USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1027 hydrogens (5 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 83 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 113 SER OG : rot -93:sc= -3.7! USER MOD Set 1.3: A 116 HIS : no HD1:sc= -15.7! C(o=-19!,f=-27!) USER MOD Set 2.1: A 31 SER OG : rot 118:sc= 0.694 USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0.799 USER MOD Set 3.1: A 81 MET CE :methyl -130:sc= -4.93! (180deg=-14.6!) USER MOD Set 3.2: A 137 THR OG1 : rot 173:sc= -0.603! USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -172:sc= -2.54 (180deg=-2.88) USER MOD Single : A 29 TYR OH : rot -100:sc= 0.0168 USER MOD Single : A 30 CYS SG : rot 51:sc= 0.595 USER MOD Single : A 32 ASN :FLIP amide:sc= -2.07 F(o=-2.9!,f=-2.1) USER MOD Single : A 35 HIS : no HE2:sc= -3.52! C(o=-3.5!,f=-14!) USER MOD Single : A 44 THR OG1 : rot 17:sc= 0.147 USER MOD Single : A 48 THR OG1 : rot -50:sc= -5.45! USER MOD Single : A 52 SER OG : rot -68:sc= 1.18 USER MOD Single : A 54 GLN :FLIP amide:sc= -0.382! C(o=-5!,f=-0.38!) USER MOD Single : A 55 HIS :FLIP no HD1:sc= -5.78! C(o=-6.7!,f=-5.8!) USER MOD Single : A 57 GLN : amide:sc= -0.888 K(o=-0.89,f=-3.8!) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.506 F(o=-1.6,f=-0.51) USER MOD Single : A 61 SER OG : rot -60:sc= 1.16 USER MOD Single : A 64 SER OG : rot 79:sc= 0.803 USER MOD Single : A 69 TYR OH : rot -58:sc= 0.565 USER MOD Single : A 71 LYS NZ :NH3+ 152:sc= -8.02! (180deg=-9.48!) USER MOD Single : A 72 SER OG : rot 13:sc= 0.844 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -7.45! C(o=-7.4!,f=-12!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot -73:sc= -1.61! USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0.884 K(o=0.88,f=0) USER MOD Single : A 92 THR OG1 : rot 49:sc= 0.867 USER MOD Single : A 94 ASN :FLIP amide:sc= -0.13 F(o=-2.4,f=-0.13) USER MOD Single : A 97 CYS SG : rot 101:sc= 0.65 USER MOD Single : A 106 ASN : amide:sc= -0.131 K(o=-0.13,f=-0.96) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -3.34! C(o=-4.3!,f=-3.3!) USER MOD Single : A 109 ASN : amide:sc= -5.06! C(o=-5.1!,f=-6.6!) USER MOD Single : A 110 THR OG1 : rot 160:sc= 0.0113 USER MOD Single : A 111 TYR OH : rot 49:sc= -4.34! USER MOD Single : A 114 LYS NZ :NH3+ -129:sc= -0.12 (180deg=-0.803) USER MOD Single : A 115 LYS NZ :NH3+ 151:sc= -0.0621 (180deg=-0.505) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.94) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc=-0.00314 X(o=-0.0031,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 CYS SG : rot 150:sc= -0.0696 USER MOD Single : A 132 LYS NZ :NH3+ 140:sc= 0.251 (180deg=-1.84!) USER MOD Single : A 138 HIS : no HD1:sc= -0.529 K(o=-0.53,f=-2.8) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.16) USER MOD Single : A 142 LYS NZ :NH3+ 165:sc= 0.201 (180deg=0.155) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -9.642 -6.478 14.193 1.00 0.00 N ATOM 2 CA LYS A 24 -8.672 -7.103 13.311 1.00 0.00 C ATOM 3 C LYS A 24 -9.371 -7.545 12.023 1.00 0.00 C ATOM 4 O LYS A 24 -9.582 -8.737 11.805 1.00 0.00 O ATOM 5 CB LYS A 24 -7.942 -8.237 14.035 1.00 0.00 C ATOM 6 CG LYS A 24 -6.990 -7.685 15.098 1.00 0.00 C ATOM 7 CD LYS A 24 -7.383 -8.174 16.493 1.00 0.00 C ATOM 8 CE LYS A 24 -6.145 -8.525 17.320 1.00 0.00 C ATOM 9 NZ LYS A 24 -5.974 -7.563 18.432 1.00 0.00 N ATOM 0 HA LYS A 24 -7.900 -6.388 13.026 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.668 -8.902 14.502 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -7.382 -8.833 13.314 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.970 -7.996 14.874 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -7.004 -6.595 15.073 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.959 -7.402 17.004 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -8.028 -9.049 16.407 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.240 -9.536 17.717 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.260 -8.515 16.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.129 -7.816 18.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.862 -6.604 18.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.811 -7.593 19.048 1.00 0.00 H new ATOM 23 N PRO A 25 -9.719 -6.535 11.182 1.00 0.00 N ATOM 24 CA PRO A 25 -10.389 -6.807 9.922 1.00 0.00 C ATOM 25 C PRO A 25 -9.410 -7.374 8.892 1.00 0.00 C ATOM 26 O PRO A 25 -9.628 -8.459 8.354 1.00 0.00 O ATOM 27 CB PRO A 25 -10.990 -5.476 9.501 1.00 0.00 C ATOM 28 CG PRO A 25 -10.247 -4.414 10.294 1.00 0.00 C ATOM 29 CD PRO A 25 -9.484 -5.112 11.408 1.00 0.00 C ATOM 0 HA PRO A 25 -11.164 -7.568 10.013 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.873 -5.316 8.429 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.059 -5.445 9.713 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.562 -3.865 9.648 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.946 -3.687 10.708 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.421 -4.875 11.369 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.844 -4.802 12.389 1.00 0.00 H new ATOM 37 N LYS A 26 -8.352 -6.615 8.648 1.00 0.00 N ATOM 38 CA LYS A 26 -7.339 -7.028 7.692 1.00 0.00 C ATOM 39 C LYS A 26 -6.081 -6.180 7.889 1.00 0.00 C ATOM 40 O LYS A 26 -6.170 -5.002 8.232 1.00 0.00 O ATOM 41 CB LYS A 26 -7.896 -6.981 6.267 1.00 0.00 C ATOM 42 CG LYS A 26 -6.810 -7.318 5.243 1.00 0.00 C ATOM 43 CD LYS A 26 -6.428 -6.084 4.422 1.00 0.00 C ATOM 44 CE LYS A 26 -5.121 -5.472 4.929 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.335 -4.923 3.802 1.00 0.00 N ATOM 0 H LYS A 26 -8.174 -5.716 9.096 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.054 -8.066 7.864 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.722 -7.686 6.172 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.299 -5.989 6.062 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.929 -7.705 5.756 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.164 -8.106 4.578 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.322 -6.359 3.373 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.226 -5.344 4.478 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.337 -4.682 5.648 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.537 -6.229 5.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.395 -4.635 4.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.229 -5.650 3.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.828 -4.098 3.405 1.00 0.00 H new ATOM 59 N LEU A 27 -4.939 -6.812 7.664 1.00 0.00 N ATOM 60 CA LEU A 27 -3.664 -6.130 7.813 1.00 0.00 C ATOM 61 C LEU A 27 -2.658 -6.715 6.819 1.00 0.00 C ATOM 62 O LEU A 27 -2.390 -7.915 6.837 1.00 0.00 O ATOM 63 CB LEU A 27 -3.194 -6.184 9.268 1.00 0.00 C ATOM 64 CG LEU A 27 -2.400 -7.429 9.670 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.896 -7.193 9.514 1.00 0.00 C ATOM 66 CD2 LEU A 27 -2.765 -7.879 11.086 1.00 0.00 C ATOM 0 H LEU A 27 -4.869 -7.789 7.380 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.768 -5.071 7.575 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.578 -5.306 9.463 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -4.068 -6.110 9.915 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.671 -8.240 8.994 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.354 -8.093 9.806 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.671 -6.955 8.474 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.590 -6.363 10.150 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.187 -8.765 11.347 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.540 -7.079 11.791 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.828 -8.114 11.130 1.00 0.00 H new ATOM 78 N LEU A 28 -2.130 -5.839 5.977 1.00 0.00 N ATOM 79 CA LEU A 28 -1.160 -6.254 4.978 1.00 0.00 C ATOM 80 C LEU A 28 0.154 -6.622 5.671 1.00 0.00 C ATOM 81 O LEU A 28 0.444 -6.130 6.760 1.00 0.00 O ATOM 82 CB LEU A 28 -1.007 -5.178 3.901 1.00 0.00 C ATOM 83 CG LEU A 28 -1.381 -5.596 2.477 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.160 -4.447 1.492 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.628 -6.861 2.061 1.00 0.00 C ATOM 0 H LEU A 28 -2.355 -4.844 5.966 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.507 -7.147 4.457 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.622 -4.322 4.180 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.029 -4.839 3.899 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.444 -5.834 2.460 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.433 -4.771 0.488 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.778 -3.597 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.110 -4.153 1.505 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.912 -7.136 1.045 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.445 -6.675 2.100 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.880 -7.675 2.741 1.00 0.00 H new ATOM 97 N TYR A 29 0.913 -7.483 5.010 1.00 0.00 N ATOM 98 CA TYR A 29 2.189 -7.923 5.549 1.00 0.00 C ATOM 99 C TYR A 29 3.226 -8.090 4.436 1.00 0.00 C ATOM 100 O TYR A 29 2.995 -8.818 3.472 1.00 0.00 O ATOM 101 CB TYR A 29 1.928 -9.285 6.195 1.00 0.00 C ATOM 102 CG TYR A 29 3.186 -10.134 6.388 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.064 -9.843 7.411 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.442 -11.191 5.538 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.248 -10.642 7.593 1.00 0.00 C ATOM 106 CE2 TYR A 29 4.626 -11.990 5.719 1.00 0.00 C ATOM 107 CZ TYR A 29 5.471 -11.676 6.738 1.00 0.00 C ATOM 108 OH TYR A 29 6.589 -12.431 6.909 1.00 0.00 O ATOM 0 H TYR A 29 0.669 -7.888 4.106 1.00 0.00 H new ATOM 0 HA TYR A 29 2.578 -7.192 6.258 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.454 -9.131 7.164 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.220 -9.838 5.578 1.00 0.00 H new ATOM 0 HD1 TYR A 29 3.863 -9.016 8.076 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.754 -11.419 4.737 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.943 -10.425 8.390 1.00 0.00 H new ATOM 0 HE2 TYR A 29 4.838 -12.820 5.061 1.00 0.00 H new ATOM 0 HH TYR A 29 7.279 -12.143 6.275 1.00 0.00 H new ATOM 118 N CYS A 30 4.346 -7.404 4.607 1.00 0.00 N ATOM 119 CA CYS A 30 5.419 -7.468 3.629 1.00 0.00 C ATOM 120 C CYS A 30 6.062 -8.854 3.710 1.00 0.00 C ATOM 121 O CYS A 30 6.199 -9.415 4.796 1.00 0.00 O ATOM 122 CB CYS A 30 6.443 -6.350 3.839 1.00 0.00 C ATOM 123 SG CYS A 30 6.697 -5.432 2.277 1.00 0.00 S ATOM 0 H CYS A 30 4.534 -6.801 5.408 1.00 0.00 H new ATOM 0 HA CYS A 30 5.012 -7.316 2.629 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.097 -5.670 4.618 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.388 -6.771 4.181 1.00 0.00 H new ATOM 0 HG CYS A 30 5.546 -5.068 1.795 1.00 0.00 H new ATOM 129 N SER A 31 6.439 -9.365 2.548 1.00 0.00 N ATOM 130 CA SER A 31 7.064 -10.675 2.474 1.00 0.00 C ATOM 131 C SER A 31 8.334 -10.698 3.328 1.00 0.00 C ATOM 132 O SER A 31 8.274 -10.960 4.528 1.00 0.00 O ATOM 133 CB SER A 31 7.392 -11.048 1.027 1.00 0.00 C ATOM 134 OG SER A 31 8.173 -12.237 0.945 1.00 0.00 O ATOM 0 H SER A 31 6.324 -8.896 1.650 1.00 0.00 H new ATOM 0 HA SER A 31 6.360 -11.412 2.860 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.466 -11.184 0.469 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.931 -10.227 0.555 1.00 0.00 H new ATOM 0 HG SER A 31 7.674 -12.923 0.455 1.00 0.00 H new ATOM 140 N ASN A 32 9.453 -10.419 2.675 1.00 0.00 N ATOM 141 CA ASN A 32 10.734 -10.404 3.360 1.00 0.00 C ATOM 142 C ASN A 32 10.790 -9.202 4.304 1.00 0.00 C ATOM 143 O ASN A 32 11.083 -9.352 5.489 1.00 0.00 O ATOM 144 CB ASN A 32 11.889 -10.277 2.364 1.00 0.00 C ATOM 145 CG ASN A 32 13.078 -11.141 2.791 1.00 0.00 C ATOM 146 OD1 ASN A 32 14.144 -10.443 3.172 1.00 0.00 O flip ATOM 147 ND2 ASN A 32 13.031 -12.360 2.775 1.00 0.00 N flip ATOM 0 H ASN A 32 9.499 -10.202 1.679 1.00 0.00 H new ATOM 0 HA ASN A 32 10.833 -11.340 3.910 1.00 0.00 H new ATOM 0 HB2 ASN A 32 11.553 -10.579 1.372 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.199 -9.235 2.292 1.00 0.00 H new ATOM 0 HD21 ASN A 32 12.180 -12.834 2.471 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.842 -12.906 3.066 1.00 0.00 H new ATOM 154 N GLY A 33 10.502 -8.036 3.744 1.00 0.00 N ATOM 155 CA GLY A 33 10.516 -6.809 4.521 1.00 0.00 C ATOM 156 C GLY A 33 10.013 -7.055 5.944 1.00 0.00 C ATOM 157 O GLY A 33 10.560 -6.513 6.903 1.00 0.00 O ATOM 0 H GLY A 33 10.258 -7.916 2.761 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.529 -6.407 4.554 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.891 -6.060 4.035 1.00 0.00 H new ATOM 161 N GLY A 34 8.975 -7.875 6.038 1.00 0.00 N ATOM 162 CA GLY A 34 8.392 -8.200 7.328 1.00 0.00 C ATOM 163 C GLY A 34 7.730 -6.972 7.956 1.00 0.00 C ATOM 164 O GLY A 34 7.341 -7.000 9.122 1.00 0.00 O ATOM 0 H GLY A 34 8.523 -8.324 5.241 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.655 -8.994 7.208 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.165 -8.582 7.995 1.00 0.00 H new ATOM 168 N HIS A 35 7.622 -5.922 7.154 1.00 0.00 N ATOM 169 CA HIS A 35 7.014 -4.687 7.617 1.00 0.00 C ATOM 170 C HIS A 35 5.508 -4.724 7.348 1.00 0.00 C ATOM 171 O HIS A 35 5.037 -5.526 6.544 1.00 0.00 O ATOM 172 CB HIS A 35 7.699 -3.474 6.984 1.00 0.00 C ATOM 173 CG HIS A 35 9.091 -3.212 7.508 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.043 -4.209 7.638 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.682 -2.058 7.931 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.152 -3.668 8.120 1.00 0.00 C ATOM 177 NE2 HIS A 35 10.926 -2.335 8.301 1.00 0.00 N ATOM 0 H HIS A 35 7.945 -5.902 6.187 1.00 0.00 H new ATOM 0 HA HIS A 35 7.154 -4.590 8.694 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.750 -3.620 5.905 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.084 -2.591 7.158 1.00 0.00 H new ATOM 0 HD1 HIS A 35 9.913 -5.193 7.403 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.217 -1.084 7.960 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.073 -4.190 8.332 1.00 0.00 H new ATOM 185 N PHE A 36 4.795 -3.845 8.037 1.00 0.00 N ATOM 186 CA PHE A 36 3.352 -3.767 7.883 1.00 0.00 C ATOM 187 C PHE A 36 2.910 -2.334 7.580 1.00 0.00 C ATOM 188 O PHE A 36 2.899 -1.484 8.468 1.00 0.00 O ATOM 189 CB PHE A 36 2.736 -4.209 9.212 1.00 0.00 C ATOM 190 CG PHE A 36 3.070 -5.649 9.605 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.240 -5.926 10.242 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.198 -6.652 9.317 1.00 0.00 C ATOM 193 CE1 PHE A 36 4.550 -7.263 10.606 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.508 -7.989 9.682 1.00 0.00 C ATOM 195 CZ PHE A 36 3.678 -8.266 10.319 1.00 0.00 C ATOM 0 H PHE A 36 5.189 -3.181 8.703 1.00 0.00 H new ATOM 0 HA PHE A 36 3.031 -4.400 7.056 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.080 -3.539 10.000 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.653 -4.102 9.152 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.932 -5.129 10.471 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.270 -6.432 8.811 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.479 -7.483 11.111 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.815 -8.786 9.454 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.914 -9.283 10.597 1.00 0.00 H new ATOM 205 N LEU A 37 2.555 -2.112 6.323 1.00 0.00 N ATOM 206 CA LEU A 37 2.113 -0.797 5.892 1.00 0.00 C ATOM 207 C LEU A 37 1.201 -0.194 6.962 1.00 0.00 C ATOM 208 O LEU A 37 0.399 -0.902 7.570 1.00 0.00 O ATOM 209 CB LEU A 37 1.468 -0.876 4.507 1.00 0.00 C ATOM 210 CG LEU A 37 2.137 -0.050 3.406 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.225 0.079 2.185 1.00 0.00 C ATOM 212 CD2 LEU A 37 2.581 1.314 3.938 1.00 0.00 C ATOM 0 H LEU A 37 2.565 -2.821 5.589 1.00 0.00 H new ATOM 0 HA LEU A 37 2.965 -0.125 5.784 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.455 -1.920 4.193 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.430 -0.556 4.593 1.00 0.00 H new ATOM 0 HG LEU A 37 3.034 -0.577 3.081 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.725 0.671 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.002 -0.913 1.791 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.297 0.571 2.475 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.053 1.881 3.136 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.713 1.861 4.307 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.293 1.173 4.751 1.00 0.00 H new ATOM 224 N ARG A 38 1.353 