USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 0 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 74 SER OG : rot -134:sc= 0.0135 USER MOD Set 1.2: A 86 SER OG : rot 180:sc= 0.0176 USER MOD Set 2.1: A 8 MET CE :methyl 145:sc= -6.85! (180deg=-11.6!) USER MOD Set 2.2: A 73 TYR OH : rot 103:sc= 0.66 USER MOD Set 3.1: A 17 HIS :FLIP no HD1:sc= -0.455 F(o=-2.5,f=-1.2) USER MOD Set 3.2: A 20 MET CE :methyl -150:sc= -0.723 (180deg=-1.99!) USER MOD Single : A 1 ALA N :NH3+ -138:sc= -1.25 (180deg=-3.72!) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc=-0.00982 K(o=-0.0098,f=-0.61) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 25 TYR OH : rot 57:sc= 0.778 USER MOD Single : A 28 TYR OH : rot 130:sc= -0.269 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-2.7!) USER MOD Single : A 50 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.3!) USER MOD Single : A 52 TYR OH : rot 53:sc= 0.434 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= 0.00829 X(o=0.0083,f=0) USER MOD Single : A 60 SER OG : rot -120:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.0528 X(o=-0.053,f=-0.067) USER MOD Single : A 69 TYR OH : rot 130:sc= -0.394 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0253 USER MOD Single : A 72 SER OG : rot -94:sc= -0.896 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= -0.182 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 80 THR OG1 : rot 82:sc= 0.568 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.56 K(o=-0.56,f=-2.6) USER MOD Single : A 87 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.289) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot 84:sc= 0.233 USER MOD Single : A 108 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.356) USER MOD Single : A 111 TYR OH : rot 27:sc= 0.444 USER MOD Single : A 112 ASN : amide:sc= -0.0867 X(o=-0.087,f=-0.087) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 HIS : no HD1:sc= -3.21! C(o=-3.2!,f=-7.3!) USER MOD Single : A 116 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.623) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot 48:sc= 0.147 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ -142:sc= 0.297 (180deg=0.00167) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.713 1.445 3.828 1.00 0.00 N ATOM 2 CA ALA A 1 -8.163 2.564 4.617 1.00 0.00 C ATOM 3 C ALA A 1 -6.654 2.458 4.746 1.00 0.00 C ATOM 4 O ALA A 1 -6.095 1.370 4.906 1.00 0.00 O ATOM 5 CB ALA A 1 -8.737 2.669 6.032 1.00 0.00 C ATOM 0 H1 ALA A 1 -9.442 1.803 3.179 1.00 0.00 H new ATOM 0 H2 ALA A 1 -7.950 0.999 3.280 1.00 0.00 H new ATOM 0 H3 ALA A 1 -9.135 0.743 4.469 1.00 0.00 H new ATOM 0 HA ALA A 1 -8.452 3.455 4.060 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.283 3.515 6.547 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.816 2.814 5.977 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -8.522 1.752 6.581 1.00 0.00 H new ATOM 6 N LEU A 2 -6.005 3.617 4.722 1.00 0.00 N ATOM 7 CA LEU A 2 -4.551 3.698 4.752 1.00 0.00 C ATOM 8 C LEU A 2 -3.961 3.866 6.163 1.00 0.00 C ATOM 9 O LEU A 2 -3.046 3.117 6.467 1.00 0.00 O ATOM 10 CB LEU A 2 -4.201 4.848 3.823 1.00 0.00 C ATOM 11 CG LEU A 2 -2.680 5.003 3.617 1.00 0.00 C ATOM 12 CD1 LEU A 2 -2.199 4.649 2.222 1.00 0.00 C ATOM 13 CD2 LEU A 2 -2.314 6.402 4.069 1.00 0.00 C ATOM 0 H LEU A 2 -6.471 4.523 4.681 1.00 0.00 H new ATOM 0 HA LEU A 2 -4.106 2.759 4.422 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.680 4.689 2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.605 5.775 4.230 1.00 0.00 H new ATOM 0 HG LEU A 2 -2.148 4.270 4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -1.119 4.786 2.164 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -2.445 3.610 2.005 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -2.687 5.297 1.494 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.243 6.557 3.941 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -2.860 7.132 3.472 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.575 6.525 5.120 1.00 0.00 H new ATOM 14 N TRP A 3 -4.378 4.830 7.013 1.00 0.00 N ATOM 15 CA TRP A 3 -3.914 4.862 8.441 1.00 0.00 C ATOM 16 C TRP A 3 -4.196 3.543 9.216 1.00 0.00 C ATOM 17 O TRP A 3 -3.352 3.111 10.007 1.00 0.00 O ATOM 18 CB TRP A 3 -4.445 6.078 9.241 1.00 0.00 C ATOM 19 CG TRP A 3 -5.984 6.095 9.546 1.00 0.00 C ATOM 20 CD1 TRP A 3 -6.645 5.402 10.594 1.00 0.00 C ATOM 21 CD2 TRP A 3 -7.008 6.473 8.693 1.00 0.00 C ATOM 22 NE1 TRP A 3 -8.035 5.374 10.432 1.00 0.00 N ATOM 23 CE2 TRP A 3 -8.236 5.982 9.220 1.00 0.00 C ATOM 24 CE3 TRP A 3 -6.956 6.968 7.371 1.00 0.00 C ATOM 25 CZ2 TRP A 3 -9.385 5.939 8.392 1.00 0.00 C ATOM 26 CZ3 TRP A 3 -8.119 7.020 6.621 1.00 0.00 C ATOM 27 CH2 TRP A 3 -9.322 6.498 7.122 1.00 0.00 C ATOM 0 H TRP A 3 -5.017 5.582 6.757 1.00 0.00 H new ATOM 0 HA TRP A 3 -2.833 4.972 8.358 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -3.909 6.124 10.189 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -4.196 6.985 8.690 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -6.131 4.945 11.427 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -8.735 4.991 11.067 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -6.019 7.302 6.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -10.296 5.478 8.743 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -8.100 7.468 5.638 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -10.212 6.532 6.511 1.00 0.00 H new ATOM 28 N GLN A 4 -5.370 2.926 8.958 1.00 0.00 N ATOM 29 CA GLN A 4 -5.680 1.599 9.480 1.00 0.00 C ATOM 30 C GLN A 4 -4.906 0.460 8.761 1.00 0.00 C ATOM 31 O GLN A 4 -4.684 -0.541 9.449 1.00 0.00 O ATOM 32 CB GLN A 4 -7.189 1.311 9.556 1.00 0.00 C ATOM 33 CG GLN A 4 -7.860 1.783 10.858 1.00 0.00 C ATOM 34 CD GLN A 4 -9.359 1.489 10.888 1.00 0.00 C ATOM 35 OE1 GLN A 4 -10.132 2.020 10.090 1.00 0.00 O ATOM 36 NE2 GLN A 4 -9.810 0.657 11.811 1.00 0.00 N ATOM 0 H GLN A 4 -6.112 3.335 8.390 1.00 0.00 H new ATOM 0 HA GLN A 4 -5.319 1.614 10.508 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -7.682 1.793 8.712 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -7.348 0.238 9.448 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.381 1.295 11.707 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.702 2.855 10.976 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.161 0.223 12.467 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -10.807 0.449 11.867 1.00 0.00 H new ATOM 37 N PHE A 5 -4.484 0.562 7.448 1.00 0.00 N ATOM 38 CA PHE A 5 -3.547 -0.459 6.878 1.00 0.00 C ATOM 39 C PHE A 5 -2.110 -0.306 7.388 1.00 0.00 C ATOM 40 O PHE A 5 -1.488 -1.296 7.744 1.00 0.00 O ATOM 41 CB PHE A 5 -3.725 -0.867 5.410 1.00 0.00 C ATOM 42 CG PHE A 5 -2.679 -0.521 4.345 1.00 0.00 C ATOM 43 CD1 PHE A 5 -2.335 0.794 4.103 1.00 0.00 C ATOM 44 CD2 PHE A 5 -2.064 -1.510 3.569 1.00 0.00 C ATOM 45 CE1 PHE A 5 -1.434 1.129 3.099 1.00 0.00 C ATOM 46 CE2 PHE A 5 -1.203 -1.176 2.518 1.00 0.00 C ATOM 47 CZ PHE A 5 -0.887 0.150 2.286 1.00 0.00 C ATOM 0 H PHE A 5 -4.764 1.301 6.803 1.00 0.00 H new ATOM 0 HA PHE A 5 -3.902 -1.391 7.319 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -3.844 -1.950 5.396 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.670 -0.438 5.076 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -2.774 1.576 4.705 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -2.258 -2.550 3.785 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -1.158 2.163 2.951 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -0.787 -1.950 1.891 1.00 0.00 H new ATOM 0 HZ PHE A 5 -0.221 0.419 1.480 1.00 0.00 H new ATOM 48 N ARG A 6 -1.618 0.927 7.448 1.00 0.00 N ATOM 49 CA ARG A 6 -0.349 1.316 8.080 1.00 0.00 C ATOM 50 C ARG A 6 0.033 0.692 9.428 1.00 0.00 C ATOM 51 O ARG A 6 1.197 0.379 9.637 1.00 0.00 O ATOM 52 CB ARG A 6 -0.373 2.839 8.187 1.00 0.00 C ATOM 53 CG ARG A 6 0.231 3.604 7.012 1.00 0.00 C ATOM 54 CD ARG A 6 0.088 3.148 5.556 1.00 0.00 C ATOM 55 NE ARG A 6 1.216 2.361 4.994 1.00 0.00 N ATOM 56 CZ ARG A 6 1.621 2.389 3.696 1.00 0.00 C ATOM 57 NH1 ARG A 6 1.133 3.211 2.770 1.00 0.00 N ATOM 58 NH2 ARG A 6 2.577 1.573 3.301 1.00 0.00 N ATOM 0 H ARG A 6 -2.110 1.722 7.041 1.00 0.00 H new ATOM 0 HA ARG A 6 0.432 0.912 7.436 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -1.408 3.158 8.309 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.158 3.128 9.094 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -0.174 4.615 7.060 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.300 3.679 7.209 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.820 2.550 5.473 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.055 4.032 4.934 1.00 0.00 H new ATOM 0 HE ARG A 6 1.727 1.751 5.632 1.00 0.00 H new ATOM 0 HH11 ARG A 6 0.403 3.880 3.015 1.00 0.00 H new ATOM 0 HH12 ARG A 6 1.489 3.172 1.815 1.00 0.00 H new ATOM 0 HH21 ARG A 6 3.005 0.929 3.966 1.00 0.00 H new ATOM 0 HH22 ARG A 6 2.889 1.585 2.330 1.00 0.00 H new ATOM 59 N SER A 7 -0.959 0.484 10.294 1.00 0.00 N ATOM 60 CA SER A 7 -0.707 -0.205 11.619 1.00 0.00 C ATOM 61 C SER A 7 -0.183 -1.684 11.611 1.00 0.00 C ATOM 62 O SER A 7 0.523 -2.167 12.495 1.00 0.00 O ATOM 63 CB SER A 7 -1.922 -0.057 12.549 1.00 0.00 C ATOM 64 OG SER A 7 -2.223 1.313 12.803 1.00 0.00 O ATOM 0 H SER A 7 -1.927 0.763 10.136 1.00 0.00 H new ATOM 0 HA SER A 7 0.157 0.338 12.001 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.787 -0.543 12.098 1.00 0.00 H new ATOM 0 HB3 SER A 7 -1.724 -0.568 13.491 1.00 0.00 H new ATOM 0 HG SER A 7 -3.001 1.373 13.396 1.00 0.00 H new ATOM 65 N MET A 8 -0.594 -2.319 10.561 1.00 0.00 N ATOM 66 CA MET A 8 -0.325 -3.692 10.135 1.00 0.00 C ATOM 67 C MET A 8 0.832 -3.810 9.127 1.00 0.00 C ATOM 68 O MET A 8 1.486 -4.837 9.099 1.00 0.00 O ATOM 69 CB MET A 8 -1.629 -4.012 9.403 1.00 0.00 C ATOM 70 CG MET A 8 -2.902 -3.721 10.208 1.00 0.00 C ATOM 71 SD MET A 8 -4.238 -4.607 9.465 1.00 0.00 S ATOM 72 CE MET A 8 -4.331 -3.717 7.962 1.00 0.00 C ATOM 0 H MET A 8 -1.200 -1.848 9.889 1.00 0.00 H new ATOM 0 HA MET A 8 -0.044 -4.337 10.967 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.661 -3.437 8.477 1.00 0.00 H new ATOM 0 HB3 MET A 8 -1.624 -5.066 9.124 1.00 0.00 H new ATOM 0 HG2 MET A 8 -2.774 -4.027 11.246 1.00 0.00 H new ATOM 0 HG3 MET A 8 -3.112 -2.651 10.214 1.00 0.00 H new ATOM 0 HE1 MET A 8 -4.603 -4.396 7.154 1.00 0.00 H new ATOM 0 HE2 MET A 8 -5.085 -2.935 8.048 1.00 0.00 H new ATOM 0 HE3 MET A 8 -3.363 -3.265 7.746 1.00 0.00 H new ATOM 73 N ILE A 9 1.028 -2.783 8.285 1.00 0.00 N ATOM 74 CA ILE A 9 2.259 -2.544 7.493 1.00 0.00 C ATOM 75 C ILE A 9 3.498 -2.402 8.437 1.00 0.00 C ATOM 76 O ILE A 9 4.566 -2.808 8.009 1.00 0.00 O ATOM 77 CB ILE A 9 2.004 -1.287 6.621 1.00 0.00 C ATOM 78 CG1 ILE A 9 0.805 -1.461 5.648 1.00 0.00 C ATOM 79 CG2 ILE A 9 3.199 -0.714 5.835 1.00 0.00 C ATOM 80 CD1 ILE A 9 1.205 -2.059 4.327 1.00 0.00 C ATOM 0 H ILE A 9 0.316 -2.070 8.127 1.00 0.00 H new ATOM 0 HA ILE A 9 2.489 -3.385 6.839 1.00 0.00 H new ATOM 0 HB ILE A 9 1.778 -0.549 7.391 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.053 -2.096 6.116 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.340 -0.491 5.476 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.877 0.161 5.271 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.988 -0.427 6.530 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.578 -1.470 5.147 1.00 0.00 H new ATOM 0 HD11 ILE A 9 0.326 -2.156 3.690 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.935 -1.412 3.841 1.00 0.00 H new ATOM 0 HD13 ILE A 9 1.644 -3.043 4.491 1.00 0.00 H new ATOM 81 N LYS A 10 3.348 -1.870 9.665 1.00 0.00 N ATOM 82 CA LYS A 10 4.359 -1.911 10.739 1.00 0.00 C ATOM 83 C LYS A 10 4.270 -3.144 11.693 1.00 0.00 C ATOM 84 O LYS A 10 5.146 -3.286 12.549 1.00 0.00 O ATOM 85 CB LYS A 10 4.385 -0.512 11.350 1.00 0.00 C ATOM 86 CG LYS A 10 3.182 -0.037 12.141 1.00 0.00 C ATOM 87 CD LYS A 10 3.139 -0.704 13.505 1.00 0.00 C ATOM 88 CE LYS A 10 2.212 -0.081 14.540 1.00 0.00 C ATOM 89 NZ LYS A 10 2.677 1.221 15.053 1.00 0.00 N ATOM 0 H LYS A 10 2.495 -1.386 9.945 1.00 0.00 H new ATOM 0 HA LYS A 10 5.355 -2.123 10.350 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.254 -0.454 12.005 1.00 0.00 H new ATOM 0 HB3 LYS A 10 4.549 0.199 10.540 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.224 1.046 12.261 1.00 0.00 H new ATOM 0 HG3 LYS A 10 2.268 -0.262 11.592 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.845 -1.744 13.366 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.150 -0.710 13.913 1.00 0.00 H new ATOM 0 HE2 LYS A 10 1.224 0.046 14.098 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.101 -0.771 15.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 1.996 1.582 15.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 3.607 1.104 15.