 134 1.485 -8.363 11.590 1.00 0.00 C ATOM 2130 OG SER A 134 0.686 -7.190 11.683 1.00 0.00 O ATOM 0 H SER A 134 -1.028 -10.094 12.317 1.00 0.00 H new ATOM 0 HA SER A 134 1.751 -10.091 12.851 1.00 0.00 H new ATOM 0 HB2 SER A 134 2.523 -8.130 11.828 1.00 0.00 H new ATOM 0 HB3 SER A 134 1.470 -8.748 10.570 1.00 0.00 H new ATOM 0 HG SER A 134 -0.084 -7.364 12.264 1.00 0.00 H new ATOM 2217 N CYS A 139 -2.117 -3.700 9.373 1.00 0.00 N ATOM 2218 CA CYS A 139 -2.543 -4.219 8.081 1.00 0.00 C ATOM 2219 C CYS A 139 -2.969 -3.079 7.160 1.00 0.00 C ATOM 2220 O CYS A 139 -2.811 -3.160 5.942 1.00 0.00 O ATOM 2221 CB CYS A 139 -3.710 -5.191 8.271 1.00 0.00 C ATOM 2222 SG CYS A 139 -4.881 -4.496 9.465 1.00 0.00 S ATOM 0 HA CYS A 139 -1.704 -4.744 7.624 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -4.208 -5.370 7.318 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.342 -6.154 8.624 1.00 0.00 H new ATOM 0 HG CYS A 139 -5.620 -5.448 9.953 1.00 0.00 H new ATOM 2228 N PHE A 140 -3.516 -2.019 7.750 1.00 0.00 N ATOM 2229 CA PHE A 140 -3.966 -0.873 6.970 1.00 0.00 C ATOM 2230 C PHE A 140 -2.891 -0.460 5.961 1.00 0.00 C ATOM 2231 O PHE A 140 -3.201 -0.003 4.861 1.00 0.00 O ATOM 2232 CB PHE A 140 -4.292 0.311 7.923 1.00 0.00 C ATOM 2233 CG PHE A 140 -5.727 0.770 7.726 1.00 0.00 C ATOM 2234 CD1 PHE A 140 -6.208 1.036 6.438 1.00 0.00 C ATOM 2235 CD2 PHE A 140 -6.571 0.926 8.833 1.00 0.00 C ATOM 2236 CE1 PHE A 140 -7.530 1.456 6.258 1.00 0.00 C ATOM 2237 CE2 PHE A 140 -7.891 1.345 8.652 1.00 0.00 C ATOM 2238 CZ PHE A 140 -8.372 1.610 7.364 1.00 0.00 C ATOM 0 H PHE A 140 -3.657 -1.931 8.756 1.00 0.00 H new ATOM 0 HA PHE A 140 -4.866 -1.148 6.420 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -4.140 0.005 8.958 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -3.609 1.139 7.732 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -5.558 0.917 5.584 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -6.201 0.722 9.827 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -7.901 1.661 5.265 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -8.541 1.465 9.506 1.00 0.00 H new ATOM 0 HZ PHE A 140 -9.393 1.933 7.225 1.00 0.00 H new ATOM 2248 N CYS A 141 -1.633 -0.632 6.345 1.00 0.00 N ATOM 2249 CA CYS A 141 -0.524 -0.280 5.470 1.00 0.00 C ATOM 2250 C CYS A 141 -0.380 -1.310 4.360 1.00 0.00 C ATOM 2251 O CYS A 141 -0.163 -0.964 3.198 1.00 0.00 O ATOM 2252 CB CYS A 141 0.773 -0.218 6.277 1.00 0.00 C ATOM 2253 SG CYS A 141 2.179 -0.051 5.149 1.00 0.00 S ATOM 0 H CYS A 141 -1.357 -1.011 7.251 1.00 0.00 H new ATOM 0 HA CYS A 141 -0.725 0.695 5.027 1.00 0.00 H new ATOM 0 HB2 CYS A 141 0.745 0.625 6.967 1.00 0.00 H new ATOM 0 HB3 CYS A 141 0.882 -1.119 6.880 1.00 0.00 H new ATOM 0 HG CYS A 141 3.282 0.004 5.835 1.00 0.00 H new ATOM 2259 N ALA A 142 -0.492 -2.582 4.729 1.00 0.00 N ATOM 2260 CA ALA A 142 -0.363 -3.665 3.759 1.00 0.00 C ATOM 2261 C ALA A 142 -1.336 -3.489 2.594 1.00 0.00 C ATOM 2262 O ALA A 142 -0.979 -3.733 1.442 1.00 0.00 O ATOM 2263 CB ALA A 142 -0.619 -5.006 4.438 1.00 0.00 C ATOM 0 H ALA A 142 -0.671 -2.887 5.686 1.00 0.00 H new ATOM 0 HA ALA A 142 0.653 -3.640 3.364 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -0.521 -5.809 3.707 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.106 -5.153 5.238 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -1.626 -5.016 4.855 1.00 0.00 H new ATOM 2269 N GLU A 143 -2.562 -3.070 2.892 1.00 0.00 N ATOM 2270 CA GLU A 143 -3.559 -2.876 1.842 1.00 0.00 C ATOM 2271 C GLU A 143 -3.070 -1.844 0.828 1.00 0.00 C ATOM 2272 O GLU A 143 -3.136 -2.068 -0.380 1.00 0.00 O ATOM 2273 CB GLU A 143 -4.891 -2.415 2.453 1.00 0.00 C ATOM 2274 CG GLU A 143 -5.639 -3.619 3.032 1.00 0.00 C ATOM 2275 CD GLU A 143 -6.843 -3.147 3.839 1.00 0.00 C ATOM 2276 OE1 GLU A 143 -6.999 -1.946 3.987 1.00 0.00 O ATOM 2277 OE2 GLU A 143 -7.593 -3.994 4.297 1.00 0.00 O ATOM 0 H GLU A 143 -2.887 -2.861 3.836 1.00 0.00 H new ATOM 0 HA GLU A 143 -3.712 -3.827 1.332 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -4.707 -1.679 3.235 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -5.501 -1.927 1.693 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -5.966 -4.276 2.226 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -4.971 -4.201 3.667 1.00 0.00 H new ATOM 2284 N GLY A 144 -2.586 -0.713 1.329 1.00 0.00 N ATOM 2285 CA GLY A 144 -2.097 0.349 0.458 1.00 0.00 C ATOM 2286 C GLY A 144 -1.077 -0.180 -0.548 1.00 0.00 C ATOM 2287 O GLY A 144 -1.143 0.138 -1.732 1.00 0.00 O ATOM 0 H GLY A 144 -2.522 -0.509 2.326 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -2.935 0.800 -0.074 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -1.642 1.135 1.061 1.00 0.00 H new ATOM 2291 N LEU A 145 -0.131 -0.981 -0.067 1.00 0.00 N ATOM 2292 CA LEU A 145 0.902 -1.538 -0.942 1.00 0.00 C ATOM 2293 C LEU A 145 0.276 -2.296 -2.112 1.00 0.00 C ATOM 2294 O LEU A 145 0.722 -2.171 -3.252 1.00 0.00 O ATOM 2295 CB LEU A 145 1.811 -2.492 -0.154 1.00 0.00 C ATOM 2296 CG LEU A 145 2.719 -1.699 0.802 1.00 0.00 C ATOM 2297 CD1 LEU A 145 3.376 -2.667 1.792 1.00 0.00 C ATOM 2298 CD2 LEU A 145 3.823 -0.968 0.004 1.00 0.00 C ATOM 0 H LEU A 145 -0.056 -1.258 0.912 1.00 0.00 H new ATOM 0 HA LEU A 145 1.492 -0.708 -1.331 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.204 -3.198 0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 145 2.420 -3.077 -0.843 1.00 0.00 H new ATOM 0 HG LEU A 145 2.117 -0.965 1.337 1.00 0.00 H new ATOM 0 HD11 LEU A 145 4.021 -2.110 2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 145 2.604 -3.182 2.364 1.00 0.00 H new ATOM 0 HD13 LEU A 145 3.971 -3.398 1.245 1.00 0.00 H new ATOM 0 HD21 LEU A 145 4.460 -0.410 0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 145 4.425 -1.698 -0.537 1.00 0.00 H new ATOM 0 HD23 LEU A 145 3.364 -0.280 -0.705 1.00 0.00 H new ATOM 2310 N LEU A 146 -0.747 -3.090 -1.820 1.00 0.00 N ATOM 2311 CA LEU A 146 -1.413 -3.875 -2.858 1.00 0.00 C ATOM 2312 C LEU A 146 -2.005 -2.974 -3.940 1.00 0.00 C ATOM 2313 O LEU A 146 -1.942 -3.299 -5.126 1.00 0.00 O ATOM 2314 CB LEU A 146 -2.525 -4.729 -2.239 1.00 0.00 C ATOM 2315 CG LEU A 146 -1.915 -5.810 -1.332 1.00 0.00 C ATOM 2316 CD1 LEU A 146 -3.032 -6.489 -0.534 1.00 0.00 C ATOM 2317 CD2 LEU A 146 -1.173 -6.869 -2.186 1.00 0.00 C ATOM 0 H LEU A 146 -1.132 -3.209 -0.883 1.00 0.00 H new ATOM 0 HA LEU A 146 -0.666 -4.522 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -3.201 -4.098 -1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -3.118 -5.195 -3.026 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.203 -5.344 -0.650 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.604 -7.257 0.111 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -3.545 -5.747 0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.743 -6.948 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.745 -7.629 -1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -1.875 -7.337 -2.876 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.376 -6.387 -2.752 1.00 0.00 H new ATOM 2329 N PHE A 147 -2.584 -1.848 -3.533 1.00 0.00 N ATOM 2330 CA PHE A 147 -3.184 -0.921 -4.489 1.00 0.00 C ATOM 2331 C PHE A 147 -2.110 -0.164 -5.269 1.00 0.00 C ATOM 2332 O PHE A 147 -2.284 0.138 -6.449 1.00 0.00 O ATOM 2333 CB PHE A 147 -4.074 0.081 -3.749 1.00 0.00 C ATOM 2334 CG PHE A 147 -5.317 -0.618 -3.245 1.00 0.00 C ATOM 2335 CD1 PHE A 147 -6.303 -1.030 -4.149 1.00 0.00 C ATOM 2336 CD2 PHE A 147 -5.483 -0.852 -1.873 1.00 0.00 C ATOM 2337 CE1 PHE A 147 -7.454 -1.677 -3.683 1.00 0.00 C ATOM 2338 CE2 PHE A 147 -6.633 -1.500 -1.407 1.00 0.00 C ATOM 2339 CZ PHE A 147 -7.619 -1.912 -2.312 1.00 0.00 C ATOM 0 H PHE A 147 -2.651 -1.557 -2.558 1.00 0.00 H new ATOM 0 HA PHE A 147 -3.782 -1.499 -5.193 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -3.528 0.520 -2.914 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -4.349 0.899 -4.415 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -6.176 -0.849 -5.206 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -4.723 -0.532 -1.175 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -8.215 -1.995 -4.381 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -6.760 -1.682 -0.350 1.00 0.00 H new ATOM 0 HZ PHE A 147 -8.507 -2.411 -1.953 1.00 0.00 H new ATOM 2349 N GLY A 148 -1.003 0.144 -4.601 1.00 0.00 N ATOM 2350 CA GLY A 148 0.087 0.870 -5.243 1.00 0.00 C ATOM 2351 C GLY A 148 0.601 0.115 -6.460 1.00 0.00 C ATOM 2352 O GLY A 148 0.896 0.712 -7.495 1.00 0.00 O ATOM 0 H GLY A 148 -0.837 -0.095 -3.623 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -0.257 1.860 -5.543 1.00 0.00 H new ATOM 0 HA3 GLY A 148 0.900 1.017 -4.532 1.00 0.00 H new ATOM 2356 N ALA A 149 0.705 -1.200 -6.328 1.00 0.00 N ATOM 2357 CA ALA A 149 1.185 -2.031 -7.422 1.00 0.00 C ATOM 2358 C ALA A 149 0.094 -2.215 -8.477 1.00 0.00 C ATOM 2359 O ALA A 149 0.385 -2.428 -9.653 1.00 0.00 O ATOM 2360 CB ALA A 149 1.622 -3.398 -6.881 1.00 0.00 C ATOM 0 H ALA A 149 0.465 -1.712 -5.479 1.00 0.00 H new ATOM 0 HA ALA A 149 2.037 -1.536 -7.888 1.00 0.00 H new ATOM 0 HB1 ALA A 149 1.981 -4.017 -7.703 1.00 0.00 H new ATOM 0 HB2 ALA A 149 2.422 -3.262 -6.153 1.00 0.00 H new ATOM 0 HB3 ALA A 149 0.774 -3.887 -6.401 1.00 0.00 H new ATOM 2366 N ALA A 150 -1.160 -2.126 -8.047 1.00 0.00 N ATOM 2367 CA ALA A 150 -2.286 -2.285 -8.965 1.00 0.00 C ATOM 2368 C ALA A 150 -2.331 -1.140 -9.975 1.00 0.00 C ATOM 2369 O ALA A 150 -2.365 -1.367 -11.184 1.00 0.00 O ATOM 2370 CB ALA A 150 -3.594 -2.318 -8.178 1.00 0.00 C ATOM 0 H ALA A 150 -1.423 -1.946 -7.078 1.00 0.00 H new ATOM 0 HA ALA A 150 -2.156 -3.223 -9.505 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -4.430 -2.437 -8.867 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -3.578 -3.155 -7.480 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -3.709 -1.386 -7.625 1.00 0.00 H new ATOM 2376 N GLN A 151 -2.328 0.088 -9.469 1.00 0.00 N ATOM 2377 CA GLN A 151 -2.367 1.260 -10.337 1.00 0.00 C ATOM 2378 C GLN A 151 -1.121 1.307 -11.216 1.00 0.00 C ATOM 2379 O GLN A 151 -1.204 1.535 -12.421 1.00 0.00 O ATOM 2380 CB GLN A 151 -2.448 2.534 -9.494 1.00 0.00 C ATOM 2381 CG GLN A 151 -3.739 2.522 -8.675 1.00 0.00 C ATOM 2382 CD GLN A 151 -3.848 3.802 -7.855 1.00 0.00 C ATOM 2383 OE1 GLN A 151 -2.951 4.118 -7.073 1.00 0.00 O ATOM 2384 NE2 GLN A 151 -4.899 4.564 -7.988 1.00 0.00 N ATOM 0 H GLN A 151 -2.299 0.298 -8.471 1.00 0.00 H new ATOM 0 HA GLN A 151 -3.250 1.193 -10.973 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -1.585 2.600 -8.831 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -2.422 3.412 -10.139 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -4.599 2.431 -9.338 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -3.752 1.655 -8.015 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -5.641 4.301 -8.636 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -4.978 5.423 -7.444 1.00 0.00 H new ATOM 2393 N HIS A 152 0.030 1.094 -10.595 1.00 0.00 N ATOM 2394 CA HIS A 152 1.298 1.116 -11.316 1.00 0.00 C ATOM 2395 C HIS A 152 1.182 0.376 -12.650 1.00 0.00 C ATOM 2396 O HIS A 152 1.883 0.697 -13.609 1.00 0.00 O ATOM 2397 CB HIS A 152 2.390 0.465 -10.465 1.00 0.00 C ATOM 2398 CG HIS A 152 3.738 0.763 -11.062 1.00 0.00 C ATOM 2399 ND1 HIS A 152 3.882 1.321 -12.323 1.00 0.00 N ATOM 2400 CD2 HIS A 152 5.013 0.586 -10.584 1.00 0.00 C ATOM 2401 CE1 HIS A 152 5.201 1.459 -12.557 1.00 0.00 C ATOM 2402 NE2 HIS A 152 5.934 1.025 -11.528 1.00 0.00 N ATOM 0 H HIS A 152 0.114 0.904 -9.596 1.00 0.00 H new ATOM 0 HA HIS A 152 1.558 2.155 -11.517 1.00 0.00 H new ATOM 0 HB2 HIS A 152 2.342 0.842 -9.443 1.00 0.00 H new ATOM 0 HB3 HIS A 152 2.233 -0.612 -10.415 1.00 0.00 H new ATOM 0 HD1 HIS A 152 3.127 1.580 -12.958 1.00 0.00 H new ATOM 0 HD2 HIS A 152 5.263 0.169 -9.620 1.00 0.00 H new ATOM 0 HE1 HIS A 152 5.616 1.870 -13.466 1.00 0.00 H new ATOM 2411 N PHE A 153 0.296 -0.625 -12.699 1.00 0.00 N ATOM 2412 CA PHE A 153 0.100 -1.419 -13.927 1.00 0.00 C ATOM 2413 C PHE A 153 -1.342 -1.305 -14.433 1.00 0.00 C ATOM 2414 O PHE A 153 -1.863 -2.228 -15.058 1.00 0.00 O ATOM 2415 CB PHE A 153 0.435 -2.892 -13.648 1.00 0.00 C ATOM 2416 CG PHE A 153 1.559 -2.966 -12.641 1.00 0.00 C ATOM 2417 CD1 PHE A 153 2.694 -2.158 -12.794 1.00 0.00 C ATOM 2418 CD2 PHE A 153 1.466 -3.838 -11.551 1.00 0.00 C ATOM 2419 CE1 PHE A 153 3.730 -2.223 -11.858 1.00 0.00 C ATOM 2420 CE2 PHE A 153 2.503 -3.903 -10.616 1.00 0.00 C ATOM 2421 CZ PHE A 153 3.636 -3.096 -10.769 1.00 0.00 C ATOM 0 H PHE A 153 -0.293 -0.906 -11.915 1.00 0.00 H new ATOM 0 HA PHE A 153 0.765 -1.029 -14.697 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.445 -3.411 -13.267 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.725 -3.392 -14.572 1.00 0.00 H new ATOM 0 HD1 PHE A 153 2.768 -1.485 -13.635 1.00 0.00 H new ATOM 0 HD2 PHE A 153 0.592 -4.461 -11.432 1.00 0.00 H new ATOM 0 HE1 PHE A 153 4.604 -1.599 -11.976 1.00 0.00 H new ATOM 0 HE2 PHE A 153 2.430 -4.576 -9.775 1.00 0.00 H new ATOM 0 HZ PHE A 153 4.437 -3.147 -10.047 1.00 0.00 H new ATOM 2431 N GLN A 154 -1.975 -0.167 -14.164 1.00 0.00 N ATOM 2432 CA GLN A 154 -3.354 0.061 -14.600 1.00 0.00 C ATOM 2433 C GLN A 154 -4.198 -1.208 -14.456 1.00 0.00 C ATOM 2434 O GLN A 154 -4.994 -1.537 -15.337 1.00 0.00 O ATOM 2435 CB GLN A 154 -3.369 0.525 -16.062 1.00 0.00 C ATOM 2436 CG GLN A 154 -4.697 1.231 -16.368 1.00 0.00 C ATOM 2437 CD GLN A 154 -4.659 2.666 -15.849 1.00 0.00 C ATOM 2438 OE1 GLN A 154 -3.881 3.483 -16.338 1.00 0.00 O ATOM 2439 NE2 GLN A 154 -5.458 3.020 -14.880 1.00 0.00 N ATOM 0 H GLN A 154 -1.560 0.610 -13.649 1.00 0.00 H new ATOM 0 HA GLN A 154 -3.785 0.834 -13.964 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -2.535 1.202 -16.247 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -3.239 -0.330 -16.726 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -4.880 1.229 -17.443 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -5.521 0.690 -15.904 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -6.102 2.340 -14.476 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -5.438 3.977 -14.526 1.00 0.00 H new ATOM 2448 N GLN A 155 -4.021 -1.914 -13.337 1.00 0.00 N ATOM 2449 CA GLN A 155 -4.770 -3.144 -13.079 1.00 0.00 C ATOM 2450 C GLN