USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1070 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 109 MET CE :methyl 168:sc= -0.0257 (180deg=-0.0896) USER MOD Set 1.2: A 110 LYS NZ :NH3+ 146:sc= -0.0271 (180deg=0) USER MOD Set 2.1: A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 57 THR OG1 : rot 170:sc= 0 USER MOD Single : A 1 SER N :NH3+ -106:sc= 0.106 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -1.85 K(o=-1.9,f=-0.89) USER MOD Single : A 9 SER OG : rot 180:sc= -0.0886 USER MOD Single : A 10 ASN : amide:sc= -2.25! C(o=-2.3!,f=-4.5!) USER MOD Single : A 11 ASN : amide:sc= -3.55! C(o=-3.5!,f=-9!) USER MOD Single : A 16 MET CE :methyl -133:sc= -15.9! (180deg=-25.2!) USER MOD Single : A 18 GLN : amide:sc= -1.57 K(o=-1.6,f=-3!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 43:sc= 0.48 USER MOD Single : A 28 SER OG : rot 180:sc= -0.411 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot -162:sc= -1.02 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.563 X(o=-0.56,f=-0.43) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.0071 X(o=-0.0071,f=-0.2) USER MOD Single : A 69 HIS : no HD1:sc= -5.58! C(o=-5.6!,f=-6.9!) USER MOD Single : A 70 HIS : no HD1:sc=-0.00145 X(o=-0.0015,f=-0.0067) USER MOD Single : A 72 ASN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -114:sc= -9.57! (180deg=-18.4!) USER MOD Single : A 79 LYS NZ :NH3+ 151:sc= -1.18 (180deg=-2.13!) USER MOD Single : A 80 HIS : no HE2:sc= -2.44! C(o=-2.4!,f=-8.4!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -2.08 K(o=-2.1,f=-0.78) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 HIS : no HD1:sc= -4.57! C(o=-4.6!,f=-4.5!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.672 K(o=-0.67,f=-7.5!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot -160:sc= -0.0344 USER MOD Single : A 116 MET CE :methyl -111:sc= -2.9 (180deg=-4.45!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -150:sc= -0.656 (180deg=-1.28) USER MOD Single : A 123 HIS : no HD1:sc= -13! C(o=-13!,f=-7.8!) USER MOD Single : A 124 LYS NZ :NH3+ 144:sc= 0.143 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -1.67 K(o=-1.7,f=-0.28) USER MOD Single : A 130 ASN : amide:sc= -0.368 K(o=-0.37,f=-4.4!) USER MOD Single : A 131 MET CE :methyl 149:sc= -0.0702 (180deg=-0.302) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.370 -12.399 -15.636 1.00 0.00 N ATOM 2 CA SER A 1 -9.715 -11.199 -15.143 1.00 0.00 C ATOM 3 C SER A 1 -8.934 -11.516 -13.867 1.00 0.00 C ATOM 4 O SER A 1 -9.208 -12.510 -13.197 1.00 0.00 O ATOM 5 CB SER A 1 -10.731 -10.086 -14.882 1.00 0.00 C ATOM 6 OG SER A 1 -11.164 -9.463 -16.088 1.00 0.00 O ATOM 0 H1 SER A 1 -9.867 -12.748 -16.477 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.357 -13.130 -14.897 1.00 0.00 H new ATOM 0 H3 SER A 1 -11.355 -12.178 -15.888 1.00 0.00 H new ATOM 0 HA SER A 1 -9.021 -10.849 -15.907 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.593 -10.498 -14.357 1.00 0.00 H new ATOM 0 HB3 SER A 1 -10.287 -9.337 -14.226 1.00 0.00 H new ATOM 0 HG SER A 1 -11.813 -8.759 -15.878 1.00 0.00 H new ATOM 12 N PRO A 2 -7.951 -10.627 -13.559 1.00 0.00 N ATOM 13 CA PRO A 2 -7.128 -10.802 -12.374 1.00 0.00 C ATOM 14 C PRO A 2 -7.903 -10.433 -11.109 1.00 0.00 C ATOM 15 O PRO A 2 -9.125 -10.284 -11.146 1.00 0.00 O ATOM 16 CB PRO A 2 -5.913 -9.917 -12.605 1.00 0.00 C ATOM 17 CG PRO A 2 -6.317 -8.930 -13.688 1.00 0.00 C ATOM 18 CD PRO A 2 -7.597 -9.438 -14.328 1.00 0.00 C ATOM 0 HA PRO A 2 -6.827 -11.838 -12.221 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.628 -9.398 -11.690 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.052 -10.509 -12.917 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.471 -7.938 -13.262 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.528 -8.838 -14.434 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.387 -8.688 -14.283 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.445 -9.678 -15.380 1.00 0.00 H new ATOM 26 N GLU A 3 -7.163 -10.298 -10.018 1.00 0.00 N ATOM 27 CA GLU A 3 -7.767 -9.949 -8.743 1.00 0.00 C ATOM 28 C GLU A 3 -8.565 -8.649 -8.870 1.00 0.00 C ATOM 29 O GLU A 3 -9.505 -8.417 -8.113 1.00 0.00 O ATOM 30 CB GLU A 3 -6.706 -9.836 -7.646 1.00 0.00 C ATOM 31 CG GLU A 3 -6.576 -11.150 -6.873 1.00 0.00 C ATOM 32 CD GLU A 3 -7.630 -11.243 -5.768 1.00 0.00 C ATOM 33 OE1 GLU A 3 -8.819 -11.378 -6.129 1.00 0.00 O ATOM 34 OE2 GLU A 3 -7.222 -11.176 -4.588 1.00 0.00 O ATOM 0 H GLU A 3 -6.151 -10.424 -9.991 1.00 0.00 H new ATOM 0 HA GLU A 3 -8.453 -10.747 -8.459 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.745 -9.574 -8.090 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.971 -9.031 -6.960 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -6.686 -11.991 -7.557 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.580 -11.223 -6.437 1.00 0.00 H new ATOM 41 N ILE A 4 -8.159 -7.836 -9.834 1.00 0.00 N ATOM 42 CA ILE A 4 -8.824 -6.566 -10.071 1.00 0.00 C ATOM 43 C ILE A 4 -10.333 -6.795 -10.171 1.00 0.00 C ATOM 44 O ILE A 4 -11.122 -5.979 -9.698 1.00 0.00 O ATOM 45 CB ILE A 4 -8.226 -5.867 -11.293 1.00 0.00 C ATOM 46 CG1 ILE A 4 -6.698 -5.960 -11.285 1.00 0.00 C ATOM 47 CG2 ILE A 4 -8.712 -4.420 -11.391 1.00 0.00 C ATOM 48 CD1 ILE A 4 -6.137 -5.616 -9.903 1.00 0.00 C ATOM 0 H ILE A 4 -7.378 -8.032 -10.460 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.659 -5.889 -9.233 1.00 0.00 H new ATOM 0 HB ILE A 4 -8.575 -6.384 -12.187 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.389 -6.967 -11.567 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -6.284 -5.280 -12.029 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -8.271 -3.947 -12.269 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -9.798 -4.406 -11.478 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.413 -3.874 -10.496 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.050 -5.689 -9.923 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -6.427 -4.600 -9.635 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.534 -6.313 -9.165 1.00 0.00 H new ATOM 60 N MET A 5 -10.689 -7.911 -10.792 1.00 0.00 N ATOM 61 CA MET A 5 -12.090 -8.257 -10.960 1.00 0.00 C ATOM 62 C MET A 5 -12.748 -8.553 -9.611 1.00 0.00 C ATOM 63 O MET A 5 -13.972 -8.512 -9.491 1.00 0.00 O ATOM 64 CB MET A 5 -12.206 -9.487 -11.865 1.00 0.00 C ATOM 65 CG MET A 5 -13.537 -9.491 -12.617 1.00 0.00 C ATOM 66 SD MET A 5 -14.675 -10.625 -11.842 1.00 0.00 S ATOM 67 CE MET A 5 -15.224 -11.542 -13.273 1.00 0.00 C ATOM 0 H MET A 5 -10.032 -8.586 -11.184 1.00 0.00 H new ATOM 0 HA MET A 5 -12.603 -7.409 -11.414 1.00 0.00 H new ATOM 0 HB2 MET A 5 -11.382 -9.497 -12.578 1.00 0.00 H new ATOM 0 HB3 MET A 5 -12.120 -10.393 -11.265 1.00 0.00 H new ATOM 0 HG2 MET A 5 -13.961 -8.487 -12.626 1.00 0.00 H new ATOM 0 HG3 MET A 5 -13.376 -9.778 -13.656 1.00 0.00 H new ATOM 0 HE1 MET A 5 -15.946 -12.299 -12.965 1.00 0.00 H new ATOM 0 HE2 MET A 5 -15.693 -10.861 -13.984 1.00 0.00 H new ATOM 0 HE3 MET A 5 -14.369 -12.026 -13.745 1.00 0.00 H new ATOM 77 N LYS A 6 -11.908 -8.843 -8.630 1.00 0.00 N ATOM 78 CA LYS A 6 -12.393 -9.145 -7.294 1.00 0.00 C ATOM 79 C LYS A 6 -11.993 -8.014 -6.343 1.00 0.00 C ATOM 80 O LYS A 6 -10.831 -7.906 -5.954 1.00 0.00 O ATOM 81 CB LYS A 6 -11.907 -10.525 -6.845 1.00 0.00 C ATOM 82 CG LYS A 6 -12.712 -11.026 -5.645 1.00 0.00 C ATOM 83 CD LYS A 6 -11.955 -12.126 -4.898 1.00 0.00 C ATOM 84 CE LYS A 6 -12.838 -13.359 -4.693 1.00 0.00 C ATOM 85 NZ LYS A 6 -12.206 -14.296 -3.738 1.00 0.00 N ATOM 0 H LYS A 6 -10.894 -8.875 -8.733 1.00 0.00 H new ATOM 0 HA LYS A 6 -13.482 -9.199 -7.288 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.998 -11.232 -7.669 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.850 -10.475 -6.583 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -12.917 -10.197 -4.968 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -13.676 -11.408 -5.983 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.062 -12.403 -5.459 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -11.620 -11.750 -3.931 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -13.816 -13.055 -4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.002 -13.859 -5.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -12.818 -15.127 -3.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.283 -14.600 -4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.072 -13.821 -2.823 1.00 0.00 H new ATOM 99 N ASN A 7 -12.979 -7.198 -5.999 1.00 0.00 N ATOM 100 CA ASN A 7 -12.744 -6.080 -5.102 1.00 0.00 C ATOM 101 C ASN A 7 -13.627 -6.232 -3.860 1.00 0.00 C ATOM 102 O ASN A 7 -14.792 -6.609 -3.966 1.00 0.00 O ATOM 103 CB ASN A 7 -13.099 -4.752 -5.773 1.00 0.00 C ATOM 104 CG ASN A 7 -14.614 -4.530 -5.785 1.00 0.00 C ATOM 105 OD1 ASN A 7 -15.343 -5.089 -6.588 1.00 0.00 O ATOM 106 ND2 ASN A 7 -15.044 -3.687 -4.850 1.00 0.00 N ATOM 0 H ASN A 7 -13.941 -7.289 -6.325 1.00 0.00 H new ATOM 0 HA ASN A 7 -11.687 -6.079 -4.835 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.612 -3.932 -5.245 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.719 -4.744 -6.794 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -16.039 -3.474 -4.774 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.379 -3.254 -4.209 1.00 0.00 H new ATOM 113 N LEU A 8 -13.036 -5.933 -2.713 1.00 0.00 N ATOM 114 CA LEU A 8 -13.752 -6.033 -1.453 1.00 0.00 C ATOM 115 C LEU A 8 -14.792 -4.914 -1.374 1.00 0.00 C ATOM 116 O LEU A 8 -15.053 -4.232 -2.365 1.00 0.00 O ATOM 117 CB LEU A 8 -12.772 -6.046 -0.278 1.00 0.00 C ATOM 118 CG LEU A 8 -11.595 -5.074 -0.376 1.00 0.00 C ATOM 119 CD1 LEU A 8 -11.312 -4.421 0.978 1.00 0.00 C ATOM 120 CD2 LEU A 8 -10.358 -5.767 -0.949 1.00 0.00 C ATOM 0 H LEU A 8 -12.068 -5.621 -2.630 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.293 -6.978 -1.396 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -13.326 -5.824 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.376 -7.056 -0.172 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.865 -4.277 -1.068 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.471 -3.734 0.882 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.193 -3.871 1.308 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -11.070 -5.191 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -9.536 -5.054 -1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -10.073 -6.596 -0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -10.582 -6.146 -1.946 1.00 0.00 H new ATOM 132 N SER A 9 -15.359 -4.759 -0.187 1.00 0.00 N ATOM 133 CA SER A 9 -16.365 -3.734 0.035 1.00 0.00 C ATOM 134 C SER A 9 -15.867 -2.388 -0.494 1.00 0.00 C ATOM 135 O SER A 9 -15.907 -2.137 -1.698 1.00 0.00 O ATOM 136 CB SER A 9 -16.720 -3.623 1.520 1.00 0.00 C ATOM 137 OG SER A 9 -17.615 -2.544 1.775 1.00 0.00 O ATOM 0 H SER A 9 -15.141 -5.326 0.632 1.00 0.00 H new ATOM 0 HA SER A 9 -17.267 -4.018 -0.506 1.00 0.00 H new ATOM 0 HB2 SER A 9 -17.172 -4.556 1.856 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.809 -3.483 2.101 1.00 0.00 H new ATOM 0 HG SER A 9 -17.819 -2.507 2.733 1.00 0.00 H new ATOM 143 N ASN A 10 -15.410 -1.558 0.431 1.00 0.00 N ATOM 144 CA ASN A 10 -14.903 -0.244 0.073 1.00 0.00 C ATOM 145 C ASN A 10 -13.477 -0.088 0.607 1.00 0.00 C ATOM 146 O ASN A 10 -12.651 0.585 -0.007 1.00 0.00 O ATOM 147 CB ASN A 10 -15.762 0.863 0.687 1.00 0.00 C ATOM 148 CG ASN A 10 -16.800 1.372 -0.317 1.00 0.00 C ATOM 149 OD1 ASN A 10 -16.709 1.144 -1.512 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.787 2.070 0.236 1.00 0.00 N ATOM 0 H ASN A 10 -15.380 -1.770 1.428 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.926 -0.158 -1.013 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.266 0.486 1.577 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.125 1.688 1.007 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.531 2.453 -0.348 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.801 2.223 1.244 1.00 0.00 H new ATOM 157 N ASN A 11 -13.235 -0.721 1.745 1.00 0.00 N ATOM 158 CA ASN A 11 -11.923 -0.660 2.369 1.00 0.00 C ATOM 159 C ASN A 11 -10.860 -0.442 1.291 1.00 0.00 C ATOM 160 O ASN A 11 -9.913 0.318 1.492 1.00 0.00 O ATOM 161 CB ASN A 11 -11.598 -1.967 3.096 1.00 0.00 C ATOM 162 CG ASN A 11 -12.877 -2.716 3.474 1.00 0.00 C ATOM 163 OD1 ASN A 11 -13.947 -2.145 3.603 1.00 0.00 O ATOM 164 ND2 ASN A 11 -12.707 -4.024 3.645 1.00 0.00 N ATOM 0 H ASN A 11 -13.923 -1.278 2.251 1.00 0.00 H new ATOM 0 HA ASN A 11 -11.928 0.160 3.087 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -10.978 -2.597 2.459 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -11.018 -1.753 3.994 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -13.500 -4.612 3.900 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -11.783 -4.439 3.521 1.00 0.00 H new ATOM 171 N PHE A 12 -11.051 -1.121 0.170 1.00 0.00 N ATOM 172 CA PHE A 12 -10.120 -1.010 -0.940 1.00 0.00 C ATOM 173 C PHE A 12 -10.736 -0.220 -2.096 1.00 0.00 C ATOM 174 O PHE A 12 -10.252 0.855 -2.444 1.00 0.00 O ATOM 175 CB PHE A 12 -9.820 -2.434 -1.415 1.00 0.00 C ATOM 176 CG PHE A 12 -8.331 -2.789 -1.414 1.00 0.00 C ATOM 177 CD1 PHE A 12 -7.674 -2.962 -0.236 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.665 -2.932 -2.592 1.00 0.00 C ATOM 179 CE1 PHE A 12 -6.293 -3.291 -0.235 1.00 0.00 C ATOM 180 CE2 PHE A 12 -6.285 -3.261 -2.591 1.00 0.00 C ATOM 181 CZ PHE A 12 -5.626 -3.434 -1.412 1.00 0.00 C ATOM 0 H PHE A 12 -11.837 -1.750 0.006 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.218 -0.489 -0.619 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -10.352 -3.139 -0.776 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.213 -2.560 -2.424 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -8.203 -2.849 0.699 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.187 -2.795 -3.528 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.772 -3.428 0.701 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -5.757 -3.374 -3.526 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.575 -3.684 -1.411 1.00 0.00 H new ATOM 191 N GLY A 13 -11.795 -0.783 -2.660 1.00 0.00 N ATOM 192 CA GLY A 13 -12.482 -0.146 -3.768 1.00 0.00 C ATOM 193 C GLY A 13 -12.655 1.355 -3.515 1.00 0.00 C ATOM 194 O GLY A 13 -12.544 2.160 -4.438 1.00 0.00 O ATOM 0 H GLY A 13 -12.194 -1.675 -2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.918 -0.301 -4.688 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.458 -0.610 -3.910 1.00 0.00 H new ATOM 198 N LYS A 14 -12.926 1.682 -2.262 1.00 0.00 N ATOM 199 CA LYS A 14 -13.115 3.071 -1.875 1.00 0.00 C ATOM 200 C LYS A 14 -11.758 3.776 -1.840 1.00 0.00 C ATOM 201 O LYS A 14 -11.581 4.820 -2.466 1.00 0.00 O ATOM 202 CB LYS A 14 -13.889 3.160 -0.558 1.00 0.00 C ATOM 203 CG LYS A 14 -14.113 4.618 -0.151 1.00 0.00 C ATOM 204 CD LYS A 14 -13.055 5.074 0.855 1.00 0.00 C ATOM 205 CE LYS A 14 -13.572 4.948 2.289 1.00 0.00 C ATOM 206 NZ LYS A 14 -13.052 6.052 3.127 1.00 0.00 N ATOM 0 H LYS A 14 -13.020 1.010 -1.500 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.726 3.592 -2.612 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.850 2.656 -0.662 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.340 2.640 0.227 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.079 5.255 -1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.106 4.730 0.284 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.153 4.474 0.736 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.779 6.109 0.654 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.662 4.964 2.292 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.266 3.990 2.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -13.413 5.951 4.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.013 6.019 3.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.365 6.963 2.734 1.00 0.00 H new ATOM 220 N ALA A 15 -10.836 3.177 -1.100 1.00 0.00 N ATOM 221 CA ALA A 15 -9.500 3.736 -0.974 1.00 0.00 C ATOM 222 C ALA A 15 -8.887 3.898 -2.367 1.00 0.00 C ATOM 223 O ALA A 15 -8.175 4.867 -2.627 1.00 0.00 O ATOM 224 CB ALA A 15 -8.655 2.840 -0.066 1.00 0.00 C ATOM 0 H ALA A 15 -10.987 2.311 -0.582 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.539 4.723 -0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.653 3.259 0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.118 2.780 0.919 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.591 1.841 -0.498 1.00 0.00 H new ATOM 230 N MET A 16 -9.186 2.935 -3.226 1.00 0.00 N ATOM 231 CA MET A 16 -8.674 2.958 -4.585 1.00 0.00 C ATOM 232 C MET A 16 -9.319 4.084 -5.396 1.00 0.00 C ATOM 233 O MET A 16 -8.628 4.845 -6.071 1.00 0.00 O ATOM 234 CB MET A 16 -8.956 1.616 -5.261 1.00 0.00 C ATOM 235 CG MET A 16 -7.670 1.002 -5.821 1.00 0.00 C ATOM 236 SD MET A 16 -7.449 -0.646 -5.175 1.00 0.00 S ATOM 237 CE MET A 16 -7.733 -0.341 -3.440 1.00 0.00 C ATOM 0 H MET A 16 -9.777 2.133 -3.007 1.00 0.00 H new ATOM 0 HA MET A 16 -7.599 3.135 -4.544 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.407 0.931 -4.543 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.677 1.755 -6.066 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.716 0.972 -6.910 1.00 0.00 H new ATOM 0 HG3 MET A 16 -6.815 1.623 -5.555 1.00 0.00 H new ATOM 0 HE1 MET A 16 -6.950 -0.822 -2.853 1.00 0.00 H new ATOM 0 HE2 MET A 16 -7.720 0.733 -3.252 1.00 0.00 H new ATOM 0 HE3 MET A 16 -8.703 -0.748 -3.153 1.00 0.00 H new ATOM 247 N ASP A 17 -10.640 4.155 -5.302 1.00 0.00 N ATOM 248 CA ASP A 17 -11.388 5.174 -6.018 1.00 0.00 C ATOM 249 C ASP A 17 -11.041 6.551 -5.445 1.00 0.00 C ATOM 250 O ASP A 17 -10.863 7.511 -6.194 1.00 0.00 O ATOM 251 CB ASP A 17 -12.895 4.963 -5.861 1.00 0.00 C ATOM 252 CG ASP A 17 -13.768 6.058 -6.478 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.478 6.432 -7.635 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.706 6.496 -5.778 1.00 0.00 O ATOM 0 H ASP A 17 -11.211 3.523 -4.741 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.123 5.109 -7.073 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.162 4.008 -6.313 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.128 4.889 -4.799 1.00 0.00 H new ATOM 259 N GLN A 18 -10.956 6.602 -4.124 1.00 0.00 N ATOM 260 CA GLN A 18 -10.636 7.845 -3.443 1.00 0.00 C ATOM 261 C GLN A 18 -9.183 8.242 -3.721 1.00 0.00 C ATOM 262 O GLN A 18 -8.889 9.415 -3.944 1.00 0.00 O ATOM 263 CB GLN A 18 -10.894 7.729 -1.940 1.00 0.00 C ATOM 264 CG GLN A 18 -12.294 8.235 -1.584 1.00 0.00 C ATOM 265 CD GLN A 18 -12.438 8.436 -0.075 1.00 0.00 C ATOM 266 OE1 GLN A 18 -11.469 8.506 0.663 1.00 0.00 O ATOM 267 NE2 GLN A 18 -13.698 8.525 0.342 1.00 0.00 N ATOM 0 H GLN A 18 -11.103 5.803 -3.507 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.288 8.628 -3.830 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.789 6.690 -1.628 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.146 8.303 -1.393 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.486 9.176 -2.100 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.041 7.522 -1.932 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.463 8.458 -0.329 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -13.899 8.660 1.333 1.00 0.00 H new ATOM 276 N CYS A 19 -8.316 7.241 -3.697 1.00 0.00 N ATOM 277 CA CYS A 19 -6.902 7.471 -3.943 1.00 0.00 C ATOM 278 C CYS A 19 -6.744 8.025 -5.361 1.00 0.00 C ATOM 279 O CYS A 19 -5.897 8.882 -5.606 1.00 0.00 O ATOM 280 CB CYS A 19 -6.076 6.201 -3.732 1.00 0.00 C ATOM 281 SG CYS A 19 -5.604 5.873 -1.994 1.00 0.00 S ATOM 0 H CYS A 19 -8.565 6.269 -3.511 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.520 8.197 -3.225 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.643 5.349 -4.107 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.169 6.270 -4.333 1.00 0.00 H new ATOM 286 N LYS A 20 -7.574 7.511 -6.257 1.00 0.00 N ATOM 287 CA LYS A 20 -7.538 7.942 -7.644 1.00 0.00 C ATOM 288 C LYS A 20 -8.001 9.397 -7.734 1.00 0.00 C ATOM 289 O LYS A 20 -7.948 10.005 -8.801 1.00 0.00 O ATOM 290 CB LYS A 20 -8.342 6.984 -8.524 1.00 0.00 C ATOM 291 CG LYS A 20 -7.595 6.672 -9.822 1.00 0.00 C ATOM 292 CD LYS A 20 -8.502 5.943 -10.816 1.00 0.00 C ATOM 293 CE LYS A 20 -8.521 6.658 -12.168 1.00 0.00 C ATOM 294 NZ LYS A 20 -9.498 7.770 -12.152 1.00 0.00 N ATOM 0 H LYS A 20 -8.275 6.800 -6.049 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.518 7.908 -8.027 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.534 6.059 -7.980 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.312 7.425 -8.756 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.231 7.598 -10.268 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.721 6.058 -9.604 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.154 4.918 -10.947 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.514 5.887 -10.416 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.527 7.042 -12.397 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.779 5.951 -12.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.499 8.245 -13.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.448 7.395 -11.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.235 8.453 -11.413 1.00 0.00 H new ATOM 308 N ASP A 21 -8.445 9.914 -6.597 1.00 0.00 N ATOM 309 CA ASP A 21 -8.918 11.287 -6.534 1.00 0.00 C ATOM 310 C ASP A 21 -7.952 12.115 -5.684 1.00 0.00 C ATOM 311 O ASP A 21 -7.247 12.979 -6.204 1.00 0.00 O ATOM 312 CB ASP A 21 -10.303 11.363 -5.886 1.00 0.00 C ATOM 313 CG ASP A 21 -11.428 11.813 -6.818 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.540 11.210 -7.907 1.00 0.00 O ATOM 315 OD2 ASP A 21 -12.153 12.751 -6.421 1.00 0.00 O ATOM 0 H ASP A 21 -8.487 9.407 -5.713 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.975 11.672 -7.552 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.554 10.381 -5.485 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.255 12.050 -5.041 1.00 0.00 H new ATOM 320 N GLU A 22 -7.952 11.824 -4.392 1.00 0.00 N ATOM 321 CA GLU A 22 -7.085 12.532 -3.465 1.00 0.00 C ATOM 322 C GLU A 22 -5.667 12.625 -4.032 1.00 0.00 C ATOM 323 O GLU A 22 -5.034 13.678 -3.963 1.00 0.00 O ATOM 324 CB GLU A 22 -7.084 11.857 -2.091 1.00 0.00 C ATOM 325 CG GLU A 22 -6.950 10.339 -2.227 1.00 0.00 C ATOM 326 CD GLU A 22 -8.098 9.623 -1.510 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.166 10.259 -1.372 1.00 0.00 O ATOM 328 OE2 GLU A 22 -7.882 8.456 -1.119 1.00 0.00 O ATOM 0 H GLU A 22 -8.539 11.107 -3.965 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.471 13.543 -3.336 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.261 12.246 -1.491 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.006 12.099 -1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.946 10.063 -3.282 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -5.997 10.015 -1.809 1.00 0.00 H new ATOM 335 N LEU A 23 -5.209 11.510 -4.580 1.00 0.00 N ATOM 336 CA LEU A 23 -3.877 11.452 -5.158 1.00 0.00 C ATOM 337 C LEU A 23 -3.976 11.616 -6.676 1.00 0.00 C ATOM 338 O LEU A 23 -2.967 11.816 -7.351 1.00 0.00 O ATOM 339 CB LEU A 23 -3.159 10.173 -4.724 1.00 0.00 C ATOM 340 CG LEU A 23 -3.485 9.665 -3.318 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.287 8.151 -3.223 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.673 10.416 -2.261 1.00 0.00 C ATOM 0 H LEU A 23 -5.737 10.639 -4.636 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.266 12.275 -4.787 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.399 9.385 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.084 10.344 -4.787 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.537 9.866 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.525 7.816 -2.214 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.944 7.653 -3.936 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.250 7.905 -3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.924 10.035 -1.271 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.609 10.269 -2.447 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.906 11.480 -2.311 1.00 0.00 H new ATOM 354 N SER A 24 -5.203 11.526 -7.169 1.00 0.00 N ATOM 355 CA SER A 24 -5.448 11.662 -8.596 1.00 0.00 C ATOM 356 C SER A 24 -4.542 10.707 -9.376 1.00 0.00 C ATOM 357 O SER A 24 -4.363 10.864 -10.583 1.00 0.00 O ATOM 358 CB SER A 24 -5.224 13.103 -9.058 1.00 0.00 C ATOM 359 OG SER A 24 -6.395 13.901 -8.901 1.00 0.00 O ATOM 0 H SER A 24 -6.038 11.361 -6.607 1.00 0.00 H new ATOM 0 HA SER A 24 -6.489 11.404 -8.791 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.406 13.544 -8.488 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.921 13.105 -10.105 1.00 0.00 H new ATOM 0 HG SER A 24 -6.808 13.708 -8.034 1.00 0.00 H new ATOM 365 N LEU A 25 -3.994 9.740 -8.654 1.00 0.00 N ATOM 366 CA LEU A 25 -3.111 8.760 -9.264 1.00 0.00 C ATOM 367 C LEU A 25 -3.949 7.650 -9.900 1.00 0.00 C ATOM 368 O LEU A 25 -5.153 7.565 -9.665 1.00 0.00 O ATOM 369 CB LEU A 25 -2.090 8.252 -8.244 1.00 0.00 C ATOM 370 CG LEU A 25 -2.548 7.093 -7.356 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.034 7.220 -7.013 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.224 5.746 -8.004 1.00 0.00 C ATOM 0 H LEU A 25 -4.144 9.614 -7.653 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.529 9.217 -10.064 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.194 7.940 -8.781 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.803 9.084 -7.601 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.995 7.141 -6.418 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.334 6.384 -6.381 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.206 8.156 -6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.621 7.210 -7.931 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.560 4.939 -7.353 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.733 5.673 -8.965 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.148 5.665 -8.157 1.00 0.00 H new ATOM 384 N PRO A 26 -3.263 6.807 -10.715 1.00 0.00 N ATOM 385 CA PRO A 26 -3.930 5.706 -11.388 1.00 0.00 C ATOM 386 C PRO A 26 -4.234 4.569 -10.410 1.00 0.00 C ATOM 387 O PRO A 26 -3.326 4.029 -9.779 1.00 0.00 O ATOM 388 CB PRO A 26 -2.984 5.292 -12.504 1.00 0.00 C ATOM 389 CG PRO A 26 -1.625 5.862 -12.129 1.00 0.00 C ATOM 390 CD PRO A 26 -1.835 6.878 -11.017 1.00 0.00 C ATOM 0 HA PRO A 26 -4.901 5.989 -11.793 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.941 4.207 -12.597 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.319 5.681 -13.465 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.956 5.067 -11.798 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.157 6.334 -12.993 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.233 6.637 -10.141 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.547 7.880 -11.336 1.00 0.00 H new ATOM 398 N ASP A 27 -5.513 4.239 -10.314 1.00 0.00 N ATOM 399 CA ASP A 27 -5.948 3.177 -9.424 1.00 0.00 C ATOM 400 C ASP A 27 -5.444 1.833 -9.956 1.00 0.00 C ATOM 401 O ASP A 27 -5.667 0.794 -9.337 1.00 0.00 O ATOM 402 CB ASP A 27 -7.475 3.112 -9.347 1.00 0.00 C ATOM 403 CG ASP A 27 -8.163 2.571 -10.601 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.446 2.391 -11.610 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.391 2.351 -10.524 1.00 0.00 O ATOM 0 H ASP A 27 -6.263 4.689 -10.839 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.546 3.383 -8.432 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.755 2.487 -8.499 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.856 4.113 -9.145 1.00 0.00 H new ATOM 410 N SER A 28 -4.775 1.898 -11.098 1.00 0.00 N ATOM 411 CA SER A 28 -4.239 0.700 -11.721 1.00 0.00 C ATOM 412 C SER A 28 -2.907 0.323 -11.068 1.00 0.00 C ATOM 413 O SER A 28 -2.629 -0.855 -10.852 1.00 0.00 O ATOM 414 CB SER A 28 -4.056 0.896 -13.227 1.00 0.00 C ATOM 415 OG SER A 28 -3.305 2.071 -13.525 1.00 0.00 O ATOM 0 H SER A 28 -4.592 2.762 -11.608 1.00 0.00 H new ATOM 0 HA SER A 28 -4.952 -0.111 -11.573 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.551 0.026 -13.647 1.00 0.00 H new ATOM 0 HB3 SER A 28 -5.033 0.959 -13.706 1.00 0.00 H new ATOM 0 HG SER A 28 -3.208 2.160 -14.496 1.00 0.00 H new ATOM 421 N VAL A 29 -2.119 1.347 -10.774 1.00 0.00 N ATOM 422 CA VAL A 29 -0.823 1.137 -10.151 1.00 0.00 C ATOM 423 C VAL A 29 -1.021 0.525 -8.763 1.00 0.00 C ATOM 424 O VAL A 29 -0.232 -0.313 -8.331 1.00 0.00 O ATOM 425 CB VAL A 29 -0.040 2.451 -10.118 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.254 2.951 -11.534 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.784 3.513 -9.306 1.00 0.00 C ATOM 0 H VAL A 29 -2.353 2.323 -10.955 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.229 0.433 -10.734 1.00 0.00 H new ATOM 0 HB VAL A 29 0.913 2.259 -9.626 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.811 3.886 -11.481 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.845 2.206 -12.068 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.684 3.117 -12.063 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.206 4.437 -9.299 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.759 3.699 -9.757 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.918 3.161 -8.283 1.00 0.00 H new ATOM 437 N VAL A 30 -2.082 0.969 -8.101 1.00 0.00 N ATOM 438 CA VAL A 30 -2.394 0.475 -6.772 1.00 0.00 C ATOM 439 C VAL A 30 -3.043 -0.906 -6.884 1.00 0.00 C ATOM 440 O VAL A 30 -2.852 -1.757 -6.018 1.00 0.00 O ATOM 441 CB VAL A 30 -3.269 1.487 -6.030 1.00 0.00 C ATOM 442 CG1 VAL A 30 -4.660 1.575 -6.659 1.00 0.00 C ATOM 443 CG2 VAL A 30 -3.361 1.146 -4.541 1.00 0.00 C ATOM 0 H VAL A 30 -2.735 1.665 -8.462 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.483 0.359 -6.185 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.798 2.466 -6.121 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.261 2.301 -6.112 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.570 1.888 -7.699 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.142 0.598 -6.615 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.989 1.881 -4.037 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.797 0.154 -4.421 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.363 1.160 -4.102 1.00 0.00 H new ATOM 453 N ALA A 31 -3.796 -1.085 -7.959 1.00 0.00 N ATOM 454 CA ALA A 31 -4.475 -2.347 -8.197 1.00 0.00 C ATOM 455 C ALA A 31 -3.445 -3.409 -8.590 1.00 0.00 C ATOM 456 O ALA A 31 -3.723 -4.605 -8.521 1.00 0.00 O ATOM 457 CB ALA A 31 -5.553 -2.156 -9.265 1.00 0.00 C ATOM 0 H ALA A 31 -3.951 -0.376 -8.676 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.974 -2.690 -7.291 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -6.061 -3.104 -9.442 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.276 -1.415 -8.924 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -5.091 -1.813 -10.191 1.00 0.00 H new ATOM 463 N ASP A 32 -2.275 -2.932 -8.993 1.00 0.00 N ATOM 464 CA ASP A 32 -1.204 -3.824 -9.399 1.00 0.00 C ATOM 465 C ASP A 32 -0.558 -4.437 -8.153 1.00 0.00 C ATOM 466 O ASP A 32 -0.053 -5.558 -8.199 1.00 0.00 O ATOM 467 CB ASP A 32 -0.119 -3.068 -10.169 1.00 0.00 C ATOM 468 CG ASP A 32 0.900 -3.954 -10.887 1.00 0.00 C ATOM 469 OD1 ASP A 32 0.730 -5.190 -10.813 1.00 0.00 O ATOM 470 OD2 ASP A 32 1.828 -3.374 -11.493 1.00 0.00 O ATOM 0 H ASP A 32 -2.047 -1.939 -9.046 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.632 -4.594 -10.041 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.599 -2.423 -10.905 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.413 -2.418 -9.474 1.00 0.00 H new ATOM 475 N LEU A 33 -0.597 -3.675 -7.070 1.00 0.00 N ATOM 476 CA LEU A 33 -0.022 -4.130 -5.815 1.00 0.00 C ATOM 477 C LEU A 33 -0.557 -5.527 -5.492 1.00 0.00 C ATOM 478 O LEU A 33 0.198 -6.399 -5.063 1.00 0.00 O ATOM 479 CB LEU A 33 -0.274 -3.104 -4.709 1.00 0.00 C ATOM 480 CG LEU A 33 0.773 -1.997 -4.570 1.00 0.00 C ATOM 481 CD1 LEU A 33 0.532 -1.168 -3.306 1.00 0.00 C ATOM 482 CD2 LEU A 33 2.190 -2.573 -4.615 1.00 0.00 C ATOM 0 H LEU A 33 -1.017 -2.746 -7.035 1.00 0.00 H new ATOM 0 HA LEU A 33 1.061 -4.215 -5.899 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.244 -2.639 -4.886 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.343 -3.633 -3.759 1.00 0.00 H new ATOM 0 HG LEU A 33 0.671 -1.324 -5.421 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.290 -0.389 -3.232 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.456 -0.710 -3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.590 -1.815 -2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.915 -1.765 -4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.321 -3.282 -3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.345 -3.083 -5.566 1.00 0.00 H new ATOM 494 N TYR A 34 -1.853 -5.696 -5.708 1.00 0.00 N ATOM 495 CA TYR A 34 -2.496 -6.970 -5.444 1.00 0.00 C ATOM 496 C TYR A 34 -2.119 -8.004 -6.506 1.00 0.00 C ATOM 497 O TYR A 34 -2.238 -9.208 -6.276 1.00 0.00 O ATOM 498 CB TYR A 34 -4.001 -6.706 -5.519 1.00 0.00 C ATOM 499 CG TYR A 34 -4.773 -7.143 -4.271 1.00 0.00 C ATOM 500 CD1 TYR A 34 -4.518 -6.539 -3.056 1.00 0.00 C ATOM 501 CD2 TYR A 34 -5.721 -8.142 -4.360 1.00 0.00 C ATOM 502 CE1 TYR A 34 -5.244 -6.948 -1.882 1.00 0.00 C ATOM 503 CE2 TYR A 34 -6.446 -8.551 -3.186 1.00 0.00 C ATOM 504 CZ TYR A 34 -6.172 -7.935 -2.005 1.00 0.00 C ATOM 505 OH TYR A 34 -6.857 -8.323 -0.896 1.00 0.00 O ATOM 0 H TYR A 34 -2.475 -4.970 -6.063 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.188 -7.362 -4.475 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.165 -5.641 -5.681 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.408 -7.226 -6.386 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.774 -5.760 -2.986 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -5.919 -8.616 -5.310 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.056 -6.482 -0.926 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.192 -9.330 -3.242 1.00 0.00 H new ATOM 0 HH TYR A 34 -7.487 -9.035 -1.133 1.00 0.00 H new ATOM 515 N ASN A 35 -1.669 -7.499 -7.645 1.00 0.00 N ATOM 516 CA ASN A 35 -1.273 -8.364 -8.744 1.00 0.00 C ATOM 517 C ASN A 35 -0.022 -9.150 -8.343 1.00 0.00 C ATOM 518 O ASN A 35 -0.096 -10.349 -8.078 1.00 0.00 O ATOM 519 CB ASN A 35 -0.939 -7.549 -9.995 1.00 0.00 C ATOM 520 CG ASN A 35 -1.704 -8.074 -11.211 1.00 0.00 C ATOM 521 OD1 ASN A 35 -1.361 -9.083 -11.804 1.00 0.00 O ATOM 522 ND2 ASN A 35 -2.756 -7.334 -11.549 1.00 0.00 N ATOM 0 H ASN A 35 -1.570 -6.501 -7.831 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.105 -9.034 -8.962 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.189 -6.501 -9.828 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.133 -7.594 -10.188 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.331 -7.600 -12.348 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.988 -6.500 -11.009 1.00 0.00 H new ATOM 529 N PHE A 36 1.097 -8.441 -8.311 1.00 0.00 N ATOM 530 CA PHE A 36 2.362 -9.057 -7.947 1.00 0.00 C ATOM 531 C PHE A 36 3.541 -8.222 -8.447 1.00 0.00 C ATOM 532 O PHE A 36 4.611 -8.759 -8.734 1.00 0.00 O ATOM 533 CB PHE A 36 2.402 -10.429 -8.623 1.00 0.00 C ATOM 534 CG PHE A 36 2.136 -11.599 -7.672 1.00 0.00 C ATOM 535 CD1 PHE A 36 2.664 -11.590 -6.418 1.00 0.00 C ATOM 536 CD2 PHE A 36 1.372 -12.647 -8.081 1.00 0.00 C ATOM 537 CE1 PHE A 36 2.418 -12.674 -5.536 1.00 0.00 C ATOM 538 CE2 PHE A 36 1.126 -13.732 -7.198 1.00 0.00 C ATOM 539 CZ PHE A 36 1.654 -13.724 -5.944 1.00 0.00 C ATOM 0 H PHE A 36 1.154 -7.447 -8.531 1.00 0.00 H new ATOM 0 HA PHE A 36 2.440 -9.135 -6.863 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.663 -10.450 -9.424 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.379 -10.566 -9.087 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.271 -10.757 -6.094 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.953 -12.654 -9.076 1.00 0.00 H new ATOM 0 HE1 PHE A 36 2.837 -12.666 -4.541 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.519 -14.564 -7.522 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.467 -14.550 -5.273 1.00 0.00 H new ATOM 549 N TRP A 37 3.308 -6.919 -8.535 1.00 0.00 N ATOM 550 CA TRP A 37 4.340 -6.005 -8.995 1.00 0.00 C ATOM 551 C TRP A 37 5.041 -5.426 -7.764 1.00 0.00 C ATOM 552 O TRP A 37 5.570 -4.316 -7.813 1.00 0.00 O ATOM 553 CB TRP A 37 3.749 -4.928 -9.909 1.00 0.00 C ATOM 554 CG TRP A 37 3.081 -3.775 -9.160 1.00 0.00 C ATOM 555 CD1 TRP A 37 2.233 -3.844 -8.125 1.00 0.00 C ATOM 556 CD2 TRP A 37 3.240 -2.366 -9.430 1.00 0.00 C ATOM 557 NE1 TRP A 37 1.835 -2.589 -7.711 1.00 0.00 N ATOM 558 CE2 TRP A 37 2.468 -1.662 -8.531 1.00 0.00 C ATOM 559 CE3 TRP A 37 4.013 -1.709 -10.404 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.392 -0.264 -8.514 1.00 0.00 C ATOM 561 CZ3 TRP A 37 3.926 -0.312 -10.376 1.00 0.00 C ATOM 562 CH2 TRP A 37 3.153 0.413 -9.477 1.00 0.00 C ATOM 0 H TRP A 37 2.421 -6.476 -8.296 1.00 0.00 H new ATOM 0 HA TRP A 37 5.079 -6.529 -9.602 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.542 -4.527 -10.540 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.017 -5.390 -10.572 1.00 0.00 H new ATOM 0 HD1 TRP A 37 1.902 -4.767 -7.671 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.195 -2.380 -6.945 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.626 -2.240 -11.