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 2.756 1.896 14.266 1.00 0.00 H new ATOM 90 N CYS A 11 3.244 -4.029 11.592 1.00 0.00 N ATOM 91 CA CYS A 11 3.340 -5.429 12.103 1.00 0.00 C ATOM 92 C CYS A 11 4.235 -6.239 11.084 1.00 0.00 C ATOM 93 O CYS A 11 5.292 -6.728 11.471 1.00 0.00 O ATOM 94 CB CYS A 11 1.946 -6.057 12.228 1.00 0.00 C ATOM 95 SG CYS A 11 0.989 -5.431 13.601 1.00 0.00 S ATOM 0 H CYS A 11 2.345 -3.804 11.165 1.00 0.00 H new ATOM 0 HA CYS A 11 3.786 -5.446 13.097 1.00 0.00 H new ATOM 0 HB2 CYS A 11 1.395 -5.881 11.304 1.00 0.00 H new ATOM 0 HB3 CYS A 11 2.053 -7.136 12.335 1.00 0.00 H new ATOM 96 N ALA A 12 3.787 -6.259 9.811 1.00 0.00 N ATOM 97 CA ALA A 12 4.527 -6.634 8.585 1.00 0.00 C ATOM 98 C ALA A 12 5.971 -6.151 8.435 1.00 0.00 C ATOM 99 O ALA A 12 6.776 -6.889 7.861 1.00 0.00 O ATOM 100 CB ALA A 12 3.602 -6.091 7.474 1.00 0.00 C ATOM 0 H ALA A 12 2.826 -5.994 9.596 1.00 0.00 H new ATOM 0 HA ALA A 12 4.708 -7.709 8.572 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.040 -6.306 6.499 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.626 -6.570 7.547 1.00 0.00 H new ATOM 0 HB3 ALA A 12 3.487 -5.013 7.591 1.00 0.00 H new ATOM 101 N ILE A 13 6.315 -4.962 8.941 1.00 0.00 N ATOM 102 CA ILE A 13 7.672 -4.443 8.987 1.00 0.00 C ATOM 103 C ILE A 13 7.724 -4.324 10.550 1.00 0.00 C ATOM 104 O ILE A 13 7.334 -3.262 11.045 1.00 0.00 O ATOM 105 CB ILE A 13 7.647 -3.104 8.196 1.00 0.00 C ATOM 106 CG1 ILE A 13 7.427 -3.220 6.674 1.00 0.00 C ATOM 107 CG2 ILE A 13 8.838 -2.202 8.489 1.00 0.00 C ATOM 108 CD1 ILE A 13 8.086 -4.377 5.966 1.00 0.00 C ATOM 0 H ILE A 13 5.630 -4.320 9.340 1.00 0.00 H new ATOM 0 HA ILE A 13 8.521 -4.980 8.564 1.00 0.00 H new ATOM 0 HB ILE A 13 6.746 -2.632 8.589 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.354 -3.280 6.492 1.00 0.00 H new ATOM 0 HG13 ILE A 13 7.778 -2.297 6.211 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.754 -1.287 7.903 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.854 -1.953 9.550 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.760 -2.719 8.224 1.00 0.00 H new ATOM 0 HD11 ILE A 13 7.848 -4.336 4.903 1.00 0.00 H new ATOM 0 HD12 ILE A 13 9.166 -4.317 6.099 1.00 0.00 H new ATOM 0 HD13 ILE A 13 7.720 -5.315 6.384 1.00 0.00 H new ATOM 109 N PRO A 14 8.201 -5.320 11.367 1.00 0.00 N ATOM 110 CA PRO A 14 8.452 -5.153 12.864 1.00 0.00 C ATOM 111 C PRO A 14 9.231 -3.847 13.138 1.00 0.00 C ATOM 112 O PRO A 14 8.705 -2.926 13.766 1.00 0.00 O ATOM 113 CB PRO A 14 9.103 -6.498 13.255 1.00 0.00 C ATOM 114 CG PRO A 14 8.534 -7.495 12.201 1.00 0.00 C ATOM 115 CD PRO A 14 8.545 -6.667 10.906 1.00 0.00 C ATOM 0 HA PRO A 14 7.577 -4.998 13.496 1.00 0.00 H new ATOM 0 HB2 PRO A 14 10.191 -6.445 13.212 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.838 -6.792 14.271 1.00 0.00 H new ATOM 0 HG2 PRO A 14 9.152 -8.388 12.115 1.00 0.00 H new ATOM 0 HG3 PRO A 14 7.529 -7.827 12.460 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.521 -6.690 10.422 1.00 0.00 H new ATOM 0 HD3 PRO A 14 7.821 -7.042 10.182 1.00 0.00 H new ATOM 116 N GLY A 15 10.410 -3.724 12.496 1.00 0.00 N ATOM 117 CA GLY A 15 10.522 -2.651 11.482 1.00 0.00 C ATOM 118 C GLY A 15 10.591 -1.167 11.873 1.00 0.00 C ATOM 119 O GLY A 15 10.819 -0.821 13.035 1.00 0.00 O ATOM 0 H GLY A 15 11.238 -4.301 12.641 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.416 -2.864 10.896 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.669 -2.761 10.813 1.00 0.00 H new ATOM 120 N SER A 16 10.421 -0.304 10.847 1.00 0.00 N ATOM 121 CA SER A 16 10.549 1.183 10.977 1.00 0.00 C ATOM 122 C SER A 16 9.167 1.886 10.821 1.00 0.00 C ATOM 123 O SER A 16 8.251 1.483 11.547 1.00 0.00 O ATOM 124 CB SER A 16 11.668 1.661 10.025 1.00 0.00 C ATOM 125 OG SER A 16 12.932 1.119 10.405 1.00 0.00 O ATOM 0 H SER A 16 10.191 -0.609 9.901 1.00 0.00 H new ATOM 0 HA SER A 16 10.859 1.473 11.981 1.00 0.00 H new ATOM 0 HB2 SER A 16 11.433 1.362 9.003 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.718 2.750 10.035 1.00 0.00 H new ATOM 0 HG SER A 16 13.623 1.435 9.786 1.00 0.00 H new ATOM 126 N HIS A 17 8.970 2.945 9.983 1.00 0.00 N ATOM 127 CA HIS A 17 7.652 3.574 9.794 1.00 0.00 C ATOM 128 C HIS A 17 6.890 2.734 8.704 1.00 0.00 C ATOM 129 O HIS A 17 7.550 2.280 7.767 1.00 0.00 O ATOM 130 CB HIS A 17 7.931 5.056 9.354 1.00 0.00 C ATOM 131 CG HIS A 17 6.649 5.867 9.412 1.00 0.00 C ATOM 132 ND1 HIS A 17 5.798 5.765 8.330 1.00 0.00 N flip ATOM 133 CD2 HIS A 17 6.038 6.501 10.488 1.00 0.00 C flip ATOM 134 CE1 HIS A 17 4.576 6.307 8.609 1.00 0.00 C flip ATOM 135 NE2 HIS A 17 4.811 6.725 9.898 1.00 0.00 N flip ATOM 0 H HIS A 17 9.715 3.372 9.433 1.00 0.00 H new ATOM 0 HA HIS A 17 7.029 3.593 10.688 1.00 0.00 H new ATOM 0 HB2 HIS A 17 8.682 5.502 10.006 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.336 5.073 8.342 1.00 0.00 H new ATOM 0 HD2 HIS A 17 6.407 6.742 11.474 1.00 0.00 H new ATOM 0 HE1 HIS A 17 3.688 6.384 7.999 1.00 0.00 H new ATOM 0 HE2 HIS A 17 4.076 7.202 10.420 1.00 0.00 H new ATOM 136 N PRO A 18 5.547 2.517 8.719 1.00 0.00 N ATOM 137 CA PRO A 18 4.832 1.773 7.623 1.00 0.00 C ATOM 138 C PRO A 18 5.046 2.279 6.188 1.00 0.00 C ATOM 139 O PRO A 18 5.485 1.483 5.357 1.00 0.00 O ATOM 140 CB PRO A 18 3.371 1.711 8.064 1.00 0.00 C ATOM 141 CG PRO A 18 3.242 2.721 9.222 1.00 0.00 C ATOM 142 CD PRO A 18 4.646 2.885 9.821 1.00 0.00 C ATOM 0 HA PRO A 18 5.267 0.779 7.518 1.00 0.00 H new ATOM 0 HB2 PRO A 18 2.703 1.970 7.243 1.00 0.00 H new ATOM 0 HB3 PRO A 18 3.102 0.706 8.389 1.00 0.00 H new ATOM 0 HG2 PRO A 18 2.861 3.676 8.862 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.540 2.361 9.974 1.00 0.00 H new ATOM 0 HD2 PRO A 18 4.821 3.908 10.155 1.00 0.00 H new ATOM 0 HD3 PRO A 18 4.789 2.238 10.687 1.00 0.00 H new ATOM 143 N LEU A 19 4.840 3.583 5.902 1.00 0.00 N ATOM 144 CA LEU A 19 5.484 4.248 4.743 1.00 0.00 C ATOM 145 C LEU A 19 6.973 4.441 5.013 1.00 0.00 C ATOM 146 O LEU A 19 7.565 3.399 5.233 1.00 0.00 O ATOM 147 CB LEU A 19 4.708 5.532 4.407 1.00 0.00 C ATOM 148 CG LEU A 19 3.663 5.243 3.351 1.00 0.00 C ATOM 149 CD1 LEU A 19 2.651 6.387 3.457 1.00 0.00 C ATOM 150 CD2 LEU A 19 4.213 5.203 1.930 1.00 0.00 C ATOM 0 H LEU A 19 4.237 4.195 6.452 1.00 0.00 H new ATOM 0 HA LEU A 19 5.439 3.627 3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.231 5.924 5.305 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.395 6.299 4.050 1.00 0.00 H new ATOM 0 HG LEU A 19 3.240 4.255 3.530 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.862 6.244 2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.216 6.397 4.456 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.154 7.336 3.271 1.00 0.00 H new ATOM 0 HD21 LEU A 19 3.403 4.991 1.232 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.659 6.167 1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.970 4.423 1.855 1.00 0.00 H new ATOM 151 N MET A 20 7.442 5.696 5.040 1.00 0.00 N ATOM 152 CA MET A 20 8.815 6.287 5.124 1.00 0.00 C ATOM 153 C MET A 20 10.107 5.496 5.236 1.00 0.00 C ATOM 154 O MET A 20 11.139 5.825 4.643 1.00 0.00 O ATOM 155 CB MET A 20 8.602 7.334 6.234 1.00 0.00 C ATOM 156 CG MET A 20 7.888 8.577 5.658 1.00 0.00 C ATOM 157 SD MET A 20 7.754 9.906 6.855 1.00 0.00 S ATOM 158 CE MET A 20 6.829 8.933 8.042 1.00 0.00 C ATOM 0 H MET A 20 6.763 6.456 4.997 1.00 0.00 H new ATOM 0 HA MET A 20 9.094 6.608 4.120 1.00 0.00 H new ATOM 0 HB2 MET A 20 8.008 6.905 7.041 1.00 0.00 H new ATOM 0 HB3 MET A 20 9.562 7.622 6.663 1.00 0.00 H new ATOM 0 HG2 MET A 20 8.433 8.933 4.784 1.00 0.00 H new ATOM 0 HG3 MET A 20 6.891 8.295 5.319 1.00 0.00 H new ATOM 0 HE1 MET A 20 6.171 9.587 8.614 1.00 0.00 H new ATOM 0 HE2 MET A 20 6.232 8.188 7.516 1.00 0.00 H new ATOM 0 HE3 MET A 20 7.520 8.432 8.719 1.00 0.00 H new ATOM 159 N ASP A 21 9.919 4.364 5.874 1.00 0.00 N ATOM 160 CA ASP A 21 10.432 3.089 5.240 1.00 0.00 C ATOM 161 C ASP A 21 10.111 2.836 3.686 1.00 0.00 C ATOM 162 O ASP A 21 10.778 1.984 3.096 1.00 0.00 O ATOM 163 CB ASP A 21 10.124 1.870 6.128 1.00 0.00 C ATOM 164 CG ASP A 21 10.979 0.628 5.876 1.00 0.00 C ATOM 165 OD1 ASP A 21 12.234 0.740 6.416 1.00 0.00 O ATOM 166 OD2 ASP A 21 10.573 -0.356 5.258 1.00 0.00 O ATOM 0 H ASP A 21 9.451 4.259 6.774 1.00 0.00 H new ATOM 0 HA ASP A 21 11.510 3.245 5.198 1.00 0.00 H new ATOM 0 HB2 ASP A 21 10.244 2.165 7.171 1.00 0.00 H new ATOM 0 HB3 ASP A 21 9.077 1.600 5.991 1.00 0.00 H new ATOM 167 N PHE A 22 9.165 3.565 3.047 1.00 0.00 N ATOM 168 CA PHE A 22 8.689 3.298 1.683 1.00 0.00 C ATOM 169 C PHE A 22 8.279 4.613 0.921 1.00 0.00 C ATOM 170 O PHE A 22 8.411 4.620 -0.300 1.00 0.00 O ATOM 171 CB PHE A 22 7.481 2.352 1.788 1.00 0.00 C ATOM 172 CG PHE A 22 7.770 0.894 2.132 1.00 0.00 C ATOM 173 CD1 PHE A 22 7.869 -0.068 1.116 1.00 0.00 C ATOM 174 CD2 PHE A 22 7.649 0.468 3.464 1.00 0.00 C ATOM 175 CE1 PHE A 22 7.743 -1.418 1.409 1.00 0.00 C ATOM 176 CE2 PHE A 22 7.358 -0.864 3.733 1.00 0.00 C ATOM 177 CZ PHE A 22 7.474 -1.809 2.714 1.00 0.00 C ATOM 0 H PHE A 22 8.708 4.368 3.479 1.00 0.00 H new ATOM 0 HA PHE A 22 9.498 2.847 1.108 1.00 0.00 H new ATOM 0 HB2 PHE A 22 6.804 2.750 2.543 1.00 0.00 H new ATOM 0 HB3 PHE A 22 6.948 2.376 0.837 1.00 0.00 H new ATOM 0 HD1 PHE A 22 8.045 0.245 0.097 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.781 1.170 4.274 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.853 -2.158 0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 22 7.045 -1.165 4.722 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.353 -2.858 2.943 1.00 0.00 H new ATOM 178 N ASN A 23 7.778 5.692 1.568 1.00 0.00 N ATOM 179 CA ASN A 23 7.398 6.997 0.879 1.00 0.00 C ATOM 180 C ASN A 23 8.373 7.571 -0.209 1.00 0.00 C ATOM 181 O ASN A 23 7.965 8.121 -1.233 1.00 0.00 O ATOM 182 CB ASN A 23 7.233 8.042 2.020 1.00 0.00 C ATOM 183 CG ASN A 23 6.639 9.411 1.691 1.00 0.00 C ATOM 184 OD1 ASN A 23 6.362 9.769 0.548 1.00 0.00 O ATOM 185 ND2 ASN A 23 6.461 10.241 2.704 1.00 0.00 N ATOM 0 H ASN A 23 7.618 5.706 2.575 1.00 0.00 H new ATOM 0 HA ASN A 23 6.499 6.784 0.300 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.610 7.590 2.792 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.217 8.207 2.460 1.00 0.00 H new ATOM 0 HD21 ASN A 23 6.094 11.178 2.537 1.00 0.00 H new ATOM 0 HD22 ASN A 23 6.691 9.945 3.653 1.00 0.00 H new ATOM 186 N ASN A 24 9.640 7.422 0.136 1.00 0.00 N ATOM 187 CA ASN A 24 10.801 7.782 -0.686 1.00 0.00 C ATOM 188 C ASN A 24 11.632 6.469 -0.757 1.00 0.00 C ATOM 189 O ASN A 24 12.516 6.205 0.065 1.00 0.00 O ATOM 190 CB ASN A 24 11.577 8.914 0.013 1.00 0.00 C ATOM 191 CG ASN A 24 11.091 10.336 -0.266 1.00 0.00 C ATOM 192 OD1 ASN A 24 9.945 10.590 -0.642 1.00 0.00 O ATOM 193 ND2 ASN A 24 11.955 11.309 -0.048 1.00 0.00 N ATOM 0 H ASN A 24 9.909 7.029 1.038 1.00 0.00 H new ATOM 0 HA ASN A 24 10.547 8.146 -1.681 1.00 0.00 H new ATOM 0 HB2 ASN A 24 11.538 8.743 1.089 1.00 0.00 H new ATOM 0 HB3 ASN A 24 12.624 8.845 -0.283 1.00 0.00 H new ATOM 0 HD21 ASN A 24 11.676 12.280 -0.190 1.00 0.00 H new ATOM 0 HD22 ASN A 24 12.901 11.090 0.263 1.00 0.00 H new ATOM 194 N TYR A 25 11.260 5.632 -1.729 1.00 0.00 N ATOM 195 CA TYR A 25 11.785 4.255 -1.872 1.00 0.00 C ATOM 196 C TYR A 25 11.390 3.836 -3.304 1.00 0.00 C ATOM 197 O TYR A 25 10.211 3.823 -3.651 1.00 0.00 O ATOM 198 CB TYR A 25 11.181 3.343 -0.802 1.00 0.00 C ATOM 199 CG TYR A 25 11.808 1.972 -0.657 1.00 0.00 C ATOM 200 CD1 TYR A 25 11.526 0.977 -1.594 1.00 0.00 C ATOM 201 CD2 TYR A 25 12.591 1.659 0.455 1.00 0.00 C ATOM 202 CE1 TYR A 25 11.977 -0.321 -1.394 1.00 0.00 C ATOM 203 CE2 TYR A 25 13.065 0.365 0.651 1.00 0.00 C ATOM 204 CZ TYR A 25 12.704 -0.641 -0.243 1.00 0.00 C ATOM 205 OH TYR A 25 12.985 -1.940 0.040 1.00 0.00 O ATOM 0 H TYR A 25 10.582 5.884 -2.448 1.00 0.00 H new ATOM 0 HA TYR A 25 12.864 4.188 -1.730 1.00 0.00 H new ATOM 0 HB2 TYR A 25 11.247 3.853 0.159 1.00 0.00 H new ATOM 0 HB3 TYR A 25 10.121 3.213 -1.022 1.00 0.00 H new ATOM 0 HD1 TYR A 25 10.955 1.218 -2.478 1.00 0.00 H new ATOM 0 HD2 TYR A 25 12.832 2.430 1.172 1.00 0.00 H new ATOM 0 HE1 TYR A 25 11.766 -1.084 -2.128 1.00 0.00 H new ATOM 0 HE2 TYR A 25 13.708 0.142 1.490 1.00 0.00 H new ATOM 0 HH TYR A 25 13.467 -2.342 -0.713 1.00 0.00 H new ATOM 206 N GLY A 26 12.399 3.492 -4.093 1.00 0.00 N ATOM 207 CA GLY A 26 12.342 3.257 -5.549 1.00 0.00 C ATOM 208 C GLY A 26 11.192 3.862 -6.376 1.00 0.00 C ATOM 209 O GLY A 26 10.262 3.220 -6.859 1.00 0.00 O ATOM 0 H GLY A 26 13.340 3.359 -3.722 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.276 3.623 -5.975 1.00 0.00 H new ATOM 0 HA3 GLY A 26 12.322 2.178 -5.704 1.00 0.00 H new ATOM 210 N CYS A 27 11.388 5.162 -6.440 1.00 0.00 N ATOM 211 CA CYS A 27 10.438 6.190 -6.887 1.00 0.00 C ATOM 212 C CYS A 27 9.563 6.774 -5.723 1.00 0.00 C ATOM 213 O CYS A 27 9.612 7.978 -5.463 1.00 0.00 O ATOM 214 CB CYS A 27 9.483 5.894 -8.075 1.00 0.00 C ATOM 215 SG CYS A 27 8.717 7.441 -8.583 1.00 0.00 S ATOM 0 H CYS A 27 12.280 5.571 -6.162 1.00 0.00 H new ATOM 0 HA CYS A 27 11.164 6.905 -7.275 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.035 5.453 -8.905 1.00 0.00 H new ATOM 0 HB3 CYS A 27 8.722 5.172 -7.779 1.00 0.00 H new ATOM 216 N TYR A 28 8.734 5.916 -5.106 1.00 0.00 N ATOM 217 CA TYR A 28 7.534 6.352 -4.355 1.00 0.00 C ATOM 218 C TYR A 28 6.980 5.486 -3.182 1.00 0.00 C ATOM 219 O TYR A 28 6.255 6.013 -2.342 1.00 0.00 O ATOM 220 CB TYR A 28 6.357 6.551 -5.361 1.00 0.00 C ATOM 221 CG TYR A 28 6.123 5.618 -6.575 1.00 0.00 C ATOM 222 CD1 TYR A 28 6.027 4.202 -6.555 1.00 0.00 C ATOM 223 CD2 TYR A 28 6.031 6.256 -7.814 1.00 0.00 C ATOM 224 CE1 TYR A 28 5.796 3.490 -7.735 1.00 0.00 C ATOM 225 CE2 TYR A 28 5.899 5.533 -8.994 1.00 0.00 C ATOM 226 CZ TYR A 28 5.713 4.162 -8.947 1.00 0.00 C ATOM 227 OH TYR A 28 5.433 3.486 -10.087 1.00 0.00 O ATOM 0 H TYR A 28 8.871 4.905 -5.110 1.00 0.00 H new ATOM 0 HA TYR A 28 7.905 7.249 -3.859 1.00 0.00 H new ATOM 0 HB2 TYR A 28 5.440 6.531 -4.773 1.00 0.00 H new ATOM 0 HB3 TYR A 28 6.457 7.560 -5.760 1.00 0.00 H new ATOM 0 HD1 TYR A 28 6.133 3.671 -5.621 1.00 0.00 H new ATOM 0 HD2 TYR A 28 6.063 7.335 -7.856 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.682 2.416 -7.704 1.00 0.00 H new ATOM 0 HE2 TYR A 28 5.942 6.040 -9.946 1.00 0.00 H new ATOM 0 HH TYR A 28 4.704 3.936 -10.563 1.00 0.00 H new ATOM 228 N CYS A 29 7.279 4.196 -3.220 1.00 0.00 N ATOM 229 CA CYS A 29 6.666 3.079 -2.492 1.00 0.00 C ATOM 230 C CYS A 29 5.537 3.367 -1.515 1.00 0.00 C ATOM 231 O CYS A 29 5.784 3.891 -0.435 1.00 0.00 O ATOM 232 CB CYS A 29 7.719 2.078 -2.001 1.00 0.00 C ATOM 233 SG CYS A 29 7.294 0.407 -2.531 1.00 0.00 S ATOM 0 H CYS A 29 8.034 3.865 -3.821 1.00 0.00 H new ATOM 0 HA CYS A 29 6.070 2.588 -3.261 1.00 0.00 H new ATOM 0 HB2 CYS A 29 8.700 2.352 -2.391 1.00 0.00 H new ATOM 0 HB3 CYS A 29 7.786 2.115 -0.914 1.00 0.00 H new ATOM 234 