1.107 7.159 1.00 0.00 N ATOM 225 CA ARG A 38 0.552 1.813 8.145 1.00 0.00 C ATOM 226 C ARG A 38 0.130 3.181 7.606 1.00 0.00 C ATOM 227 O ARG A 38 0.865 3.805 6.843 1.00 0.00 O ATOM 228 CB ARG A 38 1.329 2.005 9.450 1.00 0.00 C ATOM 229 CG ARG A 38 2.542 2.914 9.237 1.00 0.00 C ATOM 230 CD ARG A 38 2.964 3.580 10.548 1.00 0.00 C ATOM 231 NE ARG A 38 3.304 2.548 11.553 1.00 0.00 N ATOM 232 CZ ARG A 38 4.125 2.753 12.592 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.695 3.952 12.769 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.376 1.758 13.454 1.00 0.00 N ATOM 0 H ARG A 38 2.019 1.691 6.653 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.333 1.209 8.347 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.675 2.437 10.207 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.657 1.037 9.828 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.372 2.331 8.837 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.303 3.678 8.497 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.823 4.229 10.376 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.157 4.211 10.921 1.00 0.00 H new ATOM 0 HE ARG A 38 2.887 1.623 11.448 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.504 4.709 12.113 1.00 0.00 H new ATOM 0 HH12 ARG A 38 5.320 4.108 13.560 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.942 0.845 13.319 1.00 0.00 H new ATOM 0 HH22 ARG A 38 5.001 1.914 14.245 1.00 0.00 H new ATOM 248 N ILE A 39 -1.054 3.606 8.023 1.00 0.00 N ATOM 249 CA ILE A 39 -1.583 4.889 7.591 1.00 0.00 C ATOM 250 C ILE A 39 -2.096 5.660 8.808 1.00 0.00 C ATOM 251 O ILE A 39 -2.542 5.060 9.785 1.00 0.00 O ATOM 252 CB ILE A 39 -2.636 4.693 6.498 1.00 0.00 C ATOM 253 CG1 ILE A 39 -2.435 5.692 5.357 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.049 4.763 7.080 1.00 0.00 C ATOM 255 CD1 ILE A 39 -3.188 6.996 5.631 1.00 0.00 C ATOM 0 H ILE A 39 -1.662 3.085 8.655 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.796 5.493 7.139 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.510 3.695 6.077 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.372 5.900 5.234 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.784 5.256 4.421 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.778 4.621 6.283 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.173 3.981 7.829 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.204 5.737 7.544 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.028 7.689 4.805 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.253 6.787 5.729 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.819 7.442 6.555 1.00 0.00 H new ATOM 267 N LEU A 40 -2.016 6.979 8.710 1.00 0.00 N ATOM 268 CA LEU A 40 -2.467 7.839 9.791 1.00 0.00 C ATOM 269 C LEU A 40 -3.748 8.558 9.364 1.00 0.00 C ATOM 270 O LEU A 40 -3.914 8.897 8.193 1.00 0.00 O ATOM 271 CB LEU A 40 -1.346 8.785 10.226 1.00 0.00 C ATOM 272 CG LEU A 40 -0.007 8.127 10.563 1.00 0.00 C ATOM 273 CD1 LEU A 40 -0.215 6.736 11.164 1.00 0.00 C ATOM 274 CD2 LEU A 40 0.911 8.092 9.340 1.00 0.00 C ATOM 0 H LEU A 40 -1.645 7.473 7.898 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.712 7.247 10.672 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.181 9.511 9.430 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.685 9.341 11.100 1.00 0.00 H new ATOM 0 HG LEU A 40 0.490 8.734 11.320 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.753 6.291 11.394 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.803 6.819 12.078 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.743 6.106 10.449 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.856 7.619 9.608 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.433 7.523 8.543 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.099 9.109 8.997 1.00 0.00 H new ATOM 286 N PRO A 41 -4.645 8.776 10.363 1.00 0.00 N ATOM 287 CA PRO A 41 -5.906 9.449 10.103 1.00 0.00 C ATOM 288 C PRO A 41 -5.697 10.953 9.916 1.00 0.00 C ATOM 289 O PRO A 41 -6.657 11.700 9.736 1.00 0.00 O ATOM 290 CB PRO A 41 -6.784 9.116 11.299 1.00 0.00 C ATOM 291 CG PRO A 41 -5.837 8.660 12.397 1.00 0.00 C ATOM 292 CD PRO A 41 -4.483 8.389 11.762 1.00 0.00 C ATOM 0 HA PRO A 41 -6.375 9.118 9.176 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.359 9.986 11.616 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.501 8.333 11.051 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.750 9.425 13.169 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.218 7.761 12.881 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.696 8.969 12.245 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -4.206 7.339 11.853 1.00 0.00 H new ATOM 300 N ASP A 42 -4.434 11.353 9.966 1.00 0.00 N ATOM 301 CA ASP A 42 -4.087 12.755 9.804 1.00 0.00 C ATOM 302 C ASP A 42 -3.859 13.051 8.321 1.00 0.00 C ATOM 303 O ASP A 42 -4.388 14.027 7.791 1.00 0.00 O ATOM 304 CB ASP A 42 -2.798 13.093 10.557 1.00 0.00 C ATOM 305 CG ASP A 42 -2.766 14.484 11.192 1.00 0.00 C ATOM 306 OD1 ASP A 42 -2.967 15.458 10.434 1.00 0.00 O ATOM 307 OD2 ASP A 42 -2.542 14.543 12.420 1.00 0.00 O ATOM 0 H ASP A 42 -3.640 10.731 10.116 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.906 13.354 10.203 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.646 12.349 11.339 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.959 13.006 9.867 1.00 0.00 H new ATOM 312 N GLY A 43 -3.071 12.192 7.692 1.00 0.00 N ATOM 313 CA GLY A 43 -2.767 12.349 6.280 1.00 0.00 C ATOM 314 C GLY A 43 -1.308 11.989 5.990 1.00 0.00 C ATOM 315 O GLY A 43 -0.610 12.726 5.295 1.00 0.00 O ATOM 0 H GLY A 43 -2.633 11.384 8.135 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.427 11.713 5.689 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.959 13.378 5.975 1.00 0.00 H new ATOM 319 N THR A 44 -0.892 10.856 6.536 1.00 0.00 N ATOM 320 CA THR A 44 0.471 10.390 6.345 1.00 0.00 C ATOM 321 C THR A 44 0.498 8.867 6.201 1.00 0.00 C ATOM 322 O THR A 44 -0.502 8.198 6.457 1.00 0.00 O ATOM 323 CB THR A 44 1.316 10.904 7.512 1.00 0.00 C ATOM 324 OG1 THR A 44 1.670 12.230 7.126 1.00 0.00 O ATOM 325 CG2 THR A 44 2.658 10.179 7.628 1.00 0.00 C ATOM 0 H THR A 44 -1.475 10.247 7.111 1.00 0.00 H new ATOM 0 HA THR A 44 0.896 10.781 5.421 1.00 0.00 H new ATOM 0 HB THR A 44 0.759 10.787 8.442 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.081 12.528 6.401 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.218 10.582 8.472 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.484 9.114 7.784 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.230 10.323 6.711 1.00 0.00 H new ATOM 333 N VAL A 45 1.653 8.363 5.790 1.00 0.00 N ATOM 334 CA VAL A 45 1.823 6.932 5.609 1.00 0.00 C ATOM 335 C VAL A 45 3.261 6.545 5.960 1.00 0.00 C ATOM 336 O VAL A 45 4.128 7.409 6.081 1.00 0.00 O ATOM 337 CB VAL A 45 1.427 6.534 4.185 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.952 5.080 4.134 1.00 0.00 C ATOM 339 CG2 VAL A 45 0.361 7.479 3.628 1.00 0.00 C ATOM 0 H VAL A 45 2.480 8.921 5.577 1.00 0.00 H new ATOM 0 HA VAL A 45 1.165 6.381 6.281 1.00 0.00 H new ATOM 0 HB VAL A 45 2.312 6.619 3.555 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.677 4.823 3.111 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.754 4.423 4.470 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.086 4.957 4.785 1.00 0.00 H new ATOM 0 HG21 VAL A 45 0.098 7.174 2.615 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.526 7.441 4.261 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.750 8.497 3.611 1.00 0.00 H new ATOM 349 N ASP A 46 3.470 5.246 6.113 1.00 0.00 N ATOM 350 CA ASP A 46 4.788 4.734 6.448 1.00 0.00 C ATOM 351 C ASP A 46 4.718 3.212 6.592 1.00 0.00 C ATOM 352 O ASP A 46 3.702 2.600 6.264 1.00 0.00 O ATOM 353 CB ASP A 46 5.282 5.312 7.775 1.00 0.00 C ATOM 354 CG ASP A 46 4.270 6.187 8.517 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.149 5.685 8.749 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.640 7.338 8.834 1.00 0.00 O ATOM 0 H ASP A 46 2.749 4.532 6.011 1.00 0.00 H new ATOM 0 HA ASP A 46 5.474 5.022 5.651 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.574 4.488 8.426 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.179 5.901 7.586 1.00 0.00 H new ATOM 361 N GLY A 47 5.810 2.646 7.083 1.00 0.00 N ATOM 362 CA GLY A 47 5.885 1.207 7.275 1.00 0.00 C ATOM 363 C GLY A 47 6.369 0.867 8.686 1.00 0.00 C ATOM 364 O GLY A 47 6.972 1.702 9.358 1.00 0.00 O ATOM 0 H GLY A 47 6.650 3.157 7.354 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.904 0.762 7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.563 0.773 6.540 1.00 0.00 H new ATOM 368 N THR A 48 6.087 -0.362 9.093 1.00 0.00 N ATOM 369 CA THR A 48 6.485 -0.824 10.412 1.00 0.00 C ATOM 370 C THR A 48 6.963 -2.276 10.347 1.00 0.00 C ATOM 371 O THR A 48 6.224 -3.157 9.911 1.00 0.00 O ATOM 372 CB THR A 48 5.306 -0.614 11.363 1.00 0.00 C ATOM 373 OG1 THR A 48 4.935 0.747 11.162 1.00 0.00 O ATOM 374 CG2 THR A 48 5.722 -0.673 12.834 1.00 0.00 C ATOM 0 H THR A 48 5.587 -1.052 8.532 1.00 0.00 H new ATOM 0 HA THR A 48 7.332 -0.253 10.792 1.00 0.00 H new ATOM 0 HB THR A 48 4.546 -1.371 11.170 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.730 1.316 11.227 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.848 -0.518 13.466 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.157 -1.649 13.050 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.458 0.105 13.035 1.00 0.00 H new ATOM 382 N ARG A 49 8.196 -2.480 10.788 1.00 0.00 N ATOM 383 CA ARG A 49 8.781 -3.810 10.785 1.00 0.00 C ATOM 384 C ARG A 49 7.841 -4.804 11.471 1.00 0.00 C ATOM 385 O ARG A 49 7.944 -6.011 11.254 1.00 0.00 O ATOM 386 CB ARG A 49 10.132 -3.818 11.502 1.00 0.00 C ATOM 387 CG ARG A 49 10.799 -5.191 11.398 1.00 0.00 C ATOM 388 CD ARG A 49 10.627 -5.985 12.695 1.00 0.00 C ATOM 389 NE ARG A 49 11.907 -6.626 13.071 1.00 0.00 N ATOM 390 CZ ARG A 49 12.004 -7.698 13.868 1.00 0.00 C ATOM 391 NH1 ARG A 49 10.898 -8.257 14.378 1.00 0.00 N ATOM 392 NH2 ARG A 49 13.208 -8.213 14.155 1.00 0.00 N ATOM 0 H ARG A 49 8.806 -1.747 11.150 1.00 0.00 H new ATOM 0 HA ARG A 49 8.932 -4.105 9.746 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.783 -3.059 11.067 1.00 0.00 H new ATOM 0 HB3 ARG A 49 9.993 -3.556 12.551 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.366 -5.747 10.567 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.860 -5.068 11.181 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.294 -5.323 13.494 1.00 0.00 H new ATOM 0 HD3 ARG A 49 9.855 -6.744 12.567 1.00 0.00 H new ATOM 0 HE ARG A 49 12.769 -6.226 12.700 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.982 -7.866 14.159 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.973 -9.073 14.985 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.050 -7.788 13.766 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.282 -9.029 14.762 1.00 0.00 H new ATOM 406 N ASP A 50 6.947 -4.261 12.283 1.00 0.00 N ATOM 407 CA ASP A 50 5.990 -5.085 13.002 1.00 0.00 C ATOM 408 C ASP A 50 4.717 -4.276 13.256 1.00 0.00 C ATOM 409 O ASP A 50 4.776 -3.169 13.790 1.00 0.00 O ATOM 410 CB ASP A 50 6.550 -5.525 14.356 1.00 0.00 C ATOM 411 CG ASP A 50 7.082 -6.959 14.401 1.00 0.00 C ATOM 412 OD1 ASP A 50 7.570 -7.416 13.345 1.00 0.00 O ATOM 413 OD2 ASP A 50 6.988 -7.565 15.490 1.00 0.00 O ATOM 0 H ASP A 50 6.865 -3.260 12.459 1.00 0.00 H new ATOM 0 HA ASP A 50 5.780 -5.966 12.396 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.355 -4.846 14.637 1.00 0.00 H new ATOM 0 HB3 ASP A 50 5.767 -5.420 15.107 1.00 0.00 H new ATOM 418 N ARG A 51 3.594 -4.860 12.863 1.00 0.00 N ATOM 419 CA ARG A 51 2.309 -4.207 13.042 1.00 0.00 C ATOM 420 C ARG A 51 2.099 -3.841 14.513 1.00 0.00 C ATOM 421 O ARG A 51 1.940 -4.720 15.358 1.00 0.00 O ATOM 422 CB ARG A 51 1.163 -5.111 12.581 1.00 0.00 C ATOM 423 CG ARG A 51 1.119 -6.402 13.400 1.00 0.00 C ATOM 424 CD ARG A 51 1.074 -7.629 12.488 1.00 0.00 C ATOM 425 NE ARG A 51 0.795 -8.844 13.286 1.00 0.00 N ATOM 426 CZ ARG A 51 0.481 -10.034 12.758 1.00 0.00 C ATOM 427 NH1 ARG A 51 0.405 -10.178 11.428 1.00 0.00 N ATOM 428 NH2 ARG A 51 0.244 -11.081 13.560 1.00 0.00 N ATOM 0 H ARG A 51 3.548 -5.778 12.421 1.00 0.00 H new ATOM 0 HA ARG A 51 2.310 -3.302 12.435 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.215 -4.581 12.679 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.286 -5.350 11.525 1.00 0.00 H new ATOM 0 HG2 ARG A 51 1.995 -6.457 14.046 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.244 -6.395 14.050 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.304 -7.499 11.728 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.024 -7.738 11.965 1.00 0.00 H new ATOM 0 HE ARG A 51 0.845 -8.770 14.302 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.586 -9.381 10.818 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.166 -11.084 11.026 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.303 -10.972 14.572 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.005 -11.987 13.158 1.00 0.00 H new ATOM 442 N SER A 52 2.107 -2.542 14.773 1.00 0.00 N ATOM 443 CA SER A 52 1.920 -2.048 16.127 1.00 0.00 C ATOM 444 C SER A 52 1.975 -0.519 16.139 1.00 0.00 C ATOM 445 O SER A 52 2.923 0.067 16.659 1.00 0.00 O ATOM 446 CB SER A 52 2.975 -2.625 17.073 1.00 0.00 C ATOM 447 OG SER A 52 3.239 -1.756 18.171 1.00 0.00 O ATOM 0 H SER A 52 2.240 -1.816 14.069 1.00 0.00 H new ATOM 0 HA SER A 52 0.940 -2.372 16.477 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.636 -3.591 17.448 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.898 -2.803 16.521 1.00 0.00 H new ATOM 0 HG SER A 52 3.681 -0.944 17.846 1.00 0.00 H new ATOM 453 N ASP A 53 0.946 0.082 15.560 1.00 0.00 N ATOM 454 CA ASP A 53 0.865 1.532 15.497 1.00 0.00 C ATOM 455 C ASP A 53 -0.567 1.972 15.808 1.00 0.00 C ATOM 456 O ASP A 53 -1.405 1.152 16.180 1.00 0.00 O ATOM 457 CB ASP A 53 1.225 2.044 14.101 1.00 0.00 C ATOM 458 CG ASP A 53 1.871 3.430 14.068 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.684 3.700 14.978 1.00 0.00 O ATOM 460 OD2 ASP A 53 1.537 4.189 13.132 1.00 0.00 O ATOM 0 H ASP A 53 0.161 -0.408 15.130 1.00 0.00 H new ATOM 0 HA ASP A 53 1.568 1.941 16.223 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.905 1.332 13.633 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.320 2.067 13.494 1.00 0.00 H new ATOM 465 N GLN A 54 -0.804 3.265 15.643 1.00 0.00 N ATOM 466 CA GLN A 54 -2.120 3.824 15.901 1.00 0.00 C ATOM 467 C GLN A 54 -3.187 3.047 15.128 1.00 0.00 C ATOM 468 O GLN A 54 -4.235 2.711 15.677 1.00 0.00 O ATOM 469 CB GLN A 54 -2.162 5.312 15.549 1.00 0.00 C ATOM 470 CG GLN A 54 -1.487 6.152 16.635 1.00 0.00 C ATOM 471 CD GLN A 54 -0.047 5.691 16.869 1.00 0.00 C ATOM 472 OE1 GLN A 54 0.658 5.530 15.752 1.00 0.00 O flip ATOM 473 NE2 GLN A 54 0.396 5.495 17.989 1.00 0.00 N flip ATOM 0 H GLN A 54 -0.106 3.942 15.334 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.331 3.731 16.966 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -1.663 5.478 14.594 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -3.197 5.632 15.428 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.494 7.202 16.344 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.053 6.075 17.564 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.199 5.638 18.805 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.361 5.189 18.109 1.00 0.00 H new ATOM 482 N HIS A 55 -2.884 2.784 13.865 1.00 0.00 N ATOM 483 CA HIS A 55 -3.804 2.053 13.011 1.00 0.00 C ATOM 484 C HIS A 55 -3.154 1.806 11.648 1.00 0.00 C ATOM 485 O HIS A 55 -3.184 2.673 10.776 1.00 0.00 O ATOM 486 CB HIS A 55 -5.144 2.784 12.905 1.00 0.00 C ATOM 487 CG HIS A 55 -6.264 2.127 13.676 1.00 0.00 C ATOM 488 ND1 HIS A 55 -6.919 2.521 14.806 1.00 0.00 N flip ATOM 489 CD2 HIS A 55 -6.827 0.920 13.299 1.00 0.00 C flip ATOM 490 CE1 HIS A 55 -7.833 1.605 15.102 1.00 0.00 C flip ATOM 491 NE2 HIS A 55 -7.778 0.612 14.169 1.00 0.00 N flip ATOM 0 H HIS A 55 -2.014 3.064 13.413 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.020 1.080 13.453 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.019 3.805 13.265 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.429 2.849 11.855 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.540 0.330 12.441 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.509 1.640 15.943 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -8.366 -0.221 14.145 1.00 0.00 H new ATOM 499 N ILE A 56 -2.581 0.620 11.507 1.00 