USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 704 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 HIS : no HD1:sc= -7.92! C(o=-12!,f=-14!) USER MOD Set 1.2: A 74 ASN :FLIP amide:sc= -4.46 F(o=-18!,f=-12) USER MOD Single : A 26 GLN : amide:sc= -0.471 K(o=-0.47,f=-3.1!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.651 X(o=-0.65,f=-1.1) USER MOD Single : A 46 MET CE :methyl -168:sc= -0.0484 (180deg=-0.252) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -1.02 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 180:sc= -0.454 USER MOD Single : A 71 CYS SG : rot 86:sc= -0.987! USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= -0.516 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0928) USER MOD Single : A 96 MET CE :methyl 161:sc= -0.228 (180deg=-0.836) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc=-0.00374 X(o=-0.0037,f=-0.00023) USER MOD Single : A 102 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.128! USER MOD Single : A 108 ASN : amide:sc= -0.53 K(o=-0.53,f=-1.4) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 HIS : no HD1:sc= -0.13 X(o=-0.13,f=-0.0019) USER MOD Single : A 119 LYS NZ :NH3+ -149:sc= -0.131 (180deg=-0.873) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 155:sc= -1.36! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN : amide:sc= -0.0525 X(o=-0.052,f=-0.22) USER MOD Single : A 136 ASN : amide:sc= -0.212 K(o=-0.21,f=-1.2) USER MOD Single : A 138 MET CE :methyl -176:sc= -7.05! (180deg=-7.35!) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -8.05! C(o=-8.1!,f=-21!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 129:sc= 0.879 USER MOD Single : A 149 THR OG1 : rot 70:sc= 0.0211 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -9.085 8.661 -7.119 1.00 0.00 N ATOM 61 CA GLN A 26 -8.994 8.446 -8.553 1.00 0.00 C ATOM 62 C GLN A 26 -7.984 9.414 -9.172 1.00 0.00 C ATOM 63 O GLN A 26 -7.387 9.117 -10.205 1.00 0.00 O ATOM 64 CB GLN A 26 -10.365 8.584 -9.216 1.00 0.00 C ATOM 65 CG GLN A 26 -11.115 7.250 -9.210 1.00 0.00 C ATOM 66 CD GLN A 26 -11.285 6.710 -10.631 1.00 0.00 C ATOM 67 OE1 GLN A 26 -10.840 7.297 -11.603 1.00 0.00 O ATOM 68 NE2 GLN A 26 -11.951 5.561 -10.697 1.00 0.00 N ATOM 0 HA GLN A 26 -8.645 7.428 -8.727 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.952 9.338 -8.691 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -10.243 8.932 -10.242 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.570 6.525 -8.605 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -12.093 7.381 -8.747 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.297 5.122 -9.844 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.116 5.118 -11.601 1.00 0.00 H new ATOM 75 N LYS A 27 -7.826 10.554 -8.515 1.00 0.00 N ATOM 76 CA LYS A 27 -6.899 11.568 -8.988 1.00 0.00 C ATOM 77 C LYS A 27 -5.554 11.393 -8.281 1.00 0.00 C ATOM 78 O LYS A 27 -4.846 12.368 -8.034 1.00 0.00 O ATOM 79 CB LYS A 27 -7.503 12.964 -8.824 1.00 0.00 C ATOM 80 CG LYS A 27 -9.027 12.920 -8.949 1.00 0.00 C ATOM 81 CD LYS A 27 -9.451 12.243 -10.254 1.00 0.00 C ATOM 82 CE LYS A 27 -10.844 11.626 -10.125 1.00 0.00 C ATOM 83 NZ LYS A 27 -11.880 12.585 -10.570 1.00 0.00 N ATOM 0 H LYS A 27 -8.324 10.798 -7.659 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.716 11.448 -10.056 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.226 13.372 -7.852 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.092 13.633 -9.580 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.450 12.380 -8.101 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.428 13.933 -8.914 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.446 12.972 -11.064 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.730 11.469 -10.517 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.902 10.716 -10.723 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.027 11.339 -9.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.820 12.149 -10.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.835 13.442 -9.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.714 12.838 -11.565 1.00 0.00 H new ATOM 93 N ASN A 28 -5.240 10.142 -7.976 1.00 0.00 N ATOM 94 CA ASN A 28 -3.993 9.826 -7.302 1.00 0.00 C ATOM 95 C ASN A 28 -3.672 8.343 -7.498 1.00 0.00 C ATOM 96 O ASN A 28 -2.933 7.755 -6.711 1.00 0.00 O ATOM 97 CB ASN A 28 -4.095 10.092 -5.799 1.00 0.00 C ATOM 98 CG ASN A 28 -2.761 10.590 -5.237 1.00 0.00 C ATOM 99 OD1 ASN A 28 -2.183 10.009 -4.333 1.00 0.00 O ATOM 100 ND2 ASN A 28 -2.306 11.694 -5.822 1.00 0.00 N ATOM 0 H ASN A 28 -5.829 9.335 -8.184 1.00 0.00 H new ATOM 0 HA ASN A 28 -3.212 10.456 -7.728 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -4.872 10.832 -5.609 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -4.392 9.178 -5.284 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -1.423 12.105 -5.519 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.840 12.130 -6.574 1.00 0.00 H new ATOM 106 N ILE A 29 -4.245 7.782 -8.553 1.00 0.00 N ATOM 107 CA ILE A 29 -4.030 6.379 -8.863 1.00 0.00 C ATOM 108 C ILE A 29 -3.441 6.256 -10.270 1.00 0.00 C ATOM 109 O ILE A 29 -2.445 6.904 -10.589 1.00 0.00 O ATOM 110 CB ILE A 29 -5.321 5.582 -8.666 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.540 6.398 -9.101 1.00 0.00 C ATOM 112 CG2 ILE A 29 -5.448 5.091 -7.222 1.00 0.00 C ATOM 113 CD1 ILE A 29 -6.627 6.482 -10.627 1.00 0.00 C ATOM 0 H ILE A 29 -4.858 8.274 -9.204 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.306 5.944 -8.174 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.278 4.699 -9.304 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.448 5.942 -8.706 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.479 7.402 -8.681 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.374 4.528 -7.109 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.601 4.449 -6.980 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.459 5.946 -6.547 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.502 7.067 -10.910 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.729 6.961 -11.017 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.712 5.478 -11.042 1.00 0.00 H new ATOM 124 N ASP A 30 -4.082 5.421 -11.074 1.00 0.00 N ATOM 125 CA ASP A 30 -3.634 5.204 -12.439 1.00 0.00 C ATOM 126 C ASP A 30 -4.741 4.505 -13.230 1.00 0.00 C ATOM 127 O ASP A 30 -5.380 5.117 -14.085 1.00 0.00 O ATOM 128 CB ASP A 30 -2.391 4.314 -12.478 1.00 0.00 C ATOM 129 CG ASP A 30 -2.124 3.633 -13.821 1.00 0.00 C ATOM 130 OD1 ASP A 30 -1.589 4.328 -14.712 1.00 0.00 O ATOM 131 OD2 ASP A 30 -2.461 2.433 -13.926 1.00 0.00 O ATOM 0 H ASP A 30 -4.908 4.886 -10.806 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.395 6.175 -12.872 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.522 4.918 -12.215 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.489 3.545 -11.711 1.00 0.00 H new ATOM 135 N GLY A 31 -4.936 3.233 -12.917 1.00 0.00 N ATOM 136 CA GLY A 31 -5.955 2.444 -13.588 1.00 0.00 C ATOM 137 C GLY A 31 -6.896 1.789 -12.575 1.00 0.00 C ATOM 138 O GLY A 31 -7.618 0.851 -12.910 1.00 0.00 O ATOM 0 H GLY A 31 -4.405 2.728 -12.207 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.527 3.081 -14.263 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.481 1.676 -14.199 1.00 0.00 H new ATOM 142 N TRP A 32 -6.857 2.309 -11.356 1.00 0.00 N ATOM 143 CA TRP A 32 -7.698 1.787 -10.293 1.00 0.00 C ATOM 144 C TRP A 32 -8.122 0.368 -10.678 1.00 0.00 C ATOM 145 O TRP A 32 -7.392 -0.590 -10.429 1.00 0.00 O ATOM 146 CB TRP A 32 -8.886 2.714 -10.027 1.00 0.00 C ATOM 147 CG TRP A 32 -9.844 2.205 -8.949 1.00 0.00 C ATOM 148 CD1 TRP A 32 -10.841 1.320 -9.080 1.00 0.00 C ATOM 149 CD2 TRP A 32 -9.854 2.590 -7.557 1.00 0.00 C ATOM 150 NE1 TRP A 32 -11.490 1.106 -7.882 1.00 0.00 N ATOM 151 CE2 TRP A 32 -10.872 1.903 -6.926 1.00 0.00 C ATOM 152 CE3 TRP A 32 -9.031 3.487 -6.856 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -11.160 2.042 -5.564 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -9.332 3.616 -5.494 1.00 0.00 C ATOM 155 CH2 TRP A 32 -10.353 2.932 -4.844 1.00 0.00 C ATOM 0 H TRP A 32 -6.256 3.086 -11.082 1.00 0.00 H new ATOM 0 HA TRP A 32 -7.147 1.743 -9.353 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -8.510 3.693 -9.731 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -9.440 2.852 -10.955 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -11.104 0.834 -10.008 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -12.279 0.478 -7.726 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -8.229 4.034 -7.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -11.962 1.492 -5.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.729 4.294 -4.908 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -10.523 3.086 -3.789 1.00 0.00 H new ATOM 300 N PHE A 44 -11.447 2.114 2.842 1.00 0.00 N ATOM 301 CA PHE A 44 -10.005 1.983 2.966 1.00 0.00 C ATOM 302 C PHE A 44 -9.614 1.563 4.385 1.00 0.00 C ATOM 303 O PHE A 44 -9.792 2.325 5.333 1.00 0.00 O ATOM 304 CB PHE A 44 -9.403 3.357 2.670 1.00 0.00 C ATOM 305 CG PHE A 44 -9.693 4.409 3.743 1.00 0.00 C ATOM 306 CD1 PHE A 44 -10.889 5.056 3.754 1.00 0.00 C ATOM 307 CD2 PHE A 44 -8.756 4.694 4.686 1.00 0.00 C ATOM 308 CE1 PHE A 44 -11.159 6.032 4.749 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.026 5.670 5.682 1.00 0.00 C ATOM 310 CZ PHE A 44 -10.221 6.318 5.693 1.00 0.00 C ATOM 0 HA PHE A 44 -9.640 1.222 2.276 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.324 3.253 2.560 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.788 3.712 1.714 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.634 4.827 3.006 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -7.807 4.179 4.678 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -12.108 6.547 4.757 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.282 5.897 6.431 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.426 7.060 6.451 1.00 0.00 H new ATOM 319 N ILE A 45 -9.087 0.350 4.484 1.00 0.00 N ATOM 320 CA ILE A 45 -8.668 -0.180 5.771 1.00 0.00 C ATOM 321 C ILE A 45 -7.722 0.815 6.444 1.00 0.00 C ATOM 322 O ILE A 45 -8.021 1.333 7.519 1.00 0.00 O ATOM 323 CB ILE A 45 -8.073 -1.580 5.605 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.174 -2.625 5.416 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.149 -1.924 6.775 1.00 0.00 C ATOM 326 CD1 ILE A 45 -9.739 -3.075 6.765 1.00 0.00 C ATOM 0 H ILE A 45 -8.941 -0.280 3.695 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.526 -0.300 6.432 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.464 -1.588 4.701 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.974 -2.209 4.803 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.775 -3.486 4.879 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -6.739 -2.924 6.633 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.335 -1.201 6.820 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.714 -1.892 7.706 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -10.520 -3.818 6.603 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.942 -3.512 7.366 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -10.159 -2.216 7.289 1.00 0.00 H new ATOM 337 N MET A 46 -6.598 1.054 5.784 1.00 0.00 N ATOM 338 CA MET A 46 -5.605 1.978 6.306 1.00 0.00 C ATOM 339 C MET A 46 -4.933 2.757 5.173 1.00 0.00 C ATOM 340 O MET A 46 -4.681 2.208 4.102 1.00 0.00 O ATOM 341 CB MET A 46 -4.547 1.201 7.091 1.00 0.00 C ATOM 342 CG MET A 46 -3.963 0.066 6.247 1.00 0.00 C ATOM 343 SD MET A 46 -2.186 0.035 6.411 1.00 0.00 S ATOM 344 CE MET A 46 -1.760 1.469 5.438 1.00 0.00 C ATOM 0 H MET A 46 -6.353 0.624 4.892 1.00 0.00 H new ATOM 0 HA MET A 46 -6.106 2.689 6.963 1.00 0.00 H new ATOM 0 HB2 MET A 46 -3.749 1.876 7.401 1.00 0.00 H new ATOM 0 HB3 MET A 46 -4.990 0.793 8.000 1.00 0.00 H new ATOM 0 HG2 MET A 46 -4.383 -0.888 6.566 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.238 0.201 5.201 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.685 1.479 5.255 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.290 1.433 4.486 1.00 0.00 H new ATOM 0 HE3 MET A 46 -2.045 2.372 5.978 1.00 0.00 H new ATOM 352 N GLU A 47 -4.660 4.024 5.450 1.00 0.00 N ATOM 353 CA GLU A 47 -4.022 4.883 4.468 1.00 0.00 C ATOM 354 C GLU A 47 -2.688 5.406 5.007 1.00 0.00 C ATOM 355 O GLU A 47 -2.653 6.093 6.027 1.00 0.00 O ATOM 356 CB GLU A 47 -4.942 6.039 4.070 1.00 0.00 C ATOM 357 CG GLU A 47 -5.280 6.913 5.279 1.00 0.00 C ATOM 358 CD GLU A 47 -6.410 7.892 4.950 1.00 0.00 C ATOM 359 OE1 GLU A 47 -6.205 8.702 4.020 1.00 0.00 O ATOM 360 OE2 GLU A 47 -7.451 7.807 5.635 1.00 0.00 O ATOM 0 H GLU A 47 -4.869 4.476 6.340 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.825 4.294 3.573 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.460 6.645 3.303 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.860 5.644 3.634 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.574 6.282 6.118 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.394 7.466 5.591 1.00 0.00 H new ATOM 365 N GLY A 48 -1.624 5.060 4.298 1.00 