N GLY A 30 4.287 3.143 -1.917 1.00 0.00 N ATOM 235 CA GLY A 30 3.141 3.483 -1.074 1.00 0.00 C ATOM 236 C GLY A 30 2.652 4.914 -1.253 1.00 0.00 C ATOM 237 O GLY A 30 1.484 5.060 -1.631 1.00 0.00 O ATOM 0 H GLY A 30 4.042 2.730 -2.817 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.322 2.798 -1.296 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.411 3.329 -0.029 1.00 0.00 H new ATOM 238 N LEU A 31 3.474 5.969 -0.979 1.00 0.00 N ATOM 239 CA LEU A 31 2.972 7.342 -1.016 1.00 0.00 C ATOM 240 C LEU A 31 3.472 8.049 -2.240 1.00 0.00 C ATOM 241 O LEU A 31 2.750 8.230 -3.228 1.00 0.00 O ATOM 242 CB LEU A 31 2.866 8.009 0.372 1.00 0.00 C ATOM 243 CG LEU A 31 2.929 9.534 0.475 1.00 0.00 C ATOM 244 CD1 LEU A 31 1.880 10.324 -0.307 1.00 0.00 C ATOM 245 CD2 LEU A 31 2.904 9.982 1.950 1.00 0.00 C ATOM 0 H LEU A 31 4.461 5.881 -0.737 1.00 0.00 H new ATOM 0 HA LEU A 31 1.901 7.404 -1.207 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.925 7.689 0.819 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.666 7.605 0.992 1.00 0.00 H new ATOM 0 HG LEU A 31 3.877 9.775 -0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.036 11.391 -0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.971 10.098 -1.369 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.884 10.047 0.039 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.950 11.070 2.001 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.984 9.635 2.420 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.761 9.558 2.474 1.00 0.00 H new ATOM 246 N GLY A 32 4.700 8.511 -2.052 1.00 0.00 N ATOM 247 CA GLY A 32 5.111 9.740 -2.732 1.00 0.00 C ATOM 248 C GLY A 32 5.362 9.676 -4.251 1.00 0.00 C ATOM 249 O GLY A 32 4.638 8.980 -4.969 1.00 0.00 O ATOM 0 H GLY A 32 5.408 8.077 -1.459 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.345 10.494 -2.551 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.026 10.095 -2.257 1.00 0.00 H new ATOM 250 N GLY A 33 6.360 10.432 -4.744 1.00 0.00 N ATOM 251 CA GLY A 33 6.864 10.353 -6.139 1.00 0.00 C ATOM 252 C GLY A 33 5.878 10.367 -7.316 1.00 0.00 C ATOM 253 O GLY A 33 4.710 10.740 -7.164 1.00 0.00 O ATOM 0 H GLY A 33 6.850 11.127 -4.181 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.551 11.187 -6.283 1.00 0.00 H new ATOM 0 HA3 GLY A 33 7.451 9.438 -6.220 1.00 0.00 H new ATOM 254 N SER A 34 6.379 9.975 -8.505 1.00 0.00 N ATOM 255 CA SER A 34 5.565 9.946 -9.745 1.00 0.00 C ATOM 256 C SER A 34 6.211 9.120 -10.892 1.00 0.00 C ATOM 257 O SER A 34 7.429 9.153 -11.086 1.00 0.00 O ATOM 258 CB SER A 34 5.271 11.396 -10.224 1.00 0.00 C ATOM 259 OG SER A 34 6.439 12.080 -10.672 1.00 0.00 O ATOM 0 H SER A 34 7.344 9.673 -8.636 1.00 0.00 H new ATOM 0 HA SER A 34 4.633 9.441 -9.492 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.541 11.365 -11.033 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.818 11.958 -9.408 1.00 0.00 H new ATOM 0 HG SER A 34 6.197 12.984 -10.963 1.00 0.00 H new ATOM 260 N GLY A 35 5.357 8.424 -11.666 1.00 0.00 N ATOM 261 CA GLY A 35 5.773 7.708 -12.886 1.00 0.00 C ATOM 262 C GLY A 35 5.712 6.181 -12.760 1.00 0.00 C ATOM 263 O GLY A 35 4.628 5.606 -12.636 1.00 0.00 O ATOM 0 H GLY A 35 4.361 8.343 -11.463 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.137 8.020 -13.714 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.792 8.002 -13.139 1.00 0.00 H new ATOM 264 N THR A 36 6.894 5.558 -12.832 1.00 0.00 N ATOM 265 CA THR A 36 7.075 4.090 -12.758 1.00 0.00 C ATOM 266 C THR A 36 8.150 3.736 -11.649 1.00 0.00 C ATOM 267 O THR A 36 8.936 4.605 -11.254 1.00 0.00 O ATOM 268 CB THR A 36 7.384 3.406 -14.139 1.00 0.00 C ATOM 269 OG1 THR A 36 7.583 4.322 -15.219 1.00 0.00 O ATOM 270 CG2 THR A 36 6.260 2.432 -14.534 1.00 0.00 C ATOM 0 H THR A 36 7.773 6.063 -12.946 1.00 0.00 H new ATOM 0 HA THR A 36 6.114 3.666 -12.466 1.00 0.00 H new ATOM 0 HB THR A 36 8.324 2.878 -13.980 1.00 0.00 H new ATOM 0 HG1 THR A 36 7.771 3.823 -16.041 1.00 0.00 H new ATOM 0 HG21 THR A 36 6.498 1.972 -15.493 1.00 0.00 H new ATOM 0 HG22 THR A 36 6.166 1.657 -13.773 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.319 2.976 -14.616 1.00 0.00 H new ATOM 271 N PRO A 37 8.201 2.490 -11.110 1.00 0.00 N ATOM 272 CA PRO A 37 9.042 2.125 -9.926 1.00 0.00 C ATOM 273 C PRO A 37 10.497 1.739 -10.295 1.00 0.00 C ATOM 274 O PRO A 37 11.066 2.275 -11.252 1.00 0.00 O ATOM 275 CB PRO A 37 8.181 0.928 -9.416 1.00 0.00 C ATOM 276 CG PRO A 37 7.799 0.188 -10.695 1.00 0.00 C ATOM 277 CD PRO A 37 7.408 1.341 -11.599 1.00 0.00 C ATOM 0 HA PRO A 37 9.222 2.921 -9.203 1.00 0.00 H new ATOM 0 HB2 PRO A 37 8.746 0.289 -8.737 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.300 1.271 -8.873 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.630 -0.389 -11.100 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.975 -0.508 -10.537 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.634 1.120 -12.642 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.339 1.545 -11.540 1.00 0.00 H new ATOM 278 N VAL A 38 11.077 0.796 -9.528 1.00 0.00 N ATOM 279 CA VAL A 38 12.417 0.239 -9.767 1.00 0.00 C ATOM 280 C VAL A 38 12.416 -1.333 -9.680 1.00 0.00 C ATOM 281 O VAL A 38 12.746 -2.044 -10.630 1.00 0.00 O ATOM 282 CB VAL A 38 13.496 0.892 -8.827 1.00 0.00 C ATOM 283 CG1 VAL A 38 13.433 2.424 -8.796 1.00 0.00 C ATOM 284 CG2 VAL A 38 13.467 0.496 -7.327 1.00 0.00 C ATOM 0 H VAL A 38 10.617 0.395 -8.711 1.00 0.00 H new ATOM 0 HA VAL A 38 12.700 0.495 -10.788 1.00 0.00 H new ATOM 0 HB VAL A 38 14.396 0.495 -9.297 1.00 0.00 H new ATOM 0 HG11 VAL A 38 14.205 2.806 -8.128 1.00 0.00 H new ATOM 0 HG12 VAL A 38 13.596 2.815 -9.800 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.454 2.741 -8.437 1.00 0.00 H new ATOM 0 HG21 VAL A 38 14.263 1.019 -6.797 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.504 0.771 -6.897 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.613 -0.580 -7.232 1.00 0.00 H new ATOM 285 N ASP A 39 12.044 -1.764 -8.479 1.00 0.00 N ATOM 286 CA ASP A 39 12.056 -3.168 -8.011 1.00 0.00 C ATOM 287 C ASP A 39 10.717 -3.853 -8.166 1.00 0.00 C ATOM 288 O ASP A 39 9.692 -3.179 -8.320 1.00 0.00 O ATOM 289 CB ASP A 39 12.803 -3.348 -6.667 1.00 0.00 C ATOM 290 CG ASP A 39 12.325 -2.631 -5.425 1.00 0.00 C ATOM 291 OD1 ASP A 39 11.559 -1.678 -5.437 1.00 0.00 O ATOM 292 OD2 ASP A 39 12.875 -3.150 -4.287 1.00 0.00 O ATOM 0 H ASP A 39 11.708 -1.121 -7.762 1.00 0.00 H new ATOM 0 HA ASP A 39 12.681 -3.744 -8.694 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.809 -4.414 -6.442 1.00 0.00 H new ATOM 0 HB3 ASP A 39 13.839 -3.052 -6.832 1.00 0.00 H new ATOM 293 N GLU A 40 10.714 -5.224 -8.106 1.00 0.00 N ATOM 294 CA GLU A 40 9.459 -5.970 -7.888 1.00 0.00 C ATOM 295 C GLU A 40 8.605 -5.359 -6.736 1.00 0.00 C ATOM 296 O GLU A 40 7.388 -5.207 -6.850 1.00 0.00 O ATOM 297 CB GLU A 40 9.568 -7.456 -7.469 1.00 0.00 C ATOM 298 CG GLU A 40 8.308 -8.205 -7.927 1.00 0.00 C ATOM 299 CD GLU A 40 8.410 -8.870 -9.282 1.00 0.00 C ATOM 300 OE1 GLU A 40 8.870 -9.999 -9.449 1.00 0.00 O ATOM 301 OE2 GLU A 40 7.932 -8.071 -10.290 1.00 0.00 O ATOM 0 H GLU A 40 11.546 -5.806 -8.204 1.00 0.00 H new ATOM 0 HA GLU A 40 9.027 -5.897 -8.886 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.455 -7.907 -7.913 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.679 -7.534 -6.387 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.067 -8.965 -7.184 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.474 -7.503 -7.947 1.00 0.00 H new ATOM 302 N LEU A 41 9.307 -5.021 -5.646 1.00 0.00 N ATOM 303 CA LEU A 41 8.713 -4.381 -4.506 1.00 0.00 C ATOM 304 C LEU A 41 8.007 -3.057 -4.739 1.00 0.00 C ATOM 305 O LEU A 41 6.851 -2.905 -4.328 1.00 0.00 O ATOM 306 CB LEU A 41 9.763 -4.617 -3.434 1.00 0.00 C ATOM 307 CG LEU A 41 9.469 -4.288 -1.990 1.00 0.00 C ATOM 308 CD1 LEU A 41 10.084 -3.019 -1.471 1.00 0.00 C ATOM 309 CD2 LEU A 41 8.000 -4.486 -1.702 1.00 0.00 C ATOM 0 H LEU A 41 10.308 -5.193 -5.548 1.00 0.00 H new ATOM 0 HA LEU A 41 7.765 -4.782 -4.148 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.034 -5.672 -3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.648 -4.049 -3.720 1.00 0.00 H new ATOM 0 HG LEU A 41 10.007 -5.011 -1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 41 9.808 -2.882 -0.426 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.169 -3.080 -1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.722 -2.173 -2.056 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.798 -4.246 -0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.412 -3.831 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.728 -5.524 -1.895 1.00 0.00 H new ATOM 310 N ASP A 42 8.627 -2.149 -5.498 1.00 0.00 N ATOM 311 CA ASP A 42 7.937 -0.950 -5.998 1.00 0.00 C ATOM 312 C ASP A 42 6.854 -1.154 -7.107 1.00 0.00 C ATOM 313 O ASP A 42 6.093 -0.217 -7.340 1.00 0.00 O ATOM 314 CB ASP A 42 8.955 0.131 -6.349 1.00 0.00 C ATOM 315 CG ASP A 42 9.521 0.892 -5.180 1.00 0.00 C ATOM 316 OD1 ASP A 42 8.684 1.906 -4.807 1.00 0.00 O ATOM 317 OD2 ASP A 42 10.616 0.668 -4.680 1.00 0.00 O ATOM 0 H ASP A 42 9.604 -2.219 -5.781 1.00 0.00 H new ATOM 0 HA ASP A 42 7.319 -0.620 -5.163 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.779 -0.333 -6.892 1.00 0.00 H new ATOM 0 HB3 ASP A 42 8.485 0.841 -7.029 1.00 0.00 H new ATOM 318 N ARG A 43 6.730 -2.329 -7.739 1.00 0.00 N ATOM 319 CA ARG A 43 5.610 -2.639 -8.663 1.00 0.00 C ATOM 320 C ARG A 43 4.233 -2.790 -7.913 1.00 0.00 C ATOM 321 O ARG A 43 3.246 -2.254 -8.404 1.00 0.00 O ATOM 322 CB ARG A 43 5.775 -4.032 -9.330 1.00 0.00 C ATOM 323 CG ARG A 43 7.062 -4.328 -10.052 1.00 0.00 C ATOM 324 CD ARG A 43 7.570 -3.336 -11.065 1.00 0.00 C ATOM 325 NE ARG A 43 6.492 -2.766 -11.881 1.00 0.00 N ATOM 326 CZ ARG A 43 6.672 -2.182 -13.080 1.00 0.00 C ATOM 327 NH1 ARG A 43 7.859 -2.014 -13.661 1.00 0.00 N ATOM 328 NH2 ARG A 43 5.607 -1.748 -13.724 1.00 0.00 N ATOM 0 H ARG A 43 7.396 -3.094 -7.631 1.00 0.00 H new ATOM 0 HA ARG A 43 5.624 -1.810 -9.371 1.00 0.00 H new ATOM 0 HB2 ARG A 43 5.646 -4.789 -8.556 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.958 -4.160 -10.040 1.00 0.00 H new ATOM 0 HG2 ARG A 43 7.840 -4.459 -9.300 1.00 0.00 H new ATOM 0 HG3 ARG A 43 6.944 -5.286 -10.559 1.00 0.00 H new ATOM 0 HD2 ARG A 43 8.096 -2.532 -10.550 1.00 0.00 H new ATOM 0 HD3 ARG A 43 8.295 -3.825 -11.716 1.00 0.00 H new ATOM 0 HE ARG A 43 5.541 -2.816 -11.515 1.00 0.00 H new ATOM 0 HH11 ARG A 43 8.706 -2.338 -13.194 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.921 -1.562 -14.573 1.00 0.00 H new ATOM 0 HH21 ARG A 43 4.681 -1.859 -13.311 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.709 -1.301 -14.635 1.00 0.00 H new ATOM 329 N CYS A 44 4.183 -3.548 -6.786 1.00 0.00 N ATOM 330 CA CYS A 44 3.006 -3.607 -5.881 1.00 0.00 C ATOM 331 C CYS A 44 2.786 -2.312 -5.019 1.00 0.00 C ATOM 332 O CYS A 44 1.803 -2.252 -4.285 1.00 0.00 O ATOM 333 CB CYS A 44 3.230 -4.871 -5.031 1.00 0.00 C ATOM 334 SG CYS A 44 1.792 -5.413 -4.102 1.00 0.00 S ATOM 0 H CYS A 44 4.959 -4.135 -6.480 1.00 0.00 H new ATOM 0 HA CYS A 44 2.079 -3.657 -6.452 1.00 0.00 H new ATOM 0 HB2 CYS A 44 3.549 -5.681 -5.686 1.00 0.00 H new ATOM 0 HB3 CYS A 44 4.047 -4.684 -4.334 1.00 0.00 H new ATOM 335 N CYS A 45 3.689 -1.313 -5.132 1.00 0.00 N ATOM 336 CA CYS A 45 3.463 0.085 -4.765 1.00 0.00 C ATOM 337 C CYS A 45 2.907 0.912 -5.962 1.00 0.00 C ATOM 338 O CYS A 45 2.045 1.749 -5.676 1.00 0.00 O ATOM 339 CB CYS A 45 4.763 0.760 -4.332 1.00 0.00 C ATOM 340 SG CYS A 45 5.318 0.191 -2.724 1.00 0.00 S ATOM 0 H CYS A 45 4.628 -1.474 -5.496 1.00 0.00 H new ATOM 0 HA CYS A 45 2.742 0.066 -3.947 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.538 0.562 -5.073 1.00 0.00 H new ATOM 0 HB3 CYS A 45 4.618 1.840 -4.303 1.00 0.00 H new ATOM 341 N GLU A 46 3.341 0.745 -7.260 1.00 0.00 N ATOM 342 CA GLU A 46 2.586 1.354 -8.394 1.00 0.00 C ATOM 343 C GLU A 46 1.133 0.801 -8.392 1.00 0.00 C ATOM 344 O GLU A 46 0.204 1.600 -8.343 1.00 0.00 O ATOM 345 CB GLU A 46 3.330 1.072 -9.722 1.00 0.00 C ATOM 346 CG GLU A 46 2.710 1.830 -10.906 1.00 0.00 C ATOM 347 CD GLU A 46 3.445 1.659 -12.221 1.00 0.00 C ATOM 348 OE1 GLU A 46 3.884 0.584 -12.625 1.00 0.00 O ATOM 349 OE2 GLU A 46 3.527 2.837 -12.915 1.00 0.00 O ATOM 0 H GLU A 46 4.171 0.218 -7.529 1.00 0.00 H new ATOM 0 HA GLU A 46 2.527 2.437 -8.283 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.377 1.358 -9.618 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.310 0.002 -9.927 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.680 1.496 -11.035 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.673 2.892 -10.661 1.00 0.00 H new ATOM 350 N THR A 47 0.996 -0.533 -8.369 1.00 0.00 N ATOM 351 CA THR A 47 -0.271 -1.228 -8.124 1.00 0.00 C ATOM 352 C THR A 47 -0.503 -1.634 -6.598 1.00 0.00 C ATOM 353 O THR A 47 -0.846 -2.765 -6.245 1.00 0.00 O ATOM 354 CB THR A 47 -0.271 -2.491 -9.044 1.00 0.00 C ATOM 355 OG1 THR A 47 0.106 -2.184 -10.390 1.00 0.00 O ATOM 356 CG2 THR A 47 -1.680 -3.067 -9.135 1.00 0.00 C ATOM 0 H THR A 47 1.779 -1.168 -8.523 1.00 0.00 H new ATOM 0 HA THR A 47 -1.096 -0.553 -8.354 1.00 0.00 H new ATOM 0 HB THR A 47 0.441 -3.187 -8.600 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.094 -3.003 -10.928 1.00 0.00 H new ATOM 0 HG21 THR A 47 -1.672 -3.947 -9.778 1.00 0.00 H new ATOM 0 HG22 THR A 47 -2.023 -3.348 -8.139 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.353 -2.318 -9.553 1.00 0.00 H new ATOM 357 N HIS A 48 -0.298 -0.654 -5.714 1.00 0.00 N ATOM 358 CA HIS A 48 -1.122 -0.507 -4.485 1.00 0.00 C ATOM 359 C HIS A 48 -2.139 0.537 -5.022 1.00 0.00 C ATOM 360 O HIS A 48 -3.158 0.080 -5.504 1.00 0.00 O ATOM 361 CB HIS A 48 -0.444 -0.156 -3.148 1.00 0.00 C ATOM 362 CG HIS A 48 -1.543 -0.084 -2.017 1.00 0.00 C ATOM 363 ND1 HIS A 48 -1.768 1.053 -1.227 1.00 0.00 