0.00 N ATOM 500 CA ILE A 56 -1.925 0.249 10.266 1.00 0.00 C ATOM 501 C ILE A 56 -2.870 -0.621 9.434 1.00 0.00 C ATOM 502 O ILE A 56 -2.458 -1.218 8.441 1.00 0.00 O ATOM 503 CB ILE A 56 -0.573 -0.411 10.550 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.708 -1.934 10.609 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.057 0.159 11.822 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.771 -2.351 11.627 1.00 0.00 C ATOM 0 H ILE A 56 -2.558 -0.097 12.232 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.703 1.137 9.674 1.00 0.00 H new ATOM 0 HB ILE A 56 0.101 -0.180 9.725 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.973 -2.318 9.624 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.251 -2.378 10.877 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.016 -0.326 12.002 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.209 1.232 11.703 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.605 -0.022 12.669 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.847 -3.438 11.649 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.491 -1.987 12.615 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.734 -1.926 11.343 1.00 0.00 H new ATOM 518 N GLN A 57 -4.120 -0.664 9.870 1.00 0.00 N ATOM 519 CA GLN A 57 -5.128 -1.450 9.179 1.00 0.00 C ATOM 520 C GLN A 57 -5.239 -1.004 7.719 1.00 0.00 C ATOM 521 O GLN A 57 -5.276 0.191 7.433 1.00 0.00 O ATOM 522 CB GLN A 57 -6.480 -1.353 9.887 1.00 0.00 C ATOM 523 CG GLN A 57 -6.792 -2.640 10.653 1.00 0.00 C ATOM 524 CD GLN A 57 -5.626 -3.033 11.562 1.00 0.00 C ATOM 525 OE1 GLN A 57 -4.622 -3.574 11.128 1.00 0.00 O ATOM 526 NE2 GLN A 57 -5.814 -2.732 12.844 1.00 0.00 N ATOM 0 H GLN A 57 -4.458 -0.167 10.694 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.821 -2.496 9.197 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.474 -0.508 10.576 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.265 -1.162 9.155 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.693 -2.502 11.250 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.996 -3.446 9.949 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.679 -2.279 13.140 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.094 -2.954 13.531 1.00 0.00 H new ATOM 535 N LEU A 58 -5.290 -1.990 6.835 1.00 0.00 N ATOM 536 CA LEU A 58 -5.396 -1.714 5.413 1.00 0.00 C ATOM 537 C LEU A 58 -6.505 -2.580 4.811 1.00 0.00 C ATOM 538 O LEU A 58 -7.093 -3.411 5.503 1.00 0.00 O ATOM 539 CB LEU A 58 -4.039 -1.892 4.729 1.00 0.00 C ATOM 540 CG LEU A 58 -3.007 -0.793 4.993 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.720 -1.379 5.577 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.742 0.025 3.727 1.00 0.00 C ATOM 0 H LEU A 58 -5.260 -2.981 7.076 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.677 -0.674 5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.616 -2.845 5.047 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.202 -1.959 3.653 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.417 -0.110 5.738 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.003 -0.577 5.755 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.943 -1.882 6.518 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.295 -2.096 4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.005 0.799 3.942 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.362 -0.630 2.943 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.670 0.490 3.393 1.00 0.00 H new ATOM 554 N GLN A 59 -6.758 -2.357 3.530 1.00 0.00 N ATOM 555 CA GLN A 59 -7.786 -3.106 2.828 1.00 0.00 C ATOM 556 C GLN A 59 -7.849 -2.674 1.362 1.00 0.00 C ATOM 557 O GLN A 59 -7.898 -1.482 1.063 1.00 0.00 O ATOM 558 CB GLN A 59 -9.146 -2.940 3.508 1.00 0.00 C ATOM 559 CG GLN A 59 -10.118 -4.036 3.065 1.00 0.00 C ATOM 560 CD GLN A 59 -10.857 -4.631 4.265 1.00 0.00 C ATOM 561 OE1 GLN A 59 -10.247 -5.679 4.811 1.00 0.00 O flip ATOM 562 NE2 GLN A 59 -11.912 -4.170 4.668 1.00 0.00 N flip ATOM 0 H GLN A 59 -6.268 -1.668 2.960 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.526 -4.164 2.864 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.022 -2.975 4.590 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.561 -1.962 3.266 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.838 -3.624 2.358 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -9.572 -4.822 2.543 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.327 -3.363 4.202 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -12.379 -4.592 5.471 1.00 0.00 H new ATOM 571 N LEU A 60 -7.846 -3.668 0.485 1.00 0.00 N ATOM 572 CA LEU A 60 -7.903 -3.405 -0.943 1.00 0.00 C ATOM 573 C LEU A 60 -9.364 -3.384 -1.396 1.00 0.00 C ATOM 574 O LEU A 60 -10.239 -3.905 -0.706 1.00 0.00 O ATOM 575 CB LEU A 60 -7.037 -4.409 -1.707 1.00 0.00 C ATOM 576 CG LEU A 60 -5.772 -4.886 -0.990 1.00 0.00 C ATOM 577 CD1 LEU A 60 -6.033 -6.182 -0.221 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.606 -5.026 -1.971 1.00 0.00 C ATOM 0 H LEU A 60 -7.805 -4.656 0.736 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.486 -2.423 -1.166 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.648 -5.281 -1.942 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.745 -3.959 -2.656 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.488 -4.130 -0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.118 -6.499 0.279 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.813 -6.014 0.522 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.355 -6.958 -0.915 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.719 -5.366 -1.436 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.865 -5.751 -2.743 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.402 -4.061 -2.434 1.00 0.00 H new ATOM 590 N SER A 61 -9.584 -2.777 -2.553 1.00 0.00 N ATOM 591 CA SER A 61 -10.924 -2.681 -3.106 1.00 0.00 C ATOM 592 C SER A 61 -10.868 -2.774 -4.632 1.00 0.00 C ATOM 593 O SER A 61 -11.368 -1.892 -5.329 1.00 0.00 O ATOM 594 CB SER A 61 -11.605 -1.380 -2.677 1.00 0.00 C ATOM 595 OG SER A 61 -12.740 -1.080 -3.485 1.00 0.00 O ATOM 0 H SER A 61 -8.856 -2.346 -3.123 1.00 0.00 H new ATOM 0 HA SER A 61 -11.514 -3.512 -2.720 1.00 0.00 H new ATOM 0 HB2 SER A 61 -11.913 -1.459 -1.634 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.890 -0.560 -2.737 1.00 0.00 H new ATOM 0 HG SER A 61 -12.462 -0.992 -4.420 1.00 0.00 H new ATOM 601 N ALA A 62 -10.256 -3.849 -5.106 1.00 0.00 N ATOM 602 CA ALA A 62 -10.128 -4.068 -6.536 1.00 0.00 C ATOM 603 C ALA A 62 -11.422 -3.637 -7.231 1.00 0.00 C ATOM 604 O ALA A 62 -12.505 -4.095 -6.872 1.00 0.00 O ATOM 605 CB ALA A 62 -9.786 -5.535 -6.800 1.00 0.00 C ATOM 0 H ALA A 62 -9.843 -4.578 -4.524 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.317 -3.466 -6.945 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.690 -5.699 -7.873 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.845 -5.783 -6.310 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.579 -6.170 -6.406 1.00 0.00 H new ATOM 611 N GLU A 63 -11.265 -2.762 -8.213 1.00 0.00 N ATOM 612 CA GLU A 63 -12.407 -2.265 -8.961 1.00 0.00 C ATOM 613 C GLU A 63 -12.295 -2.670 -10.433 1.00 0.00 C ATOM 614 O GLU A 63 -13.174 -2.357 -11.235 1.00 0.00 O ATOM 615 CB GLU A 63 -12.537 -0.747 -8.819 1.00 0.00 C ATOM 616 CG GLU A 63 -11.340 -0.033 -9.451 1.00 0.00 C ATOM 617 CD GLU A 63 -11.801 1.012 -10.470 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.891 1.580 -10.247 1.00 0.00 O ATOM 619 OE2 GLU A 63 -11.051 1.218 -11.449 1.00 0.00 O ATOM 0 H GLU A 63 -10.365 -2.384 -8.508 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.310 -2.715 -8.548 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.458 -0.411 -9.295 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.608 -0.481 -7.764 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.747 0.449 -8.673 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.693 -0.762 -9.939 1.00 0.00 H new ATOM 626 N SER A 64 -11.207 -3.360 -10.742 1.00 0.00 N ATOM 627 CA SER A 64 -10.969 -3.811 -12.103 1.00 0.00 C ATOM 628 C SER A 64 -9.485 -4.131 -12.296 1.00 0.00 C ATOM 629 O SER A 64 -8.623 -3.334 -11.929 1.00 0.00 O ATOM 630 CB SER A 64 -11.423 -2.761 -13.119 1.00 0.00 C ATOM 631 OG SER A 64 -12.693 -3.077 -13.682 1.00 0.00 O ATOM 0 H SER A 64 -10.481 -3.618 -10.074 1.00 0.00 H new ATOM 0 HA SER A 64 -11.554 -4.715 -12.271 1.00 0.00 H new ATOM 0 HB2 SER A 64 -11.474 -1.786 -12.634 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.683 -2.683 -13.915 1.00 0.00 H new ATOM 0 HG SER A 64 -13.401 -2.837 -13.048 1.00 0.00 H new ATOM 637 N VAL A 65 -9.234 -5.297 -12.872 1.00 0.00 N ATOM 638 CA VAL A 65 -7.870 -5.732 -13.118 1.00 0.00 C ATOM 639 C VAL A 65 -7.050 -4.551 -13.641 1.00 0.00 C ATOM 640 O VAL A 65 -7.522 -3.786 -14.481 1.00 0.00 O ATOM 641 CB VAL A 65 -7.866 -6.930 -14.069 1.00 0.00 C ATOM 642 CG1 VAL A 65 -7.990 -8.244 -13.296 1.00 0.00 C ATOM 643 CG2 VAL A 65 -8.974 -6.803 -15.116 1.00 0.00 C ATOM 0 H VAL A 65 -9.953 -5.954 -13.176 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.403 -6.068 -12.192 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.910 -6.938 -14.593 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.985 -9.080 -13.996 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.151 -8.342 -12.608 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.923 -8.248 -12.733 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.949 -7.668 -15.779 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.942 -6.756 -14.617 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.822 -5.894 -15.699 1.00 0.00 H new ATOM 653 N GLY A 66 -5.835 -4.439 -13.122 1.00 0.00 N ATOM 654 CA GLY A 66 -4.945 -3.364 -13.526 1.00 0.00 C ATOM 655 C GLY A 66 -5.286 -2.065 -12.793 1.00 0.00 C ATOM 656 O GLY A 66 -4.558 -1.079 -12.899 1.00 0.00 O ATOM 0 H GLY A 66 -5.447 -5.075 -12.426 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.913 -3.644 -13.316 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -5.021 -3.209 -14.602 1.00 0.00 H new ATOM 660 N GLU A 67 -6.393 -2.106 -12.066 1.00 0.00 N ATOM 661 CA GLU A 67 -6.839 -0.944 -11.316 1.00 0.00 C ATOM 662 C GLU A 67 -7.618 -1.382 -10.074 1.00 0.00 C ATOM 663 O GLU A 67 -8.771 -1.798 -10.174 1.00 0.00 O ATOM 664 CB GLU A 67 -7.683 -0.016 -12.193 1.00 0.00 C ATOM 665 CG GLU A 67 -7.208 1.433 -12.072 1.00 0.00 C ATOM 666 CD GLU A 67 -7.949 2.337 -13.059 1.00 0.00 C ATOM 667 OE1 GLU A 67 -8.149 1.880 -14.206 1.00 0.00 O ATOM 668 OE2 GLU A 67 -8.298 3.463 -12.646 1.00 0.00 O ATOM 0 H GLU A 67 -6.994 -2.926 -11.980 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.961 -0.385 -10.993 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.622 -0.337 -13.233 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.730 -0.085 -11.899 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.371 1.789 -11.055 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.136 1.485 -12.260 1.00 0.00 H new ATOM 675 N VAL A 68 -6.955 -1.274 -8.931 1.00 0.00 N ATOM 676 CA VAL A 68 -7.570 -1.653 -7.671 1.00 0.00 C ATOM 677 C VAL A 68 -7.513 -0.469 -6.703 1.00 0.00 C ATOM 678 O VAL A 68 -6.779 0.491 -6.934 1.00 0.00 O ATOM 679 CB VAL A 68 -6.897 -2.910 -7.117 1.00 0.00 C ATOM 680 CG1 VAL A 68 -7.036 -4.081 -8.092 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.427 -2.644 -6.786 1.00 0.00 C ATOM 0 H VAL A 68 -5.998 -0.929 -8.852 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.621 -1.901 -7.819 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.405 -3.182 -6.192 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.549 -4.962 -7.674 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.092 -4.294 -8.257 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.566 -3.822 -9.041 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.972 -3.554 -6.394 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.901 -2.335 -7.689 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.360 -1.853 -6.039 1.00 0.00 H new ATOM 691 N TYR A 69 -8.298 -0.575 -5.641 1.00 0.00 N ATOM 692 CA TYR A 69 -8.346 0.475 -4.638 1.00 0.00 C ATOM 693 C TYR A 69 -7.853 -0.038 -3.283 1.00 0.00 C ATOM 694 O TYR A 69 -7.700 -1.243 -3.090 1.00 0.00 O ATOM 695 CB TYR A 69 -9.817 0.874 -4.515 1.00 0.00 C ATOM 696 CG TYR A 69 -10.235 2.010 -5.450 1.00 0.00 C ATOM 697 CD1 TYR A 69 -9.764 3.290 -5.234 1.00 0.00 C ATOM 698 CD2 TYR A 69 -11.082 1.756 -6.509 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.157 4.360 -6.114 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.474 2.826 -7.389 1.00 0.00 C ATOM 701 CZ TYR A 69 -10.992 4.075 -7.148 1.00 0.00 C ATOM 702 OH TYR A 69 -11.363 5.086 -7.980 1.00 0.00 O ATOM 0 H TYR A 69 -8.906 -1.372 -5.453 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.709 1.311 -4.927 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.438 0.002 -4.720 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.017 1.172 -3.486 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.101 3.489 -4.405 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.451 0.755 -6.678 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -9.797 5.366 -5.956 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -12.136 2.641 -8.222 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.804 5.791 -7.462 1.00 0.00 H new ATOM 712 N ILE A 70 -7.619 0.902 -2.380 1.00 0.00 N ATOM 713 CA ILE A 70 -7.147 0.561 -1.049 1.00 0.00 C ATOM 714 C ILE A 70 -7.774 1.514 -0.030 1.00 0.00 C ATOM 715 O ILE A 70 -7.684 2.732 -0.177 1.00 0.00 O ATOM 716 CB ILE A 70 -5.618 0.540 -1.011 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.062 -0.559 -1.919 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.106 0.410 0.425 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.539 -0.459 -2.033 1.00 0.00 C ATOM 0 H ILE A 70 -7.748 1.901 -2.544 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.463 -0.447 -0.780 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.254 1.492 -1.397 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.337 -1.537 -1.523 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.510 -0.479 -2.909 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.016 0.398 0.423 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.458 1.256 1.015 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.479 -0.517 0.862 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.170 -1.252 -2.684 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.268 0.510 -2.452 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.092 -0.564 -1.044 1.00 0.00 H new ATOM 731 N LYS A 71 -8.395 0.924 0.981 1.00 0.00 N ATOM 732 CA LYS A 71 -9.036 1.706 2.025 1.00 0.00 C ATOM 733 C LYS A 71 -8.583 1.192 3.393 1.00 0.00 C ATOM 734 O LYS A 71 -8.740 0.012 3.700 1.00 0.00 O ATOM 735 CB LYS A 71 -10.555 1.702 1.839 1.00 0.00 C ATOM 736 CG LYS A 71 -11.166 3.030 2.294 1.00 0.00 C ATOM 737 CD LYS A 71 -12.297 2.797 3.297 1.00 0.00 C ATOM 738 CE LYS A 71 -11.764 2.176 4.590 1.00 0.00 C ATOM 739 NZ LYS A 71 -10.656 2.990 5.137 1.00 0.00 N ATOM 0 H LYS A 71 -8.468 -0.086 1.099 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.732 2.751 1.960 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.796 1.527 0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.993 0.882 2.408 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.395 3.653 2.748 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.548 3.574 1.430 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.791 3.743 3.520 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -13.049 2.141 2.857 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.567 2.104 5.324 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -11.417 1.161 4.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.618 2.876 6.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.756 2.676 4.