0.00 N ATOM 366 CA GLY A 48 -0.291 5.485 4.692 1.00 0.00 C ATOM 367 C GLY A 48 0.656 5.506 3.491 1.00 0.00 C ATOM 368 O GLY A 48 0.336 4.964 2.434 1.00 0.00 O ATOM 0 H GLY A 48 -1.657 4.490 3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.339 6.478 5.139 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.099 4.811 5.455 1.00 0.00 H new ATOM 372 N THR A 49 1.802 6.139 3.693 1.00 0.00 N ATOM 373 CA THR A 49 2.797 6.238 2.639 1.00 0.00 C ATOM 374 C THR A 49 4.110 5.587 3.082 1.00 0.00 C ATOM 375 O THR A 49 4.720 6.016 4.060 1.00 0.00 O ATOM 376 CB THR A 49 2.948 7.715 2.267 1.00 0.00 C ATOM 377 OG1 THR A 49 4.342 7.872 2.024 1.00 0.00 O ATOM 378 CG2 THR A 49 2.669 8.647 3.449 1.00 0.00 C ATOM 0 H THR A 49 2.064 6.588 4.571 1.00 0.00 H new ATOM 0 HA THR A 49 2.484 5.694 1.748 1.00 0.00 H new ATOM 0 HB THR A 49 2.270 7.954 1.447 1.00 0.00 H new ATOM 0 HG1 THR A 49 4.528 8.801 1.775 1.00 0.00 H new ATOM 0 HG21 THR A 49 2.790 9.683 3.132 1.00 0.00 H new ATOM 0 HG22 THR A 49 1.649 8.492 3.802 1.00 0.00 H new ATOM 0 HG23 THR A 49 3.369 8.431 4.256 1.00 0.00 H new ATOM 386 N LEU A 50 4.504 4.562 2.341 1.00 0.00 N ATOM 387 CA LEU A 50 5.731 3.848 2.645 1.00 0.00 C ATOM 388 C LEU A 50 6.727 4.044 1.499 1.00 0.00 C ATOM 389 O LEU A 50 6.339 4.078 0.333 1.00 0.00 O ATOM 390 CB LEU A 50 5.435 2.380 2.956 1.00 0.00 C ATOM 391 CG LEU A 50 4.365 2.122 4.019 1.00 0.00 C ATOM 392 CD1 LEU A 50 3.037 2.775 3.628 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.210 0.626 4.291 1.00 0.00 C ATOM 0 H LEU A 50 3.995 4.209 1.531 1.00 0.00 H new ATOM 0 HA LEU A 50 6.194 4.253 3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.128 1.888 2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.361 1.904 3.278 1.00 0.00 H new ATOM 0 HG LEU A 50 4.690 2.585 4.951 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.293 2.577 4.400 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.177 3.851 3.526 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.694 2.362 2.679 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.443 0.472 5.050 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.918 0.117 3.372 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.158 0.220 4.645 1.00 0.00 H new ATOM 404 N THR A 51 7.993 4.168 1.874 1.00 0.00 N ATOM 405 CA THR A 51 9.047 4.360 0.892 1.00 0.00 C ATOM 406 C THR A 51 9.389 3.034 0.210 1.00 0.00 C ATOM 407 O THR A 51 9.762 2.067 0.875 1.00 0.00 O ATOM 408 CB THR A 51 10.240 5.004 1.601 1.00 0.00 C ATOM 409 OG1 THR A 51 10.183 6.372 1.204 1.00 0.00 O ATOM 410 CG2 THR A 51 11.582 4.514 1.051 1.00 0.00 C ATOM 0 H THR A 51 8.312 4.139 2.843 1.00 0.00 H new ATOM 0 HA THR A 51 8.726 5.027 0.092 1.00 0.00 H new ATOM 0 HB THR A 51 10.185 4.792 2.669 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.921 6.864 1.620 1.00 0.00 H new ATOM 0 HG21 THR A 51 12.395 5.002 1.588 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.657 3.434 1.182 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.651 4.756 -0.009 1.00 0.00 H new ATOM 418 N ARG A 52 9.251 3.029 -1.108 1.00 0.00 N ATOM 419 CA ARG A 52 9.541 1.837 -1.886 1.00 0.00 C ATOM 420 C ARG A 52 11.041 1.742 -2.173 1.00 0.00 C ATOM 421 O ARG A 52 11.540 2.375 -3.102 1.00 0.00 O ATOM 422 CB ARG A 52 8.775 1.846 -3.211 1.00 0.00 C ATOM 423 CG ARG A 52 9.315 0.776 -4.163 1.00 0.00 C ATOM 424 CD ARG A 52 9.981 1.413 -5.383 1.00 0.00 C ATOM 425 NE ARG A 52 10.078 0.427 -6.481 1.00 0.00 N ATOM 426 CZ ARG A 52 10.339 0.744 -7.757 1.00 0.00 C ATOM 427 NH1 ARG A 52 10.532 2.024 -8.102 1.00 0.00 N ATOM 428 NH2 ARG A 52 10.408 -0.218 -8.686 1.00 0.00 N ATOM 0 H ARG A 52 8.942 3.832 -1.656 1.00 0.00 H new ATOM 0 HA ARG A 52 9.224 0.973 -1.301 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.716 1.671 -3.024 1.00 0.00 H new ATOM 0 HB3 ARG A 52 8.858 2.828 -3.677 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.034 0.147 -3.638 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.501 0.127 -4.486 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.405 2.279 -5.711 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.975 1.773 -5.118 1.00 0.00 H new ATOM 0 HE ARG A 52 9.937 -0.557 -6.253 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.480 2.756 -7.394 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.731 2.266 -9.073 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.262 -1.193 -8.423 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.607 0.024 -9.657 1.00 0.00 H new ATOM 439 N VAL A 53 11.718 0.946 -1.357 1.00 0.00 N ATOM 440 CA VAL A 53 13.150 0.760 -1.512 1.00 0.00 C ATOM 441 C VAL A 53 13.416 -0.133 -2.726 1.00 0.00 C ATOM 442 O VAL A 53 12.487 -0.523 -3.430 1.00 0.00 O ATOM 443 CB VAL A 53 13.748 0.203 -0.218 1.00 0.00 C ATOM 444 CG1 VAL A 53 15.233 0.550 -0.107 1.00 0.00 C ATOM 445 CG2 VAL A 53 12.975 0.705 1.003 1.00 0.00 C ATOM 0 H VAL A 53 11.301 0.423 -0.587 1.00 0.00 H new ATOM 0 HA VAL A 53 13.641 1.715 -1.697 1.00 0.00 H new ATOM 0 HB VAL A 53 13.659 -0.883 -0.248 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.633 0.143 0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.771 0.122 -0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.355 1.633 -0.110 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.420 0.295 1.909 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.018 1.794 1.038 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.935 0.385 0.932 1.00 0.00 H new ATOM 455 N GLY A 54 14.691 -0.429 -2.934 1.00 0.00 N ATOM 456 CA GLY A 54 15.091 -1.268 -4.051 1.00 0.00 C ATOM 457 C GLY A 54 15.034 -0.491 -5.368 1.00 0.00 C ATOM 458 O GLY A 54 15.314 -1.044 -6.431 1.00 0.00 O ATOM 0 H GLY A 54 15.460 -0.103 -2.348 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.103 -1.640 -3.887 1.00 0.00 H new ATOM 0 HA3 GLY A 54 14.437 -2.138 -4.109 1.00 0.00 H new ATOM 462 N ALA A 55 14.670 0.777 -5.255 1.00 0.00 N ATOM 463 CA ALA A 55 14.573 1.636 -6.423 1.00 0.00 C ATOM 464 C ALA A 55 14.879 3.079 -6.018 1.00 0.00 C ATOM 465 O ALA A 55 15.587 3.791 -6.729 1.00 0.00 O ATOM 466 CB ALA A 55 13.186 1.488 -7.051 1.00 0.00 C ATOM 0 H ALA A 55 14.438 1.231 -4.372 1.00 0.00 H new ATOM 0 HA ALA A 55 15.305 1.344 -7.176 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.113 2.132 -7.927 1.00 0.00 H new ATOM 0 HB2 ALA A 55 13.030 0.451 -7.349 1.00 0.00 H new ATOM 0 HB3 ALA A 55 12.425 1.775 -6.325 1.00 0.00 H new ATOM 472 N LYS A 56 14.330 3.468 -4.877 1.00 0.00 N ATOM 473 CA LYS A 56 14.535 4.814 -4.368 1.00 0.00 C ATOM 474 C LYS A 56 13.355 5.696 -4.781 1.00 0.00 C ATOM 475 O LYS A 56 13.511 6.608 -5.592 1.00 0.00 O ATOM 476 CB LYS A 56 15.895 5.355 -4.817 1.00 0.00 C ATOM 477 CG LYS A 56 16.368 6.480 -3.894 1.00 0.00 C ATOM 478 CD LYS A 56 17.881 6.413 -3.679 1.00 0.00 C ATOM 479 CE LYS A 56 18.517 7.797 -3.818 1.00 0.00 C ATOM 480 NZ LYS A 56 19.654 7.751 -4.765 1.00 0.00 N ATOM 0 H LYS A 56 13.743 2.875 -4.290 1.00 0.00 H new ATOM 0 HA LYS A 56 14.564 4.809 -3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 56 16.629 4.549 -4.819 1.00 0.00 H new ATOM 0 HB3 LYS A 56 15.824 5.724 -5.840 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.101 7.445 -4.324 1.00 0.00 H new ATOM 0 HG3 LYS A 56 15.857 6.407 -2.934 1.00 0.00 H new ATOM 0 HD2 LYS A 56 18.094 6.009 -2.689 1.00 0.00 H new ATOM 0 HD3 LYS A 56 18.325 5.731 -4.404 1.00 0.00 H new ATOM 0 HE2 LYS A 56 17.773 8.512 -4.168 1.00 0.00 H new ATOM 0 HE3 LYS A 56 18.861 8.145 -2.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 20.075 8.698 -4.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 20.370 7.083 -4.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 19.316 7.439 -5.698 1.00 0.00 H new ATOM 490 N HIS A 57 12.201 5.394 -4.205 1.00 0.00 N ATOM 491 CA HIS A 57 10.995 6.147 -4.503 1.00 0.00 C ATOM 492 C HIS A 57 9.958 5.913 -3.403 1.00 0.00 C ATOM 493 O HIS A 57 10.116 5.015 -2.578 1.00 0.00 O ATOM 494 CB HIS A 57 10.470 5.803 -5.898 1.00 0.00 C ATOM 495 CG HIS A 57 11.415 6.165 -7.018 1.00 0.00 C ATOM 496 ND1 HIS A 57 11.843 7.461 -7.249 1.00 0.00 N ATOM 497 CD2 HIS A 57 12.012 5.387 -7.967 1.00 0.00 C ATOM 498 CE1 HIS A 57 12.658 7.452 -8.294 1.00 0.00 C ATOM 499 NE2 HIS A 57 12.761 6.167 -8.737 1.00 0.00 N ATOM 0 H HIS A 57 12.076 4.637 -3.533 1.00 0.00 H new ATOM 0 HA HIS A 57 11.222 7.213 -4.518 1.00 0.00 H new ATOM 0 HB2 HIS A 57 10.263 4.734 -5.943 1.00 0.00 H new ATOM 0 HB3 HIS A 57 9.523 6.318 -6.055 1.00 0.00 H new ATOM 0 HD2 HIS A 57 11.895 4.319 -8.073 1.00 0.00 H new ATOM 0 HE1 HIS A 57 13.154 8.312 -8.720 1.00 0.00 H new ATOM 0 HE2 HIS A 57 13.322 5.856 -9.530 1.00 0.00 H new ATOM 506 N GLU A 58 8.920 6.735 -3.428 1.00 0.00 N ATOM 507 CA GLU A 58 7.857 6.629 -2.444 1.00 0.00 C ATOM 508 C GLU A 58 6.561 6.164 -3.110 1.00 0.00 C ATOM 509 O GLU A 58 6.391 6.316 -4.319 1.00 0.00 O ATOM 510 CB GLU A 58 7.652 7.957 -1.712 1.00 0.00 C ATOM 511 CG GLU A 58 8.851 8.284 -0.820 1.00 0.00 C ATOM 512 CD GLU A 58 9.747 9.339 -1.470 1.00 0.00 C ATOM 513 OE1 GLU A 58 10.663 8.926 -2.214 1.00 0.00 O ATOM 514 OE2 GLU A 58 9.497 10.536 -1.209 1.00 0.00 O ATOM 0 H GLU A 58 8.792 7.478 -4.115 1.00 0.00 H new ATOM 0 HA GLU A 58 8.148 5.885 -1.703 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.506 8.757 -2.438 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.747 7.906 -1.106 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.501 8.645 0.147 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.427 7.378 -0.633 1.00 0.00 H new ATOM 519 N ARG A 59 5.679 5.606 -2.293 1.00 0.00 N ATOM 520 CA ARG A 59 4.404 5.118 -2.788 1.00 0.00 C ATOM 521 C ARG A 59 3.326 5.262 -1.712 1.00 0.00 C ATOM 522 O ARG A 59 3.420 4.649 -0.649 1.00 0.00 O ATOM 523 CB ARG A 59 4.502 3.650 -3.210 1.00 0.00 C ATOM 524 CG ARG A 59 5.762 3.402 -4.040 1.00 0.00 C ATOM 525 CD ARG A 59 5.604 2.157 -4.917 1.00 0.00 C ATOM 526 NE ARG A 59 5.854 0.939 -4.114 1.00 0.00 N ATOM 527 CZ ARG A 59 6.035 -0.281 -4.638 1.00 0.00 C ATOM 528 NH1 ARG A 59 5.995 -0.453 -5.966 1.00 0.00 N ATOM 529 NH2 ARG A 59 6.257 -1.330 -3.834 1.00 0.00 N ATOM 0 H ARG A 59 5.823 5.481 -1.291 1.00 0.00 H new ATOM 0 HA ARG A 59 4.135 5.717 -3.658 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.514 3.013 -2.325 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.621 3.375 -3.789 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.965 4.270 -4.667 1.00 0.00 H new ATOM 0 HG3 ARG A 59 6.619 3.279 -3.378 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.600 2.124 -5.340 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.301 2.200 -5.754 1.00 0.00 H new ATOM 0 HE ARG A 59 5.891 1.034 -3.099 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.827 0.345 -6.579 1.00 0.00 H new ATOM 0 HH12 ARG A 59 6.133 -1.382 -6.364 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.288 -1.200 -2.823 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.395 -2.258 -4.233 1.00 0.00 H new ATOM 540 N HIS A 60 2.327 6.076 -2.024 1.00 0.00 N ATOM 541 CA HIS A 60 1.234 6.308 -1.096 1.00 0.00 C ATOM 542 C HIS A 60 0.424 5.020 -0.926 1.00 0.00 C ATOM 543 O HIS A 60 -0.507 4.763 -1.687 1.00 0.00 O ATOM 544 CB HIS A 60 0.377 7.491 -1.552 1.00 0.00 C ATOM 545 CG HIS A 60 -0.035 8.417 -0.432 1.00 0.00 C ATOM 546 ND1 HIS A 60 0.679 9.555 -0.100 1.00 0.00 N ATOM 547 CD2 HIS A 60 -1.094 8.363 0.426 1.00 0.00 C ATOM 548 CE1 HIS A 60 0.068 10.150 0.915 1.00 0.00 C ATOM 549 NE2 HIS A 60 -1.029 9.409 1.239 1.00 0.00 N ATOM 0 H HIS A 60 2.252 6.582 -2.906 1.00 0.00 H new ATOM 0 HA HIS A 60 1.633 6.578 -0.118 1.00 0.00 H new ATOM 0 HB2 HIS A 60 0.931 8.062 -2.297 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -0.518 7.110 -2.043 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -1.856 7.598 0.441 1.00 0.00 H new ATOM 0 HE1 HIS A 60 0.384 11.062 1.400 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -1.691 9.624 1.984 1.00 0.00 H new ATOM 556 N ILE A 61 0.809 4.245 0.078 1.00 0.00 N ATOM 557 CA ILE A 61 0.130 2.992 0.359 1.00 0.00 C ATOM 558 C ILE A 61 -1.343 3.271 0.658 1.00 0.00 C ATOM 559 O ILE A 61 -1.694 4.358 1.114 1.00 0.00 O ATOM 560 CB ILE A 61 0.852 2.230 1.472 1.00 0.00 C ATOM 561 CG1 ILE A 61 2.155 1.613 0.960 1.00 0.00 C ATOM 562 CG2 ILE A 61 -0.068 1.183 2.105 1.00 0.00 C ATOM 563 CD1 ILE A 61 1.876 0.538 -0.092 1.00 0.00 C ATOM 0 H ILE A 61 1.583 4.461 0.707 1.00 0.00 H new ATOM 0 HA ILE A 61 0.159 2.338 -0.513 1.00 0.00 H new ATOM 0 HB ILE A 61 1.119 2.941 2.254 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.786 2.391 0.531 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.707 1.177 1.793 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.469 0.655 2.893 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.943 1.676 2.529 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.387 0.471 1.344 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.819 0.116 -0.439 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.265 -0.251 0.347 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.345 0.982 -0.934 1.00 0.00 H new ATOM 574 N PHE A 62 -2.169 2.269 0.391 1.00 0.00 N ATOM 575 CA