N ATOM 364 CD2 HIS A 48 -2.582 -1.022 -1.784 1.00 0.00 C ATOM 365 CE1 HIS A 48 -2.905 0.664 -0.592 1.00 0.00 C ATOM 366 NE2 HIS A 48 -3.530 -0.474 -0.968 1.00 0.00 N ATOM 0 H HIS A 48 0.428 0.055 -5.816 1.00 0.00 H new ATOM 0 HA HIS A 48 -1.524 -1.454 -4.126 1.00 0.00 H new ATOM 0 HB2 HIS A 48 0.305 -0.907 -2.897 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.076 0.799 -3.229 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.618 -2.021 -2.192 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.308 1.263 0.211 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.453 -0.826 -0.713 1.00 0.00 H new ATOM 367 N ASP A 49 -1.802 1.842 -5.010 1.00 0.00 N ATOM 368 CA ASP A 49 -2.431 2.938 -5.795 1.00 0.00 C ATOM 369 C ASP A 49 -3.205 2.611 -7.112 1.00 0.00 C ATOM 370 O ASP A 49 -4.294 3.155 -7.301 1.00 0.00 O ATOM 371 CB ASP A 49 -1.304 3.944 -6.148 1.00 0.00 C ATOM 372 CG ASP A 49 -0.563 4.602 -4.979 1.00 0.00 C ATOM 373 OD1 ASP A 49 0.193 3.987 -4.228 1.00 0.00 O ATOM 374 OD2 ASP A 49 -0.839 5.940 -4.866 1.00 0.00 O ATOM 0 H ASP A 49 -1.042 2.185 -4.422 1.00 0.00 H new ATOM 0 HA ASP A 49 -3.222 3.298 -5.138 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.570 3.426 -6.765 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.736 4.734 -6.762 1.00 0.00 H new ATOM 375 N ASN A 50 -2.637 1.757 -7.989 1.00 0.00 N ATOM 376 CA ASN A 50 -3.281 1.299 -9.245 1.00 0.00 C ATOM 377 C ASN A 50 -4.287 0.117 -9.144 1.00 0.00 C ATOM 378 O ASN A 50 -5.081 -0.073 -10.069 1.00 0.00 O ATOM 379 CB ASN A 50 -2.333 1.236 -10.462 1.00 0.00 C ATOM 380 CG ASN A 50 -1.895 2.630 -10.962 1.00 0.00 C ATOM 381 OD1 ASN A 50 -2.719 3.482 -11.290 1.00 0.00 O ATOM 382 ND2 ASN A 50 -0.609 2.902 -11.039 1.00 0.00 N ATOM 0 H ASN A 50 -1.708 1.360 -7.846 1.00 0.00 H new ATOM 0 HA ASN A 50 -3.957 2.128 -9.452 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -1.448 0.658 -10.196 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -2.829 0.705 -11.274 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.300 3.816 -11.370 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.078 2.199 -10.768 1.00 0.00 H new ATOM 383 N CYS A 51 -4.272 -0.669 -8.067 1.00 0.00 N ATOM 384 CA CYS A 51 -5.507 -1.316 -7.558 1.00 0.00 C ATOM 385 C CYS A 51 -6.192 -0.521 -6.371 1.00 0.00 C ATOM 386 O CYS A 51 -7.146 -1.058 -5.800 1.00 0.00 O ATOM 387 CB CYS A 51 -5.154 -2.740 -7.099 1.00 0.00 C ATOM 388 SG CYS A 51 -4.112 -2.674 -5.634 1.00 0.00 S ATOM 0 H CYS A 51 -3.433 -0.879 -7.527 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.233 -1.329 -8.371 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -6.065 -3.297 -6.882 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.638 -3.271 -7.899 1.00 0.00 H new ATOM 389 N TYR A 52 -5.727 0.701 -5.983 1.00 0.00 N ATOM 390 CA TYR A 52 -6.251 1.411 -4.767 1.00 0.00 C ATOM 391 C TYR A 52 -7.508 2.226 -5.130 1.00 0.00 C ATOM 392 O TYR A 52 -8.528 2.189 -4.438 1.00 0.00 O ATOM 393 CB TYR A 52 -5.232 2.344 -4.055 1.00 0.00 C ATOM 394 CG TYR A 52 -5.411 2.711 -2.582 1.00 0.00 C ATOM 395 CD1 TYR A 52 -6.397 2.104 -1.810 1.00 0.00 C ATOM 396 CD2 TYR A 52 -4.441 3.519 -1.937 1.00 0.00 C ATOM 397 CE1 TYR A 52 -6.349 2.203 -0.434 1.00 0.00 C ATOM 398 CE2 TYR A 52 -4.435 3.639 -0.542 1.00 0.00 C ATOM 399 CZ TYR A 52 -5.385 2.956 0.206 1.00 0.00 C ATOM 400 OH TYR A 52 -5.332 2.935 1.562 1.00 0.00 O ATOM 0 H TYR A 52 -5.001 1.213 -6.483 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.480 0.616 -4.057 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.250 1.882 -4.154 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.203 3.277 -4.617 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -7.197 1.557 -2.286 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.703 4.045 -2.525 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -7.085 1.678 0.157 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -3.698 4.258 -0.052 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.284 2.007 1.873 1.00 0.00 H new ATOM 401 N ARG A 53 -7.352 2.963 -6.235 1.00 0.00 N ATOM 402 CA ARG A 53 -8.365 3.706 -6.932 1.00 0.00 C ATOM 403 C ARG A 53 -9.755 3.099 -7.099 1.00 0.00 C ATOM 404 O ARG A 53 -10.739 3.815 -6.941 1.00 0.00 O ATOM 405 CB ARG A 53 -7.599 4.223 -8.187 1.00 0.00 C ATOM 406 CG ARG A 53 -7.901 3.422 -9.417 1.00 0.00 C ATOM 407 CD ARG A 53 -6.985 2.278 -9.690 1.00 0.00 C ATOM 408 NE ARG A 53 -6.052 2.709 -10.748 1.00 0.00 N ATOM 409 CZ ARG A 53 -6.180 2.397 -12.057 1.00 0.00 C ATOM 410 NH1 ARG A 53 -7.165 1.654 -12.555 1.00 0.00 N ATOM 411 NH2 ARG A 53 -5.279 2.859 -12.899 1.00 0.00 N ATOM 0 H ARG A 53 -6.441 3.051 -6.685 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.765 4.522 -6.331 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -7.861 5.266 -8.364 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -6.527 4.192 -7.992 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.918 3.037 -9.336 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.881 4.091 -10.277 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.441 1.997 -8.788 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.549 1.401 -10.008 1.00 0.00 H new ATOM 0 HE ARG A 53 -5.255 3.282 -10.473 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.885 1.281 -11.936 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.200 1.458 -13.555 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -4.510 3.436 -12.557 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -5.350 2.640 -13.893 1.00 0.00 H new ATOM 412 N ASP A 54 -9.785 1.810 -7.495 1.00 0.00 N ATOM 413 CA ASP A 54 -10.951 1.225 -8.238 1.00 0.00 C ATOM 414 C ASP A 54 -12.288 0.982 -7.489 1.00 0.00 C ATOM 415 O ASP A 54 -13.274 0.520 -8.051 1.00 0.00 O ATOM 416 CB ASP A 54 -10.407 -0.012 -8.957 1.00 0.00 C ATOM 417 CG ASP A 54 -11.180 -0.487 -10.180 1.00 0.00 C ATOM 418 OD1 ASP A 54 -10.991 -0.036 -11.309 1.00 0.00 O ATOM 419 OD2 ASP A 54 -12.100 -1.458 -9.880 1.00 0.00 O ATOM 0 H ASP A 54 -9.028 1.148 -7.321 1.00 0.00 H new ATOM 0 HA ASP A 54 -11.313 1.996 -8.919 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -9.381 0.195 -9.262 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -10.367 -0.832 -8.240 1.00 0.00 H new ATOM 420 N ALA A 55 -12.230 1.354 -6.221 1.00 0.00 N ATOM 421 CA ALA A 55 -13.343 1.773 -5.362 1.00 0.00 C ATOM 422 C ALA A 55 -14.269 2.867 -5.958 1.00 0.00 C ATOM 423 O ALA A 55 -15.487 2.816 -5.784 1.00 0.00 O ATOM 424 CB ALA A 55 -12.642 2.432 -4.144 1.00 0.00 C ATOM 0 H ALA A 55 -11.341 1.375 -5.721 1.00 0.00 H new ATOM 0 HA ALA A 55 -13.974 0.905 -5.172 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -13.394 2.782 -3.437 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.997 1.701 -3.656 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.042 3.277 -4.483 1.00 0.00 H new ATOM 425 N LYS A 56 -13.657 3.848 -6.639 1.00 0.00 N ATOM 426 CA LYS A 56 -14.315 4.831 -7.479 1.00 0.00 C ATOM 427 C LYS A 56 -15.258 4.272 -8.575 1.00 0.00 C ATOM 428 O LYS A 56 -16.356 4.779 -8.808 1.00 0.00 O ATOM 429 CB LYS A 56 -13.181 5.811 -7.823 1.00 0.00 C ATOM 430 CG LYS A 56 -12.791 5.808 -9.265 1.00 0.00 C ATOM 431 CD LYS A 56 -12.070 4.624 -9.830 1.00 0.00 C ATOM 432 CE LYS A 56 -10.694 4.893 -10.421 1.00 0.00 C ATOM 433 NZ LYS A 56 -10.692 5.791 -11.593 1.00 0.00 N ATOM 0 H LYS A 56 -12.645 3.974 -6.610 1.00 0.00 H new ATOM 0 HA LYS A 56 -15.119 5.384 -6.994 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.488 6.819 -7.542 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -12.307 5.565 -7.220 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.700 5.947 -9.850 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -12.165 6.684 -9.436 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.964 3.879 -9.041 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -12.695 4.181 -10.605 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -10.059 5.326 -9.648 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -10.244 3.942 -10.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.717 5.919 -11.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.269 5.374 -12.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -11.089 6.714 -11.324 1.00 0.00 H new ATOM 434 N ASN A 57 -14.738 3.230 -9.223 1.00 0.00 N ATOM 435 CA ASN A 57 -15.420 2.464 -10.291 1.00 0.00 C ATOM 436 C ASN A 57 -16.413 1.384 -9.788 1.00 0.00 C ATOM 437 O ASN A 57 -17.432 1.158 -10.441 1.00 0.00 O ATOM 438 CB ASN A 57 -14.278 1.829 -11.128 1.00 0.00 C ATOM 439 CG ASN A 57 -14.669 0.991 -12.338 1.00 0.00 C ATOM 440 OD1 ASN A 57 -15.567 1.337 -13.106 1.00 0.00 O ATOM 441 ND2 ASN A 57 -13.977 -0.107 -12.564 1.00 0.00 N ATOM 0 H ASN A 57 -13.803 2.877 -9.021 1.00 0.00 H new ATOM 0 HA ASN A 57 -16.055 3.136 -10.869 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -13.628 2.633 -11.473 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -13.684 1.202 -10.463 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -14.183 -0.680 -13.382 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -13.235 -0.384 -11.921 1.00 0.00 H new ATOM 442 N LEU A 58 -16.040 0.738 -8.682 1.00 0.00 N ATOM 443 CA LEU A 58 -16.670 -0.439 -8.054 1.00 0.00 C ATOM 444 C LEU A 58 -18.097 -0.837 -8.380 1.00 0.00 C ATOM 445 O LEU A 58 -19.024 -0.030 -8.494 1.00 0.00 O ATOM 446 CB LEU A 58 -16.272 -0.324 -6.576 1.00 0.00 C ATOM 447 CG LEU A 58 -16.234 -1.483 -5.605 1.00 0.00 C ATOM 448 CD1 LEU A 58 -15.469 -2.637 -6.194 1.00 0.00 C ATOM 449 CD2 LEU A 58 -15.471 -1.029 -4.345 1.00 0.00 C ATOM 0 H LEU A 58 -15.223 1.045 -8.154 1.00 0.00 H new ATOM 0 HA LEU A 58 -16.293 -1.343 -8.532 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -15.273 0.111 -6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -16.945 0.414 -6.139 1.00 0.00 H new ATOM 0 HG LEU A 58 -17.255 -1.790 -5.379 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.451 -3.463 -5.483 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -15.953 -2.962 -7.115 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -14.448 -2.323 -6.412 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -15.430 -1.850 -3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -14.457 -0.736 -4.619 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -15.985 -0.180 -3.895 1.00 0.00 H new ATOM 450 N ASP A 59 -18.213 -2.169 -8.479 1.00 0.00 N ATOM 451 CA ASP A 59 -19.504 -2.891 -8.505 1.00 0.00 C ATOM 452 C ASP A 59 -20.428 -2.559 -7.285 1.00 0.00 C ATOM 453 O ASP A 59 -21.656 -2.595 -7.387 1.00 0.00 O ATOM 454 CB ASP A 59 -19.085 -4.388 -8.286 1.00 0.00 C ATOM 455 CG ASP A 59 -18.612 -5.119 -9.531 1.00 0.00 C ATOM 456 OD1 ASP A 59 -19.658 -5.591 -10.283 1.00 0.00 O ATOM 457 OD2 ASP A 59 -17.426 -5.262 -9.823 1.00 0.00 O ATOM 0 H ASP A 59 -17.405 -2.788 -8.544 1.00 0.00 H new ATOM 0 HA ASP A 59 -20.041 -2.643 -9.420 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -18.289 -4.420 -7.542 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -19.934 -4.928 -7.868 1.00 0.00 H new ATOM 458 N SER A 60 -19.756 -2.315 -6.157 1.00 0.00 N ATOM 459 CA SER A 60 -20.362 -2.070 -4.859 1.00 0.00 C ATOM 460 C SER A 60 -20.285 -0.582 -4.493 1.00 0.00 C ATOM 461 O SER A 60 -21.149 -0.141 -3.730 1.00 0.00 O ATOM 462 CB SER A 60 -19.533 -2.951 -3.905 1.00 0.00 C ATOM 463 OG SER A 60 -20.281 -3.323 -2.759 1.00 0.00 O ATOM 0 H SER A 60 -18.737 -2.283 -6.129 1.00 0.00 H new ATOM 0 HA SER A 60 -21.424 -2.312 -4.822 1.00 0.00 H new ATOM 0 HB2 SER A 60 -19.201 -3.846 -4.431 1.00 0.00 H new ATOM 0 HB3 SER A 60 -18.637 -2.412 -3.597 1.00 0.00 H new ATOM 0 HG SER A 60 -19.832 -2.992 -1.953 1.00 0.00 H new ATOM 464 N CYS A 61 -19.272 0.176 -5.014 1.00 0.00 N ATOM 465 CA CYS A 61 -19.096 1.587 -4.598 1.00 0.00 C ATOM 466 C CYS A 61 -18.822 2.556 -5.769 1.00 0.00 C ATOM 467 O CYS A 61 -18.161 2.216 -6.752 1.00 0.00 O ATOM 468 CB CYS A 61 -18.010 1.619 -3.509 1.00 0.00 C ATOM 469 SG CYS A 61 -18.757 2.106 -1.946 1.00 0.00 S ATOM 0 H CYS A 61 -18.593 -0.159 -5.697 1.00 0.00 H new ATOM 0 HA CYS A 61 -20.036 1.961 -4.191 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -17.544 0.638 -3.414 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -17.222 2.321 -3.784 1.00 0.00 H new ATOM 470 N LYS A 62 -19.354 3.784 -5.653 1.00 0.00 N ATOM 471 CA LYS A 62 -19.138 4.856 -6.659 1.00 0.00 C ATOM 472 C LYS A 62 -18.476 6.080 -5.948 1.00 0.00 C ATOM 473 O LYS A 62 -19.101 7.130 -5.762 1.00 0.00 O ATOM 474 CB LYS A 62 -20.460 5.228 -7.374 1.00 0.00 C ATOM 475 CG LYS A 62 -20.908 4.328 -8.535 1.00 0.00 C ATOM 476 CD LYS A 62 -21.383 2.903 -8.251 1.00 0.00 C ATOM 477 CE LYS A 62 -22.525 2.715 -7.242 1.00 0.00 C ATOM 478 NZ LYS A 62 -23.816 3.275 -7.688 1.00 0.00 N ATOM 0 H LYS A 62 -19.942 4.068 -4.869 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.466 4.503 -7.441 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -21.255 5.239 -6.629 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.364 6.245 -7.753 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -21.717 4.843 -9.053 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -20.075 4.260 -9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -21.696 2.460 -9.197 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -20.526 2.329 -7.898 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.651 1.650 -7.045 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -22.244 3.183 -6.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -24.537 3.110 -6.