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.814 3.991 4.905 1.00 0.00 H new ATOM 753 N SER A 72 -8.029 2.105 4.178 1.00 0.00 N ATOM 754 CA SER A 72 -7.552 1.759 5.506 1.00 0.00 C ATOM 755 C SER A 72 -8.737 1.488 6.434 1.00 0.00 C ATOM 756 O SER A 72 -8.954 2.218 7.400 1.00 0.00 O ATOM 757 CB SER A 72 -6.671 2.870 6.081 1.00 0.00 C ATOM 758 OG SER A 72 -6.021 2.467 7.284 1.00 0.00 O ATOM 0 H SER A 72 -7.900 3.083 3.920 1.00 0.00 H new ATOM 0 HA SER A 72 -6.947 0.856 5.427 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.922 3.157 5.343 1.00 0.00 H new ATOM 0 HB3 SER A 72 -7.281 3.752 6.276 1.00 0.00 H new ATOM 0 HG SER A 72 -6.110 1.497 7.395 1.00 0.00 H new ATOM 764 N THR A 73 -9.474 0.436 6.108 1.00 0.00 N ATOM 765 CA THR A 73 -10.632 0.059 6.901 1.00 0.00 C ATOM 766 C THR A 73 -10.385 0.356 8.381 1.00 0.00 C ATOM 767 O THR A 73 -9.697 -0.401 9.064 1.00 0.00 O ATOM 768 CB THR A 73 -10.939 -1.414 6.620 1.00 0.00 C ATOM 769 OG1 THR A 73 -12.242 -1.606 7.162 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.053 -2.361 7.431 1.00 0.00 C ATOM 0 H THR A 73 -9.292 -0.167 5.306 1.00 0.00 H new ATOM 0 HA THR A 73 -11.508 0.647 6.626 1.00 0.00 H new ATOM 0 HB THR A 73 -10.808 -1.616 5.557 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.521 -2.535 7.022 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.312 -3.393 7.194 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.007 -2.183 7.182 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.208 -2.183 8.495 1.00 0.00 H new ATOM 778 N GLU A 74 -10.960 1.461 8.834 1.00 0.00 N ATOM 779 CA GLU A 74 -10.811 1.867 10.221 1.00 0.00 C ATOM 780 C GLU A 74 -11.449 3.240 10.443 1.00 0.00 C ATOM 781 O GLU A 74 -12.344 3.385 11.274 1.00 0.00 O ATOM 782 CB GLU A 74 -9.338 1.874 10.635 1.00 0.00 C ATOM 783 CG GLU A 74 -9.118 2.759 11.864 1.00 0.00 C ATOM 784 CD GLU A 74 -10.141 2.443 12.957 1.00 0.00 C ATOM 785 OE1 GLU A 74 -10.139 1.280 13.417 1.00 0.00 O ATOM 786 OE2 GLU A 74 -10.902 3.370 13.307 1.00 0.00 O ATOM 0 H GLU A 74 -11.530 2.087 8.265 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.328 1.141 10.849 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.013 0.857 10.852 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.726 2.235 9.808 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.110 2.608 12.250 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.196 3.808 11.580 1.00 0.00 H new ATOM 793 N THR A 75 -10.964 4.213 9.686 1.00 0.00 N ATOM 794 CA THR A 75 -11.476 5.568 9.789 1.00 0.00 C ATOM 795 C THR A 75 -12.070 6.018 8.453 1.00 0.00 C ATOM 796 O THR A 75 -13.182 6.541 8.409 1.00 0.00 O ATOM 797 CB THR A 75 -10.339 6.467 10.282 1.00 0.00 C ATOM 798 OG1 THR A 75 -10.738 7.778 9.891 1.00 0.00 O ATOM 799 CG2 THR A 75 -9.034 6.231 9.519 1.00 0.00 C ATOM 0 H THR A 75 -10.221 4.089 8.998 1.00 0.00 H new ATOM 0 HA THR A 75 -12.293 5.628 10.508 1.00 0.00 H new ATOM 0 HB THR A 75 -10.174 6.294 11.345 1.00 0.00 H new ATOM 0 HG1 THR A 75 -10.058 8.425 10.173 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.260 6.893 9.908 1.00 0.00 H new ATOM 0 HG22 THR A 75 -8.721 5.195 9.645 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.189 6.437 8.460 1.00 0.00 H new ATOM 807 N GLY A 76 -11.301 5.798 7.396 1.00 0.00 N ATOM 808 CA GLY A 76 -11.738 6.173 6.062 1.00 0.00 C ATOM 809 C GLY A 76 -10.601 6.834 5.280 1.00 0.00 C ATOM 810 O GLY A 76 -10.718 7.985 4.860 1.00 0.00 O ATOM 0 H GLY A 76 -10.378 5.365 7.437 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.087 5.289 5.527 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.583 6.858 6.131 1.00 0.00 H new ATOM 814 N GLN A 77 -9.527 6.078 5.107 1.00 0.00 N ATOM 815 CA GLN A 77 -8.370 6.576 4.382 1.00 0.00 C ATOM 816 C GLN A 77 -8.102 5.708 3.150 1.00 0.00 C ATOM 817 O GLN A 77 -7.900 4.501 3.269 1.00 0.00 O ATOM 818 CB GLN A 77 -7.139 6.637 5.288 1.00 0.00 C ATOM 819 CG GLN A 77 -6.533 8.042 5.297 1.00 0.00 C ATOM 820 CD GLN A 77 -6.086 8.438 6.705 1.00 0.00 C ATOM 821 OE1 GLN A 77 -5.971 7.618 7.601 1.00 0.00 O ATOM 822 NE2 GLN A 77 -5.842 9.737 6.850 1.00 0.00 N ATOM 0 H GLN A 77 -9.433 5.124 5.456 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.584 7.591 4.048 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.415 6.350 6.303 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.395 5.918 4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.681 8.079 4.618 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.266 8.760 4.929 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.958 10.369 6.058 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.539 10.101 7.753 1.00 0.00 H new ATOM 831 N TYR A 78 -8.108 6.358 1.996 1.00 0.00 N ATOM 832 CA TYR A 78 -7.867 5.661 0.744 1.00 0.00 C ATOM 833 C TYR A 78 -6.424 5.856 0.276 1.00 0.00 C ATOM 834 O TYR A 78 -6.029 6.962 -0.089 1.00 0.00 O ATOM 835 CB TYR A 78 -8.812 6.294 -0.280 1.00 0.00 C ATOM 836 CG TYR A 78 -10.268 5.845 -0.144 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.128 6.532 0.689 1.00 0.00 C ATOM 838 CD2 TYR A 78 -10.722 4.752 -0.854 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.498 6.109 0.816 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.093 4.329 -0.727 1.00 0.00 C ATOM 841 CZ TYR A 78 -12.913 5.028 0.103 1.00 0.00 C ATOM 842 OH TYR A 78 -14.207 4.629 0.223 1.00 0.00 O ATOM 0 H TYR A 78 -8.276 7.360 1.901 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.035 4.591 0.863 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.766 7.378 -0.180 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.460 6.051 -1.283 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.773 7.387 1.245 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.049 4.214 -1.505 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.181 6.639 1.463 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.461 3.476 -1.278 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.362 3.845 -0.345 1.00 0.00 H new ATOM 852 N LEU A 79 -5.675 4.763 0.302 1.00 0.00 N ATOM 853 CA LEU A 79 -4.283 4.800 -0.115 1.00 0.00 C ATOM 854 C LEU A 79 -4.172 5.556 -1.440 1.00 0.00 C ATOM 855 O LEU A 79 -5.146 5.658 -2.184 1.00 0.00 O ATOM 856 CB LEU A 79 -3.701 3.386 -0.163 1.00 0.00 C ATOM 857 CG LEU A 79 -2.409 3.165 0.627 1.00 0.00 C ATOM 858 CD1 LEU A 79 -1.274 4.030 0.075 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.634 3.399 2.122 1.00 0.00 C ATOM 0 H LEU A 79 -6.005 3.847 0.605 1.00 0.00 H new ATOM 0 HA LEU A 79 -3.681 5.343 0.613 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.454 2.692 0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.515 3.126 -1.205 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.108 2.124 0.506 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.368 3.854 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.094 3.771 -0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.551 5.082 0.146 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.700 3.235 2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.971 4.423 2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.391 2.706 2.489 1.00 0.00 H new ATOM 871 N ALA A 80 -2.976 6.067 -1.695 1.00 0.00 N ATOM 872 CA ALA A 80 -2.725 6.811 -2.917 1.00 0.00 C ATOM 873 C ALA A 80 -1.257 7.242 -2.955 1.00 0.00 C ATOM 874 O ALA A 80 -0.541 7.106 -1.963 1.00 0.00 O ATOM 875 CB ALA A 80 -3.683 8.001 -2.997 1.00 0.00 C ATOM 0 H ALA A 80 -2.170 5.980 -1.076 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.908 6.185 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.494 8.559 -3.914 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.712 7.641 -2.997 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.527 8.652 -2.137 1.00 0.00 H new ATOM 881 N MET A 81 -0.852 7.751 -4.109 1.00 0.00 N ATOM 882 CA MET A 81 0.517 8.202 -4.288 1.00 0.00 C ATOM 883 C MET A 81 0.562 9.527 -5.053 1.00 0.00 C ATOM 884 O MET A 81 0.032 9.628 -6.158 1.00 0.00 O ATOM 885 CB MET A 81 1.307 7.142 -5.057 1.00 0.00 C ATOM 886 CG MET A 81 2.589 6.764 -4.311 1.00 0.00 C ATOM 887 SD MET A 81 3.596 5.699 -5.329 1.00 0.00 S ATOM 888 CE MET A 81 4.841 5.222 -4.141 1.00 0.00 C ATOM 0 H MET A 81 -1.448 7.861 -4.929 1.00 0.00 H new ATOM 0 HA MET A 81 0.961 8.356 -3.304 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.690 6.255 -5.199 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.557 7.518 -6.049 1.00 0.00 H new ATOM 0 HG2 MET A 81 3.146 7.664 -4.049 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.341 6.260 -3.377 1.00 0.00 H new ATOM 0 HE1 MET A 81 5.831 5.374 -4.571 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.738 5.830 -3.242 1.00 0.00 H new ATOM 0 HE3 MET A 81 4.714 4.170 -3.884 1.00 0.00 H new ATOM 898 N ASP A 82 1.200 10.509 -4.433 1.00 0.00 N ATOM 899 CA ASP A 82 1.322 11.823 -5.041 1.00 0.00 C ATOM 900 C ASP A 82 2.439 11.796 -6.086 1.00 0.00 C ATOM 901 O ASP A 82 3.116 10.782 -6.249 1.00 0.00 O ATOM 902 CB ASP A 82 1.678 12.883 -3.997 1.00 0.00 C ATOM 903 CG ASP A 82 0.693 12.999 -2.832 1.00 0.00 C ATOM 904 OD1 ASP A 82 -0.515 13.137 -3.122 1.00 0.00 O ATOM 905 OD2 ASP A 82 1.170 12.948 -1.678 1.00 0.00 O ATOM 0 H ASP A 82 1.638 10.421 -3.516 1.00 0.00 H new ATOM 0 HA ASP A 82 0.364 12.073 -5.497 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.667 12.659 -3.596 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.747 13.851 -4.493 1.00 0.00 H new ATOM 910 N THR A 83 2.596 12.921 -6.768 1.00 0.00 N ATOM 911 CA THR A 83 3.619 13.039 -7.793 1.00 0.00 C ATOM 912 C THR A 83 5.003 12.766 -7.199 1.00 0.00 C ATOM 913 O THR A 83 5.960 12.525 -7.932 1.00 0.00 O ATOM 914 CB THR A 83 3.494 14.424 -8.429 1.00 0.00 C ATOM 915 OG1 THR A 83 2.273 14.360 -9.162 1.00 0.00 O ATOM 916 CG2 THR A 83 4.558 14.675 -9.500 1.00 0.00 C ATOM 0 H THR A 83 2.031 13.759 -6.631 1.00 0.00 H new ATOM 0 HA THR A 83 3.482 12.293 -8.576 1.00 0.00 H new ATOM 0 HB THR A 83 3.571 15.187 -7.655 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.113 15.219 -9.606 1.00 0.00 H new ATOM 0 HG21 THR A 83 4.424 15.672 -9.919 1.00 0.00 H new ATOM 0 HG22 THR A 83 5.549 14.599 -9.053 1.00 0.00 H new ATOM 0 HG23 THR A 83 4.460 13.932 -10.292 1.00 0.00 H new ATOM 924 N ASP A 84 5.064 12.814 -5.876 1.00 0.00 N ATOM 925 CA ASP A 84 6.314 12.575 -5.176 1.00 0.00 C ATOM 926 C ASP A 84 6.444 11.082 -4.867 1.00 0.00 C ATOM 927 O ASP A 84 7.320 10.676 -4.105 1.00 0.00 O ATOM 928 CB ASP A 84 6.357 13.337 -3.850 1.00 0.00 C ATOM 929 CG ASP A 84 7.526 14.312 -3.702 1.00 0.00 C ATOM 930 OD1 ASP A 84 8.234 14.507 -4.714 1.00 0.00 O ATOM 931 OD2 ASP A 84 7.687 14.840 -2.580 1.00 0.00 O ATOM 0 H ASP A 84 4.268 13.015 -5.271 1.00 0.00 H new ATOM 0 HA ASP A 84 7.128 12.916 -5.815 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.425 13.891 -3.736 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.400 12.615 -3.035 1.00 0.00 H new ATOM 936 N GLY A 85 5.558 10.306 -5.474 1.00 0.00 N ATOM 937 CA GLY A 85 5.562 8.867 -5.273 1.00 0.00 C ATOM 938 C GLY A 85 5.590 8.521 -3.783 1.00 0.00 C ATOM 939 O GLY A 85 6.131 7.487 -3.392 1.00 0.00 O ATOM 0 H GLY A 85 4.833 10.647 -6.105 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.677 8.429 -5.735 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.429 8.430 -5.768 1.00 0.00 H new ATOM 943 N LEU A 86 5.002 9.405 -2.992 1.00 0.00 N ATOM 944 CA LEU A 86 4.953 9.207 -1.553 1.00 0.00 C ATOM 945 C LEU A 86 3.542 8.774 -1.150 1.00 0.00 C ATOM 946 O LEU A 86 2.597 9.557 -1.246 1.00 0.00 O ATOM 947 CB LEU A 86 5.445 10.458 -0.823 1.00 0.00 C ATOM 948 CG LEU A 86 6.057 10.229 0.561 1.00 0.00 C ATOM 949 CD1 LEU A 86 6.393 11.559 1.238 1.00 0.00 C ATOM 950 CD2 LEU A 86 5.144 9.359 1.427 1.00 0.00 C ATOM 0 H LEU A 86 4.555 10.261 -3.320 1.00 0.00 H new ATOM 0 HA LEU A 86 5.630 8.406 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.188 10.952 -1.450 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.607 11.147 -0.719 1.00 0.00 H new ATOM 0 HG LEU A 86 6.994 9.686 0.435 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.826 11.368 2.220 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.108 12.108 0.626 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.484 12.150 1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.602 9.212 2.405 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.180 9.852 1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.999 8.392 0.945 1.00 0.00 H new ATOM 962 N LEU A 87 3.442 7.529 -0.708 1.00 0.00 N ATOM 963 CA LEU A 87 2.162 6.983 -0.290 1.00 0.00 C ATOM 964 C LEU A 87 1.407 8.033 0.528 1.00 0.00 C ATOM 965 O LEU A 87 1.951 8.594 1.477 1.00 0.00 O ATOM 966 CB LEU A 87 2.360 5.656 0.445 1.00 0.00 C ATOM 967 CG LEU A 87 2.341 4.398 -0.424 1.00 0.00 C ATOM 968 CD1 LEU A 87 3.537 4.371 -1.377 1.00 0.00 C ATOM 969 CD2 LEU A 87 2.267 3.136 0.438 1.00 0.00 C ATOM 0 H LEU A 87 4.227 6.882 -0.630 1.00 0.00 H new ATOM 0 HA LEU A 87 1.545 6.751 -1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.313 5.695 0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.581 5.563 1.201 1.00 0.00 H new ATOM 0 HG LEU A 87 1.441 4.422 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.499 3.466 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.504 5.245 -2.027 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.462 4.383 -0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.255 2.256 -0.205 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.135 3.093 1.095 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.358 3.159 1.039 1.00 0.00 H new ATOM 981 N TYR A 88 0.166 8.267 0.129 1.00 0.00 N ATOM 982 CA TYR A 88 -0.669 9.239 0.813 1.00 0.00 C ATOM 983 C TYR A 88 -2.151 8.879 0.681 1.00 0.00 C ATOM 984 O TYR A 88 -2.562 8.280 -0.311 1.00 0.00 O ATOM 985 CB TYR A 88 -0.418 10.577 0.114 1.00 0.00 C ATOM 986 CG TYR A 88 -1.370 10.859 -1.050 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.047 10.435 -2.323 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.550 11.538 -0.827 1.00 0.00 C ATOM 989 CE1 TYR A 88 -1.943 10.701 -3.419 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.446 11.804 -1.923 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.098 11.372 -3.165 1.00 0.00 C ATOM 992 OH TYR A 88 -3.944 11.624 -4.199 1.00 0.00 O ATOM 0 H TYR A 88 -0.282 7.800 -0.660 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.429 9.270 1.876 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.507 11.380 0.846 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.607 10.595 -0.256 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.123 9.904 -2.497 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.802 11.870 0.169 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -1.703 10.375 -4.420 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.373 12.334 -1.762 1.00 0.00 H new ATOM 0 HH TYR A 88 -3.562 12.322 -4.771 1.00 0.00 H new ATOM 1002 N GLY A 89 -2.912 9.260 1.696 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.339 8.985 1.706 1.00 0.00 C ATOM 1004 C GLY A 89 -5.146 10.270 1.513 1.00 0.00 C ATOM 1005 O GLY A 89 -4.756 11.331 1.997 1.00 0.00 O ATOM 0 H GLY A 89 -2.568 9.757 2.517 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.582 8.276 0.914 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -4.616 8.516 2.650 1.00 0.00 H new ATOM 1009 N SER A 90 -6.257 10.132 0.804 1.00 0.00 N ATOM 1010 CA SER A 90 -7.123 11.268 0.541 1.00 0.00 C ATOM 1011 C SER A 90 -8.588 10.826 0.559 1.00 0.00 C ATOM 1012 O SER A 90 -8.884 9.641 0.414 1.00 0.00 O ATOM 1013 CB SER A 90 -6.783 11.921 -0.800 1.00 0.00 C ATOM 1014 OG SER A 90 -6.283 13.246 -0.638 1.00 0.00 O ATOM 0 H SER A 90 -6.577 9.250 0.404 1.00 0.00 H new ATOM 0 HA SER A 90 -6.964 12.007 1.326 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.041 11.315 -1.320 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.674 11.944 -1.428 1.00 0.00 H new ATOM 0 HG SER A 90 -6.076 13.627 -1.517 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.465 11.802 0.740 1.00 0.00 N ATOM 1021 CA GLN A 91 -10.892 11.528 0.779 1.00 0.00 C ATOM 1022 C GLN A 91 -11.484 11.595 -0.630 1.00 0.00 C ATOM 1023 O GLN A 91 -12.593 12.093 -0.818 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.610 12.495 1.723 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.050 12.046 1.976 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.006 13.241 1.972 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.498 13.679 2.999 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.240 13.741 0.762 1.00 0.00 N ATOM 0 H GLN A 91 -9.216 12.784 0.861 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.039 10.519 1.165 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.072 12.552 2.669 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.608 13.497 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.352 11.332 1.210 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.111 11.530 2.934 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.795 13.326 -0.056 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.865 14.540 0.652 1.00 0.00 H new ATOM 1037 N THR A 92 -10.719 11.086 -1.584 1.00 0.00 N ATOM 1038 CA THR A 92 -11.154 11.082 -2.970 1.00 