A 155 -5.705 -2.947 -11.886 1.00 0.00 C ATOM 2451 O GLN A 155 -5.339 -3.219 -10.747 1.00 0.00 O ATOM 2452 CB GLN A 155 -3.786 -4.290 -12.799 1.00 0.00 C ATOM 2453 CG GLN A 155 -4.547 -5.558 -12.399 1.00 0.00 C ATOM 2454 CD GLN A 155 -5.622 -5.885 -13.432 1.00 0.00 C ATOM 2455 OE1 GLN A 155 -5.327 -6.472 -14.473 1.00 0.00 O ATOM 2456 NE2 GLN A 155 -6.859 -5.536 -13.203 1.00 0.00 N ATOM 0 H GLN A 155 -3.368 -1.655 -12.598 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.371 -3.393 -13.953 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -3.182 -4.484 -13.685 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -3.100 -4.003 -12.002 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -3.853 -6.394 -12.311 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -5.005 -5.420 -11.420 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -7.100 -5.050 -12.339 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -7.584 -5.750 -13.888 1.00 0.00 H new ATOM 2465 N LYS A 156 -6.909 -2.456 -12.164 1.00 0.00 N ATOM 2466 CA LYS A 156 -7.892 -2.207 -11.110 1.00 0.00 C ATOM 2467 C LYS A 156 -8.254 -3.496 -10.377 1.00 0.00 C ATOM 2468 O LYS A 156 -8.413 -4.550 -10.991 1.00 0.00 O ATOM 2469 CB LYS A 156 -9.153 -1.590 -11.713 1.00 0.00 C ATOM 2470 CG LYS A 156 -8.773 -0.355 -12.533 1.00 0.00 C ATOM 2471 CD LYS A 156 -10.030 0.465 -12.839 1.00 0.00 C ATOM 2472 CE LYS A 156 -11.046 -0.407 -13.583 1.00 0.00 C ATOM 2473 NZ LYS A 156 -10.343 -1.223 -14.613 1.00 0.00 N ATOM 0 H LYS A 156 -7.228 -2.223 -13.104 1.00 0.00 H new ATOM 0 HA LYS A 156 -7.450 -1.516 -10.392 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -9.661 -2.318 -12.346 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -9.850 -1.314 -10.922 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -8.055 0.253 -11.982 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -8.289 -0.657 -13.462 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -10.466 0.839 -11.913 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -9.771 1.334 -13.443 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -11.565 -1.059 -12.880 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -11.802 0.220 -14.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -11.001 -1.446 -15.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -9.535 -0.687 -14.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -10.002 -2.106 -14.183 1.00 0.00 H new ATOM 2487 N ILE A 157 -8.383 -3.396 -9.052 1.00 0.00 N ATOM 2488 CA ILE A 157 -8.727 -4.553 -8.227 1.00 0.00 C ATOM 2489 C ILE A 157 -9.522 -4.123 -6.998 1.00 0.00 C ATOM 2490 O ILE A 157 -9.605 -2.935 -6.684 1.00 0.00 O ATOM 2491 CB ILE A 157 -7.456 -5.271 -7.768 1.00 0.00 C ATOM 2492 CG1 ILE A 157 -6.503 -4.268 -7.081 1.00 0.00 C ATOM 2493 CG2 ILE A 157 -6.756 -5.894 -8.977 1.00 0.00 C ATOM 2494 CD1 ILE A 157 -5.583 -5.019 -6.120 1.00 0.00 C ATOM 0 H ILE A 157 -8.255 -2.529 -8.530 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.335 -5.227 -8.831 1.00 0.00 H new ATOM 0 HB ILE A 157 -7.724 -6.053 -7.058 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -5.912 -3.740 -7.829 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -7.077 -3.516 -6.539 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -5.851 -6.405 -8.650 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -7.424 -6.610 -9.455 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -6.493 -5.111 -9.689 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -4.910 -4.313 -5.634 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -6.183 -5.527 -5.365 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -4.999 -5.754 -6.675 1.00 0.00 H new ATOM 2506 N GLN A 158 -10.091 -5.100 -6.298 1.00 0.00 N ATOM 2507 CA GLN A 158 -10.866 -4.827 -5.085 1.00 0.00 C ATOM 2508 C GLN A 158 -10.405 -5.747 -3.963 1.00 0.00 C ATOM 2509 O GLN A 158 -10.128 -6.916 -4.194 1.00 0.00 O ATOM 2510 CB GLN A 158 -12.357 -5.049 -5.354 1.00 0.00 C ATOM 2511 CG GLN A 158 -13.169 -4.591 -4.140 1.00 0.00 C ATOM 2512 CD GLN A 158 -14.650 -4.867 -4.370 1.00 0.00 C ATOM 2513 OE1 GLN A 158 -15.465 -4.681 -3.466 1.00 0.00 O ATOM 2514 NE2 GLN A 158 -15.050 -5.302 -5.533 1.00 0.00 N ATOM 0 H GLN A 158 -10.032 -6.087 -6.547 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.709 -3.790 -4.789 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.664 -4.494 -6.240 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.548 -6.103 -5.556 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.828 -5.113 -3.246 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.011 -3.526 -3.967 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -14.373 -5.455 -6.280 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -16.040 -5.489 -5.695 1.00 0.00 H new