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -23.714 4.297 -7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -24.108 2.812 -8.572 1.00 0.00 H new ATOM 479 N PHE A 63 -17.184 5.933 -5.586 1.00 0.00 N ATOM 480 CA PHE A 63 -16.424 6.974 -4.869 1.00 0.00 C ATOM 481 C PHE A 63 -15.895 8.140 -5.745 1.00 0.00 C ATOM 482 O PHE A 63 -15.835 8.090 -6.976 1.00 0.00 O ATOM 483 CB PHE A 63 -15.289 6.240 -4.071 1.00 0.00 C ATOM 484 CG PHE A 63 -15.179 6.795 -2.649 1.00 0.00 C ATOM 485 CD1 PHE A 63 -16.185 6.500 -1.720 1.00 0.00 C ATOM 486 CD2 PHE A 63 -14.189 7.723 -2.306 1.00 0.00 C ATOM 487 CE1 PHE A 63 -16.225 7.144 -0.487 1.00 0.00 C ATOM 488 CE2 PHE A 63 -14.226 8.364 -1.069 1.00 0.00 C ATOM 489 CZ PHE A 63 -15.245 8.079 -0.159 1.00 0.00 C ATOM 0 H PHE A 63 -16.642 5.092 -5.783 1.00 0.00 H new ATOM 0 HA PHE A 63 -17.104 7.497 -4.197 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -15.497 5.171 -4.034 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -14.337 6.362 -4.588 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -16.938 5.765 -1.963 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -13.393 7.943 -3.002 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -17.015 6.919 0.215 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -13.463 9.084 -0.814 1.00 0.00 H new ATOM 0 HZ PHE A 63 -15.274 8.582 0.797 1.00 0.00 H new ATOM 490 N LEU A 64 -15.523 9.194 -5.022 1.00 0.00 N ATOM 491 CA LEU A 64 -15.197 10.514 -5.555 1.00 0.00 C ATOM 492 C LEU A 64 -13.763 10.841 -6.030 1.00 0.00 C ATOM 493 O LEU A 64 -13.612 11.423 -7.107 1.00 0.00 O ATOM 494 CB LEU A 64 -15.443 11.440 -4.328 1.00 0.00 C ATOM 495 CG LEU A 64 -16.910 11.824 -4.038 1.00 0.00 C ATOM 496 CD1 LEU A 64 -17.888 10.704 -3.683 1.00 0.00 C ATOM 497 CD2 LEU A 64 -16.749 12.769 -2.846 1.00 0.00 C ATOM 0 H LEU A 64 -15.437 9.149 -4.007 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.786 10.619 -6.466 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -15.038 10.949 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -14.872 12.357 -4.473 1.00 0.00 H new ATOM 0 HG LEU A 64 -17.367 12.224 -4.943 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -18.877 11.127 -3.507 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -17.939 9.991 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.546 10.194 -2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -17.729 13.125 -2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -16.272 12.238 -2.022 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -16.131 13.619 -3.136 1.00 0.00 H new ATOM 498 N VAL A 65 -12.748 10.605 -5.170 1.00 0.00 N ATOM 499 CA VAL A 65 -11.609 11.541 -5.051 1.00 0.00 C ATOM 500 C VAL A 65 -10.478 11.288 -6.081 1.00 0.00 C ATOM 501 O VAL A 65 -10.716 11.266 -7.292 1.00 0.00 O ATOM 502 CB VAL A 65 -11.234 11.725 -3.524 1.00 0.00 C ATOM 503 CG1 VAL A 65 -12.291 12.523 -2.727 1.00 0.00 C ATOM 504 CG2 VAL A 65 -10.894 10.434 -2.760 1.00 0.00 C ATOM 0 H VAL A 65 -12.693 9.790 -4.559 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.898 12.541 -5.374 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.312 12.304 -3.587 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -11.972 12.613 -1.688 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.399 13.517 -3.160 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.248 12.003 -2.769 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -10.653 10.676 -1.725 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.751 9.760 -2.785 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.037 9.949 -3.228 1.00 0.00 H new ATOM 505 N ASP A 66 -9.259 11.157 -5.575 1.00 0.00 N ATOM 506 CA ASP A 66 -8.023 10.920 -6.359 1.00 0.00 C ATOM 507 C ASP A 66 -7.769 9.398 -6.610 1.00 0.00 C ATOM 508 O ASP A 66 -7.580 8.963 -7.747 1.00 0.00 O ATOM 509 CB ASP A 66 -6.824 11.533 -5.559 1.00 0.00 C ATOM 510 CG ASP A 66 -6.715 13.050 -5.668 1.00 0.00 C ATOM 511 OD1 ASP A 66 -6.031 13.443 -6.790 1.00 0.00 O ATOM 512 OD2 ASP A 66 -7.194 13.824 -4.840 1.00 0.00 O ATOM 0 H ASP A 66 -9.082 11.213 -4.572 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.128 11.390 -7.337 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.925 11.261 -4.508 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.896 11.086 -5.916 1.00 0.00 H new ATOM 513 N ASN A 67 -7.745 8.668 -5.496 1.00 0.00 N ATOM 514 CA ASN A 67 -7.486 7.220 -5.396 1.00 0.00 C ATOM 515 C ASN A 67 -7.597 7.049 -3.856 1.00 0.00 C ATOM 516 O ASN A 67 -6.628 7.413 -3.176 1.00 0.00 O ATOM 517 CB ASN A 67 -6.188 6.663 -6.016 1.00 0.00 C ATOM 518 CG ASN A 67 -4.843 7.261 -5.613 1.00 0.00 C ATOM 519 OD1 ASN A 67 -4.515 8.392 -5.968 1.00 0.00 O ATOM 520 ND2 ASN A 67 -4.032 6.524 -4.872 1.00 0.00 N ATOM 0 H ASN A 67 -7.915 9.089 -4.583 1.00 0.00 H new ATOM 0 HA ASN A 67 -8.174 6.628 -6.000 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.151 5.597 -5.792 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.276 6.759 -7.098 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -3.124 6.892 -4.589 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.315 5.587 -4.584 1.00 0.00 H new ATOM 521 N PRO A 68 -8.720 6.585 -3.243 1.00 0.00 N ATOM 522 CA PRO A 68 -8.954 6.782 -1.787 1.00 0.00 C ATOM 523 C PRO A 68 -7.961 6.091 -0.851 1.00 0.00 C ATOM 524 O PRO A 68 -7.927 4.862 -0.759 1.00 0.00 O ATOM 525 CB PRO A 68 -10.430 6.335 -1.580 1.00 0.00 C ATOM 526 CG PRO A 68 -10.766 5.465 -2.806 1.00 0.00 C ATOM 527 CD PRO A 68 -9.920 6.072 -3.938 1.00 0.00 C ATOM 0 HA PRO A 68 -8.784 7.822 -1.508 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.544 5.771 -0.654 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.096 7.195 -1.514 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -10.511 4.419 -2.635 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -11.830 5.500 -3.040 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -9.660 5.325 -4.688 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -10.455 6.869 -4.454 1.00 0.00 H new ATOM 528 N TYR A 69 -7.181 6.934 -0.137 1.00 0.00 N ATOM 529 CA TYR A 69 -6.435 6.494 1.061 1.00 0.00 C ATOM 530 C TYR A 69 -7.513 6.608 2.210 1.00 0.00 C ATOM 531 O TYR A 69 -7.456 7.580 2.975 1.00 0.00 O ATOM 532 CB TYR A 69 -5.243 7.424 1.492 1.00 0.00 C ATOM 533 CG TYR A 69 -3.877 7.485 0.731 1.00 0.00 C ATOM 534 CD1 TYR A 69 -3.720 6.918 -0.544 1.00 0.00 C ATOM 535 CD2 TYR A 69 -2.751 8.177 1.248 1.00 0.00 C ATOM 536 CE1 TYR A 69 -2.548 7.072 -1.295 1.00 0.00 C ATOM 537 CE2 TYR A 69 -1.572 8.327 0.495 1.00 0.00 C ATOM 538 CZ TYR A 69 -1.487 7.794 -0.782 1.00 0.00 C ATOM 539 OH TYR A 69 -0.368 7.975 -1.538 1.00 0.00 O ATOM 0 H TYR A 69 -7.053 7.919 -0.370 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.998 5.515 0.866 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -5.635 8.441 1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.008 7.164 2.524 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -4.533 6.342 -0.961 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -2.800 8.598 2.241 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -2.473 6.626 -2.276 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -0.730 8.859 0.913 1.00 0.00 H new ATOM 0 HH TYR A 69 -0.129 8.925 -1.546 1.00 0.00 H new ATOM 540 N THR A 70 -8.524 5.703 2.316 1.00 0.00 N ATOM 541 CA THR A 70 -9.601 5.936 3.288 1.00 0.00 C ATOM 542 C THR A 70 -10.632 4.824 3.684 1.00 0.00 C ATOM 543 O THR A 70 -11.026 4.837 4.852 1.00 0.00 O ATOM 544 CB THR A 70 -10.495 7.227 2.944 1.00 0.00 C ATOM 545 OG1 THR A 70 -10.269 7.786 1.645 1.00 0.00 O ATOM 546 CG2 THR A 70 -10.273 8.306 3.997 1.00 0.00 C ATOM 0 H THR A 70 -8.607 4.849 1.765 1.00 0.00 H new ATOM 0 HA THR A 70 -8.937 6.026 4.148 1.00 0.00 H new ATOM 0 HB THR A 70 -11.526 6.873 2.946 1.00 0.00 H new ATOM 0 HG1 THR A 70 -10.852 8.563 1.517 1.00 0.00 H new ATOM 0 HG21 THR A 70 -10.882 9.178 3.758 1.00 0.00 H new ATOM 0 HG22 THR A 70 -10.557 7.922 4.977 1.00 0.00 H new ATOM 0 HG23 THR A 70 -9.221 8.590 4.010 1.00 0.00 H new ATOM 547 N GLU A 71 -11.143 3.947 2.789 1.00 0.00 N ATOM 548 CA GLU A 71 -12.446 3.248 3.030 1.00 0.00 C ATOM 549 C GLU A 71 -12.707 2.346 4.275 1.00 0.00 C ATOM 550 O GLU A 71 -13.766 2.479 4.894 1.00 0.00 O ATOM 551 CB GLU A 71 -12.887 2.419 1.774 1.00 0.00 C ATOM 552 CG GLU A 71 -12.930 3.164 0.433 1.00 0.00 C ATOM 553 CD GLU A 71 -13.853 4.366 0.383 1.00 0.00 C ATOM 554 OE1 GLU A 71 -15.159 4.011 0.160 1.00 0.00 O ATOM 555 OE2 GLU A 71 -13.457 5.521 0.533 1.00 0.00 O ATOM 0 H GLU A 71 -10.691 3.704 1.908 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.032 4.139 3.257 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.208 1.572 1.671 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -13.879 2.011 1.968 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.920 3.493 0.187 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.234 2.462 -0.343 1.00 0.00 H new ATOM 556 N SER A 72 -11.798 1.418 4.581 1.00 0.00 N ATOM 557 CA SER A 72 -12.141 0.193 5.350 1.00 0.00 C ATOM 558 C SER A 72 -11.451 0.010 6.734 1.00 0.00 C ATOM 559 O SER A 72 -10.969 0.963 7.347 1.00 0.00 O ATOM 560 CB SER A 72 -11.727 -0.911 4.317 1.00 0.00 C ATOM 561 OG SER A 72 -12.284 -2.166 4.678 1.00 0.00 O ATOM 0 H SER A 72 -10.816 1.480 4.314 1.00 0.00 H new ATOM 0 HA SER A 72 -13.183 0.190 5.670 1.00 0.00 H new ATOM 0 HB2 SER A 72 -12.066 -0.630 3.320 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.641 -0.988 4.274 1.00 0.00 H new ATOM 0 HG SER A 72 -11.634 -2.671 5.210 1.00 0.00 H new ATOM 562 N TYR A 73 -11.503 -1.252 7.214 1.00 0.00 N ATOM 563 CA TYR A 73 -10.642 -1.869 8.225 1.00 0.00 C ATOM 564 C TYR A 73 -11.232 -2.036 9.638 1.00 0.00 C ATOM 565 O TYR A 73 -11.879 -1.154 10.206 1.00 0.00 O ATOM 566 CB TYR A 73 -9.210 -1.317 8.340 1.00 0.00 C ATOM 567 CG TYR A 73 -8.289 -1.895 7.294 1.00 0.00 C ATOM 568 CD1 TYR A 73 -7.811 -3.183 7.517 1.00 0.00 C ATOM 569 CD2 TYR A 73 -7.962 -1.244 6.116 1.00 0.00 C ATOM 570 CE1 TYR A 73 -7.036 -3.842 6.586 1.00 0.00 C ATOM 571 CE2 TYR A 73 -7.141 -1.872 5.192 1.00 0.00 C ATOM 572 CZ TYR A 73 -6.666 -3.167 5.428 1.00 0.00 C ATOM 573 OH TYR A 73 -5.726 -3.724 4.634 1.00 0.00 O ATOM 0 H TYR A 73 -12.205 -1.909 6.873 1.00 0.00 H new ATOM 0 HA TYR A 73 -10.582 -2.862 7.779 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -9.232 -0.232 8.242 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -8.816 -1.539 9.331 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -8.054 -3.680 8.445 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -8.344 -0.253 5.918 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -6.723 -4.862 6.753 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -6.866 -1.358 4.283 1.00 0.00 H new ATOM 0 HH TYR A 73 -6.156 -4.125 3.850 1.00 0.00 H new ATOM 574 N SER A 74 -10.898 -3.236 10.153 1.00 0.00 N ATOM 575 CA SER A 74 -11.356 -3.805 11.442 1.00 0.00 C ATOM 576 C SER A 74 -10.541 -5.124 11.562 1.00 0.00 C ATOM 577 O SER A 74 -10.997 -6.188 11.130 1.00 0.00 O ATOM 578 CB SER A 74 -12.864 -4.007 11.219 1.00 0.00 C ATOM 579 OG SER A 74 -13.519 -4.637 12.300 1.00 0.00 O ATOM 0 H SER A 74 -10.270 -3.869 9.658 1.00 0.00 H new ATOM 0 HA SER A 74 -11.213 -3.226 12.354 1.00 0.00 H new ATOM 0 HB2 SER A 74 -13.329 -3.037 11.040 1.00 0.00 H new ATOM 0 HB3 SER A 74 -13.012 -4.603 10.319 1.00 0.00 H new ATOM 0 HG SER A 74 -14.114 -5.337 11.959 1.00 0.00 H new ATOM 580 N TYR A 75 -9.328 -5.079 12.128 1.00 0.00 N ATOM 581 CA TYR A 75 -8.246 -6.002 11.766 1.00 0.00 C ATOM 582 C TYR A 75 -7.638 -6.634 13.027 1.00 0.00 C ATOM 583 O TYR A 75 -8.333 -6.996 13.983 1.00 0.00 O ATOM 584 CB TYR A 75 -7.324 -5.103 10.853 1.00 0.00 C ATOM 585 CG TYR A 75 -6.688 -3.847 11.492 1.00 0.00 C ATOM 586 CD1 TYR A 75 -7.334 -2.607 11.675 1.00 0.00 C ATOM 587 CD2 TYR A 75 -5.442 -4.015 12.051 1.00 0.00 C ATOM 588 CE1 TYR A 75 -6.748 -1.617 12.470 1.00 0.00 C ATOM 589 CE2 TYR A 75 -4.858 -3.055 12.863 1.00 0.00 C ATOM 590 CZ TYR A 75 -5.504 -1.848 13.077 1.00 0.00 C ATOM 591 OH TYR A 75 -4.943 -0.892 13.871 1.00 0.00 O ATOM 0 H TYR A 75 -9.070 -4.404 12.848 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.522 -6.897 11.209 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -6.518 -5.729 10.470 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.913 -4.781 9.994 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -8.285 -2.421 11.199 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.900 -4.927 11.850 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -7.253 -0.674 12.617 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.902 -3.247 13.327 1.00 0.00 H new ATOM 0 HH TYR A 75 -4.083 -1.214 14.213 1.00 0.00 H new ATOM 592 N SER A 76 -6.321 -6.834 12.953 1.00 0.00 N ATOM 593 CA SER A 76 -5.552 -7.718 13.834 1.00 0.00 C ATOM 594 C SER A 76 -3.996 -7.465 13.652 1.00 0.00 C ATOM 595 O SER A 76 -3.542 -6.388 13.269 1.00 0.00 O ATOM 596 CB SER A 76 -5.868 -9.124 13.212 1.00 0.00 C ATOM 597 OG SER A 76 -7.171 -9.610 13.477 1.00 0.00 O ATOM 0 H SER A 76 -5.740 -6.370 12.255 1.00 0.00 H new ATOM 0 HA SER A 76 -5.794 -7.591 14.889 1.00 0.00 H new ATOM 0 HB2 SER A 76 -5.729 -9.068 12.132 1.00 0.00 H new ATOM 0 HB3 SER A 76 -5.143 -9.844 13.590 1.00 0.00 H new ATOM 0 HG SER A 76 -7.286 -10.487 13.054 1.00 0.00 H new ATOM 598 N CYS A 77 -3.244 -8.506 14.027 1.00 0.00 N ATOM 599 CA CYS A 77 -1.895 -8.822 13.629 1.00 0.00 C ATOM 600 C CYS A 77 -1.642 -10.242 14.321 1.00 0.00 C ATOM 601 O CYS A 77 -1.849 -10.394 15.533 1.00 0.00 O ATOM 602 CB CYS A 77 -0.851 -7.874 14.101 1.00 0.00 C ATOM 603 SG CYS A 77 -0.836 -6.225 13.406 1.00 0.00 S ATOM 0 H CYS A 77 -3.611 -9.203 14.675 1.00 0.00 H new ATOM 0 HA CYS A 77 -1.815 -8.789 12.542 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -0.950 -7.780 15.182 1.00 0.00 H new ATOM 0 HB3 CYS A 77 0.122 -8.326 13.909 1.00 0.00 H new ATOM 604 N SER A 78 -1.150 -11.215 13.550 1.00 0.00 N ATOM 605 CA SER A 78 -0.788 -12.551 14.101 1.00 0.00 C ATOM 606 C SER A 78 0.745 -12.577 14.298 1.00 0.00 C ATOM 607 O SER A 78 1.300 -11.802 15.084 1.00 0.00 O ATOM 608 CB SER A 78 -1.531 -13.664 13.334 1.00 0.00 C ATOM 609 OG SER A 78 -2.945 -13.506 13.469 1.00 0.00 O ATOM 0 H SER A 78 -0.989 -11.118 12.548 