0.00 C ATOM 1039 C THR A 92 -10.640 9.831 -3.686 1.00 0.00 C ATOM 1040 O THR A 92 -9.528 9.825 -4.211 1.00 0.00 O ATOM 1041 CB THR A 92 -10.687 12.387 -3.616 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.274 12.381 -3.430 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.159 13.623 -2.847 1.00 0.00 C ATOM 0 H THR A 92 -9.800 10.673 -1.424 1.00 0.00 H new ATOM 0 HA THR A 92 -12.241 11.037 -3.044 1.00 0.00 H new ATOM 0 HB THR A 92 -11.054 12.435 -4.641 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.910 11.518 -3.717 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.800 14.522 -3.348 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.248 13.637 -2.813 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.765 13.592 -1.831 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.497 8.775 -3.685 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.141 7.522 -4.328 1.00 0.00 C ATOM 1053 C PRO A 93 -11.236 7.641 -5.851 1.00 0.00 C ATOM 1054 O PRO A 93 -12.283 7.365 -6.435 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.104 6.497 -3.752 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.257 7.293 -3.163 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.822 8.746 -3.073 1.00 0.00 C ATOM 0 HA PRO A 93 -10.108 7.230 -4.138 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.456 5.814 -4.525 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.618 5.890 -2.988 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.145 7.198 -3.788 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.520 6.911 -2.176 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.516 9.400 -3.600 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.788 9.086 -2.038 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.128 8.052 -6.450 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.073 8.211 -7.893 1.00 0.00 C ATOM 1067 C ASN A 94 -8.861 7.453 -8.439 1.00 0.00 C ATOM 1068 O ASN A 94 -8.158 6.776 -7.690 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.923 9.683 -8.280 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.243 10.436 -8.093 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.682 10.454 -6.838 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -11.823 10.965 -9.027 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.262 8.280 -5.962 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.001 7.821 -8.311 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.147 10.146 -7.671 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.601 9.759 -9.319 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.430 10.913 -9.967 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.701 11.459 -8.868 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.652 7.593 -9.740 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.537 6.931 -10.395 1.00 0.00 C ATOM 1081 C GLU A 95 -6.290 6.991 -9.510 1.00 0.00 C ATOM 1082 O GLU A 95 -5.491 6.056 -9.494 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.264 7.546 -11.769 1.00 0.00 C ATOM 1084 CG GLU A 95 -8.022 6.795 -12.866 1.00 0.00 C ATOM 1085 CD GLU A 95 -8.882 7.753 -13.692 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -8.281 8.559 -14.435 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -10.122 7.657 -13.563 1.00 0.00 O ATOM 0 H GLU A 95 -9.237 8.156 -10.358 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.800 5.884 -10.548 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.563 8.594 -11.768 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.194 7.519 -11.977 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.314 6.283 -13.517 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.654 6.029 -12.417 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.163 8.100 -8.796 1.00 0.00 N ATOM 1095 CA GLU A 96 -5.027 8.294 -7.911 1.00 0.00 C ATOM 1096 C GLU A 96 -5.070 7.284 -6.763 1.00 0.00 C ATOM 1097 O GLU A 96 -4.167 6.462 -6.619 1.00 0.00 O ATOM 1098 CB GLU A 96 -4.984 9.728 -7.380 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.650 10.018 -6.691 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.272 11.494 -6.826 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -3.840 12.145 -7.730 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.423 11.939 -6.024 1.00 0.00 O ATOM 0 H GLU A 96 -6.828 8.873 -8.812 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.114 8.126 -8.482 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.133 10.428 -8.202 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.802 9.884 -6.677 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -3.716 9.751 -5.636 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.868 9.397 -7.129 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.131 7.379 -5.974 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.304 6.485 -4.842 1.00 0.00 C ATOM 1111 C CYS A 97 -6.090 5.050 -5.327 1.00 0.00 C ATOM 1112 O CYS A 97 -5.563 4.215 -4.593 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.673 6.666 -4.182 1.00 0.00 C ATOM 1114 SG CYS A 97 -7.638 8.107 -3.055 1.00 0.00 S ATOM 0 H CYS A 97 -6.879 8.061 -6.097 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.569 6.721 -4.073 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -8.438 6.809 -4.945 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -7.940 5.767 -3.628 1.00 0.00 H new ATOM 0 HG CYS A 97 -8.184 9.130 -3.642 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.509 4.807 -6.560 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.369 3.487 -7.151 1.00 0.00 C ATOM 1122 C LEU A 98 -4.900 3.063 -7.101 1.00 0.00 C ATOM 1123 O LEU A 98 -4.031 3.862 -6.754 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.968 3.465 -8.559 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.390 2.912 -8.675 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -9.183 3.661 -9.748 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.373 1.403 -8.924 1.00 0.00 C ATOM 0 H LEU A 98 -6.945 5.502 -7.166 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.933 2.751 -6.578 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.962 4.482 -8.951 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.316 2.873 -9.201 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.899 3.076 -7.725 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.190 3.249 -9.810 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.239 4.718 -9.488 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.685 3.551 -10.712 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.396 1.036 -9.002 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.840 1.193 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.871 0.903 -8.096 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.668 1.806 -7.451 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.319 1.267 -7.450 1.00 0.00 C ATOM 1141 C PHE A 99 -3.163 0.176 -8.512 1.00 0.00 C ATOM 1142 O PHE A 99 -3.585 -0.961 -8.306 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.083 0.654 -6.069 1.00 0.00 C ATOM 1144 CG PHE A 99 -1.981 1.342 -5.262 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.794 1.645 -5.853 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.188 1.652 -3.954 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.229 2.284 -5.104 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.164 2.291 -3.205 1.00 0.00 C ATOM 1149 CZ PHE A 99 0.023 2.594 -3.796 1.00 0.00 C ATOM 0 H PHE A 99 -5.391 1.146 -7.737 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.603 2.058 -7.672 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.013 0.694 -5.502 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.828 -0.399 -6.189 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.630 1.400 -6.892 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.131 1.412 -3.485 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.172 2.524 -5.573 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.328 2.536 -2.166 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.801 3.080 -3.227 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.558 0.561 -9.626 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.342 -0.370 -10.721 1.00 0.00 C ATOM 1161 C LEU A 100 -1.710 -1.653 -10.176 1.00 0.00 C ATOM 1162 O LEU A 100 -0.497 -1.718 -9.984 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.528 0.292 -11.834 1.00 0.00 C ATOM 1164 CG LEU A 100 -2.259 0.511 -13.160 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -1.704 1.731 -13.898 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -2.214 -0.751 -14.025 1.00 0.00 C ATOM 0 H LEU A 100 -2.210 1.505 -9.794 1.00 0.00 H new ATOM 0 HA LEU A 100 -3.292 -0.650 -11.176 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.174 1.258 -11.473 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.646 -0.319 -12.025 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.307 0.716 -12.942 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.241 1.864 -14.837 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.830 2.619 -13.279 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.644 1.580 -14.104 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.741 -0.569 -14.962 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.177 -1.010 -14.236 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.693 -1.574 -13.494 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.562 -2.641 -9.944 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.102 -3.918 -9.426 1.00 0.00 C ATOM 1180 C GLU A 101 -1.938 -4.925 -10.566 1.00 0.00 C ATOM 1181 O GLU A 101 -2.704 -4.910 -11.528 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.057 -4.452 -8.356 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.524 -5.748 -7.742 1.00 0.00 C ATOM 1184 CD GLU A 101 -3.477 -6.914 -8.011 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.382 -7.113 -7.172 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -3.279 -7.581 -9.050 1.00 0.00 O ATOM 0 H GLU A 101 -3.568 -2.583 -10.105 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.130 -3.768 -8.956 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.189 -3.703 -7.575 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.038 -4.631 -8.796 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.541 -5.974 -8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.395 -5.619 -6.667 1.00 0.00 H new ATOM 1193 N ARG A 102 -0.933 -5.777 -10.420 1.00 0.00 N ATOM 1194 CA ARG A 102 -0.658 -6.789 -11.426 1.00 0.00 C ATOM 1195 C ARG A 102 -0.375 -8.137 -10.759 1.00 0.00 C ATOM 1196 O ARG A 102 -1.300 -8.836 -10.348 1.00 0.00 O ATOM 1197 CB ARG A 102 0.540 -6.394 -12.291 1.00 0.00 C ATOM 1198 CG ARG A 102 0.191 -5.222 -13.210 1.00 0.00 C ATOM 1199 CD ARG A 102 1.394 -4.818 -14.065 1.00 0.00 C ATOM 1200 NE ARG A 102 2.341 -4.016 -13.260 1.00 0.00 N ATOM 1201 CZ ARG A 102 3.649 -3.902 -13.531 1.00 0.00 C ATOM 1202 NH1 ARG A 102 4.171 -4.537 -14.589 1.00 0.00 N ATOM 1203 NH2 ARG A 102 4.433 -3.152 -12.745 1.00 0.00 N ATOM 0 H ARG A 102 -0.300 -5.787 -9.620 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.539 -6.872 -12.062 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.380 -6.122 -11.652 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.858 -7.248 -12.889 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.643 -5.498 -13.856 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -0.137 -4.372 -12.612 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.893 -5.708 -14.449 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.060 -4.243 -14.928 1.00 0.00 H new ATOM 0 HE ARG A 102 1.976 -3.519 -12.448 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.573 -5.107 -15.188 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.166 -4.451 -14.796 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.035 -2.668 -11.940 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.428 -3.065 -12.951 1.00 0.00 H new ATOM 1217 N LEU A 103 0.906 -8.460 -10.672 1.00 0.00 N ATOM 1218 CA LEU A 103 1.323 -9.712 -10.062 1.00 0.00 C ATOM 1219 C LEU A 103 2.846 -9.828 -10.136 1.00 0.00 C ATOM 1220 O LEU A 103 3.424 -9.789 -11.221 1.00 0.00 O ATOM 1221 CB LEU A 103 0.584 -10.890 -10.699 1.00 0.00 C ATOM 1222 CG LEU A 103 0.001 -11.920 -9.730 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.292 -13.241 -10.444 1.00 0.00 C ATOM 1224 CD2 LEU A 103 0.916 -12.114 -8.519 1.00 0.00 C ATOM 0 H LEU A 103 1.670 -7.877 -11.014 1.00 0.00 H new ATOM 0 HA LEU A 103 1.053 -9.730 -9.006 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.228 -10.496 -11.311 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.271 -11.402 -11.373 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.949 -11.538 -9.357 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.706 -13.955 -9.732 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.011 -13.070 -11.245 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.631 -13.640 -10.864 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.478 -12.851 -7.846 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.893 -12.463 -8.853 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.030 -11.166 -7.993 1.00 0.00 H new ATOM 1236 N GLU A 104 3.455 -9.970 -8.967 1.00 0.00 N ATOM 1237 CA GLU A 104 4.900 -10.092 -8.886 1.00 0.00 C ATOM 1238 C GLU A 104 5.299 -11.558 -8.707 1.00 0.00 C ATOM 1239 O GLU A 104 6.199 -12.048 -9.388 1.00 0.00 O ATOM 1240 CB GLU A 104 5.461 -9.229 -7.754 1.00 0.00 C ATOM 1241 CG GLU A 104 6.706 -9.872 -7.140 1.00 0.00 C ATOM 1242 CD GLU A 104 7.717 -10.254 -8.223 1.00 0.00 C ATOM 1243 OE1 GLU A 104 7.741 -9.544 -9.252 1.00 0.00 O ATOM 1244 OE2 GLU A 104 8.442 -11.247 -7.999 1.00 0.00 O ATOM 0 H GLU A 104 2.973 -10.003 -8.069 1.00 0.00 H new ATOM 0 HA GLU A 104 5.329 -9.730 -9.821 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.709 -8.239 -8.136 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.701 -9.093 -6.985 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.167 -9.180 -6.435 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.420 -10.759 -6.575 1.00 0.00 H new ATOM 1251 N GLU A 105 4.611 -12.218 -7.788 1.00 0.00 N ATOM 1252 CA GLU A 105 4.882 -13.618 -7.511 1.00 0.00 C ATOM 1253 C GLU A 105 3.623 -14.458 -7.738 1.00 0.00 C ATOM 1254 O GLU A 105 3.117 -14.533 -8.857 1.00 0.00 O ATOM 1255 CB GLU A 105 5.415 -13.803 -6.089 1.00 0.00 C ATOM 1256 CG GLU A 105 6.730 -13.046 -5.893 1.00 0.00 C ATOM 1257 CD GLU A 105 7.815 -13.967 -5.331 1.00 0.00 C ATOM 1258 OE1 GLU A 105 8.314 -14.801 -6.117 1.00 0.00 O ATOM 1259 OE2 GLU A 105 8.120 -13.816 -4.129 1.00 0.00 O ATOM 0 H GLU A 105 3.865 -11.809 -7.225 1.00 0.00 H new ATOM 0 HA GLU A 105 5.653 -13.961 -8.200 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.676 -13.447 -5.371 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.569 -14.864 -5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 105 7.059 -12.629 -6.845 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.573 -12.207 -5.215 1.00 0.00 H new ATOM 1266 N ASN A 106 3.155 -15.068 -6.659 1.00 0.00 N ATOM 1267 CA ASN A 106 1.965 -15.900 -6.727 1.00 0.00 C ATOM 1268 C ASN A 106 1.287 -15.924 -5.356 1.00 0.00 C ATOM 1269 O ASN A 106 1.000 -16.994 -4.821 1.00 0.00 O ATOM 1270 CB ASN A 106 2.320 -17.339 -7.105 1.00 0.00 C ATOM 1271 CG ASN A 106 1.206 -17.978 -7.938 1.00 0.00 C ATOM 1272 OD1 ASN A 106 0.578 -17.345 -8.771 1.00 0.00 O ATOM 1273 ND2 ASN A 106 0.997 -19.263 -7.667 1.00 0.00 N ATOM 0 H ASN A 106 3.578 -15.003 -5.733 1.00 0.00 H new ATOM 0 HA ASN A 106 1.303 -15.482 -7.485 1.00 0.00 H new ATOM 0 HB2 ASN A 106 3.253 -17.351 -7.669 1.00 0.00 H new ATOM 0 HB3 ASN A 106 2.486 -17.926 -6.202 1.00 0.00 H new ATOM 0 HD21 ASN A 106 0.275 -19.779 -8.169 1.00 0.00 H new ATOM 0 HD22 ASN A 106 1.559 -19.732 -6.957 1.00 0.00 H new ATOM 1280 N HIS A 107 1.049 -14.733 -4.827 1.00 0.00 N ATOM 1281 CA HIS A 107 0.410 -14.605 -3.529 1.00 0.00 C ATOM 1282 C HIS A 107 0.055 -13.138 -3.274 1.00 0.00 C ATOM 1283 O HIS A 107 -1.098 -12.815 -2.992 1.00 0.00 O ATOM 1284 CB HIS A 107 1.290 -15.201 -2.428 1.00 0.00 C ATOM 1285 CG HIS A 107 1.137 -16.694 -2.261 1.00 0.00 C ATOM 1286 ND1 HIS A 107 0.060 -17.507 -2.459 1.00 0.00 N flip ATOM 1287 CD2 HIS A 107 2.172 -17.512 -1.843 1.00 0.00 C flip ATOM 1288 CE1 HIS A 107 0.418 -18.754 -2.178 1.00 0.00 C flip ATOM 1289 NE2 HIS A 107 1.728 -18.759 -1.796 1.00 0.00 N flip ATOM 0 H HIS A 107 1.287 -13.848 -5.274 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.519 -15.175 -3.520 