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 1.780 0.264 -7.798 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 4.500 0.241 -11.104 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.139 1.492 -9.520 1.00 0.00 H new ATOM 573 N LYS A 38 5.021 -6.202 -6.692 1.00 0.00 N ATOM 574 CA LYS A 38 5.648 -5.781 -5.451 1.00 0.00 C ATOM 575 C LYS A 38 7.022 -5.183 -5.757 1.00 0.00 C ATOM 576 O LYS A 38 7.300 -4.037 -5.399 1.00 0.00 O ATOM 577 CB LYS A 38 5.691 -6.937 -4.451 1.00 0.00 C ATOM 578 CG LYS A 38 4.309 -7.575 -4.291 1.00 0.00 C ATOM 579 CD LYS A 38 4.173 -8.256 -2.928 1.00 0.00 C ATOM 580 CE LYS A 38 2.869 -9.051 -2.838 1.00 0.00 C ATOM 581 NZ LYS A 38 1.952 -8.434 -1.854 1.00 0.00 N ATOM 0 H LYS A 38 4.580 -7.121 -6.656 1.00 0.00 H new ATOM 0 HA LYS A 38 5.057 -4.999 -4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.405 -7.688 -4.788 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.042 -6.574 -3.485 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.538 -6.812 -4.399 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.148 -8.305 -5.084 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.021 -8.922 -2.764 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.200 -7.505 -2.138 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.390 -9.088 -3.817 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.083 -10.080 -2.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.072 -8.986 -1.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.405 -8.421 -0.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.734 -7.460 -2.146 1.00 0.00 H new ATOM 595 N ASP A 39 7.848 -5.982 -6.414 1.00 0.00 N ATOM 596 CA ASP A 39 9.187 -5.546 -6.773 1.00 0.00 C ATOM 597 C ASP A 39 9.114 -4.150 -7.396 1.00 0.00 C ATOM 598 O ASP A 39 10.086 -3.397 -7.354 1.00 0.00 O ATOM 599 CB ASP A 39 9.818 -6.489 -7.798 1.00 0.00 C ATOM 600 CG ASP A 39 9.411 -6.231 -9.250 1.00 0.00 C ATOM 601 OD1 ASP A 39 9.932 -5.247 -9.820 1.00 0.00 O ATOM 602 OD2 ASP A 39 8.588 -7.023 -9.759 1.00 0.00 O ATOM 0 H ASP A 39 7.616 -6.931 -6.708 1.00 0.00 H new ATOM 0 HA ASP A 39 9.794 -5.541 -5.868 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.903 -6.412 -7.721 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.552 -7.514 -7.539 1.00 0.00 H new ATOM 607 N ASP A 40 7.954 -3.848 -7.961 1.00 0.00 N ATOM 608 CA ASP A 40 7.741 -2.557 -8.592 1.00 0.00 C ATOM 609 C ASP A 40 6.996 -1.638 -7.623 1.00 0.00 C ATOM 610 O ASP A 40 5.953 -1.083 -7.967 1.00 0.00 O ATOM 611 CB ASP A 40 6.895 -2.696 -9.858 1.00 0.00 C ATOM 612 CG ASP A 40 6.837 -1.445 -10.737 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.542 -0.368 -10.173 1.00 0.00 O ATOM 614 OD2 ASP A 40 7.088 -1.593 -11.952 1.00 0.00 O ATOM 0 H ASP A 40 7.151 -4.476 -7.995 1.00 0.00 H new ATOM 0 HA ASP A 40 8.715 -2.144 -8.854 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.289 -3.521 -10.452 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.879 -2.967 -9.570 1.00 0.00 H new ATOM 619 N TYR A 41 7.559 -1.505 -6.431 1.00 0.00 N ATOM 620 CA TYR A 41 6.960 -0.662 -5.410 1.00 0.00 C ATOM 621 C TYR A 41 7.298 0.811 -5.648 1.00 0.00 C ATOM 622 O TYR A 41 7.841 1.166 -6.692 1.00 0.00 O ATOM 623 CB TYR A 41 7.575 -1.107 -4.081 1.00 0.00 C ATOM 624 CG TYR A 41 6.803 -2.228 -3.383 1.00 0.00 C ATOM 625 CD1 TYR A 41 5.445 -2.102 -3.169 1.00 0.00 C ATOM 626 CD2 TYR A 41 7.465 -3.365 -2.967 1.00 0.00 C ATOM 627 CE1 TYR A 41 4.719 -3.157 -2.512 1.00 0.00 C ATOM 628 CE2 TYR A 41 6.739 -4.421 -2.311 1.00 0.00 C ATOM 629 CZ TYR A 41 5.401 -4.265 -2.115 1.00 0.00 C ATOM 630 OH TYR A 41 4.715 -5.262 -1.494 1.00 0.00 O ATOM 0 H TYR A 41 8.424 -1.967 -6.149 1.00 0.00 H new ATOM 0 HA TYR A 41 5.874 -0.758 -5.421 1.00 0.00 H new ATOM 0 HB2 TYR A 41 8.597 -1.440 -4.259 1.00 0.00 H new ATOM 0 HB3 TYR A 41 7.631 -0.248 -3.413 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.927 -1.212 -3.495 1.00 0.00 H new ATOM 0 HD2 TYR A 41 8.528 -3.463 -3.134 1.00 0.00 H new ATOM 0 HE1 TYR A 41 3.657 -3.071 -2.338 1.00 0.00 H new ATOM 0 HE2 TYR A 41 7.245 -5.317 -1.982 1.00 0.00 H new ATOM 0 HH TYR A 41 5.343 -5.845 -1.019 1.00 0.00 H new ATOM 640 N VAL A 42 6.963 1.629 -4.660 1.00 0.00 N ATOM 641 CA VAL A 42 7.226 3.055 -4.748 1.00 0.00 C ATOM 642 C VAL A 42 8.523 3.284 -5.525 1.00 0.00 C ATOM 643 O VAL A 42 8.645 4.259 -6.265 1.00 0.00 O ATOM 644 CB VAL A 42 7.252 3.670 -3.347 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.127 2.843 -2.402 1.00 0.00 C ATOM 646 CG2 VAL A 42 7.721 5.126 -3.396 1.00 0.00 C ATOM 0 H VAL A 42 6.512 1.331 -3.795 1.00 0.00 H new ATOM 0 HA VAL A 42 6.427 3.557 -5.294 1.00 0.00 H new ATOM 0 HB VAL A 42 6.234 3.659 -2.957 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.129 3.301 -1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 42 7.730 1.830 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 42 9.146 2.808 -2.787 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.730 5.539 -2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.726 5.171 -3.816 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.041 5.706 -4.020 1.00 0.00 H new ATOM 656 N MET A 43 9.463 2.369 -5.330 1.00 0.00 N ATOM 657 CA MET A 43 10.747 2.458 -6.003 1.00 0.00 C ATOM 658 C MET A 43 10.569 2.836 -7.475 1.00 0.00 C ATOM 659 O MET A 43 11.478 3.388 -8.093 1.00 0.00 O ATOM 660 CB MET A 43 11.470 1.114 -5.904 1.00 0.00 C ATOM 661 CG MET A 43 12.849 1.182 -6.565 1.00 0.00 C ATOM 662 SD MET A 43 13.009 -0.118 -7.778 1.00 0.00 S ATOM 663 CE MET A 43 14.027 -1.266 -6.869 1.00 0.00 C ATOM 0 H MET A 43 9.360 1.562 -4.715 1.00 0.00 H new ATOM 0 HA MET A 43 11.338 3.234 -5.517 1.00 0.00 H new ATOM 0 HB2 MET A 43 11.578 0.832 -4.857 1.00 0.00 H new ATOM 0 HB3 MET A 43 10.871 0.339 -6.383 1.00 0.00 H new ATOM 0 HG2 MET A 43 12.986 2.153 -7.040 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.629 1.084 -5.810 1.00 0.00 H new ATOM 0 HE1 MET A 43 14.225 -2.143 -7.485 1.00 0.00 H new ATOM 0 HE2 MET A 43 14.970 -0.787 -6.606 1.00 0.00 H new ATOM 0 HE3 MET A 43 13.509 -1.570 -5.960 1.00 0.00 H new ATOM 673 N THR A 44 9.391 2.522 -7.995 1.00 0.00 N ATOM 674 CA THR A 44 9.083 2.821 -9.383 1.00 0.00 C ATOM 675 C THR A 44 7.892 3.778 -9.471 1.00 0.00 C ATOM 676 O THR A 44 7.951 4.785 -10.175 1.00 0.00 O ATOM 677 CB THR A 44 8.853 1.496 -10.113 1.00 0.00 C ATOM 678 OG1 THR A 44 10.161 1.071 -10.485 1.00 0.00 O ATOM 679 CG2 THR A 44 8.127 1.680 -11.447 1.00 0.00 C ATOM 0 H THR A 44 8.639 2.064 -7.480 1.00 0.00 H new ATOM 0 HA THR A 44 9.911 3.337 -9.869 1.00 0.00 H new ATOM 0 HB THR A 44 8.275 0.827 -9.475 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.104 0.217 -10.963 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.989 0.709 -11.923 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.154 2.139 -11.271 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.719 2.323 -12.098 1.00 0.00 H new ATOM 687 N ASP A 45 6.840 3.429 -8.746 1.00 0.00 N ATOM 688 CA ASP A 45 5.637 4.245 -8.733 1.00 0.00 C ATOM 689 C ASP A 45 5.301 4.626 -7.289 1.00 0.00 C ATOM 690 O ASP A 45 4.705 3.837 -6.557 1.00 0.00 O ATOM 691 CB ASP A 45 4.445 3.476 -9.308 1.00 0.00 C ATOM 692 CG ASP A 45 3.498 4.309 -10.175 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.981 4.834 -11.202 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.313 4.404 -9.791 1.00 0.00 O ATOM 0 H ASP A 45 6.795 2.593 -8.163 1.00 0.00 H new ATOM 0 HA ASP A 45 5.823 5.131 -9.340 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.821 2.644 -9.903 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.876 3.047 -8.483 1.00 0.00 H new ATOM 699 N ARG A 46 5.697 5.836 -6.924 1.00 0.00 N ATOM 700 CA ARG A 46 5.445 6.332 -5.581 1.00 0.00 C ATOM 701 C ARG A 46 3.943 6.336 -5.290 1.00 0.00 C ATOM 702 O ARG A 46 3.520 5.990 -4.187 1.00 0.00 O ATOM 703 CB ARG A 46 5.994 7.749 -5.405 1.00 0.00 C ATOM 704 CG ARG A 46 5.510 8.367 -4.092 1.00 0.00 C ATOM 705 CD ARG A 46 4.714 9.648 -4.349 1.00 0.00 C ATOM 706 NE ARG A 46 5.632 10.743 -4.738 1.00 0.00 N ATOM 707 CZ ARG A 46 5.356 12.046 -4.580 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.188 12.422 -4.042 1.00 0.00 N ATOM 709 NH2 ARG A 46 6.247 12.968 -4.964 1.00 0.00 N ATOM 0 H ARG A 46 6.190 6.488 -7.534 1.00 0.00 H new ATOM 0 HA ARG A 46 5.953 5.668 -4.882 1.00 0.00 H new ATOM 0 HB2 ARG A 46 7.084 7.725 -5.419 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.678 8.372 -6.242 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.888 7.650 -3.556 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.365 8.588 -3.453 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.981 9.479 -5.138 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.159 9.928 -3.453 1.00 0.00 H new ATOM 0 HE ARG A 46 6.530 10.491 -5.152 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.509 11.718 -3.753 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.977 13.413 -3.922 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.134 12.679 -5.376 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.039 13.959 -4.845 1.00 0.00 H new ATOM 723 N LEU A 47 3.178 6.728 -6.297 1.00 0.00 N ATOM 724 CA LEU A 47 1.731 6.782 -6.163 1.00 0.00 C ATOM 725 C LEU A 47 1.235 5.482 -5.525 1.00 0.00 C ATOM 726 O LEU A 47 0.378 5.508 -4.642 1.00 0.00 O ATOM 727 CB LEU A 47 1.080 7.092 -7.512 1.00 0.00 C ATOM 728 CG LEU A 47 1.761 8.172 -8.354 1.00 0.00 C ATOM 729 CD1 LEU A 47 2.377 9.255 -7.464 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.791 7.559 -9.305 1.00 0.00 C ATOM 0 H LEU A 47 3.532 7.012 -7.210 1.00 0.00 H new ATOM 0 HA LEU A 47 1.439 7.596 -5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.046 6.172 -8.096 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.048 7.395 -7.334 1.00 0.00 H new ATOM 0 HG LEU A 47 1.001 8.654 -8.969 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.855 10.010 -8.088 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.595 9.721 -6.864 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.120 8.805 -6.805 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.260 8.349 -9.892 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.553 7.035 -8.728 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.295 6.856 -9.974 1.00 0.00 H new ATOM 742 N ALA A 48 1.795 4.378 -5.995 1.00 0.00 N ATOM 743 CA ALA A 48 1.420 3.072 -5.481 1.00 0.00 C ATOM 744 C ALA A 48 1.632 3.044 -3.966 1.00 0.00 C ATOM 745 O ALA A 48 0.894 2.377 -3.244 1.00 0.00 O ATOM 746 CB ALA A 48 2.225 1.988 -6.203 1.00 0.00 C ATOM 0 H ALA A 48 2.506 4.361 -6.726 1.00 0.00 H new ATOM 0 HA ALA A 48 0.365 2.874 -5.670 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.944 1.008 -5.817 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.016 2.031 -7.272 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.289 2.152 -6.035 1.00 0.00 H new ATOM 752 N GLY A 49 2.647 3.776 -3.531 1.00 0.00 N ATOM 753 CA GLY A 49 2.967 3.845 -2.115 1.00 0.00 C ATOM 754 C GLY A 49 2.057 4.842 -1.395 1.00 0.00 C ATOM 755 O GLY A 49 1.786 4.692 -0.204 1.00 0.00 O ATOM 0 H GLY A 49 3.259 4.326 -4.134 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.858 2.858 -1.666 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.008 4.140 -1.988 1.00 0.00 H new ATOM 759 N CYS A 50 1.613 5.838 -2.147 1.00 0.00 N ATOM 760 CA CYS A 50 0.740 6.861 -1.595 1.00 0.00 C ATOM 761 C CYS A 50 -0.682 6.299 -1.538 1.00 0.00 C ATOM 762 O CYS A 50 -1.378 6.460 -0.537 1.00 0.00 O ATOM 763 CB CYS A 50 0.809 8.159 -2.401 1.00 0.00 C ATOM 764 SG CYS A 50 1.886 9.452 -1.683 1.00 0.00 S ATOM 0 H CYS A 50 1.841 5.959 -3.134 1.00 0.00 H new ATOM 0 HA CYS A 50 1.069 7.118 -0.588 1.00 0.00 H new ATOM 0 HB2 CYS A 50 1.163 7.928 -3.406 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.199 8.561 -2.503 1.00 0.00 H new ATOM 769 N ALA A 51 -1.072 5.650 -2.626 1.00 0.00 N ATOM 770 CA ALA A 51 -2.399 5.064 -2.713 1.00 0.00 C ATOM 771 C ALA A 51 -2.582 4.060 -1.575 1.00 0.00 C ATOM 772 O ALA A 51 -3.605 4.071 -0.891 1.00 0.00 O ATOM 773 CB ALA A 51 -2.585 4.425 -4.092 1.00 0.00 C ATOM 0 H ALA A 51 -0.492 5.517 -3.455 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.166 5.830 -2.603 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.580 3.985 -4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.473 5.186 -4.864 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.835 3.648 -4.237 1.00 0.00 H new ATOM 779 N ILE A 52 -1.577 