1.00 0.00 H new ATOM 0 HA SER A 78 -1.151 -12.766 15.106 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.255 -13.634 12.280 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.230 -14.640 13.715 1.00 0.00 H new ATOM 0 HG SER A 78 -3.402 -14.219 12.976 1.00 0.00 H new ATOM 610 N ASN A 79 1.380 -13.468 13.565 1.00 0.00 N ATOM 611 CA ASN A 79 2.851 -13.584 13.408 1.00 0.00 C ATOM 612 C ASN A 79 3.698 -12.302 13.020 1.00 0.00 C ATOM 613 O ASN A 79 4.903 -12.266 13.272 1.00 0.00 O ATOM 614 CB ASN A 79 3.034 -14.575 12.196 1.00 0.00 C ATOM 615 CG ASN A 79 2.943 -16.065 12.518 1.00 0.00 C ATOM 616 OD1 ASN A 79 3.137 -16.517 13.647 1.00 0.00 O ATOM 617 ND2 ASN A 79 2.673 -16.875 11.510 1.00 0.00 N ATOM 0 H ASN A 79 0.877 -14.175 13.028 1.00 0.00 H new ATOM 0 HA ASN A 79 3.221 -13.865 14.394 1.00 0.00 H new ATOM 0 HB2 ASN A 79 2.279 -14.341 11.446 1.00 0.00 H new ATOM 0 HB3 ASN A 79 4.006 -14.382 11.741 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.624 -17.882 11.664 1.00 0.00 H new ATOM 0 HD22 ASN A 79 2.513 -16.493 10.578 1.00 0.00 H new ATOM 618 N THR A 80 3.019 -11.364 12.370 1.00 0.00 N ATOM 619 CA THR A 80 3.528 -10.280 11.486 1.00 0.00 C ATOM 620 C THR A 80 2.415 -10.021 10.367 1.00 0.00 C ATOM 621 O THR A 80 2.228 -8.875 9.959 1.00 0.00 O ATOM 622 CB THR A 80 4.986 -10.314 10.994 1.00 0.00 C ATOM 623 OG1 THR A 80 5.289 -9.123 10.288 1.00 0.00 O ATOM 624 CG2 THR A 80 5.432 -11.441 10.091 1.00 0.00 C ATOM 0 H THR A 80 2.002 -11.325 12.444 1.00 0.00 H new ATOM 0 HA THR A 80 3.663 -9.403 12.120 1.00 0.00 H new ATOM 0 HB THR A 80 5.518 -10.456 11.935 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.517 -8.414 10.925 1.00 0.00 H new ATOM 0 HG21 THR A 80 6.485 -11.311 9.840 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.296 -12.393 10.603 1.00 0.00 H new ATOM 0 HG23 THR A 80 4.837 -11.432 9.178 1.00 0.00 H new ATOM 625 N GLU A 81 1.668 -11.075 9.945 1.00 0.00 N ATOM 626 CA GLU A 81 0.351 -10.975 9.268 1.00 0.00 C ATOM 627 C GLU A 81 -0.775 -10.384 10.161 1.00 0.00 C ATOM 628 O GLU A 81 -0.433 -9.815 11.188 1.00 0.00 O ATOM 629 CB GLU A 81 -0.033 -12.314 8.587 1.00 0.00 C ATOM 630 CG GLU A 81 -0.202 -13.384 9.625 1.00 0.00 C ATOM 631 CD GLU A 81 -0.913 -14.645 9.248 1.00 0.00 C ATOM 632 OE1 GLU A 81 -2.272 -14.534 9.402 1.00 0.00 O ATOM 633 OE2 GLU A 81 -0.338 -15.659 8.854 1.00 0.00 O ATOM 0 H GLU A 81 1.974 -12.040 10.070 1.00 0.00 H new ATOM 0 HA GLU A 81 0.465 -10.236 8.474 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -0.958 -12.193 8.023 1.00 0.00 H new ATOM 0 HB3 GLU A 81 0.739 -12.605 7.875 1.00 0.00 H new ATOM 0 HG2 GLU A 81 0.791 -13.658 9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -0.734 -12.945 10.469 1.00 0.00 H new ATOM 634 N ILE A 82 -2.045 -10.468 9.698 1.00 0.00 N ATOM 635 CA ILE A 82 -3.223 -9.764 10.254 1.00 0.00 C ATOM 636 C ILE A 82 -4.533 -10.567 9.730 1.00 0.00 C ATOM 637 O ILE A 82 -4.711 -11.721 10.123 1.00 0.00 O ATOM 638 CB ILE A 82 -3.143 -8.264 9.852 1.00 0.00 C ATOM 639 CG1 ILE A 82 -1.898 -7.417 10.223 1.00 0.00 C ATOM 640 CG2 ILE A 82 -4.363 -7.392 10.113 1.00 0.00 C ATOM 641 CD1 ILE A 82 -0.846 -7.339 9.127 1.00 0.00 C ATOM 0 H ILE A 82 -2.285 -11.051 8.896 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.269 -9.758 11.343 1.00 0.00 H new ATOM 0 HB ILE A 82 -3.064 -8.508 8.793 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -2.222 -6.407 10.473 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.442 -7.836 11.120 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.160 -6.374 9.782 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.218 -7.788 9.564 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.587 -7.389 11.180 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.010 -6.729 9.468 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.491 -8.342 8.892 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.283 -6.890 8.235 1.00 0.00 H new ATOM 642 N THR A 83 -5.413 -9.908 8.942 1.00 0.00 N ATOM 643 CA THR A 83 -6.753 -10.376 8.474 1.00 0.00 C ATOM 644 C THR A 83 -7.281 -9.250 7.502 1.00 0.00 C ATOM 645 O THR A 83 -6.746 -9.229 6.398 1.00 0.00 O ATOM 646 CB THR A 83 -7.723 -10.875 9.565 1.00 0.00 C ATOM 647 OG1 THR A 83 -8.840 -11.513 8.943 1.00 0.00 O ATOM 648 CG2 THR A 83 -8.246 -9.826 10.535 1.00 0.00 C ATOM 0 H THR A 83 -5.200 -8.975 8.589 1.00 0.00 H new ATOM 0 HA THR A 83 -6.664 -11.318 7.932 1.00 0.00 H new ATOM 0 HB THR A 83 -7.126 -11.556 10.172 1.00 0.00 H new ATOM 0 HG1 THR A 83 -9.459 -11.834 9.632 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.917 -10.297 11.253 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.409 -9.371 11.065 1.00 0.00 H new ATOM 0 HG23 THR A 83 -8.787 -9.058 9.983 1.00 0.00 H new ATOM 649 N CYS A 84 -8.316 -8.413 7.825 1.00 0.00 N ATOM 650 CA CYS A 84 -8.679 -7.175 7.111 1.00 0.00 C ATOM 651 C CYS A 84 -9.890 -6.520 7.838 1.00 0.00 C ATOM 652 O CYS A 84 -9.744 -5.441 8.405 1.00 0.00 O ATOM 653 CB CYS A 84 -8.817 -7.119 5.595 1.00 0.00 C ATOM 654 SG CYS A 84 -10.476 -7.097 4.943 1.00 0.00 S ATOM 0 H CYS A 84 -8.931 -8.600 8.617 1.00 0.00 H new ATOM 0 HA CYS A 84 -7.752 -6.606 7.177 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -8.299 -6.228 5.239 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -8.297 -7.980 5.174 1.00 0.00 H new ATOM 655 N ASN A 85 -11.076 -7.169 7.782 1.00 0.00 N ATOM 656 CA ASN A 85 -12.357 -6.567 8.214 1.00 0.00 C ATOM 657 C ASN A 85 -13.268 -7.579 8.969 1.00 0.00 C ATOM 658 O ASN A 85 -12.815 -8.658 9.368 1.00 0.00 O ATOM 659 CB ASN A 85 -12.976 -5.889 6.961 1.00 0.00 C ATOM 660 CG ASN A 85 -13.801 -6.704 5.967 1.00 0.00 C ATOM 661 OD1 ASN A 85 -14.838 -6.232 5.508 1.00 0.00 O ATOM 662 ND2 ASN A 85 -13.397 -7.920 5.622 1.00 0.00 N ATOM 0 H ASN A 85 -11.171 -8.124 7.436 1.00 0.00 H new ATOM 0 HA ASN A 85 -12.211 -5.799 8.974 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -13.610 -5.076 7.315 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -12.157 -5.435 6.403 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -13.950 -8.475 4.968 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -12.534 -8.300 6.011 1.00 0.00 H new ATOM 663 N SER A 86 -14.555 -7.227 9.183 1.00 0.00 N ATOM 664 CA SER A 86 -15.570 -8.180 9.720 1.00 0.00 C ATOM 665 C SER A 86 -17.019 -7.819 9.246 1.00 0.00 C ATOM 666 O SER A 86 -17.964 -7.855 10.041 1.00 0.00 O ATOM 667 CB SER A 86 -15.450 -8.291 11.262 1.00 0.00 C ATOM 668 OG SER A 86 -15.699 -7.051 11.920 1.00 0.00 O ATOM 0 H SER A 86 -14.922 -6.294 8.995 1.00 0.00 H new ATOM 0 HA SER A 86 -15.363 -9.168 9.309 1.00 0.00 H new ATOM 0 HB2 SER A 86 -16.155 -9.039 11.625 1.00 0.00 H new ATOM 0 HB3 SER A 86 -14.451 -8.642 11.521 1.00 0.00 H new ATOM 0 HG SER A 86 -15.613 -7.172 12.889 1.00 0.00 H new ATOM 669 N LYS A 87 -17.189 -7.505 7.941 1.00 0.00 N ATOM 670 CA LYS A 87 -18.469 -6.999 7.394 1.00 0.00 C ATOM 671 C LYS A 87 -18.658 -7.441 5.893 1.00 0.00 C ATOM 672 O LYS A 87 -19.586 -8.187 5.575 1.00 0.00 O ATOM 673 CB LYS A 87 -18.680 -5.462 7.524 1.00 0.00 C ATOM 674 CG LYS A 87 -17.890 -4.615 8.527 1.00 0.00 C ATOM 675 CD LYS A 87 -16.476 -4.228 8.065 1.00 0.00 C ATOM 676 CE LYS A 87 -15.881 -3.092 8.909 1.00 0.00 C ATOM 677 NZ LYS A 87 -14.605 -2.619 8.345 1.00 0.00 N ATOM 0 H LYS A 87 -16.450 -7.594 7.243 1.00 0.00 H new ATOM 0 HA LYS A 87 -19.233 -7.458 8.021 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -18.495 -5.035 6.538 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -19.736 -5.308 7.745 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -18.452 -3.704 8.735 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.814 -5.164 9.465 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.825 -5.100 8.123 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -16.508 -3.923 7.019 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.588 -2.264 8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.724 -3.439 9.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.355 -1.704 8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.857 -3.312 8.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.701 -2.507 7.316 1.00 0.00 H new ATOM 678 N ASN A 88 -17.777 -6.930 5.021 1.00 0.00 N ATOM 679 CA ASN A 88 -17.771 -7.136 3.567 1.00 0.00 C ATOM 680 C ASN A 88 -18.970 -6.709 2.686 1.00 0.00 C ATOM 681 O ASN A 88 -19.698 -7.530 2.123 1.00 0.00 O ATOM 682 CB ASN A 88 -17.034 -8.385 3.026 1.00 0.00 C ATOM 683 CG ASN A 88 -17.606 -9.753 3.353 1.00 0.00 C ATOM 684 OD1 ASN A 88 -17.453 -10.256 4.466 1.00 0.00 O ATOM 685 ND2 ASN A 88 -18.261 -10.401 2.404 1.00 0.00 N ATOM 0 H ASN A 88 -17.010 -6.331 5.327 1.00 0.00 H new ATOM 0 HA ASN A 88 -17.111 -6.283 3.411 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -16.982 -8.297 1.941 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -16.010 -8.355 3.398 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -18.645 -11.327 2.591 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -18.382 -9.975 1.485 1.00 0.00 H new ATOM 686 N ASN A 89 -19.065 -5.389 2.502 1.00 0.00 N ATOM 687 CA ASN A 89 -19.447 -4.815 1.182 1.00 0.00 C ATOM 688 C ASN A 89 -18.065 -4.505 0.476 1.00 0.00 C ATOM 689 O ASN A 89 -17.075 -4.221 1.155 1.00 0.00 O ATOM 690 CB ASN A 89 -20.247 -3.502 1.299 1.00 0.00 C ATOM 691 CG ASN A 89 -21.645 -3.654 1.899 1.00 0.00 C ATOM 692 OD1 ASN A 89 -22.559 -4.173 1.259 1.00 0.00 O ATOM 693 ND2 ASN A 89 -21.848 -3.208 3.127 1.00 0.00 N ATOM 0 H ASN A 89 -18.888 -4.696 3.230 1.00 0.00 H new ATOM 0 HA ASN A 89 -20.088 -5.510 0.640 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -19.679 -2.800 1.910 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -20.339 -3.059 0.307 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -22.770 -3.292 3.554 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -21.082 -2.780 3.647 1.00 0.00 H new ATOM 694 N ALA A 90 -17.972 -4.540 -0.863 1.00 0.00 N ATOM 695 CA ALA A 90 -16.696 -4.222 -1.571 1.00 0.00 C ATOM 696 C ALA A 90 -16.177 -2.781 -1.304 1.00 0.00 C ATOM 697 O ALA A 90 -14.979 -2.603 -1.115 1.00 0.00 O ATOM 698 CB ALA A 90 -16.783 -4.608 -3.047 1.00 0.00 C ATOM 0 H ALA A 90 -18.747 -4.781 -1.481 1.00 0.00 H new ATOM 0 HA ALA A 90 -15.915 -4.846 -1.138 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -15.842 -4.367 -3.542 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.975 -5.678 -3.133 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -17.594 -4.055 -3.521 1.00 0.00 H new ATOM 699 N CYS A 91 -17.045 -1.758 -1.225 1.00 0.00 N ATOM 700 CA CYS A 91 -16.733 -0.444 -0.572 1.00 0.00 C ATOM 701 C CYS A 91 -15.623 -0.424 0.543 1.00 0.00 C ATOM 702 O CYS A 91 -14.652 0.313 0.421 1.00 0.00 O ATOM 703 CB CYS A 91 -18.064 -0.081 0.133 1.00 0.00 C ATOM 704 SG CYS A 91 -19.346 0.423 -1.020 1.00 0.00 S ATOM 0 H CYS A 91 -17.989 -1.804 -1.609 1.00 0.00 H new ATOM 0 HA CYS A 91 -16.350 0.223 -1.344 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -18.413 -0.941 0.705 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -17.885 0.724 0.845 1.00 0.00 H new ATOM 705 N GLU A 92 -15.798 -1.275 1.563 1.00 0.00 N ATOM 706 CA GLU A 92 -14.829 -1.533 2.630 1.00 0.00 C ATOM 707 C GLU A 92 -13.935 -2.706 2.200 1.00 0.00 C ATOM 708 O GLU A 92 -12.794 -2.448 1.827 1.00 0.00 O ATOM 709 CB GLU A 92 -15.505 -1.727 4.015 1.00 0.00 C ATOM 710 CG GLU A 92 -16.712 -2.676 4.069 1.00 0.00 C ATOM 711 CD GLU A 92 -17.741 -2.369 5.146 1.00 0.00 C ATOM 712 OE1 GLU A 92 -17.529 -1.665 6.135 1.00 0.00 O ATOM 713 OE2 GLU A 92 -18.942 -2.976 4.883 1.00 0.00 O ATOM 0 H GLU A 92 -16.652 -1.822 1.669 1.00 0.00 H new ATOM 0 HA GLU A 92 -14.196 -0.657 2.774 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -14.752 -2.095 4.712 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -15.824 -0.750 4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -17.210 -2.657 3.100 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -16.347 -3.692 4.220 1.00 0.00 H new ATOM 714 N ALA A 93 -14.432 -3.956 2.209 1.00 0.00 N ATOM 715 CA ALA A 93 -13.603 -5.143 1.980 1.00 0.00 C ATOM 716 C ALA A 93 -12.793 -5.263 0.691 1.00 0.00 C ATOM 717 O ALA A 93 -11.747 -5.915 0.739 1.00 0.00 O ATOM 718 CB ALA A 93 -14.396 -6.438 2.097 1.00 0.00 C ATOM 0 H ALA A 93 -15.416 -4.166 2.375 1.00 0.00 H new ATOM 0 HA ALA A 93 -12.877 -4.987 2.778 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -13.735 -7.287 1.919 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -14.823 -6.514 3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.198 -6.441 1.359 1.00 0.00 H new ATOM 719 N PHE A 94 -13.248 -4.700 -0.454 1.00 0.00 N ATOM 720 CA PHE A 94 -12.356 -4.703 -1.670 1.00 0.00 C ATOM 721 C PHE A 94 -11.153 -3.768 -1.450 1.00 0.00 C ATOM 722 O PHE A 94 -10.038 -4.135 -1.832 1.00 0.00 O ATOM 723 CB PHE A 94 -13.186 -4.480 -2.944 1.00 0.00 C ATOM 724 CG PHE A 94 -12.563 -3.936 -4.234 1.00 0.00 C ATOM 725 CD1 PHE A 94 -11.843 -2.733 -4.258 1.00 0.00 C ATOM 726 CD2 PHE A 94 -12.929 -4.500 -5.459 1.00 0.00 C ATOM 727 CE1 PHE A 94 -11.408 -2.168 -5.449 1.00 0.00 C ATOM 728 CE2 PHE A 94 -12.488 -3.948 -6.663 1.00 0.00 C ATOM 729 CZ PHE A 94 -11.711 -2.787 -6.650 1.00 0.00 C ATOM 0 H PHE A 94 -14.161 -4.262 -0.575 1.00 0.00 H new ATOM 0 HA PHE A 94 -11.902 -5.682 -1.826 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.641 -5.438 -3.194 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -13.997 -3.802 -2.676 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -11.621 -2.233 -3.326 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -13.562 -5.375 -5.475 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -10.837 -1.251 -5.439 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -12.747 -4.417 -7.601 1.00 0.00 H new ATOM 0 HZ PHE A 94 -11.346 -2.372 -7.578 1.00 0.00 H new ATOM 730 N ILE A 95 -11.390 -2.563 -0.879 1.00 0.00 N ATOM 