1.00 0.00 H new ATOM 0 HB2 HIS A 107 2.333 -14.975 -2.649 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.052 -14.714 -1.483 1.00 0.00 H new ATOM 0 HD2 HIS A 107 3.173 -17.188 -1.597 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -0.222 -19.622 -2.241 1.00 0.00 H new ATOM 0 HE2 HIS A 107 2.270 -19.579 -1.522 1.00 0.00 H new ATOM 1297 N TYR A 108 1.067 -12.290 -3.384 1.00 0.00 N ATOM 1298 CA TYR A 108 0.876 -10.866 -3.169 1.00 0.00 C ATOM 1299 C TYR A 108 0.067 -10.243 -4.309 1.00 0.00 C ATOM 1300 O TYR A 108 -0.657 -10.943 -5.015 1.00 0.00 O ATOM 1301 CB TYR A 108 2.276 -10.250 -3.157 1.00 0.00 C ATOM 1302 CG TYR A 108 3.325 -11.101 -2.438 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.417 -11.064 -1.061 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.178 -11.905 -3.165 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.403 -11.866 -0.384 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.165 -12.706 -2.488 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.229 -12.647 -1.131 1.00 0.00 C ATOM 1308 OH TYR A 108 6.160 -13.403 -0.492 1.00 0.00 O ATOM 0 H TYR A 108 2.022 -12.562 -3.619 1.00 0.00 H new ATOM 0 HA TYR A 108 0.333 -10.687 -2.241 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.599 -10.087 -4.185 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.227 -9.272 -2.679 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.750 -10.434 -0.492 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.106 -11.934 -4.242 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.485 -11.848 0.693 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.839 -13.339 -3.046 1.00 0.00 H new ATOM 0 HH TYR A 108 6.678 -13.910 -1.151 1.00 0.00 H new ATOM 1318 N ASN A 109 0.218 -8.934 -4.452 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.489 -8.210 -5.494 1.00 0.00 C ATOM 1320 C ASN A 109 0.155 -6.835 -5.680 1.00 0.00 C ATOM 1321 O ASN A 109 -0.513 -5.810 -5.552 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.957 -7.997 -5.118 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.668 -9.335 -4.905 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.541 -9.978 -3.876 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -3.422 -9.717 -5.932 1.00 0.00 N ATOM 0 H ASN A 109 0.819 -8.357 -3.864 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.433 -8.798 -6.410 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -2.020 -7.399 -4.209 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.460 -7.435 -5.905 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.938 -10.596 -5.887 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.485 -9.131 -6.765 1.00 0.00 H new ATOM 1332 N THR A 110 1.446 -6.857 -5.979 1.00 0.00 N ATOM 1333 CA THR A 110 2.188 -5.624 -6.184 1.00 0.00 C ATOM 1334 C THR A 110 1.337 -4.611 -6.951 1.00 0.00 C ATOM 1335 O THR A 110 0.450 -4.991 -7.714 1.00 0.00 O ATOM 1336 CB THR A 110 3.500 -5.974 -6.889 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.135 -6.994 -7.815 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.501 -6.659 -5.957 1.00 0.00 C ATOM 0 H THR A 110 1.997 -7.709 -6.084 1.00 0.00 H new ATOM 0 HA THR A 110 2.430 -5.145 -5.235 1.00 0.00 H new ATOM 0 HB THR A 110 3.946 -5.067 -7.297 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.815 -7.056 -8.518 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.414 -6.886 -6.507 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.735 -5.996 -5.124 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.069 -7.584 -5.575 1.00 0.00 H new ATOM 1346 N TYR A 111 1.637 -3.341 -6.722 1.00 0.00 N ATOM 1347 CA TYR A 111 0.910 -2.269 -7.382 1.00 0.00 C ATOM 1348 C TYR A 111 1.869 -1.197 -7.904 1.00 0.00 C ATOM 1349 O TYR A 111 3.082 -1.308 -7.734 1.00 0.00 O ATOM 1350 CB TYR A 111 0.006 -1.652 -6.314 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.577 -2.668 -5.329 1.00 0.00 C ATOM 1352 CD1 TYR A 111 0.257 -3.345 -4.463 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -1.936 -2.907 -5.308 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -0.292 -4.302 -3.536 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.484 -3.863 -4.381 1.00 0.00 C ATOM 1356 CZ TYR A 111 -1.635 -4.513 -3.541 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.153 -5.416 -2.666 1.00 0.00 O ATOM 0 H TYR A 111 2.374 -3.030 -6.089 1.00 0.00 H new ATOM 0 HA TYR A 111 0.348 -2.654 -8.233 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.575 -0.907 -5.758 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.813 -1.126 -6.805 1.00 0.00 H new ATOM 0 HD1 TYR A 111 1.321 -3.158 -4.480 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.588 -2.377 -5.987 1.00 0.00 H new ATOM 0 HE1 TYR A 111 0.349 -4.839 -2.853 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.546 -4.059 -4.354 1.00 0.00 H new ATOM 0 HH TYR A 111 -1.802 -5.240 -1.768 1.00 0.00 H new ATOM 1367 N ILE A 112 1.289 -0.183 -8.528 1.00 0.00 N ATOM 1368 CA ILE A 112 2.076 0.909 -9.075 1.00 0.00 C ATOM 1369 C ILE A 112 1.209 2.167 -9.157 1.00 0.00 C ATOM 1370 O ILE A 112 0.074 2.113 -9.628 1.00 0.00 O ATOM 1371 CB ILE A 112 2.698 0.503 -10.413 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.131 1.026 -10.533 1.00 0.00 C ATOM 1373 CG2 ILE A 112 1.823 0.954 -11.584 1.00 0.00 C ATOM 1374 CD1 ILE A 112 5.028 0.011 -11.243 1.00 0.00 C ATOM 0 H ILE A 112 0.282 -0.094 -8.667 1.00 0.00 H new ATOM 0 HA ILE A 112 2.913 1.141 -8.417 1.00 0.00 H new ATOM 0 HB ILE A 112 2.749 -0.585 -10.450 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.134 1.967 -11.084 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.529 1.237 -9.540 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.288 0.653 -12.523 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.839 0.492 -11.502 1.00 0.00 H new ATOM 0 HG23 ILE A 112 1.718 2.039 -11.563 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.041 0.408 -11.315 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.043 -0.920 -10.677 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.641 -0.179 -12.244 1.00 0.00 H new ATOM 1386 N SER A 113 1.777 3.269 -8.690 1.00 0.00 N ATOM 1387 CA SER A 113 1.070 4.539 -8.705 1.00 0.00 C ATOM 1388 C SER A 113 0.288 4.688 -10.012 1.00 0.00 C ATOM 1389 O SER A 113 0.862 5.025 -11.046 1.00 0.00 O ATOM 1390 CB SER A 113 2.037 5.710 -8.528 1.00 0.00 C ATOM 1391 OG SER A 113 1.364 6.906 -8.143 1.00 0.00 O ATOM 0 H SER A 113 2.718 3.309 -8.299 1.00 0.00 H new ATOM 0 HA SER A 113 0.371 4.551 -7.868 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.781 5.454 -7.774 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.574 5.881 -9.461 1.00 0.00 H new ATOM 0 HG SER A 113 1.138 7.426 -8.942 1.00 0.00 H new ATOM 1397 N LYS A 114 -1.008 4.429 -9.922 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.873 4.531 -11.085 1.00 0.00 C ATOM 1399 C LYS A 114 -1.924 5.987 -11.552 1.00 0.00 C ATOM 1400 O LYS A 114 -2.195 6.258 -12.721 1.00 0.00 O ATOM 1401 CB LYS A 114 -3.249 3.934 -10.782 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.847 3.274 -12.027 1.00 0.00 C ATOM 1403 CD LYS A 114 -5.163 3.945 -12.424 1.00 0.00 C ATOM 1404 CE LYS A 114 -5.567 3.559 -13.849 1.00 0.00 C ATOM 1405 NZ LYS A 114 -4.562 4.043 -14.821 1.00 0.00 N ATOM 0 H LYS A 114 -1.480 4.149 -9.062 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.471 3.945 -11.912 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.162 3.198 -9.982 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.918 4.717 -10.424 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.138 3.338 -12.853 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.018 2.215 -11.835 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.949 3.653 -11.728 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.060 5.028 -12.352 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.663 2.476 -13.925 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.543 3.983 -14.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.039 4.571 -15.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.885 4.667 -14.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -4.055 3.232 -15.229 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.659 6.885 -10.615 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.671 8.307 -10.916 1.00 0.00 C ATOM 1421 C LYS A 115 -0.509 8.634 -11.856 1.00 0.00 C ATOM 1422 O LYS A 115 -0.577 9.594 -12.622 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.668 9.128 -9.626 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.266 10.517 -9.858 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.314 11.612 -9.375 1.00 0.00 C ATOM 1426 CE LYS A 115 -0.618 12.294 -10.555 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.603 13.025 -11.384 1.00 0.00 N ATOM 0 H LYS A 115 -1.435 6.656 -9.647 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.589 8.579 -11.437 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.239 8.606 -8.858 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.648 9.225 -9.255 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.475 10.654 -10.919 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.217 10.600 -9.332 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.868 12.352 -8.798 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.568 11.181 -8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.141 12.985 -10.188 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.104 11.549 -11.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.139 13.836 -11.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.984 12.388 -12.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.379 13.365 -10.781 1.00 0.00 H new ATOM 1441 N HIS A 116 0.531 7.818 -11.767 1.00 0.00 N ATOM 1442 CA HIS A 116 1.706 8.008 -12.599 1.00 0.00 C ATOM 1443 C HIS A 116 2.509 6.707 -12.660 1.00 0.00 C ATOM 1444 O HIS A 116 3.630 6.642 -12.158 1.00 0.00 O ATOM 1445 CB HIS A 116 2.536 9.195 -12.105 1.00 0.00 C ATOM 1446 CG HIS A 116 2.193 9.642 -10.704 1.00 0.00 C ATOM 1447 ND1 HIS A 116 2.074 8.761 -9.643 1.00 0.00 N ATOM 1448 CD2 HIS A 116 1.945 10.886 -10.201 1.00 0.00 C ATOM 1449 CE1 HIS A 116 1.767 9.454 -8.556 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.688 10.771 -8.904 1.00 0.00 N ATOM 0 H HIS A 116 0.584 7.023 -11.130 1.00 0.00 H new ATOM 0 HA HIS A 116 1.399 8.252 -13.616 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.592 8.928 -12.142 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.395 10.033 -12.788 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.956 11.808 -10.763 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.607 9.048 -7.568 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.468 11.540 -8.272 1.00 0.00 H new ATOM 1458 N ALA A 117 1.904 5.704 -13.278 1.00 0.00 N ATOM 1459 CA ALA A 117 2.548 4.409 -13.411 1.00 0.00 C ATOM 1460 C ALA A 117 3.619 4.486 -14.501 1.00 0.00 C ATOM 1461 O ALA A 117 4.311 3.504 -14.768 1.00 0.00 O ATOM 1462 CB ALA A 117 1.493 3.341 -13.706 1.00 0.00 C ATOM 0 H ALA A 117 0.974 5.762 -13.693 1.00 0.00 H new ATOM 0 HA ALA A 117 3.043 4.130 -12.481 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.977 2.369 -13.806 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.773 3.306 -12.889 1.00 0.00 H new ATOM 0 HB3 ALA A 117 0.977 3.586 -14.634 1.00 0.00 H new ATOM 1468 N GLU A 118 3.724 5.663 -15.101 1.00 0.00 N ATOM 1469 CA GLU A 118 4.699 5.881 -16.156 1.00 0.00 C ATOM 1470 C GLU A 118 6.113 5.923 -15.571 1.00 0.00 C ATOM 1471 O GLU A 118 7.091 6.022 -16.310 1.00 0.00 O ATOM 1472 CB GLU A 118 4.389 7.162 -16.933 1.00 0.00 C ATOM 1473 CG GLU A 118 5.425 7.399 -18.034 1.00 0.00 C ATOM 1474 CD GLU A 118 4.806 8.147 -19.217 1.00 0.00 C ATOM 1475 OE1 GLU A 118 4.514 9.349 -19.038 1.00 0.00 O ATOM 1476 OE2 GLU A 118 4.638 7.499 -20.272 1.00 0.00 O ATOM 0 H GLU A 118 3.150 6.476 -14.876 1.00 0.00 H new ATOM 0 HA GLU A 118 4.641 5.048 -16.856 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.394 7.093 -17.373 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.377 8.012 -16.251 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.261 7.972 -17.634 1.00 0.00 H new ATOM 0 HG3 GLU A 118 5.826 6.444 -18.373 1.00 0.00 H new ATOM 1483 N LYS A 119 6.175 5.845 -14.250 1.00 0.00 N ATOM 1484 CA LYS A 119 7.452 5.873 -13.558 1.00 0.00 C ATOM 1485 C LYS A 119 7.629 4.573 -12.771 1.00 0.00 C ATOM 1486 O LYS A 119 8.625 4.397 -12.071 1.00 0.00 O ATOM 1487 CB LYS A 119 7.568 7.133 -12.698 1.00 0.00 C ATOM 1488 CG LYS A 119 8.884 7.864 -12.972 1.00 0.00 C ATOM 1489 CD LYS A 119 8.872 9.264 -12.355 1.00 0.00 C ATOM 1490 CE LYS A 119 9.576 10.271 -13.266 1.00 0.00 C ATOM 1491 NZ LYS A 119 9.060 11.637 -13.025 1.00 0.00 N ATOM 0 H LYS A 119 5.361 5.762 -13.641 1.00 0.00 H new ATOM 0 HA LYS A 119 8.272 5.927 -14.274 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.729 7.797 -12.905 1.00 0.00 H new ATOM 0 HB3 LYS A 119 7.510 6.864 -11.643 1.00 0.00 H new ATOM 0 HG2 LYS A 119 9.715 7.290 -12.563 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.046 7.938 -14.047 1.00 0.00 H new ATOM 0 HD2 LYS A 119 7.843 9.581 -12.183 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.365 9.241 -11.383 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.651 10.245 -13.085 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.422 9.996 -14.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 9.548 12.308 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 8.039 11.662 -13.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 9.230 11.902 -12.034 1.00 0.00 H new ATOM 1505 N ASN A 120 6.647 3.694 -12.912 1.00 0.00 N ATOM 1506 CA ASN A 120 6.682 2.415 -12.224 1.00 0.00 C ATOM 1507 C ASN A 120 6.806 2.655 -10.718 1.00 0.00 C ATOM 1508 O ASN A 120 7.491 1.908 -10.021 1.00 0.00 O ATOM 1509 CB ASN A 120 7.885 1.582 -12.670 1.00 0.00 C ATOM 1510 CG ASN A 120 7.450 0.442 -13.594 1.00 0.00 C ATOM 1511 OD1 ASN A 120 7.837 -0.703 -13.434 1.00 0.00 O ATOM 1512 ND2 ASN A 120 6.626 0.820 -14.567 1.00 0.00 N ATOM 0 H ASN A 120 5.822 3.843 -13.493 1.00 0.00 H new ATOM 0 HA ASN A 120 5.764 1.878 -12.463 1.00 0.00 H new ATOM 0 HB2 ASN A 120 8.602 2.220 -13.186 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.393 1.173 -11.796 1.00 0.00 H new ATOM 0 HD21 ASN A 120 6.279 0.133 -15.237 1.00 0.00 H new ATOM 0 HD22 ASN A 120 6.341 1.796 -14.644 1.00 0.00 H new ATOM 1519 N TRP A 121 6.134 3.701 -10.260 1.00 0.00 N ATOM 1520 CA TRP A 121 6.160 4.049 -8.849 1.00 0.00 C ATOM 1521 C TRP A 121 5.379 2.979 -8.084 1.00 0.00 C ATOM 1522 O TRP A 121 4.231 3.200 -7.699 1.00 0.00 O ATOM 1523 CB TRP A 121 5.619 5.462 -8.623 1.00 0.00 C ATOM 1524 CG TRP A 121 6.580 6.573 -9.051 1.00 0.00 C ATOM 1525 CD1 TRP A 121 7.889 6.473 -9.318 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.251 7.964 -9.252 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.427 7.693 -9.674 1.00 0.00 N ATOM 1528 CE2 TRP A 121 7.399 8.628 -9.633 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.025 8.638 -9.116 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 7.434 10.000 -9.910 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 5.077 10.008 -9.396 1.00 0.00 C ATOM 1532 CH2 TRP A 121 6.224 10.692 -9.781 1.00 0.00 C ATOM 0 H TRP A 121 5.568 4.319 -10.841 1.00 0.00 H new ATOM 0 HA TRP A 121 7.183 4.067 -8.474 1.00 0.00 H new ATOM 0 HB2 TRP A 121 4.684 5.574 -9.171 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.385 5.586 -7.566 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.452 5.553 -9.262 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.400 7.875 -9.922 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.115 8.138 -8.819 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 8.345 10.498 -10.