3.214 -1.406 1.00 0.00 N ATOM 780 CA ILE A 52 -1.615 2.205 -0.361 1.00 0.00 C ATOM 781 C ILE A 52 -1.718 2.891 1.003 1.00 0.00 C ATOM 782 O ILE A 52 -2.431 2.420 1.886 1.00 0.00 O ATOM 783 CB ILE A 52 -0.418 1.259 -0.485 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.848 -0.197 -0.299 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.697 1.656 0.485 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.649 -0.372 0.993 1.00 0.00 C ATOM 0 H ILE A 52 -0.731 3.206 -1.975 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.500 1.578 -0.470 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.015 1.349 -1.494 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.451 -0.513 -1.150 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.032 -0.840 -0.275 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.536 0.968 0.377 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.029 2.670 0.263 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.322 1.613 1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.942 -1.416 1.101 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.035 -0.078 1.844 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.541 0.253 0.956 1.00 0.00 H new ATOM 798 N ASN A 53 -0.994 3.995 1.130 1.00 0.00 N ATOM 799 CA ASN A 53 -0.995 4.750 2.370 1.00 0.00 C ATOM 800 C ASN A 53 -2.423 5.197 2.689 1.00 0.00 C ATOM 801 O ASN A 53 -2.877 5.072 3.826 1.00 0.00 O ATOM 802 CB ASN A 53 -0.123 6.002 2.254 1.00 0.00 C ATOM 803 CG ASN A 53 1.018 5.972 3.271 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.633 4.948 3.524 1.00 0.00 O ATOM 805 ND2 ASN A 53 1.270 7.148 3.837 1.00 0.00 N ATOM 0 H ASN A 53 -0.404 4.383 0.394 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.600 4.107 3.156 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.286 6.073 1.246 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.734 6.891 2.413 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.016 7.232 4.528 1.00 0.00 H new ATOM 0 HD22 ASN A 53 0.718 7.966 3.580 1.00 0.00 H new ATOM 812 N CYS A 54 -3.091 5.709 1.666 1.00 0.00 N ATOM 813 CA CYS A 54 -4.458 6.176 1.824 1.00 0.00 C ATOM 814 C CYS A 54 -5.354 4.961 2.076 1.00 0.00 C ATOM 815 O CYS A 54 -6.406 5.081 2.703 1.00 0.00 O ATOM 816 CB CYS A 54 -4.923 6.986 0.612 1.00 0.00 C ATOM 817 SG CYS A 54 -6.263 6.207 -0.364 1.00 0.00 S ATOM 0 H CYS A 54 -2.711 5.811 0.725 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.517 6.854 2.676 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.263 7.963 0.955 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.068 7.157 -0.042 1.00 0.00 H new ATOM 822 N LEU A 55 -4.905 3.820 1.574 1.00 0.00 N ATOM 823 CA LEU A 55 -5.652 2.585 1.737 1.00 0.00 C ATOM 824 C LEU A 55 -5.969 2.377 3.219 1.00 0.00 C ATOM 825 O LEU A 55 -7.029 1.858 3.565 1.00 0.00 O ATOM 826 CB LEU A 55 -4.901 1.416 1.098 1.00 0.00 C ATOM 827 CG LEU A 55 -5.753 0.209 0.700 1.00 0.00 C ATOM 828 CD1 LEU A 55 -5.985 0.176 -0.812 1.00 0.00 C ATOM 829 CD2 LEU A 55 -5.134 -1.093 1.212 1.00 0.00 C ATOM 0 H LEU A 55 -4.033 3.725 1.054 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.606 2.645 1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.388 1.782 0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.133 1.080 1.794 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.729 0.310 1.174 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.593 -0.692 -1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.501 1.085 -1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.026 0.111 -1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.760 -1.935 0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.138 -1.214 0.787 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.063 -1.059 2.299 1.00 0.00 H new ATOM 841 N ALA A 56 -5.029 2.793 4.056 1.00 0.00 N ATOM 842 CA ALA A 56 -5.194 2.658 5.493 1.00 0.00 C ATOM 843 C ALA A 56 -6.267 3.637 5.972 1.00 0.00 C ATOM 844 O ALA A 56 -6.744 3.537 7.102 1.00 0.00 O ATOM 845 CB ALA A 56 -3.848 2.883 6.184 1.00 0.00 C ATOM 0 H ALA A 56 -4.151 3.224 3.766 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.528 1.652 5.749 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.971 2.782 7.262 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.129 2.144 5.830 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.483 3.884 5.953 1.00 0.00 H new ATOM 851 N THR A 57 -6.616 4.562 5.090 1.00 0.00 N ATOM 852 CA THR A 57 -7.625 5.559 5.409 1.00 0.00 C ATOM 853 C THR A 57 -8.471 5.097 6.598 1.00 0.00 C ATOM 854 O THR A 57 -8.539 5.782 7.618 1.00 0.00 O ATOM 855 CB THR A 57 -8.445 5.822 4.145 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.666 6.370 4.632 1.00 0.00 O ATOM 857 CG2 THR A 57 -8.869 4.531 3.442 1.00 0.00 C ATOM 0 H THR A 57 -6.218 4.642 4.154 1.00 0.00 H new ATOM 0 HA THR A 57 -7.170 6.500 5.719 1.00 0.00 H new ATOM 0 HB THR A 57 -7.864 6.435 3.456 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.191 6.718 3.881 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.448 4.775 2.551 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.983 3.965 3.155 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.479 3.932 4.118 1.00 0.00 H new ATOM 865 N LYS A 58 -9.097 3.942 6.426 1.00 0.00 N ATOM 866 CA LYS A 58 -9.935 3.383 7.472 1.00 0.00 C ATOM 867 C LYS A 58 -9.272 2.123 8.033 1.00 0.00 C ATOM 868 O LYS A 58 -9.317 1.064 7.411 1.00 0.00 O ATOM 869 CB LYS A 58 -11.355 3.150 6.953 1.00 0.00 C ATOM 870 CG LYS A 58 -12.127 4.467 6.856 1.00 0.00 C ATOM 871 CD LYS A 58 -13.124 4.604 8.008 1.00 0.00 C ATOM 872 CE LYS A 58 -14.234 5.598 7.657 1.00 0.00 C ATOM 873 NZ LYS A 58 -15.417 5.379 8.519 1.00 0.00 N ATOM 0 H LYS A 58 -9.040 3.378 5.578 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.033 4.087 8.298 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.314 2.675 5.973 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.881 2.464 7.617 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.429 5.304 6.873 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.657 4.513 5.904 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -13.560 3.631 8.234 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.604 4.936 8.906 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.870 6.618 7.781 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.514 5.485 6.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -16.161 6.061 8.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.773 4.412 8.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.149 5.510 9.515 1.00 0.00 H new ATOM 887 N LEU A 59 -8.671 2.282 9.204 1.00 0.00 N ATOM 888 CA LEU A 59 -7.999 1.170 9.856 1.00 0.00 C ATOM 889 C LEU A 59 -9.046 0.193 10.394 1.00 0.00 C ATOM 890 O LEU A 59 -8.730 -0.960 10.689 1.00 0.00 O ATOM 891 CB LEU A 59 -7.030 1.682 10.923 1.00 0.00 C ATOM 892 CG LEU A 59 -5.542 1.595 10.576 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.286 2.069 9.144 1.00 0.00 C ATOM 894 CD2 LEU A 59 -4.696 2.361 11.595 1.00 0.00 C ATOM 0 H LEU A 59 -8.635 3.163 9.717 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.388 0.621 9.140 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.273 2.723 11.136 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.202 1.120 11.841 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.238 0.549 10.628 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.221 1.997 8.922 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.845 1.443 8.448 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.609 3.105 9.040 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.643 2.283 11.325 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.993 3.410 11.599 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.849 1.936 12.587 1.00 0.00 H new ATOM 906 N ASP A 60 -10.270 0.688 10.506 1.00 0.00 N ATOM 907 CA ASP A 60 -11.364 -0.128 11.004 1.00 0.00 C ATOM 908 C ASP A 60 -11.658 -1.245 10.001 1.00 0.00 C ATOM 909 O ASP A 60 -12.054 -2.344 10.389 1.00 0.00 O ATOM 910 CB ASP A 60 -12.638 0.702 11.173 1.00 0.00 C ATOM 911 CG ASP A 60 -12.682 1.569 12.434 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.627 0.975 13.533 1.00 0.00 O ATOM 913 OD2 ASP A 60 -12.769 2.805 12.270 1.00 0.00 O ATOM 0 H ASP A 60 -10.528 1.644 10.260 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.068 -0.535 11.971 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.751 1.348 10.302 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.494 0.028 11.184 1.00 0.00 H new ATOM 918 N VAL A 61 -11.453 -0.927 8.732 1.00 0.00 N ATOM 919 CA VAL A 61 -11.692 -1.890 7.670 1.00 0.00 C ATOM 920 C VAL A 61 -10.442 -2.749 7.477 1.00 0.00 C ATOM 921 O VAL A 61 -10.541 -3.951 7.231 1.00 0.00 O ATOM 922 CB VAL A 61 -12.122 -1.166 6.393 1.00 0.00 C ATOM 923 CG1 VAL A 61 -13.492 -0.505 6.572 1.00 0.00 C ATOM 924 CG2 VAL A 61 -11.071 -0.140 5.964 1.00 0.00 C ATOM 0 H VAL A 61 -11.124 -0.015 8.414 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.509 -2.559 7.939 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.209 -1.909 5.600 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.774 0.003 5.650 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.235 -1.266 6.809 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.443 0.220 7.385 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -11.401 0.360 5.054 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.938 0.597 6.756 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -10.124 -0.646 5.777 1.00 0.00 H new ATOM 934 N VAL A 62 -9.292 -2.101 7.596 1.00 0.00 N ATOM 935 CA VAL A 62 -8.024 -2.791 7.438 1.00 0.00 C ATOM 936 C VAL A 62 -7.782 -3.691 8.652 1.00 0.00 C ATOM 937 O VAL A 62 -7.330 -4.825 8.508 1.00 0.00 O ATOM 938 CB VAL A 62 -6.900 -1.776 7.213 1.00 0.00 C ATOM 939 CG1 VAL A 62 -5.609 -2.227 7.897 1.00 0.00 C ATOM 940 CG2 VAL A 62 -6.673 -1.532 5.721 1.00 0.00 C ATOM 0 H VAL A 62 -9.213 -1.105 7.800 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.046 -3.433 6.557 1.00 0.00 H new ATOM 0 HB VAL A 62 -7.206 -0.832 7.664 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.827 -1.488 7.721 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.781 -2.326 8.969 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.298 -3.189 7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.870 -0.807 5.589 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -6.399 -2.469 5.237 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.588 -1.145 5.272 1.00 0.00 H new ATOM 950 N ASP A 63 -8.094 -3.149 9.820 1.00 0.00 N ATOM 951 CA ASP A 63 -7.917 -3.890 11.059 1.00 0.00 C ATOM 952 C ASP A 63 -9.175 -3.748 11.916 1.00 0.00 C ATOM 953 O ASP A 63 -9.438 -2.681 12.469 1.00 0.00 O ATOM 954 CB ASP A 63 -6.735 -3.344 11.861 1.00 0.00 C ATOM 955 CG ASP A 63 -6.584 -1.821 11.838 1.00 0.00 C ATOM 956 OD1 ASP A 63 -6.388 -1.287 10.725 1.00 0.00 O ATOM 957 OD2 ASP A 63 -6.668 -1.227 12.935 1.00 0.00 O ATOM 0 H ASP A 63 -8.468 -2.207 9.935 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.730 -4.934 10.805 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.838 -3.668 12.897 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.818 -3.791 11.477 1.00 0.00 H new ATOM 962 N PRO A 64 -9.940 -4.869 12.004 1.00 0.00 N ATOM 963 CA PRO A 64 -11.166 -4.881 12.784 1.00 0.00 C ATOM 964 C PRO A 64 -10.859 -4.932 14.283 1.00 0.00 C ATOM 965 O PRO A 64 -11.496 -4.237 15.074 1.00 0.00 O ATOM 966 CB PRO A 64 -11.934 -6.097 12.293 1.00 0.00 C ATOM 967 CG PRO A 64 -10.914 -6.980 11.594 1.00 0.00 C ATOM 968 CD PRO A 64 -9.661 -6.151 11.362 1.00 0.00 C ATOM 0 HA PRO A 64 -11.758 -3.975 12.653 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.403 -6.624 13.124 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.732 -5.805 11.610 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.686 -7.855 12.203 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.311 -7.345 10.647 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -8.784 -6.629 11.797 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.461 -6.026 10.298 1.00 0.00 H new ATOM 976 N ASP A 65 -9.885 -5.760 14.628 1.00 0.00 N ATOM 977 CA ASP A 65 -9.487 -5.911 16.018 1.00 0.00 C ATOM 978 C ASP A 65 -8.088 -5.324 16.209 1.00 0.00 C ATOM 979 O ASP A 65 -7.522 -5.401 17.298 1.00 0.00 O ATOM 980 CB ASP A 65 -9.439 -7.387 16.420 1.00 0.00 C ATOM 981 CG ASP A 65 -9.843 -7.675 17.867 1.00 0.00 C