PHE A 62 -3.597 2.393 0.627 1.00 0.00 C ATOM 576 C PHE A 62 -4.299 1.044 0.461 1.00 0.00 C ATOM 577 O PHE A 62 -4.729 0.694 -0.637 1.00 0.00 O ATOM 578 CB PHE A 62 -4.140 3.369 -0.419 1.00 0.00 C ATOM 579 CG PHE A 62 -4.934 4.535 0.171 1.00 0.00 C ATOM 580 CD1 PHE A 62 -6.055 4.294 0.904 1.00 0.00 C ATOM 581 CD2 PHE A 62 -4.519 5.814 -0.035 1.00 0.00 C ATOM 582 CE1 PHE A 62 -6.791 5.377 1.452 1.00 0.00 C ATOM 583 CE2 PHE A 62 -5.256 6.897 0.513 1.00 0.00 C ATOM 584 CZ PHE A 62 -6.377 6.655 1.245 1.00 0.00 C ATOM 0 H PHE A 62 -1.876 1.368 0.013 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.777 2.744 1.643 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.306 3.767 -0.997 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.778 2.823 -1.114 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -6.385 3.279 1.069 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.629 6.006 -0.616 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -7.681 5.185 2.034 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -4.927 7.912 0.349 1.00 0.00 H new ATOM 0 HZ PHE A 62 -6.938 7.478 1.662 1.00 0.00 H new ATOM 593 N LEU A 63 -4.393 0.321 1.568 1.00 0.00 N ATOM 594 CA LEU A 63 -5.036 -0.982 1.559 1.00 0.00 C ATOM 595 C LEU A 63 -6.532 -0.809 1.826 1.00 0.00 C ATOM 596 O LEU A 63 -6.924 -0.150 2.788 1.00 0.00 O ATOM 597 CB LEU A 63 -4.342 -1.928 2.540 1.00 0.00 C ATOM 598 CG LEU A 63 -5.128 -2.278 3.805 1.00 0.00 C ATOM 599 CD1 LEU A 63 -6.265 -3.254 3.491 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.200 -2.812 4.898 1.00 0.00 C ATOM 0 H LEU A 63 -4.034 0.613 2.477 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.938 -1.449 0.579 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.106 -2.854 2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.394 -1.479 2.838 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.583 -1.365 4.188 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.808 -3.487 4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.946 -2.800 2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.852 -4.171 3.071 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.785 -3.053 5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.696 -3.710 4.541 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.457 -2.054 5.147 1.00 0.00 H new ATOM 611 N PHE A 64 -7.330 -1.413 0.956 1.00 0.00 N ATOM 612 CA PHE A 64 -8.775 -1.335 1.086 1.00 0.00 C ATOM 613 C PHE A 64 -9.336 -2.602 1.734 1.00 0.00 C ATOM 614 O PHE A 64 -8.755 -3.678 1.609 1.00 0.00 O ATOM 615 CB PHE A 64 -9.344 -1.206 -0.329 1.00 0.00 C ATOM 616 CG PHE A 64 -8.754 -0.046 -1.133 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.486 1.139 -0.521 1.00 0.00 C ATOM 618 CD2 PHE A 64 -8.497 -0.200 -2.460 1.00 0.00 C ATOM 619 CE1 PHE A 64 -7.938 2.215 -1.269 1.00 0.00 C ATOM 620 CE2 PHE A 64 -7.949 0.876 -3.206 1.00 0.00 C ATOM 621 CZ PHE A 64 -7.681 2.062 -2.595 1.00 0.00 C ATOM 0 H PHE A 64 -7.002 -1.958 0.159 1.00 0.00 H new ATOM 0 HA PHE A 64 -9.047 -0.487 1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -9.165 -2.136 -0.868 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.425 -1.078 -0.265 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -8.690 1.262 0.533 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -8.710 -1.141 -2.946 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.725 3.156 -0.784 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.745 0.753 -4.259 1.00 0.00 H new ATOM 0 HZ PHE A 64 -7.265 2.881 -3.163 1.00 0.00 H new ATOM 630 N ASP A 65 -10.461 -2.431 2.415 1.00 0.00 N ATOM 631 CA ASP A 65 -11.107 -3.547 3.083 1.00 0.00 C ATOM 632 C ASP A 65 -11.463 -4.618 2.051 1.00 0.00 C ATOM 633 O ASP A 65 -11.728 -5.766 2.407 1.00 0.00 O ATOM 634 CB ASP A 65 -12.401 -3.103 3.768 1.00 0.00 C ATOM 635 CG ASP A 65 -12.856 -3.992 4.929 1.00 0.00 C ATOM 636 OD1 ASP A 65 -12.816 -5.227 4.747 1.00 0.00 O ATOM 637 OD2 ASP A 65 -13.233 -3.414 5.971 1.00 0.00 O ATOM 0 H ASP A 65 -10.940 -1.537 2.518 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.417 -3.937 3.831 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -12.268 -2.087 4.139 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.196 -3.069 3.023 1.00 0.00 H new ATOM 641 N GLY A 66 -11.456 -4.207 0.791 1.00 0.00 N ATOM 642 CA GLY A 66 -11.774 -5.117 -0.295 1.00 0.00 C ATOM 643 C GLY A 66 -10.509 -5.786 -0.840 1.00 0.00 C ATOM 644 O GLY A 66 -10.533 -6.958 -1.211 1.00 0.00 O ATOM 0 H GLY A 66 -11.235 -3.255 0.499 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.470 -5.879 0.056 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.275 -4.572 -1.095 1.00 0.00 H new ATOM 648 N LEU A 67 -9.435 -5.010 -0.869 1.00 0.00 N ATOM 649 CA LEU A 67 -8.164 -5.512 -1.361 1.00 0.00 C ATOM 650 C LEU A 67 -7.083 -4.450 -1.145 1.00 0.00 C ATOM 651 O LEU A 67 -7.362 -3.254 -1.206 1.00 0.00 O ATOM 652 CB LEU A 67 -8.295 -5.969 -2.815 1.00 0.00 C ATOM 653 CG LEU A 67 -9.491 -5.411 -3.588 1.00 0.00 C ATOM 654 CD1 LEU A 67 -9.037 -4.703 -4.866 1.00 0.00 C ATOM 655 CD2 LEU A 67 -10.518 -6.509 -3.876 1.00 0.00 C ATOM 0 H LEU A 67 -9.419 -4.038 -0.560 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.860 -6.396 -0.800 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -7.384 -5.693 -3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -8.354 -7.057 -2.829 1.00 0.00 H new ATOM 0 HG LEU A 67 -9.982 -4.665 -2.964 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -9.907 -4.316 -5.396 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -8.372 -3.878 -4.609 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.508 -5.410 -5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -11.358 -6.086 -4.426 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -10.053 -7.295 -4.471 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -10.875 -6.929 -2.936 1.00 0.00 H new ATOM 666 N MET A 68 -5.872 -4.927 -0.897 1.00 0.00 N ATOM 667 CA MET A 68 -4.749 -4.033 -0.670 1.00 0.00 C ATOM 668 C MET A 68 -4.211 -3.483 -1.994 1.00 0.00 C ATOM 669 O MET A 68 -4.093 -4.217 -2.974 1.00 0.00 O ATOM 670 CB MET A 68 -3.634 -4.787 0.058 1.00 0.00 C ATOM 671 CG MET A 68 -2.459 -3.860 0.372 1.00 0.00 C ATOM 672 SD MET A 68 -0.946 -4.553 -0.271 1.00 0.00 S ATOM 673 CE MET A 68 0.094 -3.102 -0.249 1.00 0.00 C ATOM 0 H MET A 68 -5.644 -5.920 -0.848 1.00 0.00 H new ATOM 0 HA MET A 68 -5.092 -3.197 -0.061 1.00 0.00 H new ATOM 0 HB2 MET A 68 -4.022 -5.213 0.983 1.00 0.00 H new ATOM 0 HB3 MET A 68 -3.291 -5.619 -0.557 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.633 -2.877 -0.066 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.375 -3.718 1.449 1.00 0.00 H new ATOM 0 HE1 MET A 68 1.085 -3.359 -0.623 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.344 -2.331 -0.883 1.00 0.00 H new ATOM 0 HE3 MET A 68 0.177 -2.729 0.772 1.00 0.00 H new ATOM 681 N ILE A 69 -3.900 -2.194 -1.979 1.00 0.00 N ATOM 682 CA ILE A 69 -3.378 -1.537 -3.165 1.00 0.00 C ATOM 683 C ILE A 69 -2.411 -0.429 -2.745 1.00 0.00 C ATOM 684 O ILE A 69 -2.689 0.321 -1.810 1.00 0.00 O ATOM 685 CB ILE A 69 -4.523 -1.049 -4.055 1.00 0.00 C ATOM 686 CG1 ILE A 69 -4.803 0.437 -3.824 1.00 0.00 C ATOM 687 CG2 ILE A 69 -5.775 -1.907 -3.856 1.00 0.00 C ATOM 688 CD1 ILE A 69 -3.706 1.304 -4.443 1.00 0.00 C ATOM 0 H ILE A 69 -4.000 -1.588 -1.165 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.811 -2.242 -3.773 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.218 -1.160 -5.096 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.768 0.701 -4.257 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.869 0.636 -2.754 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.574 -1.539 -4.500 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.551 -2.943 -4.111 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -6.093 -1.851 -2.815 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -3.929 2.356 -4.264 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -2.746 1.055 -3.990 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.659 1.120 -5.516 1.00 0.00 H new ATOM 699 N CYS A 70 -1.295 -0.360 -3.455 1.00 0.00 N ATOM 700 CA CYS A 70 -0.285 0.644 -3.168 1.00 0.00 C ATOM 701 C CYS A 70 -0.288 1.667 -4.305 1.00 0.00 C ATOM 702 O CYS A 70 -0.683 1.352 -5.427 1.00 0.00 O ATOM 703 CB CYS A 70 1.095 0.016 -2.968 1.00 0.00 C ATOM 704 SG CYS A 70 1.511 -1.051 -4.394 1.00 0.00 S ATOM 0 H CYS A 70 -1.068 -0.984 -4.229 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.523 1.145 -2.230 1.00 0.00 H new ATOM 0 HB2 CYS A 70 1.846 0.798 -2.857 1.00 0.00 H new ATOM 0 HB3 CYS A 70 1.107 -0.570 -2.049 1.00 0.00 H new ATOM 0 HG CYS A 70 2.686 -1.577 -4.214 1.00 0.00 H new ATOM 709 N CYS A 71 0.159 2.870 -3.977 1.00 0.00 N ATOM 710 CA CYS A 71 0.213 3.941 -4.957 1.00 0.00 C ATOM 711 C CYS A 71 1.673 4.369 -5.121 1.00 0.00 C ATOM 712 O CYS A 71 2.241 5.007 -4.236 1.00 0.00 O ATOM 713 CB CYS A 71 -0.684 5.116 -4.562 1.00 0.00 C ATOM 714 SG CYS A 71 -2.250 4.495 -3.848 1.00 0.00 S ATOM 0 H CYS A 71 0.487 3.127 -3.046 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.170 3.582 -5.912 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -0.171 5.749 -3.838 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -0.893 5.734 -5.435 1.00 0.00 H new ATOM 0 HG CYS A 71 -2.090 4.273 -2.577 1.00 0.00 H new ATOM 719 N LYS A 72 2.240 4.000 -6.261 1.00 0.00 N ATOM 720 CA LYS A 72 3.623 4.337 -6.552 1.00 0.00 C ATOM 721 C LYS A 72 3.722 5.827 -6.881 1.00 0.00 C ATOM 722 O LYS A 72 3.079 6.305 -7.815 1.00 0.00 O ATOM 723 CB LYS A 72 4.176 3.426 -7.651 1.00 0.00 C ATOM 724 CG LYS A 72 5.555 3.901 -8.113 1.00 0.00 C ATOM 725 CD LYS A 72 5.533 4.295 -9.591 1.00 0.00 C ATOM 726 CE LYS A 72 6.403 3.351 -10.423 1.00 0.00 C ATOM 727 NZ LYS A 72 7.622 4.047 -10.893 1.00 0.00 N ATOM 0 H LYS A 72 1.767 3.471 -6.994 1.00 0.00 H new ATOM 0 HA LYS A 72 4.250 4.161 -5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.245 2.403 -7.280 1.00 0.00 H new ATOM 0 HB3 LYS A 72 3.489 3.413 -8.497 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.871 4.753 -7.511 1.00 0.00 H new ATOM 0 HG3 LYS A 72 6.288 3.110 -7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 72 4.508 4.272 -9.962 1.00 0.00 H new ATOM 0 HD3 LYS A 72 5.890 5.319 -9.704 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.681 2.482 -9.826 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.835 2.982 -11.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.201 3.391 -11.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 7.352 4.862 -11.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.171 4.377 -10.074 1.00 0.00 H new ATOM 737 N SER A 73 4.531 6.522 -6.096 1.00 0.00 N ATOM 738 CA SER A 73 4.722 7.948 -6.292 1.00 0.00 C ATOM 739 C SER A 73 6.208 8.255 -6.494 1.00 0.00 C ATOM 740 O SER A 73 6.986 8.224 -5.542 1.00 0.00 O ATOM 741 CB SER A 73 4.172 8.746 -5.107 1.00 0.00 C ATOM 742 OG SER A 73 4.593 8.205 -3.858 1.00 0.00 O ATOM 0 H SER A 73 5.062 6.123 -5.322 1.00 0.00 H new ATOM 0 HA SER A 73 4.171 8.247 -7.184 1.00 0.00 H new ATOM 0 HB2 SER A 73 4.502 9.782 -5.183 1.00 0.00 H new ATOM 0 HB3 SER A 73 3.083 8.754 -5.150 1.00 0.00 H new ATOM 0 HG SER A 73 4.223 8.743 -3.127 1.00 0.00 H new ATOM 747 N ASN A 74 6.555 8.545 -7.739 1.00 0.00 N ATOM 748 CA ASN A 74 7.934 8.857 -8.077 1.00 0.00 C ATOM 749 C ASN A 74 7.961 10.042 -9.046 1.00 0.00 C ATOM 750 O ASN A 74 8.018 9.853 -10.260 1.00 0.00 O ATOM 751 CB ASN A 74 8.615 7.671 -8.762 1.00 0.00 C ATOM 752 CG ASN A 74 9.903 8.107 -9.462 1.00 0.00 C ATOM 753 OD1 ASN A 74 10.557 9.079 -8.833 1.00 0.00 O flip ATOM 754 ND2 ASN A 74 10.279 7.594 -10.503 1.00 0.00 N flip ATOM 0 H ASN A 74 5.906 8.571 -8.526 1.00 0.00 H new ATOM 0 HA ASN A 74 8.463 9.092 -7.153 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.841 6.901 -8.024 1.00 0.00 H new ATOM 0 HB3 ASN A 74 7.935 7.227 -9.489 1.00 0.00 H new ATOM 0 HD21 ASN A 74 9.728 6.851 -10.934 1.00 0.00 H new ATOM 0 HD22 ASN A 74 11.144 7.908 -10.943 1.00 0.00 H new ATOM 899 N ALA A 86 -4.123 11.752 -11.168 1.00 0.00 N ATOM 900 CA ALA A 86 -3.488 10.519 -10.735 1.00 0.00 C ATOM 901 C ALA A 86 -1.979 10.620 -10.963 1.00 0.00 C ATOM 902 O ALA A 86 -1.365 9.696 -11.495 1.00 0.00 O ATOM 903 CB ALA A 86 -4.112 9.336 -11.478 1.00 0.00 C ATOM 0 HA ALA A 86 -3.650 10.357 -9.669 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.636 8.411 -11.154 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.179 9.291 -11.260 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.966 9.462 -12.551 1.00 0.00 H new ATOM 909 N GLU A 87 -1.424 11.750 -10.549 1.00 0.00 N ATOM 910 CA GLU A 87 0.001 11.983 -10.702 1.00 0.00 C ATOM 911 C GLU A 87 0.777 10.679 -10.502 1.00 0.00 C ATOM 912 O GLU A 87 1.629 10.329 -11.318 1.00 0.00 O ATOM 913 CB GLU A 87 0.487 13.063 -9.732 1.00 0.00 C ATOM 914 CG GLU A 87 -0.326 14.349 -9.893 1.00 0.00 C ATOM 915 CD GLU A 87 0.471 15.565 -9.414 1.00 0.00 C ATOM 916 OE1 GLU A 87 1.705 15.551 -9.618 1.00 0.00 O ATOM 917 OE2 GLU A 87 -0.171 16.480 -8.856 1.00 0.00 O ATOM 0 H GLU A 87 -1.936 12.514 -10.108 