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.161 10.574 -9.307 1.00 0.00 H new ATOM 0 HH2 TRP A 121 6.182 11.753 -9.980 1.00 0.00 H new ATOM 1543 N PHE A 122 6.031 1.843 -7.886 1.00 0.00 N ATOM 1544 CA PHE A 122 5.411 0.739 -7.174 1.00 0.00 C ATOM 1545 C PHE A 122 5.053 1.142 -5.742 1.00 0.00 C ATOM 1546 O PHE A 122 5.311 2.271 -5.328 1.00 0.00 O ATOM 1547 CB PHE A 122 6.436 -0.397 -7.130 1.00 0.00 C ATOM 1548 CG PHE A 122 6.341 -1.367 -8.309 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.023 -1.111 -9.457 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.573 -2.485 -8.209 1.00 0.00 C ATOM 1551 CE1 PHE A 122 6.935 -2.012 -10.552 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.484 -3.386 -9.304 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.167 -3.130 -10.452 1.00 0.00 C ATOM 0 H PHE A 122 6.983 1.663 -8.206 1.00 0.00 H new ATOM 0 HA PHE A 122 4.493 0.440 -7.679 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.438 0.032 -7.106 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.305 -0.955 -6.203 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.632 -0.223 -9.537 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.031 -2.688 -7.297 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.478 -1.809 -11.463 1.00 0.00 H new ATOM 0 HE2 PHE A 122 4.874 -4.274 -9.225 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.099 -3.815 -11.284 1.00 0.00 H new ATOM 1563 N VAL A 123 4.464 0.197 -5.025 1.00 0.00 N ATOM 1564 CA VAL A 123 4.068 0.439 -3.648 1.00 0.00 C ATOM 1565 C VAL A 123 4.791 -0.550 -2.732 1.00 0.00 C ATOM 1566 O VAL A 123 4.384 -1.705 -2.614 1.00 0.00 O ATOM 1567 CB VAL A 123 2.545 0.367 -3.521 1.00 0.00 C ATOM 1568 CG1 VAL A 123 2.044 -1.063 -3.730 1.00 0.00 C ATOM 1569 CG2 VAL A 123 2.080 0.919 -2.172 1.00 0.00 C ATOM 0 H VAL A 123 4.251 -0.738 -5.372 1.00 0.00 H new ATOM 0 HA VAL A 123 4.360 1.442 -3.338 1.00 0.00 H new ATOM 0 HB VAL A 123 2.114 0.991 -4.304 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.958 -1.086 -3.634 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.328 -1.406 -4.725 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.488 -1.717 -2.980 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.994 0.856 -2.108 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.525 0.335 -1.367 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.389 1.960 -2.079 1.00 0.00 H new ATOM 1579 N GLY A 124 5.852 -0.061 -2.106 1.00 0.00 N ATOM 1580 CA GLY A 124 6.636 -0.888 -1.205 1.00 0.00 C ATOM 1581 C GLY A 124 7.485 -0.025 -0.269 1.00 0.00 C ATOM 1582 O GLY A 124 8.066 0.972 -0.694 1.00 0.00 O ATOM 0 H GLY A 124 6.187 0.897 -2.205 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.972 -1.523 -0.618 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.282 -1.549 -1.782 1.00 0.00 H new ATOM 1586 N LEU A 125 7.530 -0.440 0.989 1.00 0.00 N ATOM 1587 CA LEU A 125 8.298 0.282 1.988 1.00 0.00 C ATOM 1588 C LEU A 125 9.679 -0.362 2.127 1.00 0.00 C ATOM 1589 O LEU A 125 9.793 -1.510 2.555 1.00 0.00 O ATOM 1590 CB LEU A 125 7.522 0.364 3.304 1.00 0.00 C ATOM 1591 CG LEU A 125 6.372 -0.632 3.468 1.00 0.00 C ATOM 1592 CD1 LEU A 125 6.896 -2.066 3.561 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.494 -0.263 4.665 1.00 0.00 C ATOM 0 H LEU A 125 7.047 -1.267 1.339 1.00 0.00 H new ATOM 0 HA LEU A 125 8.457 1.314 1.674 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.223 0.218 4.126 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.120 1.372 3.404 1.00 0.00 H new ATOM 0 HG LEU A 125 5.744 -0.577 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 125 6.058 -2.753 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.444 -2.313 2.652 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.560 -2.156 4.421 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.684 -0.987 4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.096 -0.271 5.574 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.075 0.732 4.516 1.00 0.00 H new ATOM 1605 N LYS A 126 10.694 0.405 1.758 1.00 0.00 N ATOM 1606 CA LYS A 126 12.063 -0.076 1.836 1.00 0.00 C ATOM 1607 C LYS A 126 12.152 -1.179 2.893 1.00 0.00 C ATOM 1608 O LYS A 126 11.760 -0.976 4.041 1.00 0.00 O ATOM 1609 CB LYS A 126 13.027 1.087 2.079 1.00 0.00 C ATOM 1610 CG LYS A 126 14.315 0.908 1.273 1.00 0.00 C ATOM 1611 CD LYS A 126 15.495 1.593 1.967 1.00 0.00 C ATOM 1612 CE LYS A 126 16.810 1.276 1.252 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.759 2.404 1.388 1.00 0.00 N ATOM 0 H LYS A 126 10.596 1.357 1.404 1.00 0.00 H new ATOM 0 HA LYS A 126 12.366 -0.518 0.887 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.547 2.026 1.802 1.00 0.00 H new ATOM 0 HB3 LYS A 126 13.264 1.152 3.141 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.527 -0.154 1.150 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.184 1.324 0.274 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.336 2.671 1.983 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.552 1.264 3.005 1.00 0.00 H new ATOM 0 HE2 LYS A 126 17.250 0.371 1.671 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.619 1.079 0.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.646 2.172 0.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.344 3.260 0.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.955 2.573 2.395 1.00 0.00 H new ATOM 1627 N LYS A 127 12.669 -2.322 2.468 1.00 0.00 N ATOM 1628 CA LYS A 127 12.815 -3.457 3.363 1.00 0.00 C ATOM 1629 C LYS A 127 13.815 -3.106 4.466 1.00 0.00 C ATOM 1630 O LYS A 127 14.851 -3.755 4.599 1.00 0.00 O ATOM 1631 CB LYS A 127 13.183 -4.716 2.577 1.00 0.00 C ATOM 1632 CG LYS A 127 14.158 -4.389 1.444 1.00 0.00 C ATOM 1633 CD LYS A 127 15.294 -3.492 1.939 1.00 0.00 C ATOM 1634 CE LYS A 127 16.214 -3.086 0.787 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.523 -2.630 1.305 1.00 0.00 N ATOM 0 H LYS A 127 12.992 -2.487 1.515 1.00 0.00 H new ATOM 0 HA LYS A 127 11.867 -3.681 3.852 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.631 -5.449 3.247 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.281 -5.169 2.166 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.570 -5.312 1.037 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.625 -3.893 0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.879 -2.600 2.409 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.870 -4.016 2.702 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.357 -3.931 0.113 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.749 -2.290 0.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.135 -2.358 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 17.383 -1.811 1.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.972 -3.400 1.840 1.00 0.00 H new ATOM 1649 N ASN A 128 13.469 -2.080 5.230 1.00 0.00 N ATOM 1650 CA ASN A 128 14.324 -1.635 6.318 1.00 0.00 C ATOM 1651 C ASN A 128 13.476 -0.907 7.362 1.00 0.00 C ATOM 1652 O ASN A 128 13.665 -1.097 8.563 1.00 0.00 O ATOM 1653 CB ASN A 128 15.394 -0.663 5.815 1.00 0.00 C ATOM 1654 CG ASN A 128 16.775 -1.042 6.354 1.00 0.00 C ATOM 1655 OD1 ASN A 128 17.088 -0.857 7.518 1.00 0.00 O ATOM 1656 ND2 ASN A 128 17.582 -1.580 5.444 1.00 0.00 N ATOM 0 H ASN A 128 12.608 -1.544 5.117 1.00 0.00 H new ATOM 0 HA ASN A 128 14.807 -2.512 6.748 1.00 0.00 H new ATOM 0 HB2 ASN A 128 15.411 -0.667 4.725 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.144 0.351 6.126 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.526 -1.865 5.705 1.00 0.00 H new ATOM 0 HD22 ASN A 128 17.257 -1.707 4.486 1.00 0.00 H new ATOM 1663 N GLY A 129 12.560 -0.087 6.867 1.00 0.00 N ATOM 1664 CA GLY A 129 11.683 0.671 7.742 1.00 0.00 C ATOM 1665 C GLY A 129 11.645 2.146 7.337 1.00 0.00 C ATOM 1666 O GLY A 129 12.230 2.993 8.010 1.00 0.00 O ATOM 0 H GLY A 129 12.407 0.069 5.871 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.677 0.254 7.704 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.026 0.582 8.773 1.00 0.00 H new ATOM 1670 N SER A 130 10.951 2.407 6.240 1.00 0.00 N ATOM 1671 CA SER A 130 10.829 3.765 5.737 1.00 0.00 C ATOM 1672 C SER A 130 10.208 3.752 4.339 1.00 0.00 C ATOM 1673 O SER A 130 10.632 2.985 3.475 1.00 0.00 O ATOM 1674 CB SER A 130 12.189 4.465 5.707 1.00 0.00 C ATOM 1675 OG SER A 130 12.203 5.567 4.803 1.00 0.00 O ATOM 0 H SER A 130 10.467 1.701 5.685 1.00 0.00 H new ATOM 0 HA SER A 130 10.178 4.322 6.411 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.439 4.815 6.709 1.00 0.00 H new ATOM 0 HB3 SER A 130 12.959 3.749 5.418 1.00 0.00 H new ATOM 0 HG SER A 130 13.088 5.988 4.814 1.00 0.00 H new ATOM 1681 N CYS A 131 9.214 4.609 4.159 1.00 0.00 N ATOM 1682 CA CYS A 131 8.531 4.705 2.880 1.00 0.00 C ATOM 1683 C CYS A 131 9.570 5.025 1.803 1.00 0.00 C ATOM 1684 O CYS A 131 10.710 5.363 2.117 1.00 0.00 O ATOM 1685 CB CYS A 131 7.408 5.744 2.916 1.00 0.00 C ATOM 1686 SG CYS A 131 5.953 5.124 1.995 1.00 0.00 S ATOM 0 H CYS A 131 8.865 5.243 4.878 1.00 0.00 H new ATOM 0 HA CYS A 131 8.051 3.754 2.649 1.00 0.00 H new ATOM 0 HB2 CYS A 131 7.131 5.957 3.949 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.754 6.681 2.479 1.00 0.00 H new ATOM 0 HG CYS A 131 4.868 5.620 2.513 1.00 0.00 H new ATOM 1692 N LYS A 132 9.138 4.906 0.556 1.00 0.00 N ATOM 1693 CA LYS A 132 10.017 5.178 -0.569 1.00 0.00 C ATOM 1694 C LYS A 132 9.527 6.429 -1.301 1.00 0.00 C ATOM 1695 O LYS A 132 8.479 6.979 -0.967 1.00 0.00 O ATOM 1696 CB LYS A 132 10.134 3.946 -1.467 1.00 0.00 C ATOM 1697 CG LYS A 132 11.594 3.516 -1.621 1.00 0.00 C ATOM 1698 CD LYS A 132 12.214 3.184 -0.263 1.00 0.00 C ATOM 1699 CE LYS A 132 13.513 3.963 -0.048 1.00 0.00 C ATOM 1700 NZ LYS A 132 13.270 5.151 0.800 1.00 0.00 N ATOM 0 H LYS A 132 8.191 4.625 0.300 1.00 0.00 H new ATOM 0 HA LYS A 132 11.029 5.387 -0.221 1.00 0.00 H new ATOM 0 HB2 LYS A 132 9.553 3.127 -1.044 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.710 4.165 -2.447 1.00 0.00 H new ATOM 0 HG2 LYS A 132 11.653 2.646 -2.274 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.163 4.313 -2.099 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.507 3.423 0.532 1.00 0.00 H new ATOM 0 HD3 LYS A 132 12.413 2.114 -0.202 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.257 3.319 0.422 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.922 4.273 -1.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 14.060 5.270 1.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 13.193 5.996 0.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 12.386 5.023 1.332 1.00 0.00 H new ATOM 1714 N ARG A 133 10.311 6.843 -2.287 1.00 0.00 N ATOM 1715 CA ARG A 133 9.970 8.019 -3.069 1.00 0.00 C ATOM 1716 C ARG A 133 9.788 7.642 -4.541 1.00 0.00 C ATOM 1717 O ARG A 133 10.363 6.662 -5.011 1.00 0.00 O ATOM 1718 CB ARG A 133 11.057 9.090 -2.955 1.00 0.00 C ATOM 1719 CG ARG A 133 11.171 9.604 -1.518 1.00 0.00 C ATOM 1720 CD ARG A 133 10.618 11.025 -1.398 1.00 0.00 C ATOM 1721 NE ARG A 133 11.704 11.962 -1.036 1.00 0.00 N ATOM 1722 CZ ARG A 133 11.600 13.296 -1.106 1.00 0.00 C ATOM 1723 NH1 ARG A 133 10.457 13.858 -1.524 1.00 0.00 N ATOM 1724 NH2 ARG A 133 12.638 14.069 -0.757 1.00 0.00 N ATOM 0 H ARG A 133 11.180 6.385 -2.561 1.00 0.00 H new ATOM 0 HA ARG A 133 9.037 8.421 -2.675 1.00 0.00 H new ATOM 0 HB2 ARG A 133 12.014 8.678 -3.275 1.00 0.00 H new ATOM 0 HB3 ARG A 133 10.828 9.919 -3.625 1.00 0.00 H new ATOM 0 HG2 ARG A 133 10.626 8.940 -0.846 1.00 0.00 H new ATOM 0 HG3 ARG A 133 12.215 9.589 -1.204 1.00 0.00 H new ATOM 0 HD2 ARG A 133 10.164 11.328 -2.342 1.00 0.00 H new ATOM 0 HD3 ARG A 133 9.833 11.056 -0.642 1.00 0.00 H new ATOM 0 HE ARG A 133 12.587 11.568 -0.713 1.00 0.00 H new ATOM 0 HH11 ARG A 133 9.667 13.270 -1.789 1.00 0.00 H new ATOM 0 HH12 ARG A 133 10.378 14.874 -1.577 1.00 0.00 H new ATOM 0 HH21 ARG A 133 13.508 13.642 -0.438 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.558 15.084 -0.810 1.00 0.00 H new ATOM 1738 N GLY A 134 8.985 8.442 -5.228 1.00 0.00 N ATOM 1739 CA GLY A 134 8.719 8.205 -6.637 1.00 0.00 C ATOM 1740 C GLY A 134 9.960 7.653 -7.343 1.00 0.00 C ATOM 1741 O GLY A 134 9.950 6.523 -7.830 1.00 0.00 O ATOM 0 H GLY A 134 8.510 9.255 -4.835 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.893 7.501 -6.742 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.408 9.135 -7.114 1.00 0.00 H new ATOM 1745 N PRO A 135 11.024 8.498 -7.378 1.00 0.00 N ATOM 1746 CA PRO A 135 12.270 8.107 -8.017 1.00 0.00 C ATOM 1747 C PRO A 135 13.043 7.113 -7.148 1.00 0.00 C ATOM 1748 O PRO A 135 14.225 7.313 -6.871 1.00 0.00 O ATOM 1749 CB PRO A 135 13.022 9.408 -8.243 1.00 0.00 C ATOM 1750 CG PRO A 135 12.385 10.425 -7.310 1.00 0.00 C ATOM 1751 CD PRO A 135 11.072 9.843 -6.813 1.00 0.00 C ATOM 0 HA PRO A 135 12.113 7.585 -8.961 1.00 0.00 H new ATOM 0 HB2 PRO A 135 14.083 9.289 -8.025 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.944 9.729 -9.282 1.00 0.00 H new ATOM 0 HG2 PRO A 135 13.048 10.642 -6.472 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.212 11.366 -7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.038 9.816 -5.724 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.223 10.442 -7.144 1.00 0.00 H new ATOM 1759 N ARG A 136 12.344 6.063 -6.742 1.00 0.00 N ATOM 1760 CA ARG A 136 12.950 5.037 -5.910 1.00 0.00 C ATOM 1761 C ARG A 136 11.875 4.100 -5.355 1.00 0.00 C ATOM 1762 O ARG A 136 11.931 3.708 -4.190 1.00 0.00 O ATOM 1763 CB ARG A 136 13.727 5.658 -4.747 1.00 0.00 C ATOM 1764 CG ARG A 136 15.220 5.742 -5.068 1.00 0.00 C ATOM 1765 CD ARG A 136 16.033 4.846 -4.130 1.00 0.00 C ATOM 1766 NE ARG A 136 16.743 5.674 -3.129 1.00 0.00 N ATOM 1767 CZ ARG A 136 17.846 5.282 -2.477 1.00 0.00 C ATOM 1768 NH1 ARG A 136 18.373 4.074 -2.717 1.00 0.00 N ATOM 1769 NH2 ARG A 136 18.423 6.099 -1.586 1.00 0.00 N ATOM 0 H ARG A 136 11.364 5.901 -6.974 1.00 0.00 H new ATOM 0 HA ARG A 136 13.643 4.471 -6.533 1.00 0.00 H new ATOM 0 HB2 ARG A 136 13.340 6.655 -4.538 1.00 0.00 H new ATOM 0 HB3 ARG A 136 13.578 5.063 -3.846 1.00 0.00 H new ATOM 0 HG2 ARG A 136 15.391 5.442 -6.102 1.00 0.00 H new ATOM 0 HG3 ARG A 136 15.558 6.774 -4.975 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.374 4.139 -3.627 1.00 0.00 H new ATOM 0 HD3 ARG A 136 16.751 4.260 -4.704 1.00 0.00 H new ATOM 0 HE ARG A 136 16.369 6.600 -2.923 1.00 0.00 H new ATOM 0 HH11 ARG A 136 17.935 3.452 -3.396 1.00 0.00 H new ATOM 0 HH12 ARG A 136 19.213 3.776 -2.220 1.00 0.00 H new ATOM 0 HH21 ARG A 136 18.023 7.019 -1.404 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.263 5.801 -1.090 1.00 0.00 H new ATOM 1783 N THR A 137 10.923 3.769 -6.214 1.00 0.00 N ATOM 1784 CA THR A 137 9.837 2.887 -5.823 1.00 0.00 C ATOM 1785 C THR A 137 9.564 1.858 -6.923 1.00 0.00 C ATOM 1786 O THR A 137 8.507 1.884 -7.553 1.00 0.00 O ATOM 1787 CB THR A 137 8.621 3.753 -5.486 1.00 0.00 C ATOM 1788 OG1 THR A 137 7.515 2.864 -5.617 1.00 0.00 O ATOM 1789 CG2 THR A 137 8.361 4.832 -6.539 1.00 0.00 C ATOM 0 H THR A 137 10.881 4.096 -7.179 1.00 0.00 H new ATOM 0 HA THR A 137 10.097 2.309 -4.937 1.00 0.00 H new ATOM 0 HB THR A 137 8.768 4.224 -4.514 1.00 0.00 H new ATOM 0 HG1 THR A 137 6.699 3.310 -5.308 1.00 0.00 H new ATOM 0 HG21 THR A 137 7.488 5.418 -6.252 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.229 5.487 -6.611 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.180 4.361 -7.505 1.00 0.00 H new ATOM 1797 N HIS A 138 10.534 0.978 -7.120 1.00 0.00 N ATOM 1798 CA HIS A 138 10.412 -0.057 -8.132 1.00 0.00 C ATOM 1799 C HIS A 138 10.649 -1.428 -7.496 1.00 0.00 C ATOM 1800 O HIS A 138 11.359 -1.539 -6.498 1.00 0.00 O ATOM 1801 CB HIS A 138 11.349 0.221 -9.309 1.00 0.00 C ATOM 1802 CG HIS A 138 11.328 1.654 -9.786 1.00 0.00 C ATOM 1803 ND1 HIS A 138 11.814 2.704 -9.027 1.00 0.00 N ATOM 1804 CD2 HIS A 138 10.877 2.198 -10.952 1.00 0.00 C ATOM 1805 CE1 HIS A 138 11.655 3.825 -9.714 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.074 3.510 -10.907 1.00 0.00 N ATOM 0 H HIS A 138 11.409 0.960 -6.596 1.00 0.00 H new ATOM 0 HA HIS A 138 9.401 -0.055 -8.539 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.367 -0.040 -9.019 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.077 -0.431 -10.139 1.00 0.00 H new ATOM 0 HD2 HIS A 138 10.434 1.654 -11.773 1.00 0.00 H new ATOM 0 HE1 HIS A 138 11.936 4.815 -9.387 1.00 0.00 H new ATOM 0 HE2 HIS A 138 10.831 4.173 -11.643 1.00 0.00 H new ATOM 1814 N TYR A 139 10.040 -2.438 -8.100 1.00 0.00 N ATOM 1815 CA TYR A 139 10.176 -3.797 -7.605 1.00 0.00 C ATOM 1816 C TYR A 139 11.641 -4.239 -7.612 1.00 0.00 C ATOM 1817 O TYR A 139 12.077 -4.940 -8.524 1.00 0.00 O ATOM 1818 CB TYR A 139 9.385 -4.680 -8.573 1.00 0.00 C ATOM 1819 CG TYR A 139 9.974 -4.740 -9.983 1.00 0.00 C ATOM 1820 CD1 TYR A 139 9.712 -3.728 -10.884 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.768 -5.806 -10.355 1.00 0.00 C ATOM 1822 CE1 TYR A 139 10.266 -3.784 -12.212 1.00 0.00 C ATOM 1823 CE2 TYR A 139 11.323 -5.862 -11.682 1.00 0.00 C ATOM 1824 CZ TYR A 139 11.045 -4.849 -12.546 1.00 0.00 C ATOM 1825 OH TYR A 139 11.568 -4.902 -13.800 1.00 0.00 O ATOM 0 H TYR A 139 9.451 -2.342 -8.927 1.00 0.00 H new ATOM 0 HA TYR A 139 9.812 -3.870 -6.580 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.335 -5.691 -8.168 