ATOM 2523 N ILE A 159 -10.320 -5.208 -2.743 1.00 0.00 N ATOM 2524 CA ILE A 159 -9.880 -6.011 -1.588 1.00 0.00 C ATOM 2525 C ILE A 159 -10.946 -6.055 -0.506 1.00 0.00 C ATOM 2526 O ILE A 159 -11.444 -5.020 -0.061 1.00 0.00 O ATOM 2527 CB ILE A 159 -8.577 -5.442 -1.004 1.00 0.00 C ATOM 2528 CG1 ILE A 159 -7.465 -5.568 -2.057 1.00 0.00 C ATOM 2529 CG2 ILE A 159 -8.189 -6.238 0.260 1.00 0.00 C ATOM 2530 CD1 ILE A 159 -6.136 -5.090 -1.471 1.00 0.00 C ATOM 0 H ILE A 159 -10.545 -4.237 -2.527 1.00 0.00 H new ATOM 0 HA ILE A 159 -9.705 -7.027 -1.942 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.715 -4.394 -0.737 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -7.377 -6.604 -2.383 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -7.717 -4.977 -2.938 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -7.265 -5.835 0.674 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.985 -6.156 1.000 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -8.043 -7.286 -0.001 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -5.353 -5.182 -2.223 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -6.226 -4.047 -1.167 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -5.880 -5.699 -0.604 1.00 0.00 H new ATOM 2542 N SER A 160 -11.276 -7.272 -0.075 1.00 0.00 N ATOM 2543 CA SER A 160 -12.271 -7.471 0.977 1.00 0.00 C ATOM 2544 C SER A 160 -11.581 -7.927 2.258 1.00 0.00 C ATOM 2545 O SER A 160 -11.198 -9.089 2.392 1.00 0.00 O ATOM 2546 CB SER A 160 -13.300 -8.515 0.538 1.00 0.00 C ATOM 2547 OG SER A 160 -14.185 -7.931 -0.412 1.00 0.00 O ATOM 0 H SER A 160 -10.869 -8.134 -0.438 1.00 0.00 H new ATOM 0 HA SER A 160 -12.785 -6.528 1.163 1.00 0.00 H new ATOM 0 HB2 SER A 160 -12.797 -9.378 0.101 1.00 0.00 H new ATOM 0 HB3 SER A 160 -13.860 -8.876 1.401 1.00 0.00 H new ATOM 0 HG SER A 160 -14.845 -8.597 -0.697 1.00 0.00 H new ATOM 2553 N HIS A 161 -11.418 -6.992 3.193 1.00 0.00 N ATOM 2554 CA HIS A 161 -10.759 -7.286 4.467 1.00 0.00 C ATOM 2555 C HIS A 161 -11.778 -7.374 5.602 1.00 0.00 C ATOM 2556 O HIS A 161 -12.006 -6.398 6.318 1.00 0.00 O ATOM 2557 CB HIS A 161 -9.736 -6.192 4.781 1.00 0.00 C ATOM 2558 CG HIS A 161 -8.910 -6.604 5.963 1.00 0.00 C ATOM 2559 ND1 HIS A 161 -7.850 -5.841 6.428 1.00 0.00 N ATOM 2560 CD2 HIS A 161 -8.973 -7.698 6.782 1.00 0.00 C ATOM 2561 CE1 HIS A 161 -7.325 -6.485 7.487 1.00 0.00 C ATOM 2562 NE2 HIS A 161 -7.972 -7.623 7.745 1.00 0.00 N ATOM 0 H HIS A 161 -11.732 -6.027 3.094 1.00 0.00 H new ATOM 0 HA HIS A 161 -10.256 -8.249 4.380 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -9.094 -6.021 3.917 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -10.246 -5.252 4.990 1.00 0.00 H new ATOM 0 HD1 HIS A 161 -7.527 -4.955 6.039 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -9.692 -8.499 6.694 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -6.482 -6.124 8.058 1.00 0.00 H new ATOM 2571 N ASP A 162 -12.385 -8.550 5.763 1.00 0.00 N ATOM 2572 CA ASP A 162 -13.377 -8.756 6.820 1.00 0.00 C ATOM 2573 C ASP A 162 -12.712 -9.297 8.082 1.00 0.00 C ATOM 2574 O ASP A 162 -13.118 -8.964 9.196 1.00 0.00 O ATOM 2575 CB ASP A 162 -14.456 -9.731 6.346 1.00 0.00 C ATOM 2576 CG ASP A 162 -15.221 -9.132 5.171 1.00 0.00 C ATOM 2577 OD1 ASP A 162 -15.036 -7.956 4.907 1.00 0.00 O ATOM 2578 OD2 ASP A 162 -15.981 -9.859 4.552 1.00 0.00 O ATOM 0 H ASP A 162 -12.210 -9.369 5.181 1.00 0.00 H new ATOM 0 HA ASP A 162 -13.837 -7.795 7.051 1.00 0.00 H new ATOM 0 HB2 ASP A 162 -13.999 -10.675 6.050 1.00 0.00 H new ATOM 0 HB3 ASP A 162 -15.143 -9.951 7.163 1.00 0.00 H new ATOM 2583 N THR A 163 -11.678 -10.125 7.908 1.00 0.00 N ATOM 2584 CA THR A 163 -10.962 -10.690 9.057 1.00 0.00 C ATOM 2585 C THR A 163 -9.690 -9.893 9.322 1.00 0.00 C ATOM 2586 O THR A 163 -8.844 -9.756 8.443 1.00 0.00 O ATOM 2587 CB THR A 163 -10.600 -12.156 8.793 1.00 0.00 C ATOM 2588 OG1 THR A 163 -11.713 -12.818 8.207 1.00 0.00 O ATOM 2589 CG2 THR A 163 -10.234 -12.840 10.115 1.00 0.00 C ATOM 0 H THR A 163 -11.321 -10.416 6.998 1.00 0.00 H new ATOM 0 HA THR A 163 -11.613 -10.636 9.930 1.00 0.00 H new ATOM 0 HB THR A 163 -9.749 -12.204 8.114 1.00 0.00 H new ATOM 0 HG1 THR A 163 -11.544 -13.783 8.182 1.00 0.00 H new ATOM 0 HG21 THR A 163 -9.977 -13.882 9.926 1.00 0.00 H new ATOM 0 HG22 THR A 163 -9.381 -12.331 10.564 1.00 0.00 H new ATOM 0 HG23 THR A 163 -11.084 -12.794 10.796 1.00 0.00 H new ATOM 2597 N CYS A 164 -9.565 -9.360 10.537 1.00 0.00 N ATOM 2598 CA CYS A 164 -8.386 -8.569 10.896 1.00 0.00 C ATOM 2599 C CYS A 164 -7.993 -8.797 12.351 1.00 0.00 C ATOM 2600 O CYS A 164 -8.843 -8.813 13.242 1.00 0.00 O ATOM 2601 CB CYS A 164 -8.673 -7.082 10.675 1.00 0.00 C ATOM 2602 SG CYS A 164 -7.117 -6.158 10.687 1.00 0.00 S ATOM 0 H CYS A 164 -10.255 -9.459 11.281 1.00 0.00 H new ATOM 0 HA CYS A 164 -7.559 -8.886 10.260 1.00 0.00 H new ATOM 0 HB2 CYS A 164 -9.187 -6.937 9.725 1.00 0.00 H new ATOM 0 HB3 CYS A 164 -9.336 -6.709 11.456 1.00 0.00 H new ATOM 0 HG CYS A 164 -7.181 -5.189 9.822 1.00 0.00 H new ATOM 2608 N MET A 165 -6.695 -8.964 12.579 1.00 0.00 N ATOM 2609 CA MET A 165 -6.180 -9.178 13.926 1.00 0.00 C ATOM 2610 C MET A 165 -6.630 -8.049 14.848 1.00 0.00 C ATOM 2611 O MET A 165 -6.686 -8.212 16.068 1.00 0.00 O ATOM 2612 CB MET A 165 -4.641 -9.243 13.880 1.00 0.00 C ATOM 2613 CG MET A 165 -4.052 -9.107 15.296 1.00 0.00 C ATOM 2614 SD MET A 165 -4.922 -10.219 16.429 1.00 0.00 S ATOM 2615 CE MET A 165 -3.921 -9.876 17.897 1.00 0.00 C ATOM 0 H MET A 165 -5.982 -8.955 11.850 1.00 0.00 H new ATOM 0 HA MET A 165 -6.570 -10.118 14.315 1.00 0.00 H new ATOM 0 HB2 MET A 165 -4.324 -10.187 13.437 1.00 0.00 H new ATOM 0 HB3 MET A 165 -4.257 -8.447 13.242 1.00 0.00 H new ATOM 0 HG2 MET A 165 -2.989 -9.346 15.282 1.00 0.00 H new ATOM 0 HG3 MET A 165 -4.143 -8.077 15.641 1.00 0.00 H new ATOM 0 HE1 MET A 165 -4.289 -10.468 18.735 1.00 0.00 H new ATOM 0 HE2 MET A 165 -2.882 -10.137 17.698 1.00 0.00 H new ATOM 0 HE3 MET A 165 -3.988 -8.816 18.144 1.00 0.00 H new ATOM 2625 N HIS A 166 -6.941 -6.905 14.258 1.00 0.00 N ATOM 2626 CA HIS A 166 -7.374 -5.751 15.030 1.00 0.00 C ATOM 2627 C HIS A 166 -8.722 -6.007 15.701 1.00 0.00 C ATOM 2628 O HIS A 166 -9.089 -5.311 16.647 1.00 0.00 O ATOM 2629 CB HIS A 166 -7.481 -4.527 14.119 1.00 0.00 C ATOM 2630 CG HIS A 166 -7.639 -3.291 14.958 1.00 0.00 C ATOM 2631 ND1 HIS A 166 -6.796 -3.012 16.022 1.00 0.00 N ATOM 2632 CD2 HIS A 166 -8.533 -2.252 14.905 1.00 0.00 C ATOM 2633 CE1 HIS A 166 -7.198 -1.846 16.562 1.00 0.00 C ATOM 2634 NE2 HIS A 166 -8.254 -1.341 15.917 1.00 0.00 N ATOM 0 H HIS A 166 -6.902 -6.751 13.250 1.00 0.00 H new ATOM 0 HA HIS A 166 -6.633 -5.569 15.808 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -6.590 -4.445 13.496 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -8.332 -4.634 13.446 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -9.333 -2.156 14.186 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -6.725 -1.376 17.412 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -8.749 -0.473 16.123 1.00 0.00 H new ATOM 2643 N THR A 167 -9.468 -7.002 15.205 1.00 0.00 N ATOM 2644 CA THR A 167 -10.783 -7.320 15.778 1.00 0.00 C ATOM 2645 C THR A 167 -10.701 -8.540 16.699 1.00 0.00 C ATOM 2646 O THR A 167 -11.706 -9.203 16.957 1.00 0.00 O ATOM 2647 CB THR A 167 -11.793 -7.584 14.647 1.00 0.00 C ATOM 2648 OG1 THR A 167 -11.510 -6.722 13.554 1.00 0.00 O ATOM 2649 CG2 THR A 167 -13.218 -7.322 15.147 1.00 0.00 C ATOM 0 H THR A 167 -9.190 -7.593 14.421 1.00 0.00 H new ATOM 0 HA THR A 167 -11.114 -6.468 16.371 1.00 0.00 H new ATOM 0 HB THR A 167 -11.712 -8.623 14.328 1.00 0.00 H new ATOM 0 HG1 THR A 167 -12.151 -6.889 12.831 1.00 0.00 H new ATOM 0 HG21 THR A 167 -13.927 -7.511 14.341 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.437 -7.983 15.985 1.00 0.00 H new ATOM 0 HG23 THR A 167 -13.305 -6.285 15.471 1.00 0.00 H new ATOM 2657 N GLY A 168 -9.503 -8.823 17.200 1.00 0.00 N ATOM 2658 CA GLY A 168 -9.307 -9.958 18.104 1.00 0.00 C ATOM 2659 C GLY A 168 -9.003 -11.244 17.339 1.00 0.00 C ATOM 2660 O GLY A 168 -8.498 -12.208 17.913 1.00 0.00 O ATOM 0 H GLY A 168 -8.658 -8.289 16.999 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -8.488 -9.740 18.789 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -10.201 -10.098 18.711 1.00 0.00 H new ATOM 2664 N ALA A 169 -9.307 -11.257 16.045 1.00 0.00 N ATOM 2665 CA ALA A 169 -9.051 -12.442 15.231 1.00 0.00 C ATOM 2666 C ALA A 169 -7.590 -12.859 15.368 1.00 0.00 C ATOM 2667 O ALA A 169 -6.724 -12.026 15.610 1.00 0.00 O ATOM 2668 CB ALA A 169 -9.372 -12.156 13.762 1.00 0.00 C ATOM 0 H ALA A 169 -9.725 -10.474 15.543 1.00 0.00 H new ATOM 0 HA ALA A 169 -9.691 -13.252 15.580 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -9.177 -13.048 13.167 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -10.422 -11.879 13.666 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.746 -11.338 13.406 1.00 0.00 H new ATOM 2674 N ASP A 170 -7.320 -14.154 15.221 1.00 0.00 N ATOM 2675 CA ASP A 170 -5.949 -14.652 15.339 1.00 0.00 C ATOM 2676 C ASP A 170 -5.207 -14.483 14.020 1.00 0.00 C ATOM 2677 O ASP A 170 -4.032 -14.834 13.907 1.00 0.00 O ATOM 2678 CB ASP A 170 -5.960 -16.128 15.740 1.00 0.00 C ATOM 2679 CG ASP A 170 -4.539 -16.601 16.027 1.00 0.00 C ATOM 2680 OD1 ASP A 170 -3.658 -15.759 16.090 1.00 0.00 O ATOM 2681 OD2 ASP A 170 -4.353 -17.796 16.181 1.00 0.00 O ATOM 0 H ASP A 170 -8.020 -14.869 15.023 1.00 0.00 H new ATOM 0 HA ASP A 170 -5.436 -14.075 16.108 1.00 0.00 