731 CA ILE A 95 -10.294 -1.609 -0.578 1.00 0.00 C ATOM 732 C ILE A 95 -9.377 -2.221 0.521 1.00 0.00 C ATOM 733 O ILE A 95 -8.165 -2.209 0.320 1.00 0.00 O ATOM 734 CB ILE A 95 -10.860 -0.188 -0.271 1.00 0.00 C ATOM 735 CG1 ILE A 95 -11.425 0.474 -1.560 1.00 0.00 C ATOM 736 CG2 ILE A 95 -9.761 0.775 0.254 1.00 0.00 C ATOM 737 CD1 ILE A 95 -12.827 0.082 -2.012 1.00 0.00 C ATOM 0 H ILE A 95 -12.319 -2.230 -0.620 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.657 -1.453 -1.449 1.00 0.00 H new ATOM 0 HB ILE A 95 -11.634 -0.336 0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.411 1.554 -1.414 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.737 0.254 -2.377 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -10.199 1.753 0.455 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.334 0.373 1.173 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.977 0.876 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.081 0.625 -2.922 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.860 -0.990 -2.208 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.544 0.330 -1.230 1.00 0.00 H new ATOM 738 N CYS A 96 -9.944 -2.823 1.594 1.00 0.00 N ATOM 739 CA CYS A 96 -9.189 -3.645 2.558 1.00 0.00 C ATOM 740 C CYS A 96 -8.238 -4.699 1.948 1.00 0.00 C ATOM 741 O CYS A 96 -7.123 -4.822 2.438 1.00 0.00 O ATOM 742 CB CYS A 96 -10.136 -4.336 3.576 1.00 0.00 C ATOM 743 SG CYS A 96 -10.406 -6.089 3.237 1.00 0.00 S ATOM 0 H CYS A 96 -10.938 -2.750 1.812 1.00 0.00 H new ATOM 0 HA CYS A 96 -8.545 -2.921 3.057 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -9.720 -4.228 4.578 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -11.097 -3.822 3.573 1.00 0.00 H new ATOM 744 N ASN A 97 -8.663 -5.437 0.905 1.00 0.00 N ATOM 745 CA ASN A 97 -7.867 -6.594 0.385 1.00 0.00 C ATOM 746 C ASN A 97 -6.745 -6.269 -0.584 1.00 0.00 C ATOM 747 O ASN A 97 -5.735 -6.976 -0.544 1.00 0.00 O ATOM 748 CB ASN A 97 -8.868 -7.611 -0.159 1.00 0.00 C ATOM 749 CG ASN A 97 -8.396 -9.052 -0.333 1.00 0.00 C ATOM 750 OD1 ASN A 97 -7.344 -9.477 0.148 1.00 0.00 O ATOM 751 ND2 ASN A 97 -9.195 -9.856 -1.011 1.00 0.00 N ATOM 0 H ASN A 97 -9.536 -5.267 0.405 1.00 0.00 H new ATOM 0 HA ASN A 97 -7.293 -7.005 1.215 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -9.732 -7.620 0.506 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -9.216 -7.253 -1.128 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -8.943 -10.836 -1.139 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -10.064 -9.497 -1.406 1.00 0.00 H new ATOM 752 N CYS A 98 -6.882 -5.228 -1.427 1.00 0.00 N ATOM 753 CA CYS A 98 -5.678 -4.673 -2.096 1.00 0.00 C ATOM 754 C CYS A 98 -4.684 -3.998 -1.094 1.00 0.00 C ATOM 755 O CYS A 98 -3.478 -4.131 -1.301 1.00 0.00 O ATOM 756 CB CYS A 98 -5.941 -3.811 -3.334 1.00 0.00 C ATOM 757 SG CYS A 98 -4.567 -4.207 -4.458 1.00 0.00 S ATOM 0 H CYS A 98 -7.764 -4.770 -1.657 1.00 0.00 H new ATOM 0 HA CYS A 98 -5.183 -5.557 -2.498 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.905 -4.047 -3.785 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -5.957 -2.750 -3.084 1.00 0.00 H new ATOM 758 N ASP A 99 -5.182 -3.369 0.000 1.00 0.00 N ATOM 759 CA ASP A 99 -4.353 -2.898 1.131 1.00 0.00 C ATOM 760 C ASP A 99 -3.562 -4.033 1.802 1.00 0.00 C ATOM 761 O ASP A 99 -2.340 -4.009 1.695 1.00 0.00 O ATOM 762 CB ASP A 99 -5.155 -2.082 2.164 1.00 0.00 C ATOM 763 CG ASP A 99 -5.493 -0.657 1.780 1.00 0.00 C ATOM 764 OD1 ASP A 99 -6.147 -0.585 0.588 1.00 0.00 O ATOM 765 OD2 ASP A 99 -5.193 0.317 2.463 1.00 0.00 O ATOM 0 H ASP A 99 -6.176 -3.175 0.120 1.00 0.00 H new ATOM 0 HA ASP A 99 -3.623 -2.219 0.690 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.086 -2.611 2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -4.589 -2.060 3.096 1.00 0.00 H new ATOM 766 N ARG A 100 -4.214 -5.005 2.445 1.00 0.00 N ATOM 767 CA ARG A 100 -3.509 -6.109 3.119 1.00 0.00 C ATOM 768 C ARG A 100 -2.857 -7.185 2.229 1.00 0.00 C ATOM 769 O ARG A 100 -2.077 -7.953 2.779 1.00 0.00 O ATOM 770 CB ARG A 100 -4.303 -6.635 4.309 1.00 0.00 C ATOM 771 CG ARG A 100 -5.647 -7.309 4.151 1.00 0.00 C ATOM 772 CD ARG A 100 -5.713 -8.608 3.347 1.00 0.00 C ATOM 773 NE ARG A 100 -4.782 -9.653 3.838 1.00 0.00 N ATOM 774 CZ ARG A 100 -4.286 -10.652 3.088 1.00 0.00 C ATOM 775 NH1 ARG A 100 -4.562 -10.828 1.798 1.00 0.00 N ATOM 776 NH2 ARG A 100 -3.474 -11.513 3.668 1.00 0.00 N ATOM 0 H ARG A 100 -5.230 -5.054 2.516 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.605 -5.648 3.518 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -3.657 -7.344 4.827 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -4.454 -5.791 4.982 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -6.036 -7.514 5.148 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -6.325 -6.594 3.685 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -6.731 -8.995 3.379 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -5.487 -8.392 2.303 1.00 0.00 H new ATOM 0 HE ARG A 100 -4.497 -9.610 4.817 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -5.187 -10.181 1.317 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -4.149 -11.610 1.290 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -3.241 -11.409 4.655 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -3.079 -12.284 3.129 1.00 0.00 H new ATOM 777 N ASN A 101 -3.115 -7.267 0.909 1.00 0.00 N ATOM 778 CA ASN A 101 -2.213 -8.016 -0.015 1.00 0.00 C ATOM 779 C ASN A 101 -1.014 -7.112 -0.519 1.00 0.00 C ATOM 780 O ASN A 101 -0.032 -7.666 -1.015 1.00 0.00 O ATOM 781 CB ASN A 101 -3.048 -8.595 -1.175 1.00 0.00 C ATOM 782 CG ASN A 101 -2.344 -9.693 -1.977 1.00 0.00 C ATOM 783 OD1 ASN A 101 -2.178 -10.817 -1.503 1.00 0.00 O ATOM 784 ND2 ASN A 101 -1.924 -9.404 -3.197 1.00 0.00 N ATOM 0 H ASN A 101 -3.921 -6.836 0.457 1.00 0.00 H new ATOM 0 HA ASN A 101 -1.751 -8.845 0.522 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -3.978 -8.996 -0.772 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.318 -7.784 -1.852 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -1.456 -10.116 -3.757 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -2.068 -8.469 -3.578 1.00 0.00 H new ATOM 785 N ALA A 102 -1.085 -5.768 -0.386 1.00 0.00 N ATOM 786 CA ALA A 102 0.102 -4.892 -0.409 1.00 0.00 C ATOM 787 C ALA A 102 0.846 -4.876 0.973 1.00 0.00 C ATOM 788 O ALA A 102 2.051 -4.723 0.907 1.00 0.00 O ATOM 789 CB ALA A 102 -0.236 -3.498 -0.947 1.00 0.00 C ATOM 0 H ALA A 102 -1.963 -5.265 -0.260 1.00 0.00 H new ATOM 0 HA ALA A 102 0.816 -5.315 -1.115 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.663 -2.881 -0.949 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.620 -3.584 -1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.992 -3.036 -0.312 1.00 0.00 H new ATOM 790 N ALA A 103 0.232 -5.084 2.173 1.00 0.00 N ATOM 791 CA ALA A 103 0.988 -5.393 3.453 1.00 0.00 C ATOM 792 C ALA A 103 1.913 -6.657 3.431 1.00 0.00 C ATOM 793 O ALA A 103 2.937 -6.720 4.102 1.00 0.00 O ATOM 794 CB ALA A 103 -0.006 -5.533 4.620 1.00 0.00 C ATOM 0 H ALA A 103 -0.780 -5.046 2.295 1.00 0.00 H new ATOM 0 HA ALA A 103 1.663 -4.546 3.574 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.539 -5.755 5.538 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.558 -4.601 4.742 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.704 -6.343 4.408 1.00 0.00 H new ATOM 795 N ILE A 104 1.468 -7.606 2.637 1.00 0.00 N ATOM 796 CA ILE A 104 2.126 -8.851 2.171 1.00 0.00 C ATOM 797 C ILE A 104 3.246 -8.495 1.221 1.00 0.00 C ATOM 798 O ILE A 104 4.399 -8.675 1.564 1.00 0.00 O ATOM 799 CB ILE A 104 0.917 -9.614 1.534 1.00 0.00 C ATOM 800 CG1 ILE A 104 0.036 -10.396 2.524 1.00 0.00 C ATOM 801 CG2 ILE A 104 1.122 -10.469 0.278 1.00 0.00 C ATOM 802 CD1 ILE A 104 -0.030 -9.847 3.935 1.00 0.00 C ATOM 0 H ILE A 104 0.529 -7.534 2.246 1.00 0.00 H new ATOM 0 HA ILE A 104 2.622 -9.464 2.924 1.00 0.00 H new ATOM 0 HB ILE A 104 0.402 -8.722 1.177 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.977 -10.436 2.124 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.401 -11.422 2.572 1.00 0.00 H new ATOM 0 HG21 ILE A 104 0.173 -10.919 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 104 1.492 -9.842 -0.533 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.847 -11.256 0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.679 -10.479 4.541 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.970 -9.834 4.367 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -0.429 -8.833 3.913 1.00 0.00 H new ATOM 803 N CYS A 105 2.950 -7.918 0.061 1.00 0.00 N ATOM 804 CA CYS A 105 4.019 -7.430 -0.837 1.00 0.00 C ATOM 805 C CYS A 105 5.100 -6.505 -0.105 1.00 0.00 C ATOM 806 O CYS A 105 6.286 -6.567 -0.405 1.00 0.00 O ATOM 807 CB CYS A 105 3.438 -6.503 -1.904 1.00 0.00 C ATOM 808 SG CYS A 105 2.316 -7.100 -3.135 1.00 0.00 S ATOM 0 H CYS A 105 2.001 -7.773 -0.285 1.00 0.00 H new ATOM 0 HA CYS A 105 4.474 -8.340 -1.227 1.00 0.00 H new ATOM 0 HB2 CYS A 105 2.931 -5.694 -1.379 1.00 0.00 H new ATOM 0 HB3 CYS A 105 4.282 -6.060 -2.433 1.00 0.00 H new ATOM 809 N PHE A 106 4.641 -5.736 0.877 1.00 0.00 N ATOM 810 CA PHE A 106 5.494 -4.858 1.692 1.00 0.00 C ATOM 811 C PHE A 106 6.263 -5.606 2.758 1.00 0.00 C ATOM 812 O PHE A 106 7.451 -5.319 2.903 1.00 0.00 O ATOM 813 CB PHE A 106 4.651 -3.686 2.147 1.00 0.00 C ATOM 814 CG PHE A 106 4.200 -2.763 0.946 1.00 0.00 C ATOM 815 CD1 PHE A 106 4.636 -2.842 -0.421 1.00 0.00 C ATOM 816 CD2 PHE A 106 3.124 -1.940 1.233 1.00 0.00 C ATOM 817 CE1 PHE A 106 3.986 -2.108 -1.406 1.00 0.00 C ATOM 818 CE2 PHE A 106 2.509 -1.168 0.255 1.00 0.00 C ATOM 819 CZ PHE A 106 2.946 -1.249 -1.064 1.00 0.00 C ATOM 0 H PHE A 106 3.656 -5.700 1.138 1.00 0.00 H new ATOM 0 HA PHE A 106 6.313 -4.444 1.104 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.768 -4.058 2.667 1.00 0.00 H new ATOM 0 HB3 PHE A 106 5.217 -3.092 2.865 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.472 -3.474 -0.684 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.752 -1.897 2.246 1.00 0.00 H new ATOM 0 HE1 PHE A 106 4.288 -2.204 -2.438 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.695 -0.508 0.517 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.476 -0.643 -1.825 1.00 0.00 H new ATOM 820 N SER A 107 5.675 -6.605 3.440 1.00 0.00 N ATOM 821 CA SER A 107 6.502 -7.491 4.286 1.00 0.00 C ATOM 822 C SER A 107 7.481 -8.444 3.513 1.00 0.00 C ATOM 823 O SER A 107 8.517 -8.813 4.070 1.00 0.00 O ATOM 824 CB SER A 107 5.607 -8.340 5.221 1.00 0.00 C ATOM 825 OG SER A 107 6.354 -9.238 6.044 1.00 0.00 O ATOM 0 H SER A 107 4.677 -6.816 3.428 1.00 0.00 H new ATOM 0 HA SER A 107 7.134 -6.807 4.853 1.00 0.00 H new ATOM 0 HB2 SER A 107 5.021 -7.676 5.856 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.900 -8.911 4.619 1.00 0.00 H new ATOM 0 HG SER A 107 6.677 -8.762 6.838 1.00 0.00 H new ATOM 826 N LYS A 108 7.119 -8.856 2.279 1.00 0.00 N ATOM 827 CA LYS A 108 7.566 -10.142 1.720 1.00 0.00 C ATOM 828 C LYS A 108 7.585 -10.334 0.175 1.00 0.00 C ATOM 829 O LYS A 108 7.918 -11.445 -0.256 1.00 0.00 O ATOM 830 CB LYS A 108 6.827 -11.325 2.409 1.00 0.00 C ATOM 831 CG LYS A 108 5.393 -11.163 2.890 1.00 0.00 C ATOM 832 CD LYS A 108 4.254 -11.811 2.108 1.00 0.00 C ATOM 833 CE LYS A 108 4.585 -12.919 1.110 1.00 0.00 C ATOM 834 NZ LYS A 108 3.387 -13.629 0.629 1.00 0.00 N ATOM 0 H LYS A 108 6.520 -8.315 1.655 1.00 0.00 H new ATOM 0 HA LYS A 108 8.630 -10.128 1.955 1.00 0.00 H new ATOM 0 HB2 LYS A 108 6.840 -12.163 1.712 1.00 0.00 H new ATOM 0 HB3 LYS A 108 7.425 -11.619 3.272 1.00 0.00 H new ATOM 0 HG2 LYS A 108 5.347 -11.546 3.910 1.00 0.00 H new ATOM 0 HG3 LYS A 108 5.186 -10.094 2.941 1.00 0.00 H new ATOM 0 HD2 LYS A 108 3.547 -12.218 2.831 1.00 0.00 H new ATOM 0 HD3 LYS A 108 3.735 -11.021 1.565 1.00 0.00 H new ATOM 0 HE2 LYS A 108 5.114 -12.490 0.259 1.00 0.00 H new ATOM 0 HE3 LYS A 108 5.262 -13.633 1.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 3.666 -14.546 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 2.733 -13.784 1.