1.00 0.00 H new ATOM 0 HA GLU A 87 0.184 12.341 -11.715 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.403 12.701 -8.707 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.542 13.270 -9.911 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.603 14.480 -10.939 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.253 14.271 -9.325 1.00 0.00 H new ATOM 922 N TYR A 88 0.455 9.996 -9.414 1.00 0.00 N ATOM 923 CA TYR A 88 1.110 8.738 -9.097 1.00 0.00 C ATOM 924 C TYR A 88 0.453 7.575 -9.843 1.00 0.00 C ATOM 925 O TYR A 88 -0.244 7.783 -10.835 1.00 0.00 O ATOM 926 CB TYR A 88 0.925 8.534 -7.592 1.00 0.00 C ATOM 927 CG TYR A 88 1.282 9.760 -6.750 1.00 0.00 C ATOM 928 CD1 TYR A 88 2.360 10.547 -7.097 1.00 0.00 C ATOM 929 CD2 TYR A 88 0.523 10.079 -5.641 1.00 0.00 C ATOM 930 CE1 TYR A 88 2.696 11.701 -6.304 1.00 0.00 C ATOM 931 CE2 TYR A 88 0.859 11.233 -4.848 1.00 0.00 C ATOM 932 CZ TYR A 88 1.927 11.987 -5.218 1.00 0.00 C ATOM 933 OH TYR A 88 2.244 13.076 -4.469 1.00 0.00 O ATOM 0 H TYR A 88 -0.252 10.290 -8.740 1.00 0.00 H new ATOM 0 HA TYR A 88 2.160 8.767 -9.389 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.112 8.262 -7.397 1.00 0.00 H new ATOM 0 HB3 TYR A 88 1.541 7.694 -7.271 1.00 0.00 H new ATOM 0 HD1 TYR A 88 2.953 10.298 -7.965 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -0.322 9.463 -5.369 1.00 0.00 H new ATOM 0 HE1 TYR A 88 3.538 12.325 -6.565 1.00 0.00 H new ATOM 0 HE2 TYR A 88 0.275 11.494 -3.978 1.00 0.00 H new ATOM 0 HH TYR A 88 1.609 13.159 -3.727 1.00 0.00 H new ATOM 942 N ARG A 89 0.699 6.376 -9.337 1.00 0.00 N ATOM 943 CA ARG A 89 0.140 5.179 -9.942 1.00 0.00 C ATOM 944 C ARG A 89 -0.285 4.185 -8.859 1.00 0.00 C ATOM 945 O ARG A 89 0.445 3.963 -7.894 1.00 0.00 O ATOM 946 CB ARG A 89 1.152 4.507 -10.872 1.00 0.00 C ATOM 947 CG ARG A 89 0.495 3.389 -11.683 1.00 0.00 C ATOM 948 CD ARG A 89 1.404 2.161 -11.761 1.00 0.00 C ATOM 949 NE ARG A 89 1.987 2.047 -13.117 1.00 0.00 N ATOM 950 CZ ARG A 89 1.277 1.768 -14.218 1.00 0.00 C ATOM 951 NH1 ARG A 89 -0.046 1.572 -14.131 1.00 0.00 N ATOM 952 NH2 ARG A 89 1.891 1.684 -15.407 1.00 0.00 N ATOM 0 H ARG A 89 1.278 6.207 -8.514 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.730 5.479 -10.526 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.578 5.249 -11.548 1.00 0.00 H new ATOM 0 HB3 ARG A 89 1.975 4.100 -10.285 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.456 3.114 -11.226 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.274 3.746 -12.689 1.00 0.00 H new ATOM 0 HD2 ARG A 89 2.199 2.240 -11.020 1.00 0.00 H new ATOM 0 HD3 ARG A 89 0.835 1.262 -11.524 1.00 0.00 H new ATOM 0 HE ARG A 89 2.992 2.190 -13.219 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -0.513 1.635 -13.226 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -0.586 1.360 -14.970 1.00 0.00 H new ATOM 0 HH21 ARG A 89 2.898 1.832 -15.473 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.351 1.472 -16.246 1.00 0.00 H new ATOM 963 N LEU A 90 -1.464 3.613 -9.055 1.00 0.00 N ATOM 964 CA LEU A 90 -1.994 2.648 -8.107 1.00 0.00 C ATOM 965 C LEU A 90 -1.617 1.235 -8.560 1.00 0.00 C ATOM 966 O LEU A 90 -1.372 1.004 -9.743 1.00 0.00 O ATOM 967 CB LEU A 90 -3.499 2.853 -7.919 1.00 0.00 C ATOM 968 CG LEU A 90 -4.406 1.837 -8.615 1.00 0.00 C ATOM 969 CD1 LEU A 90 -3.895 1.518 -10.022 1.00 0.00 C ATOM 970 CD2 LEU A 90 -4.570 0.575 -7.765 1.00 0.00 C ATOM 0 H LEU A 90 -2.067 3.799 -9.856 1.00 0.00 H new ATOM 0 HA LEU A 90 -1.550 2.797 -7.123 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.718 2.834 -6.851 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.758 3.848 -8.280 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.395 2.282 -8.725 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.558 0.793 -10.494 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.873 2.431 -10.617 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.889 1.102 -9.958 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.219 -0.131 -8.283 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.594 0.117 -7.601 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.013 0.838 -6.805 1.00 0.00 H new ATOM 981 N LYS A 91 -1.585 0.329 -7.595 1.00 0.00 N ATOM 982 CA LYS A 91 -1.243 -1.055 -7.879 1.00 0.00 C ATOM 983 C LYS A 91 -2.147 -1.978 -7.059 1.00 0.00 C ATOM 984 O LYS A 91 -1.910 -2.190 -5.871 1.00 0.00 O ATOM 985 CB LYS A 91 0.250 -1.295 -7.650 1.00 0.00 C ATOM 986 CG LYS A 91 0.892 -1.963 -8.867 1.00 0.00 C ATOM 987 CD LYS A 91 2.368 -1.584 -8.988 1.00 0.00 C ATOM 988 CE LYS A 91 2.938 -2.016 -10.340 1.00 0.00 C ATOM 989 NZ LYS A 91 4.417 -2.069 -10.287 1.00 0.00 N ATOM 0 H LYS A 91 -1.790 0.525 -6.615 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.422 -1.284 -8.930 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.747 -0.347 -7.447 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.390 -1.923 -6.770 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.797 -3.046 -8.784 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.361 -1.665 -9.771 1.00 0.00 H new ATOM 0 HD2 LYS A 91 2.481 -0.506 -8.870 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.934 -2.054 -8.184 1.00 0.00 H new ATOM 0 HE2 LYS A 91 2.543 -2.995 -10.612 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.621 -1.318 -11.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 4.787 -2.364 -11.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 4.790 -1.128 -10.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.714 -2.753 -9.562 1.00 0.00 H new ATOM 999 N GLU A 92 -3.164 -2.502 -7.727 1.00 0.00 N ATOM 1000 CA GLU A 92 -4.105 -3.397 -7.076 1.00 0.00 C ATOM 1001 C GLU A 92 -3.373 -4.614 -6.505 1.00 0.00 C ATOM 1002 O GLU A 92 -2.560 -5.232 -7.192 1.00 0.00 O ATOM 1003 CB GLU A 92 -5.212 -3.827 -8.042 1.00 0.00 C ATOM 1004 CG GLU A 92 -6.588 -3.718 -7.382 1.00 0.00 C ATOM 1005 CD GLU A 92 -7.536 -2.867 -8.230 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -7.287 -2.788 -9.453 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -8.487 -2.316 -7.637 1.00 0.00 O ATOM 0 H GLU A 92 -3.357 -2.324 -8.713 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.575 -2.860 -6.252 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.183 -3.203 -8.935 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.040 -4.854 -8.365 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -7.010 -4.714 -7.246 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.486 -3.277 -6.390 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.686 -4.920 -5.254 1.00 0.00 N ATOM 1013 CA LYS A 93 -3.067 -6.050 -4.584 1.00 0.00 C ATOM 1014 C LYS A 93 -4.136 -6.828 -3.814 1.00 0.00 C ATOM 1015 O LYS A 93 -4.216 -6.735 -2.590 1.00 0.00 O ATOM 1016 CB LYS A 93 -1.899 -5.584 -3.713 1.00 0.00 C ATOM 1017 CG LYS A 93 -0.573 -5.698 -4.467 1.00 0.00 C ATOM 1018 CD LYS A 93 -0.176 -4.357 -5.087 1.00 0.00 C ATOM 1019 CE LYS A 93 1.259 -4.400 -5.616 1.00 0.00 C ATOM 1020 NZ LYS A 93 1.388 -5.421 -6.680 1.00 0.00 N ATOM 0 H LYS A 93 -4.360 -4.405 -4.688 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.636 -6.735 -5.314 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.059 -4.550 -3.406 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.857 -6.184 -2.804 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.209 -6.033 -3.786 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.659 -6.453 -5.249 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -0.860 -4.112 -5.900 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -0.269 -3.566 -4.342 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.538 -3.422 -6.007 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.947 -4.626 -4.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.314 -5.324 -7.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.308 -6.370 -6.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.633 -5.287 -7.383 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.931 -7.578 -4.562 1.00 0.00 N ATOM 1031 CA PHE A 94 -5.993 -8.371 -3.965 1.00 0.00 C ATOM 1032 C PHE A 94 -5.423 -9.399 -2.985 1.00 0.00 C ATOM 1033 O PHE A 94 -5.295 -10.576 -3.318 1.00 0.00 O ATOM 1034 CB PHE A 94 -6.697 -9.107 -5.106 1.00 0.00 C ATOM 1035 CG PHE A 94 -7.004 -8.227 -6.319 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -8.138 -7.475 -6.345 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -6.143 -8.195 -7.371 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -8.422 -6.658 -7.470 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -6.429 -7.379 -8.498 1.00 0.00 C ATOM 1040 CZ PHE A 94 -7.562 -6.627 -8.523 1.00 0.00 C ATOM 0 H PHE A 94 -4.861 -7.654 -5.577 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.677 -7.724 -3.415 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -6.074 -9.943 -5.425 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -7.629 -9.530 -4.731 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -8.822 -7.500 -5.509 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.242 -8.790 -7.350 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -9.321 -6.061 -7.490 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -5.747 -7.356 -9.335 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.779 -6.005 -9.379 1.00 0.00 H new ATOM 1049 N PHE A 95 -5.097 -8.917 -1.795 1.00 0.00 N ATOM 1050 CA PHE A 95 -4.544 -9.779 -0.764 1.00 0.00 C ATOM 1051 C PHE A 95 -5.120 -9.430 0.610 1.00 0.00 C ATOM 1052 O PHE A 95 -4.686 -9.972 1.625 1.00 0.00 O ATOM 1053 CB PHE A 95 -3.033 -9.542 -0.745 1.00 0.00 C ATOM 1054 CG PHE A 95 -2.373 -9.622 -2.122 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -2.683 -10.642 -2.967 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.476 -8.673 -2.504 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -2.071 -10.718 -4.245 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.863 -8.748 -3.783 1.00 0.00 C ATOM 1059 CZ PHE A 95 -1.173 -9.769 -4.626 1.00 0.00 C ATOM 0 H PHE A 95 -5.205 -7.940 -1.521 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.790 -10.819 -0.978 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.835 -8.560 -0.315 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -2.569 -10.277 -0.088 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -3.396 -11.395 -2.665 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.230 -7.862 -1.834 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -2.318 -11.528 -4.915 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.151 -7.995 -4.086 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.706 -9.827 -5.598 1.00 0.00 H new ATOM 1068 N MET A 96 -6.090 -8.528 0.597 1.00 0.00 N ATOM 1069 CA MET A 96 -6.731 -8.100 1.829 1.00 0.00 C ATOM 1070 C MET A 96 -7.326 -9.293 2.580 1.00 0.00 C ATOM 1071 O MET A 96 -7.678 -9.180 3.754 1.00 0.00 O ATOM 1072 CB MET A 96 -7.839 -7.096 1.507 1.00 0.00 C ATOM 1073 CG MET A 96 -8.702 -6.818 2.739 1.00 0.00 C ATOM 1074 SD MET A 96 -10.081 -7.950 2.787 1.00 0.00 S ATOM 1075 CE MET A 96 -10.514 -7.837 4.516 1.00 0.00 C ATOM 0 H MET A 96 -6.448 -8.081 -0.247 1.00 0.00 H new ATOM 0 HA MET A 96 -5.979 -7.632 2.464 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.399 -6.165 1.150 1.00 0.00 H new ATOM 0 HB3 MET A 96 -8.463 -7.483 0.701 1.00 0.00 H new ATOM 0 HG2 MET A 96 -8.103 -6.923 3.644 1.00 0.00 H new ATOM 0 HG3 MET A 96 -9.065 -5.791 2.714 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.532 -8.199 4.661 1.00 0.00 H new ATOM 0 HE2 MET A 96 -9.826 -8.445 5.104 1.00 0.00 H new ATOM 0 HE3 MET A 96 -10.448 -6.798 4.840 1.00 0.00 H new ATOM 1083 N ARG A 97 -7.420 -10.410 1.874 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.966 -11.623 2.459 1.00 0.00 C ATOM 1085 C ARG A 97 -6.835 -12.531 2.947 1.00 0.00 C ATOM 1086 O ARG A 97 -7.087 -13.549 3.591 1.00 0.00 O ATOM 1087 CB ARG A 97 -8.822 -12.385 1.447 1.00 0.00 C ATOM 1088 CG ARG A 97 -9.740 -13.388 2.150 1.00 0.00 C ATOM 1089 CD ARG A 97 -10.825 -13.898 1.200 1.00 0.00 C ATOM 1090 NE ARG A 97 -12.105 -14.050 1.929 1.00 0.00 N ATOM 1091 CZ ARG A 97 -13.117 -14.823 1.515 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -13.006 -15.520 0.376 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -14.241 -14.900 2.241 1.00 0.00 N ATOM 0 H ARG A 97 -7.127 -10.501 0.901 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.593 -11.332 3.302 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.421 -11.681 0.869 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.177 -12.909 0.742 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.152 -14.228 2.520 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.203 -12.917 3.017 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.950 -13.202 0.370 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.525 -14.854 0.772 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.223 -13.534 2.801 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.150 -15.462 -0.176 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.777 -16.109 0.061 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.325 -14.370 3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -15.012 -15.489 1.926 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.615 -12.131 2.622 1.00 0.00 N ATOM 1105 CA LYS A 98 -4.446 -12.898 3.019 1.00 0.00 C ATOM 1106 C LYS A 98 -3.182 -12.137 2.615 1.00 0.00 C ATOM 1107 O LYS A 98 -3.056 -11.697 1.473 1.00 0.00 O ATOM 1108 CB LYS A 98 -4.516 -14.317 2.451 1.00 0.00 C ATOM 1109 CG LYS A 98 -5.152 -15.278 3.458 1.00 0.00 C ATOM 1110 CD LYS A 98 -4.292 -16.531 3.636 1.00 0.00 C ATOM 1111 CE LYS A 98 -5.058 -17.618 4.394 1.00 0.00 C ATOM 1112 NZ LYS A 98 -5.050 -18.886 3.631 1.00 0.00 N ATOM 0 H LYS A 98 -5.410 -11.286 2.088 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.418 -13.015 4.102 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.096 -14.315 1.528 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -3.513 -14.661 2.197 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.274 -14.777 4.418 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -6.148 -15.561 3.117 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.987 -16.909 2.660 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.381 -16.277 4.178 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -4.606 -17.773 5.374 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -6.085 -17.296 4.