ATOM 982 OD1 ASP A 65 -9.537 -6.817 18.723 1.00 0.00 O ATOM 983 OD2 ASP A 65 -10.447 -8.748 18.085 1.00 0.00 O ATOM 0 H ASP A 65 -9.359 -6.334 13.969 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.219 -5.392 16.637 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.095 -7.951 15.756 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -8.427 -7.759 16.260 1.00 0.00 H new ATOM 988 N GLY A 66 -7.570 -4.749 15.133 1.00 0.00 N ATOM 989 CA GLY A 66 -6.247 -4.149 15.169 1.00 0.00 C ATOM 990 C GLY A 66 -5.203 -5.087 14.562 1.00 0.00 C ATOM 991 O GLY A 66 -4.136 -5.292 15.141 1.00 0.00 O ATOM 0 H GLY A 66 -8.043 -4.686 14.231 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.256 -3.206 14.622 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -5.977 -3.917 16.199 1.00 0.00 H new ATOM 995 N ASN A 67 -5.545 -5.632 13.403 1.00 0.00 N ATOM 996 CA ASN A 67 -4.649 -6.542 12.712 1.00 0.00 C ATOM 997 C ASN A 67 -3.276 -5.885 12.560 1.00 0.00 C ATOM 998 O ASN A 67 -2.249 -6.555 12.660 1.00 0.00 O ATOM 999 CB ASN A 67 -5.173 -6.871 11.312 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.557 -8.170 10.789 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -4.560 -9.198 11.446 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -4.032 -8.068 9.571 1.00 0.00 N ATOM 0 H ASN A 67 -6.430 -5.460 12.926 1.00 0.00 H new ATOM 0 HA ASN A 67 -4.582 -7.458 13.298 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.259 -6.964 11.338 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -4.939 -6.053 10.631 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -3.599 -8.881 9.133 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.063 -7.177 9.075 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.302 -4.582 12.322 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.072 -3.826 12.156 1.00 0.00 C ATOM 1011 C LEU A 68 -2.403 -2.335 12.068 1.00 0.00 C ATOM 1012 O LEU A 68 -3.558 -1.942 12.221 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.278 -4.351 10.958 1.00 0.00 C ATOM 1014 CG LEU A 68 -1.626 -3.738 9.601 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -2.962 -2.995 9.661 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.494 -2.840 9.099 1.00 0.00 C ATOM 0 H LEU A 68 -4.156 -4.030 12.240 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.424 -3.959 13.022 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.218 -4.183 11.149 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.424 -5.429 10.895 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.740 -4.547 8.880 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.186 -2.569 8.683 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.753 -3.690 9.943 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.901 -2.196 10.400 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.767 -2.417 8.132 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.325 -2.034 9.813 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.417 -3.428 8.993 1.00 0.00 H new ATOM 1028 N HIS A 69 -1.368 -1.546 11.820 1.00 0.00 N ATOM 1029 CA HIS A 69 -1.533 -0.106 11.709 1.00 0.00 C ATOM 1030 C HIS A 69 -0.540 0.448 10.687 1.00 0.00 C ATOM 1031 O HIS A 69 0.672 0.350 10.877 1.00 0.00 O ATOM 1032 CB HIS A 69 -1.407 0.562 13.081 1.00 0.00 C ATOM 1033 CG HIS A 69 -2.663 0.490 13.916 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.171 -0.700 14.407 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -3.506 1.473 14.343 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.271 -0.435 15.095 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -4.478 0.913 15.055 1.00 0.00 N ATOM 0 H HIS A 69 -0.411 -1.877 11.693 1.00 0.00 H new ATOM 0 HA HIS A 69 -2.536 0.122 11.348 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -0.591 0.092 13.629 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -1.135 1.608 12.941 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -3.401 2.528 14.137 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -4.895 -1.159 15.599 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -5.251 1.409 15.498 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.089 1.017 9.625 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.268 1.586 8.570 1.00 0.00 C ATOM 1048 C HIS A 70 0.940 2.294 9.189 1.00 0.00 C ATOM 1049 O HIS A 70 0.819 2.945 10.225 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.097 2.504 7.670 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.270 3.903 8.214 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -2.128 4.200 9.258 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -0.688 5.080 7.847 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -2.058 5.500 9.499 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -1.166 6.046 8.623 1.00 0.00 N ATOM 0 H HIS A 70 -2.094 1.096 9.472 1.00 0.00 H new ATOM 0 HA HIS A 70 0.109 0.790 7.927 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.622 2.562 6.691 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.081 2.059 7.521 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.039 5.206 7.058 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -2.611 6.035 10.257 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -0.909 7.032 8.572 1.00 0.00 H new ATOM 1064 N GLY A 71 2.077 2.145 8.527 1.00 0.00 N ATOM 1065 CA GLY A 71 3.306 2.761 8.996 1.00 0.00 C ATOM 1066 C GLY A 71 3.947 1.927 10.106 1.00 0.00 C ATOM 1067 O GLY A 71 5.156 1.698 10.096 1.00 0.00 O ATOM 0 H GLY A 71 2.173 1.605 7.667 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.004 2.866 8.166 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.096 3.765 9.365 1.00 0.00 H new ATOM 1071 N ASN A 72 3.110 1.496 11.039 1.00 0.00 N ATOM 1072 CA ASN A 72 3.581 0.691 12.153 1.00 0.00 C ATOM 1073 C ASN A 72 2.727 -0.573 12.261 1.00 0.00 C ATOM 1074 O ASN A 72 1.798 -0.633 13.065 1.00 0.00 O ATOM 1075 CB ASN A 72 3.461 1.456 13.473 1.00 0.00 C ATOM 1076 CG ASN A 72 4.252 0.762 14.583 1.00 0.00 C ATOM 1077 OD1 ASN A 72 5.082 -0.100 14.344 1.00 0.00 O ATOM 1078 ND2 ASN A 72 3.950 1.183 15.808 1.00 0.00 N ATOM 0 H ASN A 72 2.109 1.689 11.046 1.00 0.00 H new ATOM 0 HA ASN A 72 4.627 0.443 11.972 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.828 2.474 13.342 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.412 1.530 13.761 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.423 0.780 16.617 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.245 1.908 15.939 1.00 0.00 H new ATOM 1085 N ALA A 73 3.073 -1.554 11.440 1.00 0.00 N ATOM 1086 CA ALA A 73 2.349 -2.814 11.432 1.00 0.00 C ATOM 1087 C ALA A 73 2.519 -3.503 12.787 1.00 0.00 C ATOM 1088 O ALA A 73 3.635 -3.624 13.291 1.00 0.00 O ATOM 1089 CB ALA A 73 2.844 -3.680 10.271 1.00 0.00 C ATOM 0 H ALA A 73 3.845 -1.502 10.776 1.00 0.00 H new ATOM 0 HA ALA A 73 1.283 -2.644 11.280 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.301 -4.625 10.265 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.674 -3.158 9.329 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.910 -3.875 10.391 1.00 0.00 H new ATOM 1095 N LYS A 74 1.397 -3.937 13.341 1.00 0.00 N ATOM 1096 CA LYS A 74 1.407 -4.609 14.628 1.00 0.00 C ATOM 1097 C LYS A 74 2.259 -5.877 14.528 1.00 0.00 C ATOM 1098 O LYS A 74 2.662 -6.273 13.436 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.021 -4.865 15.110 1.00 0.00 C ATOM 1100 CG LYS A 74 -0.681 -3.566 15.580 1.00 0.00 C ATOM 1101 CD LYS A 74 -0.666 -3.464 17.106 1.00 0.00 C ATOM 1102 CE LYS A 74 0.240 -2.324 17.572 1.00 0.00 C ATOM 1103 NZ LYS A 74 1.313 -2.839 18.450 1.00 0.00 N ATOM 0 H LYS A 74 0.473 -3.836 12.921 1.00 0.00 H new ATOM 0 HA LYS A 74 1.865 -3.974 15.386 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.608 -5.304 14.303 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.009 -5.588 15.926 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -0.158 -2.712 15.150 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -1.709 -3.525 15.219 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.679 -3.301 17.473 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.320 -4.405 17.533 1.00 0.00 H new ATOM 0 HE2 LYS A 74 0.678 -1.824 16.708 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -0.349 -1.579 18.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 1.919 -2.051 18.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.890 -3.296 19.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 1.886 -3.533 17.928 1.00 0.00 H new ATOM 1117 N ASP A 75 2.505 -6.478 15.682 1.00 0.00 N ATOM 1118 CA ASP A 75 3.299 -7.693 15.740 1.00 0.00 C ATOM 1119 C ASP A 75 2.490 -8.856 15.161 1.00 0.00 C ATOM 1120 O ASP A 75 2.953 -9.996 15.150 1.00 0.00 O ATOM 1121 CB ASP A 75 3.668 -8.044 17.182 1.00 0.00 C ATOM 1122 CG ASP A 75 4.887 -7.306 17.736 1.00 0.00 C ATOM 1123 OD1 ASP A 75 5.222 -6.249 17.157 1.00 0.00 O ATOM 1124 OD2 ASP A 75 5.457 -7.813 18.727 1.00 0.00 O ATOM 0 H ASP A 75 2.168 -6.146 16.586 1.00 0.00 H new ATOM 0 HA ASP A 75 4.211 -7.526 15.166 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.812 -7.831 17.822 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.853 -9.116 17.243 1.00 0.00 H new ATOM 1129 N PHE A 76 1.293 -8.528 14.696 1.00 0.00 N ATOM 1130 CA PHE A 76 0.414 -9.529 14.118 1.00 0.00 C ATOM 1131 C PHE A 76 0.647 -9.662 12.612 1.00 0.00 C ATOM 1132 O PHE A 76 0.745 -10.770 12.089 1.00 0.00 O ATOM 1133 CB PHE A 76 -1.021 -9.061 14.362 1.00 0.00 C ATOM 1134 CG PHE A 76 -1.221 -8.334 15.695 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -0.665 -8.834 16.831 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -1.955 -7.190 15.743 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -0.850 -8.161 18.067 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.140 -6.517 16.979 1.00 0.00 C ATOM 1139 CZ PHE A 76 -1.583 -7.016 18.115 1.00 0.00 C ATOM 0 H PHE A 76 0.912 -7.582 14.708 1.00 0.00 H new ATOM 0 HA PHE A 76 0.607 -10.500 14.574 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.319 -8.398 13.550 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.685 -9.925 14.328 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.083 -9.743 16.793 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -2.397 -6.794 14.841 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.409 -8.558 18.969 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.723 -5.609 17.017 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.723 -6.503 19.055 1.00 0.00 H new ATOM 1149 N ALA A 77 0.728 -8.513 11.956 1.00 0.00 N ATOM 1150 CA ALA A 77 0.946 -8.485 10.520 1.00 0.00 C ATOM 1151 C ALA A 77 2.281 -9.161 10.200 1.00 0.00 C ATOM 1152 O ALA A 77 2.321 -10.138 9.452 1.00 0.00 O ATOM 1153 CB ALA A 77 0.892 -7.039 10.023 1.00 0.00 C ATOM 0 H ALA A 77 0.647 -7.595 12.393 1.00 0.00 H new ATOM 0 HA ALA A 77 0.162 -9.037 10.001 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.056 -7.018 8.946 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.085 -6.613 10.250 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.667 -6.455 10.519 1.00 0.00 H new ATOM 1159 N MET A 78 3.339 -8.615 10.779 1.00 0.00 N ATOM 1160 CA MET A 78 4.672 -9.152 10.563 1.00 0.00 C ATOM 1161 C MET A 78 4.917 -10.379 11.444 1.00 0.00 C ATOM 1162 O MET A 78 5.999 -10.538 12.007 1.00 0.00 O ATOM 1163 CB MET A 78 5.714 -8.078 10.881 1.00 0.00 C ATOM 1164 CG MET A 78 5.533 -7.543 12.303 1.00 0.00 C ATOM 1165 SD MET A 78 6.746 -8.273 13.391 1.00 0.00 S ATOM 1166 CE MET A 78 5.675 -9.238 14.446 1.00 0.00 C ATOM 0 H MET A 78 3.301 -7.805 11.398 1.00 0.00 H new ATOM 0 HA MET A 78 4.757 -9.454 9.519 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.716 -8.494 10.770 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.627 -7.259 10.167 1.00 0.00 H new ATOM 0 HG2 MET A 78 5.635 -6.458 12.308 1.00 0.00 H new ATOM 0 HG3 MET A 78 4.529 -7.770 12.660 1.00 0.00 H new ATOM 0 HE1 MET A 78 5.706 -8.838 15.459 1.00 0.00 H new ATOM 0 HE2 MET A 78 4.654 -9.191 14.068 1.00 0.00 H new ATOM 0 HE3 MET A 78 6.011 -10.275 14.455 1.00 0.00 H new ATOM 1176 N LYS A 79 3.893 -11.215 11.539 1.00 0.00 N ATOM 1177 CA LYS A 79 3.984 -12.422 12.341 1.00 0.00 C ATOM 1178 C LYS A 79 2.986 -13.455 11.815 1.00 0.00 C ATOM 1179 O LYS A 79 3.342 -14.614 11.603 1.00 0.00 O ATOM 1180 CB LYS A 79 3.803 -12.093 13.825 1.00 0.00 C ATOM 1181 CG LYS A 79 4.206 -13.280 14.703 1.00 0.00 C ATOM 1182 CD LYS A 79 5.693 -13.221 15.055 1.00 0.00 C ATOM 1183 CE LYS A 79 6.158 -14.531 15.693 1.00 0.00 C ATOM 1184 NZ LYS A 79 6.948 -15.327 14.728 1.00 0.00 N ATOM 0 H LYS A 79 2.996 -11.079 11.073 1.00 0.00 H new ATOM 0 HA LYS A 79 4.977 -12.864 12.254 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.406 -11.223 14.084 1.00 0.00 H new ATOM 0 HB3 LYS A 79 2.763 -11.829 14.019 1.00 0.00 H new ATOM 0 HG2 LYS A 79 3.612 -13.279 15.617 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.989 -14.213 14.182 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.276 -13.024 14.155 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.875 -12.394 15.741 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.760 -14.318 16.576 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.294 -15.106 16.