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.362 -4.309 -8.633 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.091 -2.894 -10.593 1.00 0.00 H new ATOM 0 HD2 TYR A 139 10.973 -6.598 -9.650 1.00 0.00 H new ATOM 0 HE1 TYR A 139 10.068 -2.999 -12.927 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.946 -6.690 -11.985 1.00 0.00 H new ATOM 0 HH TYR A 139 12.103 -5.717 -13.897 1.00 0.00 H new ATOM 1835 N GLY A 140 12.360 -3.811 -6.584 1.00 0.00 N ATOM 1836 CA GLY A 140 13.766 -4.154 -6.461 1.00 0.00 C ATOM 1837 C GLY A 140 14.028 -4.942 -5.175 1.00 0.00 C ATOM 1838 O GLY A 140 14.884 -5.824 -5.147 1.00 0.00 O ATOM 0 H GLY A 140 11.995 -3.230 -5.829 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.077 -4.744 -7.323 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.367 -3.245 -6.464 1.00 0.00 H new ATOM 1842 N GLN A 141 13.273 -4.596 -4.143 1.00 0.00 N ATOM 1843 CA GLN A 141 13.412 -5.260 -2.858 1.00 0.00 C ATOM 1844 C GLN A 141 12.081 -5.885 -2.437 1.00 0.00 C ATOM 1845 O GLN A 141 11.059 -5.678 -3.090 1.00 0.00 O ATOM 1846 CB GLN A 141 13.923 -4.289 -1.792 1.00 0.00 C ATOM 1847 CG GLN A 141 14.948 -3.317 -2.380 1.00 0.00 C ATOM 1848 CD GLN A 141 14.282 -2.007 -2.803 1.00 0.00 C ATOM 1849 OE1 GLN A 141 13.725 -1.276 -2.000 1.00 0.00 O ATOM 1850 NE2 GLN A 141 14.369 -1.751 -4.106 1.00 0.00 N ATOM 0 H GLN A 141 12.563 -3.864 -4.170 1.00 0.00 H new ATOM 0 HA GLN A 141 14.149 -6.057 -2.960 1.00 0.00 H new ATOM 0 HB2 GLN A 141 13.086 -3.731 -1.373 1.00 0.00 H new ATOM 0 HB3 GLN A 141 14.375 -4.848 -0.973 1.00 0.00 H new ATOM 0 HG2 GLN A 141 15.725 -3.113 -1.643 1.00 0.00 H new ATOM 0 HG3 GLN A 141 15.437 -3.775 -3.240 1.00 0.00 H new ATOM 0 HE21 GLN A 141 14.850 -2.405 -4.723 1.00 0.00 H new ATOM 0 HE22 GLN A 141 13.955 -0.900 -4.487 1.00 0.00 H new ATOM 1859 N LYS A 142 12.136 -6.639 -1.349 1.00 0.00 N ATOM 1860 CA LYS A 142 10.947 -7.296 -0.833 1.00 0.00 C ATOM 1861 C LYS A 142 10.165 -6.314 0.041 1.00 0.00 C ATOM 1862 O LYS A 142 9.739 -6.660 1.142 1.00 0.00 O ATOM 1863 CB LYS A 142 11.322 -8.594 -0.115 1.00 0.00 C ATOM 1864 CG LYS A 142 10.766 -9.812 -0.857 1.00 0.00 C ATOM 1865 CD LYS A 142 11.825 -10.908 -0.982 1.00 0.00 C ATOM 1866 CE LYS A 142 11.334 -12.218 -0.361 1.00 0.00 C ATOM 1867 NZ LYS A 142 10.965 -13.186 -1.418 1.00 0.00 N ATOM 0 H LYS A 142 12.985 -6.810 -0.811 1.00 0.00 H new ATOM 0 HA LYS A 142 10.289 -7.589 -1.651 1.00 0.00 H new ATOM 0 HB2 LYS A 142 12.407 -8.673 -0.041 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.934 -8.576 0.903 1.00 0.00 H new ATOM 0 HG2 LYS A 142 9.897 -10.200 -0.326 1.00 0.00 H new ATOM 0 HG3 LYS A 142 10.427 -9.514 -1.849 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.066 -11.067 -2.033 1.00 0.00 H new ATOM 0 HD3 LYS A 142 12.743 -10.589 -0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 142 12.113 -12.642 0.272 1.00 0.00 H new ATOM 0 HE3 LYS A 142 10.473 -12.024 0.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 10.880 -14.136 -1.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.056 -12.909 -1.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.700 -13.194 -2.154 1.00 0.00 H new ATOM 1881 N ALA A 143 9.999 -5.108 -0.483 1.00 0.00 N ATOM 1882 CA ALA A 143 9.275 -4.073 0.236 1.00 0.00 C ATOM 1883 C ALA A 143 7.907 -3.866 -0.417 1.00 0.00 C ATOM 1884 O ALA A 143 7.010 -3.278 0.185 1.00 0.00 O ATOM 1885 CB ALA A 143 10.109 -2.791 0.261 1.00 0.00 C ATOM 0 H ALA A 143 10.353 -4.825 -1.397 1.00 0.00 H new ATOM 0 HA ALA A 143 9.104 -4.372 1.270 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.566 -2.014 0.800 1.00 0.00 H new ATOM 0 HB2 ALA A 143 11.058 -2.984 0.761 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.298 -2.460 -0.760 1.00 0.00 H new ATOM 1891 N ILE A 144 7.790 -4.361 -1.641 1.00 0.00 N ATOM 1892 CA ILE A 144 6.547 -4.237 -2.383 1.00 0.00 C ATOM 1893 C ILE A 144 5.715 -5.507 -2.190 1.00 0.00 C ATOM 1894 O ILE A 144 4.489 -5.469 -2.277 1.00 0.00 O ATOM 1895 CB ILE A 144 6.829 -3.904 -3.849 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.760 -4.941 -4.479 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.375 -2.482 -3.992 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.783 -4.804 -6.002 1.00 0.00 C ATOM 0 H ILE A 144 8.536 -4.849 -2.137 1.00 0.00 H new ATOM 0 HA ILE A 144 5.955 -3.406 -2.000 1.00 0.00 H new ATOM 0 HB ILE A 144 5.887 -3.945 -4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.768 -4.817 -4.084 1.00 0.00 H new ATOM 0 HG13 ILE A 144 7.431 -5.944 -4.205 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.567 -2.270 -5.044 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.644 -1.771 -3.606 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.303 -2.390 -3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.453 -5.553 -6.425 1.00 0.00 H new ATOM 0 HD12 ILE A 144 6.778 -4.952 -6.396 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.135 -3.809 -6.272 1.00 0.00 H new ATOM 1910 N LEU A 145 6.416 -6.601 -1.930 1.00 0.00 N ATOM 1911 CA LEU A 145 5.757 -7.880 -1.724 1.00 0.00 C ATOM 1912 C LEU A 145 4.778 -7.762 -0.555 1.00 0.00 C ATOM 1913 O LEU A 145 5.157 -7.959 0.599 1.00 0.00 O ATOM 1914 CB LEU A 145 6.791 -8.994 -1.550 1.00 0.00 C ATOM 1915 CG LEU A 145 6.943 -9.958 -2.728 1.00 0.00 C ATOM 1916 CD1 LEU A 145 7.073 -9.195 -4.048 1.00 0.00 C ATOM 1917 CD2 LEU A 145 8.113 -10.918 -2.504 1.00 0.00 C ATOM 0 H LEU A 145 7.433 -6.628 -1.857 1.00 0.00 H new ATOM 0 HA LEU A 145 5.173 -8.153 -2.603 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.760 -8.535 -1.354 1.00 0.00 H new ATOM 0 HB3 LEU A 145 6.527 -9.572 -0.665 1.00 0.00 H new ATOM 0 HG LEU A 145 6.038 -10.562 -2.793 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.180 -9.904 -4.869 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.182 -8.588 -4.207 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.950 -8.549 -4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 145 8.199 -11.592 -3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 145 9.036 -10.348 -2.398 1.00 0.00 H new ATOM 0 HD23 LEU A 145 7.939 -11.499 -1.598 1.00 0.00 H new ATOM 1929 N PHE A 146 3.538 -7.440 -0.893 1.00 0.00 N ATOM 1930 CA PHE A 146 2.502 -7.293 0.115 1.00 0.00 C ATOM 1931 C PHE A 146 1.518 -8.464 0.065 1.00 0.00 C ATOM 1932 O PHE A 146 0.859 -8.683 -0.951 1.00 0.00 O ATOM 1933 CB PHE A 146 1.751 -5.998 -0.200 1.00 0.00 C ATOM 1934 CG PHE A 146 2.554 -4.728 0.087 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.467 -4.714 1.095 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.355 -3.612 -0.666 1.00 0.00 C ATOM 1937 CE1 PHE A 146 4.213 -3.535 1.361 1.00 0.00 C ATOM 1938 CE2 PHE A 146 3.100 -2.433 -0.399 1.00 0.00 C ATOM 1939 CZ PHE A 146 4.014 -2.420 0.608 1.00 0.00 C ATOM 0 H PHE A 146 3.227 -7.277 -1.851 1.00 0.00 H new ATOM 0 HA PHE A 146 2.950 -7.272 1.108 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.463 -6.004 -1.251 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.830 -5.973 0.383 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.625 -5.599 1.693 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.630 -3.623 -1.467 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.938 -3.524 2.161 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.941 -1.547 -0.995 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.582 -1.524 0.810 1.00 0.00 H new ATOM 1949 N LEU A 147 1.449 -9.186 1.174 1.00 0.00 N ATOM 1950 CA LEU A 147 0.557 -10.329 1.269 1.00 0.00 C ATOM 1951 C LEU A 147 -0.569 -10.011 2.256 1.00 0.00 C ATOM 1952 O LEU A 147 -0.310 -9.667 3.408 1.00 0.00 O ATOM 1953 CB LEU A 147 1.342 -11.594 1.619 1.00 0.00 C ATOM 1954 CG LEU A 147 0.577 -12.913 1.498 1.00 0.00 C ATOM 1955 CD1 LEU A 147 1.494 -14.106 1.773 1.00 0.00 C ATOM 1956 CD2 LEU A 147 -0.655 -12.917 2.405 1.00 0.00 C ATOM 0 H LEU A 147 1.997 -9.001 2.015 1.00 0.00 H new ATOM 0 HA LEU A 147 0.090 -10.529 0.305 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.218 -11.644 0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.706 -11.500 2.642 1.00 0.00 H new ATOM 0 HG LEU A 147 0.222 -13.009 0.472 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.925 -15.031 1.680 1.00 0.00 H new ATOM 0 HD12 LEU A 147 2.312 -14.110 1.053 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.899 -14.029 2.782 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -1.181 -13.866 2.300 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -0.344 -12.787 3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.319 -12.101 2.120 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.826 -10.140 1.754 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.992 -9.871 2.579 1.00 0.00 C ATOM 1970 C PRO A 148 -3.234 -11.008 3.574 1.00 0.00 C ATOM 1971 O PRO A 148 -3.234 -12.179 3.197 1.00 0.00 O ATOM 1972 CB PRO A 148 -4.136 -9.689 1.595 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.670 -10.319 0.292 1.00 0.00 C ATOM 1974 CD PRO A 148 -2.170 -10.546 0.395 1.00 0.00 C ATOM 0 HA PRO A 148 -2.873 -8.983 3.199 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -5.044 -10.170 1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -4.368 -8.633 1.457 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.188 -11.262 0.117 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.901 -9.668 -0.551 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.915 -11.591 0.217 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.628 -9.955 -0.344 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.435 -10.623 4.826 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.678 -11.595 5.878 1.00 0.00 C ATOM 1984 C LEU A 149 -4.917 -11.180 6.673 1.00 0.00 C ATOM 1985 O LEU A 149 -4.824 -10.874 7.861 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.427 -11.775 6.740 1.00 0.00 C ATOM 1987 CG LEU A 149 -2.094 -10.623 7.690 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -2.046 -11.105 9.141 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.797 -9.926 7.274 1.00 0.00 C ATOM 0 H LEU A 149 -3.434 -9.651 5.135 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.886 -12.576 5.450 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.545 -12.684 7.330 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.575 -11.932 6.079 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.892 -9.884 7.623 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.807 -10.266 9.795 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.016 -11.518 9.419 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.281 -11.874 9.244 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -0.584 -9.111 7.966 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.024 -10.643 7.294 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.906 -9.527 6.266 1.00 0.00 H new ATOM 2001 N PRO A 150 -6.080 -11.183 5.968 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.337 -10.811 6.595 1.00 0.00 C ATOM 2003 C PRO A 150 -7.847 -11.929 7.506 1.00 0.00 C ATOM 2004 O PRO A 150 -7.374 -13.062 7.429 1.00 0.00 O ATOM 2005 CB PRO A 150 -8.279 -10.510 5.440 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.663 -11.169 4.217 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.229 -11.540 4.560 1.00 0.00 C ATOM 0 HA PRO A 150 -7.240 -9.944 7.249 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.276 -10.905 5.636 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.385 -9.435 5.293 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.230 -12.056 3.935 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.688 -10.491 3.364 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.046 -12.602 4.399 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.519 -10.996 3.936 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.805 -11.572 8.349 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.384 -12.531 9.274 1.00 0.00 C ATOM 2017 C VAL A 151 -10.740 -12.012 9.757 1.00 0.00 C ATOM 2018 O VAL A 151 -11.043 -12.072 10.948 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.408 -12.808 10.420 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -7.248 -13.688 9.950 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.893 -11.503 11.030 1.00 0.00 C ATOM 0 H VAL A 151 -9.195 -10.631 8.411 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.559 -13.485 8.776 1.00 0.00 H new ATOM 0 HB VAL A 151 -8.948 -13.350 11.196 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -6.569 -13.870 10.783 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -7.637 -14.638 9.585 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -6.711 -13.183 9.147 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.202 -11.729 11.842 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.377 -10.922 10.265 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -8.733 -10.927 11.418 1.00 0.00 H new ATOM 2031 N SER A 152 -11.519 -11.515 8.808 1.00 0.00 N ATOM 2032 CA SER A 152 -12.836 -10.986 9.122 1.00 0.00 C ATOM 2033 C SER A 152 -13.517 -11.866 10.172 1.00 0.00 C ATOM 2034 O SER A 152 -14.009 -12.949 9.855 1.00 0.00 O ATOM 2035 CB SER A 152 -13.704 -10.890 7.866 1.00 0.00 C ATOM 2036 OG SER A 152 -15.091 -10.801 8.181 1.00 0.00 O ATOM 0 H SER A 152 -11.264 -11.467 7.822 1.00 0.00 H new ATOM 0 HA SER A 152 -12.714 -9.980 9.524 1.00 0.00 H new ATOM 0 HB2 SER A 152 -13.407 -10.016 7.286 1.00 0.00 H new ATOM 0 HB3 SER A 152 -13.530 -11.764 7.238 1.00 0.00 H new ATOM 0 HG SER A 152 -15.611 -10.740 7.353 1.00 0.00 H new ATOM 2042 N SER A 153 -13.524 -11.369 11.400 1.00 0.00 N ATOM 2043 CA SER A 153 -14.136 -12.097 12.498 1.00 0.00 C ATOM 2044 C SER A 153 -13.997 -11.300 13.797 1.00 0.00 C ATOM 2045 O SER A 153 -13.216 -11.665 14.673 1.00 0.00 O ATOM 2046 CB SER A 153 -13.509 -13.484 12.658 1.00 0.00 C ATOM 2047 OG SER A 153 -14.088 -14.210 13.739 1.00 0.00 O ATOM 0 H SER A 153 -13.116 -10.471 11.659 1.00 0.00 H new ATOM 0 HA SER A 153 -15.194 -12.230 12.271 1.00 0.00 H new ATOM 0 HB2 SER A 153 -13.635 -14.048 11.734 1.00 0.00 H new ATOM 0 HB3 SER A 153 -12.437 -13.380 12.824 1.00 0.00 H new ATOM 0 HG SER A 153 -13.662 -15.090 13.807 1.00 0.00 H new ATOM 2053 N ASP A 154 -14.768 -10.225 13.879 1.00 0.00 N ATOM 2054 CA ASP A 154 -14.740 -9.372 15.055 1.00 0.00 C ATOM 2055 C ASP A 154 -16.048 -8.582 15.137 1.00 0.00 C ATOM 2056 O ASP A 154 -16.758 -8.444 14.142 1.00 0.00 O ATOM 2057 CB ASP A 154 -13.586 -8.371 14.983 1.00 0.00 C ATOM 2058 CG ASP A 154 -13.229 -7.698 16.310 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -13.944 -6.738 16.670 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -12.249 -8.160 16.934 1.00 0.00 O ATOM 0 H ASP A 154 -15.416 -9.926 13.150 1.00 0.00 H new ATOM 0 HA ASP A 154 -14.610 -10.008 15.930 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -12.702 -8.885 14.604 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -13.840 -7.598 14.258 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 13.418 -11.863 -3.784 1.00 0.00 C HETATM 2067 C2 NTS A 178 14.254 -11.553 -2.712 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.314 -10.251 -2.221 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.533 -9.254 -2.803 1.00 0.00 C HETATM 2070 C5 NTS A 178 11.918 -8.552 -4.450 1.00 0.00 C HETATM 2071 C6 NTS A 178 11.075 -8.842 -5.522 1.00 0.00 C HETATM 2072 C7 NTS A 178 11.010 -10.142 -6.019 1.00 0.00 C HETATM 2073 C8 NTS A 178 11.786 -11.149 -5.445 1.00 0.00 C HETATM 2074 C9 NTS A 178 12.633 -10.866 -4.370 1.00 0.00 C HETATM 2075 C10 NTS A 178 12.694 -9.560 -3.876 1.00 0.00 C HETATM 2076 O11 NTS A 178 13.600 -13.593 -6.169 1.00 0.00 O HETATM 2077 O12 NTS A 178 11.811 -14.354 -3.966 1.00 0.00 O HETATM 2078 O13 NTS A 178 14.724 -14.505 -3.612 1.00 0.00 O HETATM 2079 O31 NTS A 178 15.895 -8.123 -0.929 1.00 0.00 O HETATM 2080 O32 NTS A 178 16.874 -10.893 -0.895 1.00 0.00 O HETATM 2081 O33 NTS A 178 14.531 -10.137 0.723 1.00 0.00 O HETATM 2082 O61 NTS A 178 8.403 -7.600 -5.585 1.00 0.00 O HETATM 2083 O62 NTS A 178 9.991 -7.772 -8.052 1.00 0.00 O HETATM 2084 O63 NTS A 178 10.796 -5.925 -5.904 1.00 0.00 O HETATM 2085 S1 NTS A 178 13.383 -13.583 -4.382 1.00 0.00 S HETATM 2086 S3 NTS A 178 15.407 -9.852 -0.823 1.00 0.00 S HETATM 2087 S6 NTS A 178 10.066 -7.528 -6.271 1.00 0.00 S HETATM 0 H8 NTS A 178 11.731 -12.164 -5.838 1.00 0.00 H new HETATM 0 H7 NTS A 178 10.352 -10.372 -6.857 1.00 0.00 H new HETATM 0 H5 NTS A 178 11.971 -7.536 -4.059 1.00 0.00 H new HETATM 0 H4 NTS A 178 13.577 -8.234 -2.420 1.00 0.00 H new HETATM 0 H2 NTS A 178 14.863 -12.333 -2.256 1.00 0.00 H new