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -5.574 -19.612 4.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -5.502 -18.737 2.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -4.069 -19.200 3.490 1.00 0.00 H new ATOM 1122 N VAL A 99 -2.278 -12.003 3.575 1.00 0.00 N ATOM 1123 CA VAL A 99 -1.028 -11.303 3.334 1.00 0.00 C ATOM 1124 C VAL A 99 0.053 -11.860 4.263 1.00 0.00 C ATOM 1125 O VAL A 99 -0.211 -12.766 5.053 1.00 0.00 O ATOM 1126 CB VAL A 99 -1.234 -9.795 3.493 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -2.552 -9.352 2.855 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -1.172 -9.385 4.965 1.00 0.00 C ATOM 0 H VAL A 99 -2.387 -12.368 4.521 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.691 -11.466 2.310 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.422 -9.289 2.971 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.674 -8.276 2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.541 -9.593 1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.381 -9.871 3.336 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.321 -8.309 5.049 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.953 -9.904 5.521 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.198 -9.649 5.376 1.00 0.00 H new ATOM 1138 N GLN A 100 1.244 -11.295 4.139 1.00 0.00 N ATOM 1139 CA GLN A 100 2.365 -11.725 4.958 1.00 0.00 C ATOM 1140 C GLN A 100 3.423 -10.623 5.029 1.00 0.00 C ATOM 1141 O GLN A 100 4.453 -10.702 4.362 1.00 0.00 O ATOM 1142 CB GLN A 100 2.965 -13.028 4.428 1.00 0.00 C ATOM 1143 CG GLN A 100 2.460 -14.230 5.228 1.00 0.00 C ATOM 1144 CD GLN A 100 3.442 -15.400 5.138 1.00 0.00 C ATOM 1145 OE1 GLN A 100 3.900 -15.780 4.073 1.00 0.00 O ATOM 1146 NE2 GLN A 100 3.739 -15.948 6.313 1.00 0.00 N ATOM 0 H GLN A 100 1.458 -10.543 3.484 1.00 0.00 H new ATOM 0 HA GLN A 100 2.000 -11.917 5.967 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.705 -13.151 3.377 1.00 0.00 H new ATOM 0 HB3 GLN A 100 4.053 -12.981 4.484 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.323 -13.945 6.271 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.485 -14.539 4.851 1.00 0.00 H new ATOM 0 HE21 GLN A 100 3.320 -15.581 7.167 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.386 -16.735 6.360 1.00 0.00 H new ATOM 1153 N ILE A 101 3.134 -9.619 5.844 1.00 0.00 N ATOM 1154 CA ILE A 101 4.047 -8.502 6.011 1.00 0.00 C ATOM 1155 C ILE A 101 5.196 -8.921 6.930 1.00 0.00 C ATOM 1156 O ILE A 101 4.972 -9.556 7.959 1.00 0.00 O ATOM 1157 CB ILE A 101 3.295 -7.261 6.495 1.00 0.00 C ATOM 1158 CG1 ILE A 101 3.951 -5.983 5.970 1.00 0.00 C ATOM 1159 CG2 ILE A 101 3.169 -7.256 8.019 1.00 0.00 C ATOM 1160 CD1 ILE A 101 4.954 -5.426 6.982 1.00 0.00 C ATOM 0 H ILE A 101 2.279 -9.556 6.396 1.00 0.00 H new ATOM 0 HA ILE A 101 4.488 -8.225 5.053 1.00 0.00 H new ATOM 0 HB ILE A 101 2.284 -7.294 6.089 1.00 0.00 H new ATOM 0 HG12 ILE A 101 4.457 -6.191 5.027 1.00 0.00 H new ATOM 0 HG13 ILE A 101 3.185 -5.236 5.763 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.630 -6.363 8.337 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.624 -8.143 8.342 1.00 0.00 H new ATOM 0 HG23 ILE A 101 4.163 -7.258 8.466 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.406 -4.518 6.584 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.440 -5.197 7.915 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.732 -6.166 7.169 1.00 0.00 H new ATOM 1171 N ASN A 102 6.402 -8.549 6.525 1.00 0.00 N ATOM 1172 CA ASN A 102 7.586 -8.880 7.300 1.00 0.00 C ATOM 1173 C ASN A 102 8.404 -7.609 7.540 1.00 0.00 C ATOM 1174 O ASN A 102 9.436 -7.401 6.905 1.00 0.00 O ATOM 1175 CB ASN A 102 8.473 -9.877 6.552 1.00 0.00 C ATOM 1176 CG ASN A 102 8.163 -11.313 6.978 1.00 0.00 C ATOM 1177 OD1 ASN A 102 7.024 -11.693 7.190 1.00 0.00 O ATOM 1178 ND2 ASN A 102 9.240 -12.087 7.091 1.00 0.00 N ATOM 0 H ASN A 102 6.584 -8.022 5.671 1.00 0.00 H new ATOM 0 HA ASN A 102 7.260 -9.322 8.241 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.320 -9.771 5.478 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.522 -9.654 6.748 1.00 0.00 H new ATOM 0 HD21 ASN A 102 9.140 -13.063 7.370 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.166 -11.704 6.898 1.00 0.00 H new ATOM 1184 N ASP A 103 7.909 -6.792 8.459 1.00 0.00 N ATOM 1185 CA ASP A 103 8.580 -5.547 8.792 1.00 0.00 C ATOM 1186 C ASP A 103 9.996 -5.852 9.287 1.00 0.00 C ATOM 1187 O ASP A 103 10.254 -5.832 10.490 1.00 0.00 O ATOM 1188 CB ASP A 103 7.840 -4.802 9.904 1.00 0.00 C ATOM 1189 CG ASP A 103 7.795 -5.529 11.251 1.00 0.00 C ATOM 1190 OD1 ASP A 103 7.232 -6.645 11.273 1.00 0.00 O ATOM 1191 OD2 ASP A 103 8.324 -4.953 12.224 1.00 0.00 O ATOM 0 H ASP A 103 7.052 -6.968 8.983 1.00 0.00 H new ATOM 0 HA ASP A 103 8.602 -4.926 7.896 1.00 0.00 H new ATOM 0 HB2 ASP A 103 8.314 -3.831 10.048 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.818 -4.613 9.576 1.00 0.00 H new ATOM 1195 N LYS A 104 10.875 -6.127 8.336 1.00 0.00 N ATOM 1196 CA LYS A 104 12.257 -6.436 8.660 1.00 0.00 C ATOM 1197 C LYS A 104 13.144 -5.252 8.271 1.00 0.00 C ATOM 1198 O LYS A 104 13.901 -5.330 7.305 1.00 0.00 O ATOM 1199 CB LYS A 104 12.677 -7.758 8.013 1.00 0.00 C ATOM 1200 CG LYS A 104 14.087 -8.159 8.451 1.00 0.00 C ATOM 1201 CD LYS A 104 14.039 -9.211 9.561 1.00 0.00 C ATOM 1202 CE LYS A 104 14.315 -8.581 10.928 1.00 0.00 C ATOM 1203 NZ LYS A 104 13.392 -9.129 11.947 1.00 0.00 N ATOM 0 H LYS A 104 10.657 -6.142 7.340 1.00 0.00 H new ATOM 0 HA LYS A 104 12.373 -6.583 9.734 1.00 0.00 H new ATOM 0 HB2 LYS A 104 11.971 -8.542 8.287 1.00 0.00 H new ATOM 0 HB3 LYS A 104 12.643 -7.663 6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 104 14.639 -8.552 7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 104 14.626 -7.279 8.802 1.00 0.00 H new ATOM 0 HD2 LYS A 104 13.061 -9.691 9.569 1.00 0.00 H new ATOM 0 HD3 LYS A 104 14.775 -9.990 9.361 1.00 0.00 H new ATOM 0 HE2 LYS A 104 15.347 -8.774 11.222 1.00 0.00 H new ATOM 0 HE3 LYS A 104 14.198 -7.499 10.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 13.593 -8.691 12.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 12.410 -8.923 11.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 13.524 -10.158 12.017 1.00 0.00 H new ATOM 1213 N ASP A 105 13.023 -4.183 9.045 1.00 0.00 N ATOM 1214 CA ASP A 105 13.804 -2.985 8.794 1.00 0.00 C ATOM 1215 C ASP A 105 14.511 -2.562 10.083 1.00 0.00 C ATOM 1216 O ASP A 105 14.803 -3.397 10.938 1.00 0.00 O ATOM 1217 CB ASP A 105 12.911 -1.828 8.343 1.00 0.00 C ATOM 1218 CG ASP A 105 12.182 -1.096 9.472 1.00 0.00 C ATOM 1219 OD1 ASP A 105 11.377 -1.764 10.156 1.00 0.00 O ATOM 1220 OD2 ASP A 105 12.446 0.116 9.625 1.00 0.00 O ATOM 0 H ASP A 105 12.395 -4.122 9.847 1.00 0.00 H new ATOM 0 HA ASP A 105 14.524 -3.212 8.008 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.522 -1.108 7.799 1.00 0.00 H new ATOM 0 HB3 ASP A 105 12.170 -2.212 7.642 1.00 0.00 H new ATOM 1224 N ASP A 106 14.764 -1.265 10.183 1.00 0.00 N ATOM 1225 CA ASP A 106 15.430 -0.721 11.354 1.00 0.00 C ATOM 1226 C ASP A 106 15.369 0.807 11.306 1.00 0.00 C ATOM 1227 O ASP A 106 14.709 1.379 10.441 1.00 0.00 O ATOM 1228 CB ASP A 106 16.903 -1.134 11.392 1.00 0.00 C ATOM 1229 CG ASP A 106 17.187 -2.450 12.119 1.00 0.00 C ATOM 1230 OD1 ASP A 106 17.010 -2.465 13.355 1.00 0.00 O ATOM 1231 OD2 ASP A 106 17.577 -3.411 11.420 1.00 0.00 O ATOM 0 H ASP A 106 14.520 -0.575 9.472 1.00 0.00 H new ATOM 0 HA ASP A 106 14.924 -1.107 12.239 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.268 -1.216 10.368 1.00 0.00 H new ATOM 0 HB3 ASP A 106 17.475 -0.340 11.872 1.00 0.00 H new ATOM 1235 N THR A 107 16.066 1.425 12.249 1.00 0.00 N ATOM 1236 CA THR A 107 16.099 2.875 12.326 1.00 0.00 C ATOM 1237 C THR A 107 17.014 3.329 13.465 1.00 0.00 C ATOM 1238 O THR A 107 17.983 2.647 13.796 1.00 0.00 O ATOM 1239 CB THR A 107 14.660 3.374 12.467 1.00 0.00 C ATOM 1240 OG1 THR A 107 14.793 4.786 12.607 1.00 0.00 O ATOM 1241 CG2 THR A 107 14.012 2.929 13.779 1.00 0.00 C ATOM 0 H THR A 107 16.612 0.947 12.966 1.00 0.00 H new ATOM 0 HA THR A 107 16.522 3.309 11.420 1.00 0.00 H new ATOM 0 HB THR A 107 14.067 3.011 11.628 1.00 0.00 H new ATOM 0 HG1 THR A 107 13.905 5.190 12.702 1.00 0.00 H new ATOM 0 HG21 THR A 107 12.992 3.310 13.828 1.00 0.00 H new ATOM 0 HG22 THR A 107 13.995 1.840 13.826 1.00 0.00 H new ATOM 0 HG23 THR A 107 14.586 3.319 14.619 1.00 0.00 H new ATOM 1249 N ASN A 108 16.674 4.476 14.034 1.00 0.00 N ATOM 1250 CA ASN A 108 17.452 5.029 15.129 1.00 0.00 C ATOM 1251 C ASN A 108 18.932 5.052 14.737 1.00 0.00 C ATOM 1252 O ASN A 108 19.802 5.189 15.594 1.00 0.00 O ATOM 1253 CB ASN A 108 17.311 4.175 16.391 1.00 0.00 C ATOM 1254 CG ASN A 108 17.945 4.870 17.597 1.00 0.00 C ATOM 1255 OD1 ASN A 108 17.966 6.085 17.705 1.00 0.00 O ATOM 1256 ND2 ASN A 108 18.459 4.034 18.495 1.00 0.00 N ATOM 0 H ASN A 108 15.869 5.038 13.757 1.00 0.00 H new ATOM 0 HA ASN A 108 17.083 6.035 15.331 1.00 0.00 H new ATOM 0 HB2 ASN A 108 16.256 3.985 16.590 1.00 0.00 H new ATOM 0 HB3 ASN A 108 17.786 3.206 16.234 1.00 0.00 H new ATOM 0 HD21 ASN A 108 18.905 4.400 19.336 1.00 0.00 H new ATOM 0 HD22 ASN A 108 18.407 3.027 18.342 1.00 0.00 H new ATOM 1262 N GLU A 109 19.169 4.917 13.440 1.00 0.00 N ATOM 1263 CA GLU A 109 20.527 4.921 12.924 1.00 0.00 C ATOM 1264 C GLU A 109 20.599 4.137 11.612 1.00 0.00 C ATOM 1265 O GLU A 109 21.529 4.314 10.828 1.00 0.00 O ATOM 1266 CB GLU A 109 21.507 4.356 13.954 1.00 0.00 C ATOM 1267 CG GLU A 109 22.796 3.880 13.282 1.00 0.00 C ATOM 1268 CD GLU A 109 23.880 3.586 14.321 1.00 0.00 C ATOM 1269 OE1 GLU A 109 24.441 4.570 14.849 1.00 0.00 O ATOM 1270 OE2 GLU A 109 24.123 2.384 14.563 1.00 0.00 O ATOM 0 H GLU A 109 18.444 4.804 12.732 1.00 0.00 H new ATOM 0 HA GLU A 109 20.815 5.953 12.724 1.00 0.00 H new ATOM 0 HB2 GLU A 109 21.740 5.120 14.696 1.00 0.00 H new ATOM 0 HB3 GLU A 109 21.042 3.526 14.486 1.00 0.00 H new ATOM 0 HG2 GLU A 109 22.595 2.983 12.697 1.00 0.00 H new ATOM 0 HG3 GLU A 109 23.150 4.641 12.587 1.00 0.00 H new ATOM 1275 N TYR A 110 19.603 3.285 11.414 1.00 0.00 N ATOM 1276 CA TYR A 110 19.541 2.473 10.211 1.00 0.00 C ATOM 1277 C TYR A 110 18.650 3.127 9.153 1.00 0.00 C ATOM 1278 O TYR A 110 18.285 4.295 9.279 1.00 0.00 O ATOM 1279 CB TYR A 110 18.919 1.141 10.632 1.00 0.00 C ATOM 1280 CG TYR A 110 19.694 -0.088 10.153 1.00 0.00 C ATOM 1281 CD1 TYR A 110 20.905 -0.409 10.733 1.00 0.00 C ATOM 1282 CD2 TYR A 110 19.183 -0.876 9.141 1.00 0.00 C ATOM 1283 CE1 TYR A 110 21.634 -1.566 10.281 1.00 0.00 C ATOM 1284 CE2 TYR A 110 19.912 -2.032 8.691 1.00 0.00 C ATOM 1285 CZ TYR A 110 21.102 -2.320 9.283 1.00 0.00 C ATOM 1286 OH TYR A 110 21.791 -3.413 8.856 1.00 0.00 O ATOM 0 H TYR A 110 18.833 3.140 12.067 1.00 0.00 H new ATOM 0 HA TYR A 110 20.534 2.352 9.779 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.849 1.112 11.719 1.00 0.00 H new ATOM 0 HB3 TYR A 110 17.901 1.089 10.246 1.00 0.00 H new ATOM 0 HD1 TYR A 110 21.305 0.207 11.525 1.00 0.00 H new ATOM 0 HD2 TYR A 110 18.236 -0.625 8.687 1.00 0.00 H new ATOM 0 HE1 TYR A 110 22.583 -1.829 10.725 1.00 0.00 H new ATOM 0 HE2 TYR A 110 19.523 -2.657 7.901 1.00 0.00 H new ATOM 0 HH TYR A 110 21.290 -3.856 8.140 1.00 0.00 H new ATOM 1295 N LYS A 111 18.324 2.345 8.134 1.00 0.00 N ATOM 1296 CA LYS A 111 17.483 2.834 7.055 1.00 0.00 C ATOM 1297 C LYS A 111 16.935 1.645 6.263 1.00 0.00 C ATOM 1298 O LYS A 111 15.968 1.785 5.515 1.00 0.00 O ATOM 1299 CB LYS A 111 18.245 3.845 6.196 1.00 0.00 C ATOM 1300 CG LYS A 111 17.306 4.930 5.664 1.00 0.00 C ATOM 1301 CD LYS A 111 17.424 6.212 6.492 1.00 0.00 C ATOM 1302 CE LYS A 111 16.053 6.665 6.997 1.00 0.00 C ATOM 1303 NZ LYS A 111 15.359 7.467 5.965 1.00 0.00 N ATOM 0 H LYS A 111 18.627 1.376 8.033 1.00 0.00 H new ATOM 0 HA LYS A 111 16.626 3.374 7.456 1.00 0.00 H new ATOM 0 HB2 LYS A 111 19.039 4.303 6.786 1.00 0.00 H new ATOM 0 HB3 LYS A 111 18.723 3.332 5.362 1.00 0.00 H new ATOM 0 HG2 LYS A 111 17.544 5.143 4.622 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.277 4.570 5.689 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.090 6.043 7.338 1.00 0.00 H new ATOM 0 HD3 LYS A 111 17.872 7.000 5.887 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.449 5.795 7.257 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.171 7.255 7.