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.916 -13.059 -0.102 1.00 0.00 H new ATOM 835 N ALA A 109 7.341 -9.305 -0.656 1.00 0.00 N ATOM 836 CA ALA A 109 7.635 -9.387 -2.114 1.00 0.00 C ATOM 837 C ALA A 109 9.103 -9.894 -2.457 1.00 0.00 C ATOM 838 O ALA A 109 9.919 -10.072 -1.548 1.00 0.00 O ATOM 839 CB ALA A 109 7.589 -7.968 -2.758 1.00 0.00 C ATOM 0 H ALA A 109 6.946 -8.414 -0.356 1.00 0.00 H new ATOM 0 HA ALA A 109 6.886 -10.083 -2.491 1.00 0.00 H new ATOM 0 HB1 ALA A 109 7.806 -8.045 -3.823 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.597 -7.538 -2.620 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.332 -7.328 -2.282 1.00 0.00 H new ATOM 840 N PRO A 110 9.456 -10.053 -3.745 1.00 0.00 N ATOM 841 CA PRO A 110 10.894 -10.129 -4.254 1.00 0.00 C ATOM 842 C PRO A 110 11.630 -8.777 -4.111 1.00 0.00 C ATOM 843 O PRO A 110 11.901 -7.981 -5.015 1.00 0.00 O ATOM 844 CB PRO A 110 10.640 -10.499 -5.729 1.00 0.00 C ATOM 845 CG PRO A 110 9.386 -11.369 -5.590 1.00 0.00 C ATOM 846 CD PRO A 110 8.483 -10.451 -4.770 1.00 0.00 C ATOM 0 HA PRO A 110 11.535 -10.825 -3.714 1.00 0.00 H new ATOM 0 HB2 PRO A 110 10.468 -9.621 -6.352 1.00 0.00 H new ATOM 0 HB3 PRO A 110 11.475 -11.044 -6.169 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.950 -11.620 -6.557 1.00 0.00 H new ATOM 0 HG3 PRO A 110 9.591 -12.309 -5.079 1.00 0.00 H new ATOM 0 HD2 PRO A 110 8.104 -9.606 -5.345 1.00 0.00 H new ATOM 0 HD3 PRO A 110 7.618 -10.968 -4.355 1.00 0.00 H new ATOM 847 N TYR A 111 11.873 -8.634 -2.830 1.00 0.00 N ATOM 848 CA TYR A 111 12.239 -7.371 -2.173 1.00 0.00 C ATOM 849 C TYR A 111 13.639 -6.812 -2.560 1.00 0.00 C ATOM 850 O TYR A 111 14.512 -7.614 -2.915 1.00 0.00 O ATOM 851 CB TYR A 111 12.373 -7.777 -0.648 1.00 0.00 C ATOM 852 CG TYR A 111 11.791 -6.740 0.271 1.00 0.00 C ATOM 853 CD1 TYR A 111 10.424 -6.813 0.403 1.00 0.00 C ATOM 854 CD2 TYR A 111 12.488 -5.641 0.819 1.00 0.00 C ATOM 855 CE1 TYR A 111 9.726 -5.794 1.019 1.00 0.00 C ATOM 856 CE2 TYR A 111 11.786 -4.655 1.515 1.00 0.00 C ATOM 857 CZ TYR A 111 10.397 -4.733 1.622 1.00 0.00 C ATOM 858 OH TYR A 111 9.725 -3.701 2.187 1.00 0.00 O ATOM 0 H TYR A 111 11.823 -9.417 -2.178 1.00 0.00 H new ATOM 0 HA TYR A 111 11.503 -6.613 -2.441 1.00 0.00 H new ATOM 0 HB2 TYR A 111 11.870 -8.730 -0.482 1.00 0.00 H new ATOM 0 HB3 TYR A 111 13.425 -7.926 -0.405 1.00 0.00 H new ATOM 0 HD1 TYR A 111 9.893 -7.673 0.022 1.00 0.00 H new ATOM 0 HD2 TYR A 111 13.559 -5.564 0.700 1.00 0.00 H new ATOM 0 HE1 TYR A 111 8.646 -5.820 1.034 1.00 0.00 H new ATOM 0 HE2 TYR A 111 12.318 -3.833 1.970 1.00 0.00 H new ATOM 0 HH TYR A 111 8.843 -4.008 2.484 1.00 0.00 H new ATOM 859 N ASN A 112 13.904 -5.496 -2.423 1.00 0.00 N ATOM 860 CA ASN A 112 15.294 -4.983 -2.466 1.00 0.00 C ATOM 861 C ASN A 112 15.239 -3.657 -1.653 1.00 0.00 C ATOM 862 O ASN A 112 14.616 -2.662 -2.028 1.00 0.00 O ATOM 863 CB ASN A 112 15.881 -4.701 -3.865 1.00 0.00 C ATOM 864 CG ASN A 112 16.236 -5.916 -4.714 1.00 0.00 C ATOM 865 OD1 ASN A 112 17.185 -6.642 -4.419 1.00 0.00 O ATOM 866 ND2 ASN A 112 15.495 -6.170 -5.781 1.00 0.00 N ATOM 0 H ASN A 112 13.191 -4.780 -2.284 1.00 0.00 H new ATOM 0 HA ASN A 112 15.956 -5.752 -2.069 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.164 -4.096 -4.420 1.00 0.00 H new ATOM 0 HB3 ASN A 112 16.780 -4.097 -3.742 1.00 0.00 H new ATOM 0 HD21 ASN A 112 15.708 -6.975 -6.370 1.00 0.00 H new ATOM 0 HD22 ASN A 112 14.711 -5.560 -6.014 1.00 0.00 H new ATOM 867 N LYS A 113 15.956 -3.734 -0.541 1.00 0.00 N ATOM 868 CA LYS A 113 16.033 -2.755 0.548 1.00 0.00 C ATOM 869 C LYS A 113 17.438 -2.178 0.696 1.00 0.00 C ATOM 870 O LYS A 113 18.266 -2.535 1.539 1.00 0.00 O ATOM 871 CB LYS A 113 15.480 -3.500 1.759 1.00 0.00 C ATOM 872 CG LYS A 113 16.177 -4.782 2.273 1.00 0.00 C ATOM 873 CD LYS A 113 16.418 -5.995 1.365 1.00 0.00 C ATOM 874 CE LYS A 113 17.806 -6.088 0.696 1.00 0.00 C ATOM 875 NZ LYS A 113 18.879 -6.489 1.625 1.00 0.00 N ATOM 0 H LYS A 113 16.548 -4.544 -0.357 1.00 0.00 H new ATOM 0 HA LYS A 113 15.446 -1.853 0.376 1.00 0.00 H new ATOM 0 HB2 LYS A 113 15.453 -2.793 2.588 1.00 0.00 H new ATOM 0 HB3 LYS A 113 14.447 -3.764 1.531 1.00 0.00 H new ATOM 0 HG2 LYS A 113 17.151 -4.478 2.657 1.00 0.00 H new ATOM 0 HG3 LYS A 113 15.595 -5.137 3.124 1.00 0.00 H new ATOM 0 HD2 LYS A 113 16.262 -6.899 1.954 1.00 0.00 H new ATOM 0 HD3 LYS A 113 15.661 -5.990 0.581 1.00 0.00 H new ATOM 0 HE2 LYS A 113 17.759 -6.805 -0.124 1.00 0.00 H new ATOM 0 HE3 LYS A 113 18.056 -5.121 0.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 19.783 -6.532 1.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 18.950 -5.793 2.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 18.662 -7.425 2.023 1.00 0.00 H new ATOM 876 N GLU A 114 17.682 -1.311 -0.292 1.00 0.00 N ATOM 877 CA GLU A 114 18.986 -1.285 -0.970 1.00 0.00 C ATOM 878 C GLU A 114 19.213 0.103 -1.574 1.00 0.00 C ATOM 879 O GLU A 114 20.204 0.761 -1.245 1.00 0.00 O ATOM 880 CB GLU A 114 18.871 -2.599 -1.808 1.00 0.00 C ATOM 881 CG GLU A 114 19.409 -2.539 -3.189 1.00 0.00 C ATOM 882 CD GLU A 114 20.899 -2.509 -3.387 1.00 0.00 C ATOM 883 OE1 GLU A 114 21.627 -3.485 -3.209 1.00 0.00 O ATOM 884 OE2 GLU A 114 21.343 -1.275 -3.788 1.00 0.00 O ATOM 0 H GLU A 114 17.008 -0.628 -0.637 1.00 0.00 H new ATOM 0 HA GLU A 114 19.928 -1.341 -0.425 1.00 0.00 H new ATOM 0 HB2 GLU A 114 19.389 -3.395 -1.272 1.00 0.00 H new ATOM 0 HB3 GLU A 114 17.820 -2.882 -1.861 1.00 0.00 H new ATOM 0 HG2 GLU A 114 19.022 -3.401 -3.731 1.00 0.00 H new ATOM 0 HG3 GLU A 114 18.995 -1.650 -3.666 1.00 0.00 H new ATOM 885 N HIS A 115 18.284 0.540 -2.437 1.00 0.00 N ATOM 886 CA HIS A 115 18.289 1.873 -3.050 1.00 0.00 C ATOM 887 C HIS A 115 17.694 3.002 -2.182 1.00 0.00 C ATOM 888 O HIS A 115 18.136 4.108 -2.470 1.00 0.00 O ATOM 889 CB HIS A 115 17.665 1.828 -4.477 1.00 0.00 C ATOM 890 CG HIS A 115 16.220 1.337 -4.631 1.00 0.00 C ATOM 891 ND1 HIS A 115 15.163 1.918 -3.992 1.00 0.00 N ATOM 892 CD2 HIS A 115 15.980 -0.031 -4.718 1.00 0.00 C ATOM 893 CE1 HIS A 115 14.463 0.813 -3.615 1.00 0.00 C ATOM 894 NE2 HIS A 115 14.811 -0.405 -4.100 1.00 0.00 N ATOM 0 H HIS A 115 17.495 -0.035 -2.733 1.00 0.00 H new ATOM 0 HA HIS A 115 19.340 2.147 -3.136 1.00 0.00 H new ATOM 0 HB2 HIS A 115 17.719 2.834 -4.894 1.00 0.00 H new ATOM 0 HB3 HIS A 115 18.298 1.192 -5.095 1.00 0.00 H new ATOM 0 HD2 HIS A 115 16.641 -0.724 -5.217 1.00 0.00 H new ATOM 0 HE1 HIS A 115 13.632 0.906 -2.931 1.00 0.00 H new ATOM 0 HE2 HIS A 115 14.350 -1.312 -4.029 1.00 0.00 H new ATOM 895 N LYS A 116 16.829 2.723 -1.141 1.00 0.00 N ATOM 896 CA LYS A 116 16.010 3.669 -0.364 1.00 0.00 C ATOM 897 C LYS A 116 16.538 5.074 -0.180 1.00 0.00 C ATOM 898 O LYS A 116 17.749 5.312 -0.259 1.00 0.00 O ATOM 899 CB LYS A 116 15.979 2.851 0.994 1.00 0.00 C ATOM 900 CG LYS A 116 15.213 3.687 2.013 1.00 0.00 C ATOM 901 CD LYS A 116 14.831 2.932 3.240 1.00 0.00 C ATOM 902 CE LYS A 116 14.613 3.986 4.334 1.00 0.00 C ATOM 903 NZ LYS A 116 14.224 3.418 5.634 1.00 0.00 N ATOM 0 H LYS A 116 16.694 1.764 -0.820 1.00 0.00 H new ATOM 0 HA LYS A 116 15.063 3.914 -0.846 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.495 1.885 0.849 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.991 2.651 1.345 1.00 0.00 H new ATOM 0 HG2 LYS A 116 15.823 4.544 2.299 1.00 0.00 H new ATOM 0 HG3 LYS A 116 14.311 4.080 1.543 1.00 0.00 H new ATOM 0 HD2 LYS A 116 13.925 2.349 3.073 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.614 2.229 3.525 1.00 0.00 H new ATOM 0 HE2 LYS A 116 15.530 4.562 4.459 1.00 0.00 H new ATOM 0 HE3 LYS A 116 13.841 4.683 4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.758 4.150 6.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.567 2.625 5.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 15.071 3.076 6.131 1.00 0.00 H new ATOM 904 N ASN A 117 15.619 5.995 0.213 1.00 0.00 N ATOM 905 CA ASN A 117 16.006 7.332 0.767 1.00 0.00 C ATOM 906 C ASN A 117 16.086 8.387 -0.373 1.00 0.00 C ATOM 907 O ASN A 117 15.458 9.445 -0.311 1.00 0.00 O ATOM 908 CB ASN A 117 17.225 7.186 1.725 1.00 0.00 C ATOM 909 CG ASN A 117 17.187 8.076 2.951 1.00 0.00 C ATOM 910 OD1 ASN A 117 17.549 9.251 2.899 1.00 0.00 O ATOM 911 ND2 ASN A 117 16.748 7.548 4.081 1.00 0.00 N ATOM 0 H ASN A 117 14.612 5.844 0.160 1.00 0.00 H new ATOM 0 HA ASN A 117 15.236 7.744 1.419 1.00 0.00 H new ATOM 0 HB2 ASN A 117 17.290 6.148 2.050 1.00 0.00 H new ATOM 0 HB3 ASN A 117 18.135 7.402 1.166 1.00 0.00 H new ATOM 0 HD21 ASN A 117 16.706 8.116 4.927 1.00 0.00 H new ATOM 0 HD22 ASN A 117 16.452 6.572 4.107 1.00 0.00 H new ATOM 912 N LEU A 118 16.834 7.960 -1.412 1.00 0.00 N ATOM 913 CA LEU A 118 16.642 8.427 -2.819 1.00 0.00 C ATOM 914 C LEU A 118 16.619 9.945 -3.087 1.00 0.00 C ATOM 915 O LEU A 118 17.497 10.687 -2.646 1.00 0.00 O ATOM 916 CB LEU A 118 15.590 7.507 -3.489 1.00 0.00 C ATOM 917 CG LEU A 118 16.022 6.045 -3.535 1.00 0.00 C ATOM 918 CD1 LEU A 118 14.862 5.111 -3.528 1.00 0.00 C ATOM 919 CD2 LEU A 118 16.681 5.647 -4.825 1.00 0.00 C ATOM 0 H LEU A 118 17.590 7.283 -1.309 1.00 0.00 H new ATOM 0 HA LEU A 118 17.573 8.297 -3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.648 7.585 -2.946 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.403 7.857 -4.504 1.00 0.00 H new ATOM 0 HG LEU A 118 16.678 5.975 -2.668 1.00 0.00 H new ATOM 0 HD11 LEU A 118 15.222 4.083 -3.562 1.00 0.00 H new ATOM 0 HD12 LEU A 118 14.279 5.261 -2.619 1.00 0.00 H new ATOM 0 HD13 LEU A 118 14.234 5.304 -4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 118 16.960 4.594 -4.782 1.00 0.00 H new ATOM 0 HD22 LEU A 118 15.988 5.805 -5.651 1.00 0.00 H new ATOM 0 HD23 LEU A 118 17.574 6.253 -4.979 1.00 0.00 H new ATOM 920 N ASP A 119 15.636 10.344 -3.905 1.00 0.00 N ATOM 921 CA ASP A 119 15.848 11.034 -5.195 1.00 0.00 C ATOM 922 C ASP A 119 14.844 10.163 -6.128 1.00 0.00 C ATOM 923 O ASP A 119 14.356 9.067 -5.850 1.00 0.00 O ATOM 924 CB ASP A 119 17.281 10.964 -5.736 1.00 0.00 C ATOM 925 CG ASP A 119 18.132 12.215 -5.649 1.00 0.00 C ATOM 926 OD1 ASP A 119 18.110 12.792 -4.405 1.00 0.00 O ATOM 927 OD2 ASP A 119 18.776 12.657 -6.598 1.00 0.00 O ATOM 0 H ASP A 119 14.650 10.196 -3.689 1.00 0.00 H new ATOM 0 HA ASP A 119 15.671 12.108 -5.139 1.00 0.00 H new ATOM 0 HB2 ASP A 119 17.801 10.168 -5.204 1.00 0.00 H new ATOM 0 HB3 ASP A 119 17.229 10.667 -6.783 1.00 0.00 H new ATOM 928 N THR A 120 14.469 10.790 -7.211 1.00 0.00 N ATOM 929 CA THR A 120 13.304 10.420 -8.043 1.00 0.00 C ATOM 930 C THR A 120 13.502 10.886 -9.498 1.00 0.00 C ATOM 931 O THR A 120 12.886 11.859 -9.948 1.00 0.00 O ATOM 932 CB THR A 120 12.004 11.008 -7.386 1.00 0.00 C ATOM 933 OG1 THR A 120 12.050 12.427 -7.233 1.00 0.00 O ATOM 934 CG2 THR A 120 11.768 10.362 -6.011 1.00 0.00 C ATOM 0 H THR A 120 14.969 11.604 -7.569 1.00 0.00 H new ATOM 0 HA THR A 120 13.200 9.336 -8.086 1.00 0.00 H new ATOM 0 HB THR A 120 11.183 10.776 -8.064 1.00 0.00 H new ATOM 0 HG1 THR A 120 12.349 12.837 -8.071 1.00 0.00 H new ATOM 0 HG21 THR A 120 10.864 10.777 -5.564 1.00 0.00 H new ATOM 0 HG22 THR A 120 11.652 9.285 -6.130 1.00 0.00 H new ATOM 0 HG23 THR A 120 12.620 10.566 -5.362 1.00 0.00 H new ATOM 935 N LYS A 121 14.358 10.165 -10.245 1.00 0.00 N ATOM 936 CA LYS A 121 14.801 10.612 -11.623 1.00 0.00 C ATOM 937 C LYS A 121 15.559 9.423 -12.303 1.00 0.00 C ATOM 938 O LYS A 121 15.127 8.850 -13.304 1.00 0.00 O ATOM 939 CB LYS A 121 15.627 11.926 -11.494 1.00 0.00 C ATOM 940 CG LYS A 121 16.747 11.838 -10.428 1.00 0.00 C ATOM 941 CD LYS A 121 17.078 13.155 -9.731 1.00 0.00 C ATOM 942 CE LYS A 121 16.153 13.325 -8.505 1.00 0.00 C ATOM 943 NZ LYS A 121 16.293 14.641 -7.859 1.00 0.00 N ATOM 0 H LYS A 121 14.764 9.280 -9.943 1.00 0.00 H new ATOM 0 HA LYS A 121 13.961 10.857 -12.272 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.071 12.165 -12.460 1.00 0.00 H new ATOM 0 HB3 LYS A 121 14.956 12.746 -11.240 1.00 0.00 H new ATOM 0 HG2 LYS A 121 16.453 11.109 -9.673 1.00 0.00 H new ATOM 0 HG3 LYS A 121 17.651 11.458 -10.903 1.00 0.00 H new ATOM 0 HD2 LYS A 121 18.122 13.163 -9.418 1.00 0.00 H new ATOM 0 HD3 LYS A 121 16.946 13.989 -10.420 1.00 0.00 H new ATOM 0 HE2 LYS A 121 15.117 13.187 -8.816 1.00 0.00 H new ATOM 0 HE3 LYS A 121 16.375 12.544 -7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 15.649 14.698 -7.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 17.273 14.766 -7.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 16.055 15.389 -8.541 1.00 0.00 H new ATOM 944 N LYS A 122 16.636 9.044 -11.624 1.00 0.00 N ATOM 945 CA LYS A 122 17.292 7.740 -11.627 1.00 0.00 C ATOM 946 C LYS A 122 16.326 6.558 -11.158 1.00 0.00 C ATOM 947 O LYS A 122 16.121 5.533 -11.803 1.00 0.00 O ATOM 948 CB LYS A 122 18.308 8.055 -10.424 1.00 0.00 C ATOM 949 CG LYS A 122 19.626 8.606 -10.830 1.00 0.00 C ATOM 950 CD LYS A 122 20.485 9.188 -9.723 1.00 0.00 C ATOM 951 CE LYS A 122 20.014 10.586 -9.310 1.00 0.00 C ATOM 952 NZ LYS A 122 20.917 11.191 -8.316 1.00 0.00 N ATOM 0 H LYS A 122 17.114 9.697 -11.004 1.00 0.00 H new ATOM 0 HA LYS A 122 17.682 7.417 -12.592 1.00 0.00 H new ATOM 0 HB2 LYS A 122 17.832 8.762 -9.745 1.00 0.00 H new ATOM 0 HB3 LYS A 122 18.475 7.136 -9.862 1.00 0.00 H new ATOM 0 HG2 LYS A 122 20.191 7.813 -11.320 1.00 0.00 H new ATOM 0 HG3 LYS A 122 19.456 9.383 -11.575 1.00 0.00 H new ATOM 0 HD2 LYS A 122 20.460 8.526 -8.858 1.00 0.00 H new ATOM 0 HD3 LYS A 122 21.522 9.238 -10.056 1.00 0.00 H new ATOM 0 HE2 LYS A 122 19.959 11.227 -10.190 1.00 0.00 H new ATOM 0 HE3 LYS A 122 19.007 10.524 -8.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 20.359 11.724 -7.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 21.452 10.442 -7.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 21.579 11.835 -8.795 1.00 0.00 H new ATOM 953 N TYR A 123 15.765 6.905 -10.020 1.00 0.00 N ATOM 954 CA TYR A 123 14.889 6.226 -9.075 1.00 0.00 C ATOM 955 C TYR A 123 13.436 6.331 -9.487 1.00 0.00 C ATOM 956 O TYR A 123 12.760 5.301 -9.472 1.00 0.00 O ATOM 957 CB TYR A 123 15.403 7.082 -7.885 1.00 0.00 C ATOM 958 CG TYR A 123 16.926 6.840 -7.523 1.00 0.00 C ATOM 959 CD1 TYR A 123 17.700 5.722 -7.905 1.00 0.00 C ATOM 960 CD2 TYR A 123 17.542 7.858 -6.846 1.00 0.00 C ATOM 961 CE1 TYR A 123 19.076 5.751 -7.741 1.00 0.00 C ATOM 962 CE2 TYR A 123 18.912 7.861 -6.640 1.00 0.00 C ATOM 963 CZ TYR A 123 19.693 6.802 -7.081 1.00 0.00 C ATOM 964 OH TYR A 123 21.053 6.857 -6.990 1.00 0.00 O ATOM 0 H TYR A 123 15.948 7.846 -9.672 1.00 0.00 H new ATOM 0 HA TYR A 123 14.916 5.147 -8.921 1.00 0.00 H new ATOM 0 HB2 TYR A 123 15.260 8.136 -8.122 1.00 0.00 H new ATOM 0 HB3 TYR A 123 14.794 6.867 -7.007 1.00 0.00 H new ATOM 0 HD1 TYR A 123 17.222 4.848 -8.323 1.00 0.00 H new ATOM 0 HD2 TYR A 123 16.948 8.675 -6.465 1.00 0.00 H new ATOM 0 HE1 TYR A 123 19.676 4.943 -8.133 1.00 0.00 H new ATOM 0 HE2 TYR A 123 19.376 8.694 -6.132 1.00 0.00 H new ATOM 0 HH TYR A 123 21.315 7.661 -6.495 1.00 0.00 H new ATOM 965 N CYS A 124 12.943 7.522 -9.935 1.00 0.00 N ATOM 966 CA CYS A 124 11.659 7.638 -10.615 1.00 0.00 C ATOM 967 C CYS A 124 11.760 7.275 -12.101 1.00 0.00 C ATOM 968 O CYS A 124 11.395 6.189 -12.552 1.00 0.00 O ATOM 969 CB CYS A 124 10.787 8.856 -10.354 1.00 0.00 C ATOM 970 SG CYS A 124 10.122 8.836 -8.696 1.00 0.00 S ATOM 971 OXT CYS A 124 12.299 8.284 -12.860 1.00 0.00 O ATOM 0 H CYS A 124 13.434 8.409 -9.827 1.00 0.00 H new ATOM 0 HA CYS A 124 11.074 6.879 -10.096 1.00 0.00 H new ATOM 0 HB2 CYS A 124 11.372 9.763 -10.502 1.00 0.00 H new ATOM 0 HB3 CYS A 124 9.970 8.882 -11.075 1.00 0.00 H new TER 972 CYS A 124 HETATM 973 CA CA A 125 3.073 5.284 -4.718 1.00 0.00 CA