H new ATOM 0 HB2 ASP A 170 -6.584 -16.269 16.622 1.00 0.00 H new ATOM 0 HB3 ASP A 170 -6.397 -16.727 14.941 1.00 0.00 H new ATOM 2686 N HIS A 171 -5.901 -13.944 13.027 1.00 0.00 N ATOM 2687 CA HIS A 171 -5.304 -13.729 11.716 1.00 0.00 C ATOM 2688 C HIS A 171 -6.153 -12.761 10.902 1.00 0.00 C ATOM 2689 O HIS A 171 -7.087 -12.151 11.423 1.00 0.00 O ATOM 2690 CB HIS A 171 -5.185 -15.058 10.971 1.00 0.00 C ATOM 2691 CG HIS A 171 -6.559 -15.619 10.722 1.00 0.00 C ATOM 2692 ND1 HIS A 171 -6.991 -15.983 9.456 1.00 0.00 N ATOM 2693 CD2 HIS A 171 -7.607 -15.884 11.567 1.00 0.00 C ATOM 2694 CE1 HIS A 171 -8.252 -16.441 9.575 1.00 0.00 C ATOM 2695 NE2 HIS A 171 -8.674 -16.402 10.843 1.00 0.00 N ATOM 0 H HIS A 171 -6.874 -13.649 13.103 1.00 0.00 H new ATOM 0 HA HIS A 171 -4.310 -13.302 11.852 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -4.664 -14.911 10.025 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.593 -15.763 11.555 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -7.603 -15.715 12.634 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -8.849 -16.796 8.748 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -9.584 -16.691 11.202 1.00 0.00 H new ATOM 2704 N CYS A 172 -5.826 -12.627 9.619 1.00 0.00 N ATOM 2705 CA CYS A 172 -6.570 -11.726 8.735 1.00 0.00 C ATOM 2706 C CYS A 172 -6.843 -12.400 7.397 1.00 0.00 C ATOM 2707 O CYS A 172 -6.153 -13.347 7.017 1.00 0.00 O ATOM 2708 CB CYS A 172 -5.774 -10.440 8.511 1.00 0.00 C ATOM 2709 SG CYS A 172 -5.072 -9.882 10.083 1.00 0.00 S ATOM 0 H CYS A 172 -5.058 -13.125 9.169 1.00 0.00 H new ATOM 0 HA CYS A 172 -7.522 -11.483 9.208 1.00 0.00 H new ATOM 0 HB2 CYS A 172 -4.978 -10.614 7.787 1.00 0.00 H new ATOM 0 HB3 CYS A 172 -6.421 -9.667 8.095 1.00 0.00 H new ATOM 0 HG CYS A 172 -4.394 -8.790 9.892 1.00 0.00 H new ATOM 2715 N MET A 173 -7.859 -11.909 6.682 1.00 0.00 N ATOM 2716 CA MET A 173 -8.218 -12.479 5.380 1.00 0.00 C ATOM 2717 C MET A 173 -8.474 -11.374 4.358 1.00 0.00 C ATOM 2718 O MET A 173 -9.466 -10.651 4.450 1.00 0.00 O ATOM 2719 CB MET A 173 -9.474 -13.344 5.523 1.00 0.00 C ATOM 2720 CG MET A 173 -9.904 -13.850 4.151 1.00 0.00 C ATOM 2721 SD MET A 173 -11.118 -15.177 4.347 1.00 0.00 S ATOM 2722 CE MET A 173 -12.437 -14.173 5.075 1.00 0.00 C ATOM 0 H MET A 173 -8.442 -11.126 6.978 1.00 0.00 H new ATOM 0 HA MET A 173 -7.387 -13.092 5.031 1.00 0.00 H new ATOM 0 HB2 MET A 173 -9.275 -14.186 6.186 1.00 0.00 H new ATOM 0 HB3 MET A 173 -10.278 -12.764 5.976 1.00 0.00 H new ATOM 0 HG2 MET A 173 -10.333 -13.034 3.569 1.00 0.00 H new ATOM 0 HG3 MET A 173 -9.038 -14.214 3.599 1.00 0.00 H new ATOM 0 HE1 MET A 173 -13.405 -14.550 4.746 1.00 0.00 H new ATOM 0 HE2 MET A 173 -12.377 -14.226 6.162 1.00 0.00 H new ATOM 0 HE3 MET A 173 -12.324 -13.137 4.756 1.00 0.00 H new ATOM 2732 N LEU A 174 -7.578 -11.255 3.376 1.00 0.00 N ATOM 2733 CA LEU A 174 -7.720 -10.237 2.324 1.00 0.00 C ATOM 2734 C LEU A 174 -7.917 -10.914 0.971 1.00 0.00 C ATOM 2735 O LEU A 174 -7.025 -11.589 0.475 1.00 0.00 O ATOM 2736 CB LEU A 174 -6.458 -9.340 2.280 1.00 0.00 C ATOM 2737 CG LEU A 174 -6.662 -8.097 3.159 1.00 0.00 C ATOM 2738 CD1 LEU A 174 -6.791 -8.516 4.627 1.00 0.00 C ATOM 2739 CD2 LEU A 174 -5.459 -7.157 2.999 1.00 0.00 C ATOM 0 H LEU A 174 -6.751 -11.845 3.284 1.00 0.00 H new ATOM 0 HA LEU A 174 -8.589 -9.618 2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -5.591 -9.902 2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -6.252 -9.039 1.253 1.00 0.00 H new ATOM 0 HG LEU A 174 -7.572 -7.583 2.851 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -6.936 -7.631 5.247 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -7.646 -9.183 4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -5.884 -9.033 4.939 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -5.602 -6.274 3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -4.550 -7.674 3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -5.370 -6.854 1.956 1.00 0.00 H new ATOM 2751 N ILE A 175 -9.092 -10.726 0.383 1.00 0.00 N ATOM 2752 CA ILE A 175 -9.397 -11.330 -0.922 1.00 0.00 C ATOM 2753 C ILE A 175 -9.301 -10.277 -2.020 1.00 0.00 C ATOM 2754 O ILE A 175 -10.039 -9.295 -2.009 1.00 0.00 O ATOM 2755 CB ILE A 175 -10.807 -11.919 -0.902 1.00 0.00 C ATOM 2756 CG1 ILE A 175 -11.015 -12.732 0.386 1.00 0.00 C ATOM 2757 CG2 ILE A 175 -11.005 -12.823 -2.119 1.00 0.00 C ATOM 2758 CD1 ILE A 175 -9.900 -13.773 0.537 1.00 0.00 C ATOM 0 H ILE A 175 -9.847 -10.167 0.779 1.00 0.00 H new ATOM 0 HA ILE A 175 -8.676 -12.122 -1.122 1.00 0.00 H new ATOM 0 HB ILE A 175 -11.534 -11.107 -0.934 1.00 0.00 H new ATOM 0 HG12 ILE A 175 -11.021 -12.066 1.249 1.00 0.00 H new ATOM 0 HG13 ILE A 175 -11.985 -13.228 0.360 1.00 0.00 H new ATOM 0 HG21 ILE A 175 -12.011 -13.241 -2.102 1.00 0.00 H new ATOM 0 HG22 ILE A 175 -10.870 -12.241 -3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 175 -10.275 -13.632 -2.094 1.00 0.00 H new ATOM 0 HD11 ILE A 175 -10.057 -14.344 1.452 1.00 0.00 H new ATOM 0 HD12 ILE A 175 -9.914 -14.448 -0.318 1.00 0.00 H new ATOM 0 HD13 ILE A 175 -8.935 -13.268 0.585 1.00 0.00 H new ATOM 2770 N ILE A 176 -8.384 -10.484 -2.965 1.00 0.00 N ATOM 2771 CA ILE A 176 -8.197 -9.535 -4.060 1.00 0.00 C ATOM 2772 C ILE A 176 -8.901 -10.017 -5.321 1.00 0.00 C ATOM 2773 O ILE A 176 -8.426 -10.926 -6.001 1.00 0.00 O ATOM 2774 CB ILE A 176 -6.697 -9.352 -4.348 1.00 0.00 C ATOM 2775 CG1 ILE A 176 -5.930 -9.052 -3.017 1.00 0.00 C ATOM 2776 CG2 ILE A 176 -6.507 -8.185 -5.332 1.00 0.00 C ATOM 2777 CD1 ILE A 176 -5.102 -10.274 -2.604 1.00 0.00 C ATOM 0 H ILE A 176 -7.764 -11.294 -2.994 1.00 0.00 H new ATOM 0 HA ILE A 176 -8.630 -8.581 -3.760 1.00 0.00 H new ATOM 0 HB ILE A 176 -6.299 -10.267 -4.786 1.00 0.00 H new ATOM 0 HG12 ILE A 176 -5.278 -8.188 -3.150 1.00 0.00 H new ATOM 0 HG13 ILE A 176 -6.638 -8.799 -2.228 1.00 0.00 H new ATOM 0 HG21 ILE A 176 -5.445 -8.052 -5.538 1.00 0.00 H new ATOM 0 HG22 ILE A 176 -7.033 -8.404 -6.261 1.00 0.00 H new ATOM 0 HG23 ILE A 176 -6.908 -7.271 -4.894 1.00 0.00 H new ATOM 0 HD11 ILE A 176 -4.571 -10.057 -1.677 1.00 0.00 H new ATOM 0 HD12 ILE A 176 -5.763 -11.127 -2.453 1.00 0.00 H new ATOM 0 HD13 ILE A 176 -4.382 -10.508 -3.388 1.00 0.00 H new ATOM 2789 N GLU A 177 -10.032 -9.393 -5.633 1.00 0.00 N ATOM 2790 CA GLU A 177 -10.791 -9.754 -6.823 1.00 0.00 C ATOM 2791 C GLU A 177 -10.241 -9.009 -8.032 1.00 0.00 C ATOM 2792 O GLU A 177 -10.063 -7.791 -7.992 1.00 0.00 O ATOM 2793 CB GLU A 177 -12.270 -9.400 -6.626 1.00 0.00 C ATOM 2794 CG GLU A 177 -13.073 -9.816 -7.863 1.00 0.00 C ATOM 2795 CD GLU A 177 -14.554 -9.527 -7.643 1.00 0.00 C ATOM 2796 OE1 GLU A 177 -14.878 -8.940 -6.624 1.00 0.00 O ATOM 2797 OE2 GLU A 177 -15.342 -9.896 -8.498 1.00 0.00 O ATOM 0 H GLU A 177 -10.441 -8.639 -5.081 1.00 0.00 H new ATOM 0 HA GLU A 177 -10.700 -10.827 -6.991 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -12.659 -9.905 -5.742 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -12.377 -8.329 -6.455 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -12.714 -9.275 -8.739 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -12.927 -10.878 -8.062 1.00 0.00 H new ATOM 2804 N LEU A 178 -9.965 -9.742 -9.103 1.00 0.00 N ATOM 2805 CA LEU A 178 -9.426 -9.135 -10.319 1.00 0.00 C ATOM 2806 C LEU A 178 -10.553 -8.797 -11.288 1.00 0.00 C ATOM 2807 O LEU A 178 -11.360 -9.658 -11.636 1.00 0.00 O ATOM 2808 CB LEU A 178 -8.449 -10.100 -10.999 1.00 0.00 C ATOM 2809 CG LEU A 178 -7.413 -10.608 -9.981 1.00 0.00 C ATOM 2810 CD1 LEU A 178 -6.751 -11.874 -10.521 1.00 0.00 C ATOM 2811 CD2 LEU A 178 -6.340 -9.535 -9.749 1.00 0.00 C ATOM 0 H LEU A 178 -10.103 -10.751 -9.157 1.00 0.00 H new ATOM 0 HA LEU A 178 -8.903 -8.219 -10.043 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -8.995 -10.942 -11.425 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -7.944 -9.597 -11.824 1.00 0.00 H new ATOM 0 HG LEU A 178 -7.914 -10.827 -9.038 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -6.017 -12.236 -9.801 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -7.509 -12.640 -10.682 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -6.254 -11.650 -11.465 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -5.610 -9.901 -9.027 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -5.839 -9.312 -10.691 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -6.808 -8.629 -9.364 1.00 0.00 H new ATOM 2823 N GLN A 179 -10.603 -7.541 -11.720 1.00 0.00 N ATOM 2824 CA GLN A 179 -11.642 -7.106 -12.650 1.00 0.00 C ATOM 2825 C GLN A 179 -11.239 -7.408 -14.089 1.00 0.00 C ATOM 2826 O GLN A 179 -10.063 -7.336 -14.446 1.00 0.00 O ATOM 2827 CB GLN A 179 -11.888 -5.604 -12.493 1.00 0.00 C ATOM 2828 CG GLN A 179 -12.454 -5.324 -11.101 1.00 0.00 C ATOM 2829 CD GLN A 179 -12.906 -3.871 -11.006 1.00 0.00 C ATOM 2830 OE1 GLN A 179 -13.420 -3.446 -9.971 1.00 0.00 O ATOM 2831 NE2 GLN A 179 -12.745 -3.079 -12.031 1.00 0.00 N ATOM 0 H GLN A 179 -9.944 -6.812 -11.445 1.00 0.00 H new ATOM 0 HA GLN A 179 -12.557 -7.652 -12.420 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -10.957 -5.055 -12.636 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -12.584 -5.257 -13.257 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -13.294 -5.989 -10.900 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -11.697 -5.529 -10.344 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -12.319 -3.433 -12.887 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -13.045 -2.106 -11.976 1.00 0.00 H new