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.430 7.766 6.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.929 8.307 5.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.230 6.893 5.108 1.00 0.00 H new ATOM 1313 N HIS A 112 17.577 0.502 6.454 1.00 0.00 N ATOM 1314 CA HIS A 112 17.166 -0.712 5.767 1.00 0.00 C ATOM 1315 C HIS A 112 15.675 -0.957 6.008 1.00 0.00 C ATOM 1316 O HIS A 112 15.297 -1.569 7.006 1.00 0.00 O ATOM 1317 CB HIS A 112 18.038 -1.895 6.186 1.00 0.00 C ATOM 1318 CG HIS A 112 17.999 -3.058 5.224 1.00 0.00 C ATOM 1319 ND1 HIS A 112 18.507 -4.308 5.536 1.00 0.00 N ATOM 1320 CD2 HIS A 112 17.510 -3.148 3.954 1.00 0.00 C ATOM 1321 CE1 HIS A 112 18.326 -5.105 4.494 1.00 0.00 C ATOM 1322 NE2 HIS A 112 17.708 -4.385 3.514 1.00 0.00 N ATOM 0 H HIS A 112 18.379 0.390 7.074 1.00 0.00 H new ATOM 0 HA HIS A 112 17.310 -0.594 4.693 1.00 0.00 H new ATOM 0 HB2 HIS A 112 19.069 -1.555 6.288 1.00 0.00 H new ATOM 0 HB3 HIS A 112 17.717 -2.239 7.169 1.00 0.00 H new ATOM 0 HD2 HIS A 112 17.041 -2.348 3.400 1.00 0.00 H new ATOM 0 HE1 HIS A 112 18.617 -6.143 4.431 1.00 0.00 H new ATOM 0 HE2 HIS A 112 17.442 -4.739 2.595 1.00 0.00 H new ATOM 1329 N ALA A 113 14.869 -0.468 5.077 1.00 0.00 N ATOM 1330 CA ALA A 113 13.427 -0.628 5.176 1.00 0.00 C ATOM 1331 C ALA A 113 13.099 -2.096 5.450 1.00 0.00 C ATOM 1332 O ALA A 113 13.999 -2.925 5.572 1.00 0.00 O ATOM 1333 CB ALA A 113 12.768 -0.112 3.896 1.00 0.00 C ATOM 0 H ALA A 113 15.186 0.039 4.251 1.00 0.00 H new ATOM 0 HA ALA A 113 13.031 -0.042 6.006 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.687 -0.232 3.970 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.008 0.943 3.763 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.139 -0.679 3.042 1.00 0.00 H new ATOM 1339 N PHE A 114 11.807 -2.373 5.541 1.00 0.00 N ATOM 1340 CA PHE A 114 11.348 -3.728 5.799 1.00 0.00 C ATOM 1341 C PHE A 114 10.828 -4.383 4.519 1.00 0.00 C ATOM 1342 O PHE A 114 10.586 -3.704 3.523 1.00 0.00 O ATOM 1343 CB PHE A 114 10.203 -3.627 6.809 1.00 0.00 C ATOM 1344 CG PHE A 114 9.043 -2.741 6.349 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.091 -1.398 6.557 1.00 0.00 C ATOM 1346 CD2 PHE A 114 7.966 -3.296 5.732 1.00 0.00 C ATOM 1347 CE1 PHE A 114 8.014 -0.575 6.130 1.00 0.00 C ATOM 1348 CE2 PHE A 114 6.891 -2.473 5.304 1.00 0.00 C ATOM 1349 CZ PHE A 114 6.937 -1.130 5.513 1.00 0.00 C ATOM 0 H PHE A 114 11.063 -1.683 5.441 1.00 0.00 H new ATOM 0 HA PHE A 114 12.171 -4.335 6.177 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.823 -4.628 7.013 1.00 0.00 H new ATOM 0 HB3 PHE A 114 10.594 -3.237 7.748 1.00 0.00 H new ATOM 0 HD1 PHE A 114 9.947 -0.957 7.046 1.00 0.00 H new ATOM 0 HD2 PHE A 114 7.928 -4.363 5.567 1.00 0.00 H new ATOM 0 HE1 PHE A 114 8.051 0.492 6.296 1.00 0.00 H new ATOM 0 HE2 PHE A 114 6.036 -2.914 4.812 1.00 0.00 H new ATOM 0 HZ PHE A 114 6.118 -0.505 5.189 1.00 0.00 H new ATOM 1358 N GLU A 115 10.669 -5.697 4.587 1.00 0.00 N ATOM 1359 CA GLU A 115 10.182 -6.452 3.445 1.00 0.00 C ATOM 1360 C GLU A 115 8.746 -6.919 3.692 1.00 0.00 C ATOM 1361 O GLU A 115 8.383 -7.256 4.818 1.00 0.00 O ATOM 1362 CB GLU A 115 11.099 -7.638 3.141 1.00 0.00 C ATOM 1363 CG GLU A 115 12.281 -7.682 4.111 1.00 0.00 C ATOM 1364 CD GLU A 115 13.370 -8.631 3.607 1.00 0.00 C ATOM 1365 OE1 GLU A 115 13.585 -8.645 2.376 1.00 0.00 O ATOM 1366 OE2 GLU A 115 13.962 -9.322 4.465 1.00 0.00 O ATOM 0 H GLU A 115 10.869 -6.258 5.415 1.00 0.00 H new ATOM 0 HA GLU A 115 10.187 -5.798 2.573 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.533 -8.567 3.210 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.467 -7.565 2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 115 12.694 -6.681 4.232 1.00 0.00 H new ATOM 0 HG3 GLU A 115 11.938 -8.006 5.093 1.00 0.00 H new ATOM 1371 N ILE A 116 7.967 -6.924 2.620 1.00 0.00 N ATOM 1372 CA ILE A 116 6.578 -7.343 2.706 1.00 0.00 C ATOM 1373 C ILE A 116 6.363 -8.564 1.809 1.00 0.00 C ATOM 1374 O ILE A 116 7.114 -8.781 0.859 1.00 0.00 O ATOM 1375 CB ILE A 116 5.645 -6.173 2.389 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.076 -4.909 3.134 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.188 -6.541 2.679 1.00 0.00 C ATOM 1378 CD1 ILE A 116 7.261 -4.238 2.436 1.00 0.00 C ATOM 0 H ILE A 116 8.271 -6.645 1.687 1.00 0.00 H new ATOM 0 HA ILE A 116 6.333 -7.648 3.723 1.00 0.00 H new ATOM 0 HB ILE A 116 5.718 -5.957 1.323 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.240 -4.212 3.189 1.00 0.00 H new ATOM 0 HG13 ILE A 116 6.348 -5.162 4.159 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.545 -5.692 2.445 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.899 -7.395 2.066 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.081 -6.798 3.733 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.547 -3.342 2.986 1.00 0.00 H new ATOM 0 HD12 ILE A 116 8.103 -4.929 2.404 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.977 -3.965 1.420 1.00 0.00 H new ATOM 1389 N ILE A 117 5.332 -9.327 2.141 1.00 0.00 N ATOM 1390 CA ILE A 117 5.008 -10.521 1.377 1.00 0.00 C ATOM 1391 C ILE A 117 3.494 -10.742 1.404 1.00 0.00 C ATOM 1392 O ILE A 117 2.948 -11.199 2.406 1.00 0.00 O ATOM 1393 CB ILE A 117 5.813 -11.718 1.885 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.295 -11.572 1.530 1.00 0.00 C ATOM 1395 CG2 ILE A 117 5.227 -13.033 1.368 1.00 0.00 C ATOM 1396 CD1 ILE A 117 8.105 -12.754 2.064 1.00 0.00 C ATOM 0 H ILE A 117 4.710 -9.142 2.928 1.00 0.00 H new ATOM 0 HA ILE A 117 5.294 -10.395 0.333 1.00 0.00 H new ATOM 0 HB ILE A 117 5.742 -11.740 2.972 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.409 -11.508 0.448 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.683 -10.643 1.947 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.818 -13.868 1.744 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.198 -13.133 1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.247 -13.037 0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.154 -12.626 1.798 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.008 -12.801 3.149 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.730 -13.679 1.626 1.00 0.00 H new ATOM 1407 N LEU A 118 2.860 -10.407 0.290 1.00 0.00 N ATOM 1408 CA LEU A 118 1.420 -10.564 0.173 1.00 0.00 C ATOM 1409 C LEU A 118 1.113 -11.752 -0.741 1.00 0.00 C ATOM 1410 O LEU A 118 2.023 -12.359 -1.302 1.00 0.00 O ATOM 1411 CB LEU A 118 0.773 -9.254 -0.282 1.00 0.00 C ATOM 1412 CG LEU A 118 1.655 -8.327 -1.121 1.00 0.00 C ATOM 1413 CD1 LEU A 118 1.813 -8.862 -2.546 1.00 0.00 C ATOM 1414 CD2 LEU A 118 1.117 -6.895 -1.103 1.00 0.00 C ATOM 0 H LEU A 118 3.317 -10.028 -0.539 1.00 0.00 H new ATOM 0 HA LEU A 118 0.981 -10.788 1.145 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.120 -9.494 -0.859 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.444 -8.708 0.602 1.00 0.00 H new ATOM 0 HG LEU A 118 2.649 -8.304 -0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.444 -8.185 -3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.274 -9.849 -2.515 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.833 -8.934 -3.018 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.762 -6.256 -1.707 1.00 0.00 H new ATOM 0 HD22 LEU A 118 0.107 -6.881 -1.512 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.099 -6.526 -0.077 1.00 0.00 H new ATOM 1425 N LYS A 119 -0.173 -12.047 -0.863 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.611 -13.151 -1.700 1.00 0.00 C ATOM 1427 C LYS A 119 0.015 -13.012 -3.090 1.00 0.00 C ATOM 1428 O LYS A 119 0.799 -12.096 -3.333 1.00 0.00 O ATOM 1429 CB LYS A 119 -2.138 -13.234 -1.721 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.623 -14.556 -1.119 1.00 0.00 C ATOM 1431 CD LYS A 119 -3.888 -15.049 -1.826 1.00 0.00 C ATOM 1432 CE LYS A 119 -3.870 -16.570 -1.982 1.00 0.00 C ATOM 1433 NZ LYS A 119 -2.727 -16.993 -2.819 1.00 0.00 N ATOM 0 H LYS A 119 -0.926 -11.541 -0.396 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.268 -14.100 -1.288 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.559 -12.399 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.497 -13.144 -2.746 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -1.838 -15.308 -1.204 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.824 -14.424 -0.056 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.768 -14.748 -1.257 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -3.967 -14.580 -2.807 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -3.804 -17.041 -1.001 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.803 -16.906 -2.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -2.980 -17.856 -3.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -2.492 -16.237 -3.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -1.904 -17.184 -2.212 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.354 -13.935 -3.965 1.00 0.00 N ATOM 1444 CA ASP A 120 0.162 -13.927 -5.323 1.00 0.00 C ATOM 1445 C ASP A 120 1.684 -14.079 -5.287 1.00 0.00 C ATOM 1446 O ASP A 120 2.358 -13.860 -6.293 1.00 0.00 O ATOM 1447 CB ASP A 120 -0.165 -12.610 -6.029 1.00 0.00 C ATOM 1448 CG ASP A 120 -1.415 -12.643 -6.911 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -2.138 -13.659 -6.835 1.00 0.00 O ATOM 1450 OD2 ASP A 120 -1.620 -11.649 -7.642 1.00 0.00 O ATOM 0 H ASP A 120 -1.004 -14.694 -3.760 1.00 0.00 H new ATOM 0 HA ASP A 120 -0.302 -14.751 -5.865 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.291 -11.832 -5.275 1.00 0.00 H new ATOM 0 HB3 ASP A 120 0.688 -12.323 -6.644 1.00 0.00 H new ATOM 1454 N GLU A 121 2.181 -14.452 -4.117 1.00 0.00 N ATOM 1455 CA GLU A 121 3.612 -14.635 -3.937 1.00 0.00 C ATOM 1456 C GLU A 121 4.374 -13.419 -4.469 1.00 0.00 C ATOM 1457 O GLU A 121 5.017 -13.495 -5.515 1.00 0.00 O ATOM 1458 CB GLU A 121 4.090 -15.921 -4.614 1.00 0.00 C ATOM 1459 CG GLU A 121 4.418 -16.997 -3.577 1.00 0.00 C ATOM 1460 CD GLU A 121 5.488 -17.957 -4.103 1.00 0.00 C ATOM 1461 OE1 GLU A 121 5.090 -18.964 -4.725 1.00 0.00 O ATOM 1462 OE2 GLU A 121 6.680 -17.660 -3.869 1.00 0.00 O ATOM 0 H GLU A 121 1.619 -14.632 -3.285 1.00 0.00 H new ATOM 0 HA GLU A 121 3.815 -14.728 -2.870 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.319 -16.287 -5.292 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.973 -15.712 -5.218 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.766 -16.527 -2.657 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.515 -17.554 -3.328 1.00 0.00 H new ATOM 1467 N ASN A 122 4.278 -12.328 -3.724 1.00 0.00 N ATOM 1468 CA ASN A 122 4.950 -11.099 -4.108 1.00 0.00 C ATOM 1469 C ASN A 122 5.552 -10.441 -2.863 1.00 0.00 C ATOM 1470 O ASN A 122 4.946 -10.461 -1.792 1.00 0.00 O ATOM 1471 CB ASN A 122 3.968 -10.107 -4.737 1.00 0.00 C ATOM 1472 CG ASN A 122 4.241 -9.943 -6.234 1.00 0.00 C ATOM 1473 OD1 ASN A 122 5.090 -9.177 -6.656 1.00 0.00 O ATOM 1474 ND2 ASN A 122 3.474 -10.704 -7.010 1.00 0.00 N ATOM 0 H ASN A 122 3.745 -12.270 -2.856 1.00 0.00 H new ATOM 0 HA ASN A 122 5.724 -11.351 -4.833 1.00 0.00 H new ATOM 0 HB2 ASN A 122 2.946 -10.455 -4.586 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.053 -9.141 -4.240 1.00 0.00 H new ATOM 0 HD21 ASN A 122 3.579 -10.667 -8.024 1.00 0.00 H new ATOM 0 HD22 ASN A 122 2.781 -11.325 -6.591 1.00 0.00 H new ATOM 1480 N SER A 123 6.736 -9.876 -3.046 1.00 0.00 N ATOM 1481 CA SER A 123 7.425 -9.214 -1.951 1.00 0.00 C ATOM 1482 C SER A 123 7.649 -7.738 -2.290 1.00 0.00 C ATOM 1483 O SER A 123 7.620 -7.355 -3.458 1.00 0.00 O ATOM 1484 CB SER A 123 8.760 -9.898 -1.648 1.00 0.00 C ATOM 1485 OG SER A 123 9.856 -8.992 -1.735 1.00 0.00 O ATOM 0 H SER A 123 7.236 -9.863 -3.935 1.00 0.00 H new ATOM 0 HA SER A 123 6.801 -9.285 -1.060 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.727 -10.332 -0.648 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.913 -10.720 -2.347 1.00 0.00 H new ATOM 0 HG SER A 123 10.689 -9.466 -1.533 1.00 0.00 H new ATOM 1490 N VAL A 124 7.868 -6.952 -1.247 1.00 0.00 N ATOM 1491 CA VAL A 124 8.097 -5.528 -1.418 1.00 0.00 C ATOM 1492 C VAL A 124 9.145 -5.058 -0.406 1.00 0.00 C ATOM 1493 O VAL A 124 9.632 -5.849 0.400 1.00 0.00 O ATOM 1494 CB VAL A 124 6.775 -4.768 -1.306 1.00 0.00 C ATOM 1495 CG1 VAL A 124 6.726 -3.604 -2.299 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.584 -5.707 -1.504 1.00 0.00 C ATOM 0 H VAL A 124 7.892 -7.275 -0.280 1.00 0.00 H new ATOM 0 HA VAL A 124 8.491 -5.322 -2.413 1.00 0.00 H new ATOM 0 HB VAL A 124 6.711 -4.354 -0.300 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.775 -3.080 -2.199 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.544 -2.914 -2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.823 -3.988 -3.315 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.656 -5.141 -1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.641 -6.164 -2.492 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.604 -6.486 -0.742 1.00 0.00 H new ATOM 1506 N ILE A 125 9.458 -3.773 -0.480 1.00 0.00 N ATOM 1507 CA ILE A 125 10.437 -3.188 0.421 1.00 0.00 C ATOM 1508 C ILE A 125 9.995 -1.774 0.800 1.00 0.00 C ATOM 1509 O ILE A 125 10.420 -0.800 0.180 1.00 0.00 O ATOM 1510 CB ILE A 125 11.836 -3.250 -0.197 1.00 0.00 C ATOM 1511 CG1 ILE A 125 12.105 -4.627 -0.808 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.904 -2.858 0.826 1.00 0.00 C ATOM 1513 CD1 ILE A 125 13.572 -4.766 -1.221 1.00 0.00 C ATOM 0 H ILE A 125 9.051 -3.120 -1.150 1.00 0.00 H new ATOM 0 HA ILE A 125 10.495 -3.762 1.346 1.00 0.00 H new ATOM 0 HB ILE A 125 11.884 -2.523 -1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 125 11.851 -5.405 -0.088 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.463 -4.775 -1.676 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.889 -2.910 0.362 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.720 -1.841 1.173 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.865 -3.543 1.673 1.00 0.00 H new ATOM 0 HD11 ILE A 125 13.737 -5.753 -1.652 1.00 0.00 H new ATOM 0 HD12 ILE A 125 13.816 -4.002 -1.959 1.00 0.00 H new ATOM 0 HD13 ILE A 125 14.210 -4.641 -0.346 1.00 0.00 H new ATOM 1524 N PHE A 126 9.147 -1.706 1.816 1.00 0.00 N ATOM 1525 CA PHE A 126 8.643 -0.427 2.285 1.00 0.00 C ATOM 1526 C PHE A 126 9.455 0.078 3.480 1.00 0.00 C ATOM 1527 O PHE A 126 9.773 -0.689 4.388 1.00 0.00 O ATOM 1528 CB PHE A 126 7.195 -0.652 2.726 1.00 0.00 C ATOM 1529 CG PHE A 126 6.189 -0.672 1.574 1.00 0.00 C ATOM 1530 CD1 PHE A 126 6.257 0.272 0.595 1.00 0.00 C ATOM 1531 CD2 PHE A 126 5.228 -1.632 1.527 1.00 0.00 C ATOM 1532 CE1 PHE A 126 5.324 0.252 -0.474 1.00 0.00 C ATOM 1533 CE2 PHE A 126 4.295 -1.650 0.457 1.00 0.00 C ATOM 1534 CZ PHE A 126 4.363 -0.708 -0.522 1.00 0.00 C ATOM 0 H PHE A 126 8.797 -2.516 2.327 1.00 0.00 H new ATOM 0 HA PHE A 126 8.716 0.316 1.491 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.133 -1.597 3.265 1.00 0.00 H new ATOM 0 HB3 PHE A 126 6.913 0.134 3.427 1.00 0.00 H new ATOM 0 HD1 PHE A 126 7.020 1.035 0.632 1.00 0.00 H new ATOM 0 HD2 PHE A 126 5.174 -2.381 2.303 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.378 1.001 -1.251 1.00 0.00 H new ATOM 0 HE2 PHE A 126 3.531 -2.412 0.420 1.00 0.00 H new ATOM 0 HZ PHE A 126 3.654 -0.723 -1.337 1.00 0.00 H new ATOM 1543 N SER A 127 9.767 1.365 3.442 1.00 0.00 N ATOM 1544 CA SER A 127 10.536 1.981 4.510 1.00 0.00 C ATOM 1545 C SER A 127 9.635 2.898 5.340 1.00 0.00 C ATOM 1546 O SER A 127 8.966 3.775 4.796 1.00 0.00 O ATOM 1547 CB SER A 127 11.723 2.767 3.951 1.00 0.00 C ATOM 1548 OG SER A 127 12.858 2.702 4.810 1.00 0.00 O ATOM 0 H SER A 127 9.501 1.998 2.688 1.00 0.00 H new ATOM 0 HA SER A 127 10.928 1.191 5.150 1.00 0.00 H new ATOM 0 HB2 SER A 127 11.988 2.374 2.969 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.434 3.809 3.810 1.00 0.00 H new ATOM 0 HG SER A 127 13.674 2.845 4.286 1.00 0.00 H new ATOM 1553 N ALA A 128 9.648 2.664 6.645 1.00 0.00 N ATOM 1554 CA ALA A 128 8.842 3.458 7.556 1.00 0.00 C ATOM 1555 C ALA A 128 9.761 4.312 8.431 1.00 0.00 C ATOM 1556 O ALA A 128 10.816 3.852 8.864 1.00 0.00 O ATOM 1557 CB ALA A 128 7.944 2.534 8.380 1.00 0.00 C ATOM 0 H ALA A 128 10.204 1.936 7.092 1.00 0.00 H new ATOM 0 HA ALA A 128 8.192 4.136 7.003 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.339 3.129 9.064 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.291 1.972 7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.562 1.841 8.951 1.00 0.00 H new ATOM 1563 N LYS A 129 9.326 5.541 8.667 1.00 0.00 N ATOM 1564 CA LYS A 129 10.097 6.463 9.484 1.00 0.00 C ATOM 1565 C LYS A 129 9.318 6.779 10.763 1.00 0.00 C ATOM 1566 O LYS A 129 9.654 7.717 11.483 1.00 0.00 O ATOM 1567 CB LYS A 129 10.480 7.705 8.676 1.00 0.00 C ATOM 1568 CG LYS A 129 9.257 8.586 8.412 1.00 0.00 C ATOM 1569 CD LYS A 129 9.586 9.696 7.411 1.00 0.00 C ATOM 1570 CE LYS A 129 8.313 10.388 6.922 1.00 0.00 C ATOM 1571 NZ LYS A 129 7.716 9.640 5.794 1.00 0.00 N ATOM 0 H LYS A 129 8.450 5.920 8.307 1.00 0.00 H new ATOM 0 HA LYS A 129 11.039 6.005 9.788 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.234 8.277 9.217 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.927 7.403 7.729 1.00 0.00 H new ATOM 0 HG2 LYS A 129 8.440 7.975 8.027 1.00 0.00 H new ATOM 0 HG3 LYS A 129 8.912 9.026 9.348 1.00 0.00 H new ATOM 0 HD2 LYS A 129 10.246 10.428 7.878 1.00 0.00 H new ATOM 0 HD3 LYS A 129 10.125 9.277 6.562 1.00 0.00 H new ATOM 0 HE2 LYS A 129 7.595 10.460 7.739 1.00 0.00 H new ATOM 0 HE3 LYS A 129 8.543 11.406 6.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 6.853 10.124 5.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 8.397 9.593 5.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.478 8.676 6.104 1.00 0.00 H new ATOM 1581 N SER A 130 8.291 5.977 11.005 1.00 0.00 N ATOM 1582 CA SER A 130 7.462 6.159 12.184 1.00 0.00 C ATOM 1583 C SER A 130 7.290 4.825 12.914 1.00 0.00 C ATOM 1584 O SER A 130 6.669 3.902 12.390 1.00 0.00 O ATOM 1585 CB SER A 130 6.096 6.740 11.812 1.00 0.00 C ATOM 1586 OG SER A 130 6.080 8.162 11.895 1.00 0.00 O ATOM 0 H SER A 130 8.015 5.200 10.405 1.00 0.00 H new ATOM 0 HA SER A 130 7.960 6.867 12.846 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.835 6.433 10.799 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.335 6.330 12.475 1.00 0.00 H new ATOM 0 HG SER A 130 5.192 8.494 11.648 1.00 0.00 H new ATOM 1591 N ALA A 131 7.852 4.767 14.112 1.00 0.00 N ATOM 1592 CA ALA A 131 7.768 3.562 14.920 1.00 0.00 C ATOM 1593 C ALA A 131 6.322 3.066 14.941 1.00 0.00 C ATOM 1594 O ALA A 131 6.075 1.861 14.953 1.00 0.00 O ATOM 1595 CB ALA A 131 8.307 3.848 16.322 1.00 0.00 C ATOM 0 H ALA A 131 8.367 5.535 14.543 1.00 0.00 H new ATOM 0 HA ALA A 131 8.381 2.770 14.491 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.244 2.944 16.928 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.347 4.167 16.254 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.715 4.637 16.785 1.00 0.00 H new ATOM 1601 N GLU A 132 5.402 4.021 14.945 1.00 0.00 N ATOM 1602 CA GLU A 132 3.986 3.696 14.965 1.00 0.00 C ATOM 1603 C GLU A 132 3.539 3.187 13.593 1.00 0.00 C ATOM 1604 O GLU A 132 2.735 2.261 13.503 1.00 0.00 O ATOM 1605 CB GLU A 132 3.154 4.903 15.400 1.00 0.00 C ATOM 1606 CG GLU A 132 2.548 4.680 16.788 1.00 0.00 C ATOM 1607 CD GLU A 132 1.065 4.318 16.688 1.00 0.00 C ATOM 1608 OE1 GLU A 132 0.789 3.156 16.318 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.242 5.210 16.983 1.00 0.00 O ATOM 0 H GLU A 132 5.610 5.019 14.935 1.00 0.00 H new ATOM 0 HA GLU A 132 3.825 2.903 15.695 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.780 5.795 15.412 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.359 5.081 14.676 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.087 3.883 17.300 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.666 5.581 17.389 1.00 0.00 H new ATOM 1614 N GLU A 133 4.081 3.814 12.559 1.00 0.00 N ATOM 1615 CA GLU A 133 3.747 3.436 11.197 1.00 0.00 C ATOM 1616 C GLU A 133 4.178 1.994 10.925 1.00 0.00 C ATOM 1617 O GLU A 133 3.400 1.198 10.401 1.00 0.00 O ATOM 1618 CB GLU A 133 4.384 4.397 10.190 1.00 0.00 C ATOM 1619 CG GLU A 133 3.634 5.731 10.155 1.00 0.00 C ATOM 1620 CD GLU A 133 3.999 6.533 8.904 1.00 0.00 C ATOM 1621 OE1 GLU A 133 5.001 7.276 8.980 1.00 0.00 O ATOM 1622 OE2 GLU A 133 3.269 6.384 7.901 1.00 0.00 O ATOM 0 H GLU A 133 4.749 4.581 12.637 1.00 0.00 H new ATOM 0 HA GLU A 133 2.665 3.500 11.078 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.427 4.569 10.456 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.378 3.946 9.198 1.00 0.00 H new ATOM 0 HG2 GLU A 133 2.560 5.549 10.174 1.00 0.00 H new ATOM 0 HG3 GLU A 133 3.874 6.311 11.046 1.00 0.00 H new ATOM 1627 N LYS A 134 5.416 1.700 11.295 1.00 0.00 N ATOM 1628 CA LYS A 134 5.959 0.367 11.098 1.00 0.00 C ATOM 1629 C LYS A 134 5.022 -0.660 11.736 1.00 0.00 C ATOM 1630 O LYS A 134 4.728 -1.693 11.137 1.00 0.00 O ATOM 1631 CB LYS A 134 7.398 0.293 11.616 1.00 0.00 C ATOM 1632 CG LYS A 134 7.474 0.716 13.084 1.00 0.00 C ATOM 1633 CD LYS A 134 8.851 0.403 13.674 1.00 0.00 C ATOM 1634 CE LYS A 134 9.026 -1.101 13.889 1.00 0.00 C ATOM 1635 NZ LYS A 134 10.461 -1.461 13.892 1.00 0.00 N ATOM 0 H LYS A 134 6.058 2.362 11.730 1.00 0.00 H new ATOM 0 HA LYS A 134 6.015 0.131 10.035 1.00 0.00 H new ATOM 0 HB2 LYS A 134 7.776 -0.724 11.507 1.00 0.00 H new ATOM 0 HB3 LYS A 134 8.039 0.938 11.014 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.272 1.784 13.170 1.00 0.00 H new ATOM 0 HG3 LYS A 134 6.703 0.199 13.656 1.00 0.00 H new ATOM 0 HD2 LYS A 134 9.629 0.771 13.006 1.00 0.00 H new ATOM 0 HD3 LYS A 134 8.972 0.926 14.623 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.569 -1.395 14.834 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.509 -1.649 13.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.562 -2.486 14.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.887 -1.199 12.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.945 -0.952 14.659 1.00 0.00 H new ATOM 1645 N ASN A 135 4.581 -0.341 12.944 1.00 0.00 N ATOM 1646 CA ASN A 135 3.683 -1.224 13.670 1.00 0.00 C ATOM 1647 C ASN A 135 2.312 -1.219 12.991 1.00 0.00 C ATOM 1648 O ASN A 135 1.719 -2.275 12.775 1.00 0.00 O ATOM 1649 CB ASN A 135 3.499 -0.755 15.114 1.00 0.00 C ATOM 1650 CG ASN A 135 3.881 -1.859 16.102 1.00 0.00 C ATOM 1651 OD1 ASN A 135 4.889 -2.531 15.962 1.00 0.00 O ATOM 1652 ND2 ASN A 135 3.020 -2.008 17.105 1.00 0.00 N ATOM 0 H ASN A 135 4.829 0.516 13.438 1.00 0.00 H new ATOM 0 HA ASN A 135 4.117 -2.224 13.669 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.113 0.128 15.294 1.00 0.00 H new ATOM 0 HB3 ASN A 135 2.462 -0.461 15.275 1.00 0.00 H new ATOM 0 HD21 ASN A 135 3.185 -2.719 17.817 1.00 0.00 H new ATOM 0 HD22 ASN A 135 2.195 -1.411 17.162 1.00 0.00 H new ATOM 1658 N ASN A 136 1.847 -0.019 12.677 1.00 0.00 N ATOM 1659 CA ASN A 136 0.556 0.137 12.027 1.00 0.00 C ATOM 1660 C ASN A 136 0.683 -0.244 10.551 1.00 0.00 C ATOM 1661 O ASN A 136 -0.321 -0.456 9.873 1.00 0.00 O ATOM 1662 CB ASN A 136 0.074 1.587 12.102 1.00 0.00 C ATOM 1663 CG ASN A 136 -1.231 1.691 12.894 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -1.522 0.892 13.769 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -1.999 2.717 12.538 1.00 0.00 N ATOM 0 H ASN A 136 2.341 0.855 12.860 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.159 -0.508 12.538 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.839 2.204 12.572 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -0.075 1.977 11.095 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.892 2.872 13.006 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -1.695 3.348 11.797 1.00 0.00 H new ATOM 1671 N TRP A 137 1.926 -0.318 10.096 1.00 0.00 N ATOM 1672 CA TRP A 137 2.197 -0.670 8.713 1.00 0.00 C ATOM 1673 C TRP A 137 2.091 -2.190 8.582 1.00 0.00 C ATOM 1674 O TRP A 137 1.546 -2.696 7.601 1.00 0.00 O ATOM 1675 CB TRP A 137 3.554 -0.124 8.265 1.00 0.00 C ATOM 1676 CG TRP A 137 3.536 1.359 7.891 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.575 2.260 8.135 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.571 2.083 7.191 1.00 0.00 C ATOM 1679 NE1 TRP A 137 2.912 3.506 7.647 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.165 3.394 7.055 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.809 1.642 6.691 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 4.938 4.374 6.419 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.569 2.633 6.058 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.175 3.958 5.912 1.00 0.00 C ATOM 0 H TRP A 137 2.756 -0.140 10.661 1.00 0.00 H new ATOM 0 HA TRP A 137 1.465 -0.212 8.048 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.278 -0.277 9.065 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.901 -0.700 7.407 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.652 2.039 8.650 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.346 4.353 7.709 1.00 0.00 H new ATOM 0 HE3 TRP A 137 6.147 0.621 6.787 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.598 5.395 6.