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.638 -15.911 15.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.311 -15.942 14.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 7.451 -14.688 14.080 1.00 0.00 H new ATOM 1198 N HIS A 80 1.757 -12.999 11.618 1.00 0.00 N ATOM 1199 CA HIS A 80 0.707 -13.870 11.121 1.00 0.00 C ATOM 1200 C HIS A 80 1.048 -14.326 9.700 1.00 0.00 C ATOM 1201 O HIS A 80 0.357 -15.172 9.134 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.657 -13.183 11.211 1.00 0.00 C ATOM 1203 CG HIS A 80 -0.962 -12.267 10.050 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.046 -11.356 9.553 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.089 -12.134 9.291 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -0.608 -10.708 8.542 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -1.873 -11.191 8.382 1.00 0.00 N ATOM 0 H HIS A 80 1.466 -12.037 11.794 1.00 0.00 H new ATOM 0 HA HIS A 80 0.643 -14.761 11.746 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.433 -13.946 11.272 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.702 -12.608 12.136 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.900 -11.208 9.905 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.001 -12.700 9.410 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -0.145 -9.933 7.949 1.00 0.00 H new ATOM 1216 N GLY A 81 2.112 -13.745 9.166 1.00 0.00 N ATOM 1217 CA GLY A 81 2.553 -14.080 7.823 1.00 0.00 C ATOM 1218 C GLY A 81 4.059 -13.860 7.669 1.00 0.00 C ATOM 1219 O GLY A 81 4.554 -13.690 6.557 1.00 0.00 O ATOM 0 H GLY A 81 2.682 -13.044 9.639 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.310 -15.120 7.605 1.00 0.00 H new ATOM 0 HA3 GLY A 81 2.017 -13.469 7.097 1.00 0.00 H new ATOM 1223 N ALA A 82 4.745 -13.869 8.803 1.00 0.00 N ATOM 1224 CA ALA A 82 6.185 -13.672 8.808 1.00 0.00 C ATOM 1225 C ALA A 82 6.835 -14.717 9.715 1.00 0.00 C ATOM 1226 O ALA A 82 6.324 -15.014 10.794 1.00 0.00 O ATOM 1227 CB ALA A 82 6.503 -12.240 9.247 1.00 0.00 C ATOM 0 H ALA A 82 4.330 -14.010 9.724 1.00 0.00 H new ATOM 0 HA ALA A 82 6.594 -13.805 7.806 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.583 -12.092 9.251 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.043 -11.536 8.554 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.110 -12.071 10.250 1.00 0.00 H new ATOM 1233 N ASP A 83 7.953 -15.250 9.243 1.00 0.00 N ATOM 1234 CA ASP A 83 8.679 -16.258 9.999 1.00 0.00 C ATOM 1235 C ASP A 83 9.301 -15.610 11.238 1.00 0.00 C ATOM 1236 O ASP A 83 9.622 -14.423 11.227 1.00 0.00 O ATOM 1237 CB ASP A 83 9.809 -16.863 9.164 1.00 0.00 C ATOM 1238 CG ASP A 83 9.787 -16.492 7.681 1.00 0.00 C ATOM 1239 OD1 ASP A 83 8.921 -17.046 6.970 1.00 0.00 O ATOM 1240 OD2 ASP A 83 10.638 -15.663 7.290 1.00 0.00 O ATOM 0 H ASP A 83 8.374 -15.003 8.347 1.00 0.00 H new ATOM 0 HA ASP A 83 7.976 -17.043 10.278 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.762 -16.548 9.588 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.764 -17.949 9.252 1.00 0.00 H new ATOM 1245 N GLU A 84 9.453 -16.419 12.276 1.00 0.00 N ATOM 1246 CA GLU A 84 10.032 -15.940 13.519 1.00 0.00 C ATOM 1247 C GLU A 84 11.259 -15.071 13.234 1.00 0.00 C ATOM 1248 O GLU A 84 11.522 -14.108 13.953 1.00 0.00 O ATOM 1249 CB GLU A 84 10.388 -17.105 14.444 1.00 0.00 C ATOM 1250 CG GLU A 84 10.347 -16.674 15.911 1.00 0.00 C ATOM 1251 CD GLU A 84 10.686 -17.844 16.836 1.00 0.00 C ATOM 1252 OE1 GLU A 84 11.752 -18.457 16.609 1.00 0.00 O ATOM 1253 OE2 GLU A 84 9.873 -18.100 17.750 1.00 0.00 O ATOM 0 H GLU A 84 9.185 -17.403 12.282 1.00 0.00 H new ATOM 0 HA GLU A 84 9.289 -15.328 14.030 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.691 -17.927 14.283 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.382 -17.478 14.199 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.053 -15.860 16.074 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.356 -16.290 16.153 1.00 0.00 H new ATOM 1260 N THR A 85 11.976 -15.443 12.184 1.00 0.00 N ATOM 1261 CA THR A 85 13.169 -14.710 11.795 1.00 0.00 C ATOM 1262 C THR A 85 12.791 -13.458 11.003 1.00 0.00 C ATOM 1263 O THR A 85 13.358 -12.388 11.218 1.00 0.00 O ATOM 1264 CB THR A 85 14.081 -15.666 11.023 1.00 0.00 C ATOM 1265 OG1 THR A 85 15.367 -15.057 11.100 1.00 0.00 O ATOM 1266 CG2 THR A 85 13.768 -15.690 9.525 1.00 0.00 C ATOM 0 H THR A 85 11.754 -16.242 11.591 1.00 0.00 H new ATOM 0 HA THR A 85 13.715 -14.351 12.668 1.00 0.00 H new ATOM 0 HB THR A 85 13.982 -16.672 11.431 1.00 0.00 H new ATOM 0 HG1 THR A 85 16.021 -15.612 10.626 1.00 0.00 H new ATOM 0 HG21 THR A 85 14.443 -16.384 9.023 1.00 0.00 H new ATOM 0 HG22 THR A 85 12.738 -16.013 9.374 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.900 -14.691 9.110 1.00 0.00 H new ATOM 1274 N MET A 86 11.836 -13.633 10.103 1.00 0.00 N ATOM 1275 CA MET A 86 11.374 -12.529 9.275 1.00 0.00 C ATOM 1276 C MET A 86 10.953 -11.337 10.137 1.00 0.00 C ATOM 1277 O MET A 86 11.279 -10.194 9.823 1.00 0.00 O ATOM 1278 CB MET A 86 10.189 -12.988 8.425 1.00 0.00 C ATOM 1279 CG MET A 86 9.278 -11.812 8.073 1.00 0.00 C ATOM 1280 SD MET A 86 10.171 -10.623 7.087 1.00 0.00 S ATOM 1281 CE MET A 86 9.824 -11.252 5.453 1.00 0.00 C ATOM 0 H MET A 86 11.368 -14.522 9.928 1.00 0.00 H new ATOM 0 HA MET A 86 12.195 -12.216 8.630 1.00 0.00 H new ATOM 0 HB2 MET A 86 10.553 -13.457 7.511 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.620 -13.744 8.966 1.00 0.00 H new ATOM 0 HG2 MET A 86 8.405 -12.168 7.526 1.00 0.00 H new ATOM 0 HG3 MET A 86 8.912 -11.339 8.984 1.00 0.00 H new ATOM 0 HE1 MET A 86 10.311 -10.621 4.709 1.00 0.00 H new ATOM 0 HE2 MET A 86 10.202 -12.271 5.368 1.00 0.00 H new ATOM 0 HE3 MET A 86 8.747 -11.249 5.283 1.00 0.00 H new ATOM 1291 N ALA A 87 10.236 -11.646 11.209 1.00 0.00 N ATOM 1292 CA ALA A 87 9.766 -10.615 12.117 1.00 0.00 C ATOM 1293 C ALA A 87 10.946 -9.735 12.535 1.00 0.00 C ATOM 1294 O ALA A 87 10.852 -8.508 12.502 1.00 0.00 O ATOM 1295 CB ALA A 87 9.072 -11.267 13.314 1.00 0.00 C ATOM 0 H ALA A 87 9.970 -12.596 11.468 1.00 0.00 H new ATOM 0 HA ALA A 87 9.034 -9.974 11.626 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.719 -10.493 13.996 1.00 0.00 H new ATOM 0 HB2 ALA A 87 8.225 -11.858 12.966 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.777 -11.915 13.835 1.00 0.00 H new ATOM 1301 N GLN A 88 12.029 -10.394 12.919 1.00 0.00 N ATOM 1302 CA GLN A 88 13.226 -9.687 13.344 1.00 0.00 C ATOM 1303 C GLN A 88 13.938 -9.078 12.135 1.00 0.00 C ATOM 1304 O GLN A 88 14.454 -7.964 12.211 1.00 0.00 O ATOM 1305 CB GLN A 88 14.162 -10.613 14.123 1.00 0.00 C ATOM 1306 CG GLN A 88 15.577 -10.034 14.186 1.00 0.00 C ATOM 1307 CD GLN A 88 16.503 -10.739 13.193 1.00 0.00 C ATOM 1308 OE1 GLN A 88 17.019 -11.816 13.443 1.00 0.00 O ATOM 1309 NE2 GLN A 88 16.684 -10.073 12.056 1.00 0.00 N ATOM 0 H GLN A 88 12.103 -11.411 12.945 1.00 0.00 H new ATOM 0 HA GLN A 88 12.930 -8.879 14.013 1.00 0.00 H new ATOM 0 HB2 GLN A 88 13.779 -10.757 15.133 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.187 -11.594 13.648 1.00 0.00 H new ATOM 0 HG2 GLN A 88 15.547 -8.967 13.966 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.973 -10.140 15.196 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.221 -9.175 11.912 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.285 -10.460 11.329 1.00 0.00 H new ATOM 1318 N GLN A 89 13.943 -9.834 11.047 1.00 0.00 N ATOM 1319 CA GLN A 89 14.584 -9.381 9.824 1.00 0.00 C ATOM 1320 C GLN A 89 14.119 -7.967 9.473 1.00 0.00 C ATOM 1321 O GLN A 89 14.940 -7.073 9.267 1.00 0.00 O ATOM 1322 CB GLN A 89 14.310 -10.350 8.672 1.00 0.00 C ATOM 1323 CG GLN A 89 15.090 -11.653 8.853 1.00 0.00 C ATOM 1324 CD GLN A 89 15.569 -12.198 7.505 1.00 0.00 C ATOM 1325 OE1 GLN A 89 14.825 -12.806 6.753 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.847 -11.946 7.242 1.00 0.00 N ATOM 0 H GLN A 89 13.513 -10.757 10.987 1.00 0.00 H new ATOM 0 HA GLN A 89 15.661 -9.357 9.988 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.243 -10.565 8.620 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.588 -9.884 7.727 1.00 0.00 H new ATOM 0 HG2 GLN A 89 15.947 -11.481 9.505 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.459 -12.393 9.345 1.00 0.00 H new ATOM 0 HE21 GLN A 89 17.414 -11.431 7.915 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.260 -12.267 6.367 1.00 0.00 H new ATOM 1335 N LEU A 90 12.806 -7.807 9.416 1.00 0.00 N ATOM 1336 CA LEU A 90 12.222 -6.516 9.094 1.00 0.00 C ATOM 1337 C LEU A 90 12.898 -5.432 9.936 1.00 0.00 C ATOM 1338 O LEU A 90 13.302 -4.394 9.411 1.00 0.00 O ATOM 1339 CB LEU A 90 10.700 -6.560 9.255 1.00 0.00 C ATOM 1340 CG LEU A 90 9.980 -7.678 8.502 1.00 0.00 C ATOM 1341 CD1 LEU A 90 8.612 -7.967 9.126 1.00 0.00 C ATOM 1342 CD2 LEU A 90 9.871 -7.355 7.010 1.00 0.00 C ATOM 0 H LEU A 90 12.129 -8.550 9.587 1.00 0.00 H new ATOM 0 HA LEU A 90 12.401 -6.267 8.048 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.469 -6.656 10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.292 -5.605 8.925 1.00 0.00 H new ATOM 0 HG LEU A 90 10.575 -8.587 8.592 1.00 0.00 H new ATOM 0 HD11 LEU A 90 8.121 -8.766 8.571 1.00 0.00 H new ATOM 0 HD12 LEU A 90 8.743 -8.273 10.164 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.997 -7.068 9.088 1.00 0.00 H new ATOM 0 HD21 LEU A 90 9.355 -8.167 6.499 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.311 -6.429 6.878 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.870 -7.238 6.589 1.00 0.00 H new ATOM 1354 N VAL A 91 13.000 -5.707 11.228 1.00 0.00 N ATOM 1355 CA VAL A 91 13.619 -4.769 12.147 1.00 0.00 C ATOM 1356 C VAL A 91 15.012 -4.400 11.630 1.00 0.00 C ATOM 1357 O VAL A 91 15.584 -3.392 12.042 1.00 0.00 O ATOM 1358 CB VAL A 91 13.643 -5.356 13.559 1.00 0.00 C ATOM 1359 CG1 VAL A 91 13.900 -4.268 14.602 1.00 0.00 C ATOM 1360 CG2 VAL A 91 12.345 -6.107 13.861 1.00 0.00 C ATOM 0 H VAL A 91 12.664 -6.568 11.660 1.00 0.00 H new ATOM 0 HA VAL A 91 13.037 -3.849 12.202 1.00 0.00 H new ATOM 0 HB VAL A 91 14.465 -6.070 13.611 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.912 -4.713 15.597 1.00 0.00 H new ATOM 0 HG12 VAL A 91 14.862 -3.795 14.405 1.00 0.00 H new ATOM 0 HG13 VAL A 91 13.110 -3.519 14.549 1.00 0.00 H new ATOM 0 HG21 VAL A 91 12.387 -6.515 14.871 1.00 0.00 H new ATOM 0 HG22 VAL A 91 11.501 -5.422 13.781 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.220 -6.920 13.146 1.00 0.00 H new ATOM 1370 N ASP A 92 15.519 -5.238 10.737 1.00 0.00 N ATOM 1371 CA ASP A 92 16.833 -5.014 10.162 1.00 0.00 C ATOM 1372 C ASP A 92 16.750 -3.877 9.141 1.00 0.00 C ATOM 1373 O ASP A 92 17.303 -2.800 9.361 1.00 0.00 O ATOM 1374 CB ASP A 92 17.337 -6.264 9.436 1.00 0.00 C ATOM 1375 CG ASP A 92 17.227 -7.563 10.236 1.00 0.00 C ATOM 1376 OD1 ASP A 92 16.647 -7.501 11.342 1.00 0.00 O ATOM 1377 OD2 ASP A 92 17.725 -8.590 9.722 1.00 0.00 O ATOM 0 H ASP A 92 15.042 -6.074 10.398 1.00 0.00 H new ATOM 0 HA ASP A 92 17.518 -4.766 10.973 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.777 -6.378 8.508 1.00 0.00 H new ATOM 0 HB3 ASP A 92 18.381 -6.111 9.162 1.00 0.00 H new ATOM 1382 N ILE A 93 16.057 -4.154 8.048 1.00 0.00 N ATOM 1383 CA ILE A 93 15.894 -3.168 6.993 1.00 0.00 C ATOM 1384 C ILE A 93 15.063 -1.997 7.520 1.00 0.00 C ATOM 1385 O ILE A 93 15.425 -0.837 7.323 1.00 0.00 O ATOM 1386 CB ILE A 93 15.313 -3.819 5.736 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.792 -3.659 5.689 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.739 -5.284 5.630 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.104 -4.686 6.590 1.00 0.00 C ATOM 0 H ILE A 93 15.601 -5.049 7.869 1.00 0.00 