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.529 2.348 5.655 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.820 4.663 5.410 1.00 0.00 H new ATOM 1694 N MET A 138 2.620 -2.876 9.584 1.00 0.00 N ATOM 1695 CA MET A 138 2.592 -4.330 9.593 1.00 0.00 C ATOM 1696 C MET A 138 1.324 -4.849 10.274 1.00 0.00 C ATOM 1697 O MET A 138 0.773 -5.873 9.871 1.00 0.00 O ATOM 1698 CB MET A 138 3.822 -4.860 10.331 1.00 0.00 C ATOM 1699 CG MET A 138 3.951 -4.217 11.713 1.00 0.00 C ATOM 1700 SD MET A 138 4.016 -5.481 12.971 1.00 0.00 S ATOM 1701 CE MET A 138 2.288 -5.922 13.057 1.00 0.00 C ATOM 0 H MET A 138 3.071 -2.453 10.395 1.00 0.00 H new ATOM 0 HA MET A 138 2.598 -4.682 8.561 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.750 -5.943 10.435 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.718 -4.655 9.745 1.00 0.00 H new ATOM 0 HG2 MET A 138 4.851 -3.604 11.755 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.105 -3.554 11.895 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.138 -6.655 13.850 1.00 0.00 H new ATOM 0 HE2 MET A 138 1.695 -5.032 13.269 1.00 0.00 H new ATOM 0 HE3 MET A 138 1.974 -6.349 12.105 1.00 0.00 H new ATOM 1709 N ALA A 139 0.897 -4.118 11.294 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.295 -4.494 12.034 1.00 0.00 C ATOM 1711 C ALA A 139 -1.502 -4.476 11.093 1.00 0.00 C ATOM 1712 O ALA A 139 -2.300 -5.412 11.082 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.473 -3.551 13.227 1.00 0.00 C ATOM 0 H ALA A 139 1.355 -3.269 11.625 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.199 -5.506 12.428 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.367 -3.832 13.783 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.397 -3.622 13.880 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.576 -2.527 12.869 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.598 -3.400 10.325 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.694 -3.248 9.384 1.00 0.00 C ATOM 1721 C ALA A 140 -2.722 -4.454 8.443 1.00 0.00 C ATOM 1722 O ALA A 140 -3.771 -5.063 8.239 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.541 -1.926 8.631 1.00 0.00 C ATOM 0 H ALA A 140 -0.934 -2.625 10.336 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.649 -3.216 9.909 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -3.364 -1.812 7.925 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.555 -1.099 9.341 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.595 -1.923 8.090 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.556 -4.764 7.893 1.00 0.00 N ATOM 1730 CA LEU A 141 -1.434 -5.886 6.978 1.00 0.00 C ATOM 1731 C LEU A 141 -1.696 -7.188 7.738 1.00 0.00 C ATOM 1732 O LEU A 141 -2.459 -8.036 7.279 1.00 0.00 O ATOM 1733 CB LEU A 141 -0.081 -5.852 6.266 1.00 0.00 C ATOM 1734 CG LEU A 141 -0.126 -5.925 4.738 1.00 0.00 C ATOM 1735 CD1 LEU A 141 0.184 -4.563 4.114 1.00 0.00 C ATOM 1736 CD2 LEU A 141 0.806 -7.021 4.215 1.00 0.00 C ATOM 0 H LEU A 141 -0.688 -4.257 8.064 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.184 -5.819 6.190 1.00 0.00 H new ATOM 0 HB2 LEU A 141 0.435 -4.935 6.551 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.521 -6.683 6.632 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.139 -6.193 4.438 1.00 0.00 H new ATOM 0 HD11 LEU A 141 0.145 -4.643 3.028 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.552 -3.833 4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 141 1.180 -4.241 4.419 1.00 0.00 H new ATOM 0 HD21 LEU A 141 0.756 -7.053 3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 141 1.829 -6.807 4.525 1.00 0.00 H new ATOM 0 HD23 LEU A 141 0.498 -7.985 4.620 1.00 0.00 H new ATOM 1747 N ILE A 142 -1.048 -7.306 8.888 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.201 -8.490 9.715 1.00 0.00 C ATOM 1749 C ILE A 142 -2.663 -8.621 10.145 1.00 0.00 C ATOM 1750 O ILE A 142 -3.119 -9.712 10.485 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.216 -8.457 10.886 1.00 0.00 C ATOM 1752 CG1 ILE A 142 1.212 -8.727 10.408 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -0.644 -9.427 11.990 1.00 0.00 C ATOM 1754 CD1 ILE A 142 1.290 -10.036 9.621 1.00 0.00 C ATOM 0 H ILE A 142 -0.416 -6.601 9.266 1.00 0.00 H new ATOM 0 HA ILE A 142 -0.954 -9.386 9.146 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.228 -7.455 11.315 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.552 -7.902 9.782 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.883 -8.774 11.265 1.00 0.00 H new ATOM 0 HG21 ILE A 142 0.073 -9.384 12.810 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -1.632 -9.148 12.357 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -0.678 -10.441 11.591 1.00 0.00 H new ATOM 0 HD11 ILE A 142 2.316 -10.203 9.293 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.973 -10.862 10.257 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.636 -9.977 8.751 1.00 0.00 H new ATOM 1765 N SER A 143 -3.358 -7.493 10.118 1.00 0.00 N ATOM 1766 CA SER A 143 -4.759 -7.468 10.500 1.00 0.00 C ATOM 1767 C SER A 143 -5.601 -8.204 9.456 1.00 0.00 C ATOM 1768 O SER A 143 -6.549 -8.907 9.801 1.00 0.00 O ATOM 1769 CB SER A 143 -5.258 -6.031 10.668 1.00 0.00 C ATOM 1770 OG SER A 143 -6.463 -5.970 11.427 1.00 0.00 O ATOM 0 H SER A 143 -2.976 -6.590 9.837 1.00 0.00 H new ATOM 0 HA SER A 143 -4.860 -7.974 11.460 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.489 -5.435 11.160 1.00 0.00 H new ATOM 0 HB3 SER A 143 -5.425 -5.588 9.686 1.00 0.00 H new ATOM 0 HG SER A 143 -6.748 -5.036 11.513 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.223 -8.016 8.199 1.00 0.00 N ATOM 1776 CA LEU A 144 -5.931 -8.654 7.103 1.00 0.00 C ATOM 1777 C LEU A 144 -5.684 -10.163 7.150 1.00 0.00 C ATOM 1778 O LEU A 144 -6.619 -10.944 7.329 1.00 0.00 O ATOM 1779 CB LEU A 144 -5.545 -8.011 5.769 1.00 0.00 C ATOM 1780 CG LEU A 144 -5.949 -6.545 5.590 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -5.521 -6.022 4.218 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -7.447 -6.356 5.835 1.00 0.00 C ATOM 0 H LEU A 144 -4.436 -7.431 7.916 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.006 -8.503 7.206 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.464 -8.087 5.651 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -5.995 -8.592 4.964 1.00 0.00 H new ATOM 0 HG LEU A 144 -5.423 -5.951 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -5.820 -4.979 4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -4.438 -6.100 4.120 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -5.999 -6.614 3.438 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.708 -5.306 5.702 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.011 -6.963 5.127 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.691 -6.664 6.852 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.421 -10.530 6.988 1.00 0.00 N ATOM 1794 CA GLN A 145 -4.040 -11.931 7.011 1.00 0.00 C ATOM 1795 C GLN A 145 -4.683 -12.638 8.206 1.00 0.00 C ATOM 1796 O GLN A 145 -4.851 -13.857 8.195 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.518 -12.086 7.037 1.00 0.00 C ATOM 1798 CG GLN A 145 -2.117 -13.562 7.045 1.00 0.00 C ATOM 1799 CD GLN A 145 -2.889 -14.347 5.984 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -2.737 -14.144 4.791 1.00 0.00 O ATOM 1801 NE2 GLN A 145 -3.727 -15.252 6.482 1.00 0.00 N ATOM 0 H GLN A 145 -3.649 -9.880 6.840 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.405 -12.400 6.097 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -2.084 -11.592 6.168 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.114 -11.591 7.920 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -1.046 -13.652 6.862 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -2.309 -13.989 8.029 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -3.807 -15.372 7.492 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -4.290 -15.826 5.854 1.00 0.00 H new ATOM 1808 N TYR A 146 -5.027 -11.842 9.208 1.00 0.00 N ATOM 1809 CA TYR A 146 -5.648 -12.375 10.407 1.00 0.00 C ATOM 1810 C TYR A 146 -7.153 -12.571 10.206 1.00 0.00 C ATOM 1811 O TYR A 146 -7.718 -13.566 10.659 1.00 0.00 O ATOM 1812 CB TYR A 146 -5.425 -11.328 11.500 1.00 0.00 C ATOM 1813 CG TYR A 146 -4.328 -11.696 12.501 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -3.217 -12.397 12.079 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.449 -11.326 13.825 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -2.184 -12.745 13.022 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -3.417 -11.673 14.767 1.00 0.00 C ATOM 1818 CZ TYR A 146 -2.335 -12.365 14.319 1.00 0.00 C ATOM 1819 OH TYR A 146 -1.360 -12.693 15.209 1.00 0.00 O ATOM 0 H TYR A 146 -4.887 -10.832 9.213 1.00 0.00 H new ATOM 0 HA TYR A 146 -5.218 -13.344 10.662 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.171 -10.377 11.031 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -6.360 -11.177 12.040 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -3.121 -12.685 11.042 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -5.318 -10.776 14.155 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -1.310 -13.295 12.706 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -3.500 -11.390 15.806 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.601 -12.356 16.097 1.00 0.00 H new ATOM 1828 N ARG A 147 -7.756 -11.607 9.526 1.00 0.00 N ATOM 1829 CA ARG A 147 -9.183 -11.662 9.259 1.00 0.00 C ATOM 1830 C ARG A 147 -9.474 -12.644 8.123 1.00 0.00 C ATOM 1831 O ARG A 147 -10.154 -12.299 7.157 1.00 0.00 O ATOM 1832 CB ARG A 147 -9.726 -10.282 8.882 1.00 0.00 C ATOM 1833 CG ARG A 147 -11.112 -10.054 9.486 1.00 0.00 C ATOM 1834 CD ARG A 147 -11.767 -8.800 8.901 1.00 0.00 C ATOM 1835 NE ARG A 147 -11.608 -7.663 9.835 1.00 0.00 N ATOM 1836 CZ ARG A 147 -12.135 -7.626 11.066 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -12.854 -8.661 11.520 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -11.940 -6.553 11.846 1.00 0.00 N ATOM 0 H ARG A 147 -7.283 -10.784 9.152 1.00 0.00 H new ATOM 0 HA ARG A 147 -9.678 -11.999 10.170 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.041 -9.510 9.233 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -9.779 -10.192 7.797 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.743 -10.922 9.294 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -11.029 -9.954 10.568 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -11.314 -8.558 7.940 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -12.825 -8.985 8.717 1.00 0.00 H new ATOM 0 HE ARG A 147 -11.064 -6.859 9.522 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -13.001 -9.479 10.928 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -13.255 -8.631 12.458 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.391 -5.765 11.502 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.341 -6.524 12.783 1.00 0.00 H new ATOM 1849 N SER A 148 -8.944 -13.849 8.276 1.00 0.00 N ATOM 1850 CA SER A 148 -9.138 -14.885 7.275 1.00 0.00 C ATOM 1851 C SER A 148 -9.212 -16.256 7.948 1.00 0.00 C ATOM 1852 O SER A 148 -8.774 -17.255 7.379 1.00 0.00 O ATOM 1853 CB SER A 148 -8.015 -14.862 6.236 1.00 0.00 C ATOM 1854 OG SER A 148 -8.517 -14.958 4.905 1.00 0.00 O ATOM 0 H SER A 148 -8.380 -14.131 9.078 1.00 0.00 H new ATOM 0 HA SER A 148 -10.078 -14.691 6.759 1.00 0.00 H new ATOM 0 HB2 SER A 148 -7.442 -13.941 6.342 1.00 0.00 H new ATOM 0 HB3 SER A 148 -7.329 -15.688 6.425 1.00 0.00 H new ATOM 0 HG SER A 148 -8.142 -14.234 4.361 1.00 0.00 H new ATOM 1859 N THR A 149 -9.768 -16.261 9.150 1.00 0.00 N ATOM 1860 CA THR A 149 -9.905 -17.494 9.907 1.00 0.00 C ATOM 1861 C THR A 149 -10.587 -17.222 11.250 1.00 0.00 C ATOM 1862 O THR A 149 -11.372 -18.040 11.727 1.00 0.00 O ATOM 1863 CB THR A 149 -8.516 -18.120 10.047 1.00 0.00 C ATOM 1864 OG1 THR A 149 -8.651 -19.403 9.442 1.00 0.00 O ATOM 1865 CG2 THR A 149 -8.157 -18.429 11.501 1.00 0.00 C ATOM 0 H THR A 149 -10.129 -15.430 9.619 1.00 0.00 H new ATOM 0 HA THR A 149 -10.548 -18.206 9.390 1.00 0.00 H new ATOM 0 HB THR A 149 -7.770 -17.447 9.625 1.00 0.00 H new ATOM 0 HG1 THR A 149 -8.757 -19.298 8.473 1.00 0.00 H new ATOM 0 HG21 THR A 149 -7.162 -18.872 11.544 1.00 0.00 H new ATOM 0 HG22 THR A 149 -8.170 -17.507 12.083 1.00 0.00 H new ATOM 0 HG23 THR A 149 -8.883 -19.129 11.914 1.00 0.00 H new ATOM 1873 N LEU A 150 -10.262 -16.072 11.820 1.00 0.00 N ATOM 1874 CA LEU A 150 -10.833 -15.682 13.099 1.00 0.00 C ATOM 1875 C LEU A 150 -12.204 -15.044 12.866 1.00 0.00 C ATOM 1876 O LEU A 150 -12.837 -15.280 11.838 1.00 0.00 O ATOM 1877 CB LEU A 150 -9.862 -14.788 13.870 1.00 0.00 C ATOM 1878 CG LEU A 150 -9.759 -13.338 13.391 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -10.420 -12.384 14.386 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -8.305 -12.955 13.109 1.00 0.00 C ATOM 0 H LEU A 150 -9.610 -15.397 11.420 1.00 0.00 H new ATOM 0 HA LEU A 150 -10.990 -16.558 13.729 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -10.159 -14.783 14.919 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -8.870 -15.237 13.822 1.00 0.00 H new ATOM 0 HG LEU A 150 -10.303 -13.250 12.450 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -10.333 -11.360 14.022 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -11.473 -12.642 14.493 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -9.926 -12.468 15.354 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -8.261 -11.920 12.770 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.717 -13.064 14.020 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -7.900 -13.608 12.335 1.00 0.00 H new