H new ATOM 0 HA ILE A 93 16.862 -2.764 6.696 1.00 0.00 H new ATOM 0 HB ILE A 93 15.718 -3.303 4.866 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.519 -2.652 6.005 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.442 -3.777 4.664 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.312 -5.723 4.728 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.826 -5.344 5.584 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.382 -5.831 6.503 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.024 -4.550 6.538 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.360 -5.692 6.257 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.438 -4.549 7.619 1.00 0.00 H new ATOM 1401 N ILE A 94 13.966 -2.340 8.179 1.00 0.00 N ATOM 1402 CA ILE A 94 13.082 -1.330 8.735 1.00 0.00 C ATOM 1403 C ILE A 94 13.896 -0.358 9.589 1.00 0.00 C ATOM 1404 O ILE A 94 13.500 0.790 9.779 1.00 0.00 O ATOM 1405 CB ILE A 94 11.925 -1.990 9.489 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.061 -2.827 8.544 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.100 -0.947 10.248 1.00 0.00 C ATOM 1408 CD1 ILE A 94 9.572 -2.619 8.833 1.00 0.00 C ATOM 0 H ILE A 94 13.669 -3.303 8.340 1.00 0.00 H new ATOM 0 HA ILE A 94 12.623 -0.745 7.938 1.00 0.00 H new ATOM 0 HB ILE A 94 12.344 -2.671 10.230 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.276 -2.554 7.511 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.313 -3.882 8.654 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.284 -1.442 10.775 1.00 0.00 H new ATOM 0 HG22 ILE A 94 11.737 -0.432 10.967 1.00 0.00 H new ATOM 0 HG23 ILE A 94 10.690 -0.224 9.543 1.00 0.00 H new ATOM 0 HD11 ILE A 94 8.980 -3.225 8.147 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.356 -2.916 9.859 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.319 -1.567 8.698 1.00 0.00 H new ATOM 1420 N HIS A 95 15.023 -0.853 10.081 1.00 0.00 N ATOM 1421 CA HIS A 95 15.897 -0.043 10.912 1.00 0.00 C ATOM 1422 C HIS A 95 16.682 0.933 10.031 1.00 0.00 C ATOM 1423 O HIS A 95 17.039 2.024 10.471 1.00 0.00 O ATOM 1424 CB HIS A 95 16.805 -0.926 11.770 1.00 0.00 C ATOM 1425 CG HIS A 95 16.320 -1.109 13.188 1.00 0.00 C ATOM 1426 ND1 HIS A 95 17.162 -1.032 14.284 1.00 0.00 N ATOM 1427 CD2 HIS A 95 15.073 -1.366 13.678 1.00 0.00 C ATOM 1428 CE1 HIS A 95 16.443 -1.235 15.379 1.00 0.00 C ATOM 1429 NE2 HIS A 95 15.149 -1.442 15.000 1.00 0.00 N ATOM 0 H HIS A 95 15.351 -1.805 9.920 1.00 0.00 H new ATOM 0 HA HIS A 95 15.299 0.546 11.607 1.00 0.00 H new ATOM 0 HB2 HIS A 95 16.895 -1.905 11.298 1.00 0.00 H new ATOM 0 HB3 HIS A 95 17.804 -0.490 11.792 1.00 0.00 H new ATOM 0 HD2 HIS A 95 14.176 -1.487 13.089 1.00 0.00 H new ATOM 0 HE1 HIS A 95 16.816 -1.236 16.393 1.00 0.00 H new ATOM 0 HE2 HIS A 95 14.368 -1.625 15.630 1.00 0.00 H new ATOM 1438 N GLY A 96 16.926 0.504 8.801 1.00 0.00 N ATOM 1439 CA GLY A 96 17.661 1.325 7.854 1.00 0.00 C ATOM 1440 C GLY A 96 16.715 2.238 7.070 1.00 0.00 C ATOM 1441 O GLY A 96 17.126 3.288 6.579 1.00 0.00 O ATOM 0 H GLY A 96 16.628 -0.402 8.439 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.397 1.928 8.385 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.211 0.686 7.163 1.00 0.00 H new ATOM 1445 N CYS A 97 15.466 1.803 6.977 1.00 0.00 N ATOM 1446 CA CYS A 97 14.459 2.568 6.263 1.00 0.00 C ATOM 1447 C CYS A 97 13.780 3.514 7.255 1.00 0.00 C ATOM 1448 O CYS A 97 13.844 4.732 7.099 1.00 0.00 O ATOM 1449 CB CYS A 97 13.451 1.657 5.561 1.00 0.00 C ATOM 1450 SG CYS A 97 13.978 1.052 3.916 1.00 0.00 S ATOM 0 H CYS A 97 15.130 0.931 7.385 1.00 0.00 H new ATOM 0 HA CYS A 97 14.933 3.152 5.474 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.251 0.798 6.202 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.511 2.197 5.450 1.00 0.00 H new ATOM 1455 N GLU A 98 13.145 2.917 8.253 1.00 0.00 N ATOM 1456 CA GLU A 98 12.454 3.691 9.270 1.00 0.00 C ATOM 1457 C GLU A 98 13.335 4.846 9.747 1.00 0.00 C ATOM 1458 O GLU A 98 12.833 5.914 10.096 1.00 0.00 O ATOM 1459 CB GLU A 98 12.032 2.802 10.442 1.00 0.00 C ATOM 1460 CG GLU A 98 10.976 3.498 11.304 1.00 0.00 C ATOM 1461 CD GLU A 98 11.147 3.133 12.781 1.00 0.00 C ATOM 1462 OE1 GLU A 98 10.663 2.042 13.155 1.00 0.00 O ATOM 1463 OE2 GLU A 98 11.757 3.951 13.501 1.00 0.00 O ATOM 0 H GLU A 98 13.095 1.906 8.379 1.00 0.00 H new ATOM 0 HA GLU A 98 11.549 4.109 8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.635 1.860 10.064 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.903 2.560 11.052 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.055 4.578 11.181 1.00 0.00 H new ATOM 0 HG3 GLU A 98 9.980 3.211 10.968 1.00 0.00 H new ATOM 1470 N LYS A 99 14.638 4.594 9.748 1.00 0.00 N ATOM 1471 CA LYS A 99 15.593 5.600 10.178 1.00 0.00 C ATOM 1472 C LYS A 99 15.729 6.667 9.087 1.00 0.00 C ATOM 1473 O LYS A 99 15.990 7.831 9.383 1.00 0.00 O ATOM 1474 CB LYS A 99 16.921 4.948 10.567 1.00 0.00 C ATOM 1475 CG LYS A 99 17.753 4.614 9.327 1.00 0.00 C ATOM 1476 CD LYS A 99 19.030 5.453 9.281 1.00 0.00 C ATOM 1477 CE LYS A 99 19.192 6.132 7.921 1.00 0.00 C ATOM 1478 NZ LYS A 99 20.625 6.316 7.601 1.00 0.00 N ATOM 0 H LYS A 99 15.052 3.708 9.458 1.00 0.00 H new ATOM 0 HA LYS A 99 15.236 6.104 11.076 1.00 0.00 H new ATOM 0 HB2 LYS A 99 17.483 5.619 11.216 1.00 0.00 H new ATOM 0 HB3 LYS A 99 16.730 4.039 11.137 1.00 0.00 H new ATOM 0 HG2 LYS A 99 18.010 3.555 9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 99 17.162 4.795 8.429 1.00 0.00 H new ATOM 0 HD2 LYS A 99 19.002 6.208 10.067 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.894 4.818 9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 99 18.715 5.529 7.148 1.00 0.00 H new ATOM 0 HE3 LYS A 99 18.688 7.098 7.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 20.717 6.778 6.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 21.070 6.910 8.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 21.096 5.389 7.574 1.00 0.00 H new ATOM 1492 N SER A 100 15.545 6.228 7.850 1.00 0.00 N ATOM 1493 CA SER A 100 15.645 7.130 6.716 1.00 0.00 C ATOM 1494 C SER A 100 14.257 7.655 6.341 1.00 0.00 C ATOM 1495 O SER A 100 14.131 8.539 5.495 1.00 0.00 O ATOM 1496 CB SER A 100 16.291 6.436 5.515 1.00 0.00 C ATOM 1497 OG SER A 100 17.449 7.129 5.058 1.00 0.00 O ATOM 0 H SER A 100 15.328 5.261 7.609 1.00 0.00 H new ATOM 0 HA SER A 100 16.280 7.969 7.002 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.563 5.416 5.788 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.566 6.366 4.704 1.00 0.00 H new ATOM 0 HG SER A 100 17.833 6.654 4.292 1.00 0.00 H new ATOM 1503 N ALA A 101 13.251 7.089 6.990 1.00 0.00 N ATOM 1504 CA ALA A 101 11.876 7.488 6.736 1.00 0.00 C ATOM 1505 C ALA A 101 11.289 8.111 8.003 1.00 0.00 C ATOM 1506 O ALA A 101 10.570 7.448 8.749 1.00 0.00 O ATOM 1507 CB ALA A 101 11.074 6.279 6.255 1.00 0.00 C ATOM 0 H ALA A 101 13.360 6.357 7.692 1.00 0.00 H new ATOM 0 HA ALA A 101 11.834 8.240 5.948 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.043 6.578 6.065 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.515 5.892 5.336 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.091 5.503 7.020 1.00 0.00 H new ATOM 1513 N PRO A 102 11.625 9.411 8.214 1.00 0.00 N ATOM 1514 CA PRO A 102 11.138 10.131 9.379 1.00 0.00 C ATOM 1515 C PRO A 102 9.663 10.504 9.217 1.00 0.00 C ATOM 1516 O PRO A 102 9.089 10.331 8.141 1.00 0.00 O ATOM 1517 CB PRO A 102 12.046 11.344 9.499 1.00 0.00 C ATOM 1518 CG PRO A 102 12.707 11.508 8.140 1.00 0.00 C ATOM 1519 CD PRO A 102 12.474 10.229 7.352 1.00 0.00 C ATOM 0 HA PRO A 102 11.173 9.531 10.288 1.00 0.00 H new ATOM 0 HB2 PRO A 102 11.475 12.234 9.765 1.00 0.00 H new ATOM 0 HB3 PRO A 102 12.792 11.198 10.281 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.287 12.364 7.612 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.774 11.697 8.255 1.00 0.00 H new ATOM 0 HD2 PRO A 102 11.988 10.435 6.398 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.414 9.725 7.129 1.00 0.00 H new ATOM 1527 N PRO A 103 9.074 11.020 10.329 1.00 0.00 N ATOM 1528 CA PRO A 103 7.677 11.417 10.320 1.00 0.00 C ATOM 1529 C PRO A 103 7.486 12.736 9.566 1.00 0.00 C ATOM 1530 O PRO A 103 6.748 13.610 10.015 1.00 0.00 O ATOM 1531 CB PRO A 103 7.286 11.510 11.785 1.00 0.00 C ATOM 1532 CG PRO A 103 8.589 11.617 12.559 1.00 0.00 C ATOM 1533 CD PRO A 103 9.722 11.239 11.619 1.00 0.00 C ATOM 0 HA PRO A 103 7.041 10.704 9.795 1.00 0.00 H new ATOM 0 HB2 PRO A 103 6.652 12.378 11.966 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.719 10.632 12.094 1.00 0.00 H new ATOM 0 HG2 PRO A 103 8.727 12.631 12.935 1.00 0.00 H new ATOM 0 HG3 PRO A 103 8.574 10.955 13.425 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.468 12.032 11.558 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.238 10.342 11.961 1.00 0.00 H new ATOM 1541 N ASN A 104 8.165 12.833 8.431 1.00 0.00 N ATOM 1542 CA ASN A 104 8.079 14.028 7.610 1.00 0.00 C ATOM 1543 C ASN A 104 6.636 14.216 7.137 1.00 0.00 C ATOM 1544 O ASN A 104 5.902 13.242 6.973 1.00 0.00 O ATOM 1545 CB ASN A 104 8.970 13.911 6.372 1.00 0.00 C ATOM 1546 CG ASN A 104 9.249 15.287 5.764 1.00 0.00 C ATOM 1547 OD1 ASN A 104 8.426 15.870 5.077 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.452 15.774 6.054 1.00 0.00 N ATOM 0 H ASN A 104 8.776 12.104 8.062 1.00 0.00 H new ATOM 0 HA ASN A 104 8.408 14.874 8.213 1.00 0.00 H new ATOM 0 HB2 ASN A 104 9.911 13.431 6.641 1.00 0.00 H new ATOM 0 HB3 ASN A 104 8.487 13.273 5.631 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.733 16.687 5.696 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.094 15.235 6.635 1.00 0.00 H new ATOM 1555 N ASP A 105 6.272 15.474 6.934 1.00 0.00 N ATOM 1556 CA ASP A 105 4.929 15.801 6.484 1.00 0.00 C ATOM 1557 C ASP A 105 4.601 14.980 5.234 1.00 0.00 C ATOM 1558 O ASP A 105 3.433 14.725 4.945 1.00 0.00 O ATOM 1559 CB ASP A 105 4.816 17.282 6.119 1.00 0.00 C ATOM 1560 CG ASP A 105 4.968 18.250 7.295 1.00 0.00 C ATOM 1561 OD1 ASP A 105 4.467 17.901 8.385 1.00 0.00 O ATOM 1562 OD2 ASP A 105 5.580 19.318 7.074 1.00 0.00 O ATOM 0 H ASP A 105 6.883 16.279 7.073 1.00 0.00 H new ATOM 0 HA ASP A 105 4.237 15.576 7.295 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.576 17.516 5.374 1.00 0.00 H new ATOM 0 HB3 ASP A 105 3.847 17.453 5.650 1.00 0.00 H new ATOM 1567 N ASP A 106 5.652 14.589 4.529 1.00 0.00 N ATOM 1568 CA ASP A 106 5.490 13.803 3.318 1.00 0.00 C ATOM 1569 C ASP A 106 5.363 12.324 3.688 1.00 0.00 C ATOM 1570 O ASP A 106 5.734 11.450 2.907 1.00 0.00 O ATOM 1571 CB ASP A 106 6.700 13.956 2.395 1.00 0.00 C ATOM 1572 CG ASP A 106 7.403 15.314 2.471 1.00 0.00 C ATOM 1573 OD1 ASP A 106 6.675 16.329 2.499 1.00 0.00 O ATOM 1574 OD2 ASP A 106 8.653 15.304 2.500 1.00 0.00 O ATOM 0 H ASP A 106 6.619 14.802 4.773 1.00 0.00 H new ATOM 0 HA ASP A 106 4.597 14.158 2.804 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.422 13.176 2.635 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.378 13.787 1.367 1.00 0.00 H new ATOM 1579 N LYS A 107 4.836 12.089 4.881 1.00 0.00 N ATOM 1580 CA LYS A 107 4.656 10.730 5.365 1.00 0.00 C ATOM 1581 C LYS A 107 4.170 9.845 4.217 1.00 0.00 C ATOM 1582 O LYS A 107 4.449 8.647 4.190 1.00 0.00 O ATOM 1583 CB LYS A 107 3.733 10.715 6.586 1.00 0.00 C ATOM 1584 CG LYS A 107 2.290 11.031 6.188 1.00 0.00 C ATOM 1585 CD LYS A 107 1.473 11.481 7.400 1.00 0.00 C ATOM 1586 CE LYS A 107 0.260 10.572 7.610 1.00 0.00 C ATOM 1587 NZ LYS A 107 -0.949 11.378 7.893 1.00 0.00 N ATOM 0 H LYS A 107 4.528 12.816 5.527 1.00 0.00 H new ATOM 0 HA LYS A 107 5.606 10.318 5.706 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.776 9.737 7.066 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.080 11.445 7.317 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.281 11.813 5.429 1.00 0.00 H new ATOM 0 HG3 LYS A 107 1.830 10.149 5.742 1.00 0.00 H new ATOM 0 HD2 LYS A 107 2.100 11.468 8.291 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.141 12.510 7.258 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.098 9.961 6.722 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.450 9.888 8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.763 10.746 8.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.797 11.942 8.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.138 12.013 7.092 1.00 0.00 H new ATOM 1601 N CYS A 108 3.451 10.468 3.294 1.00 0.00 N ATOM 1602 CA CYS A 108 2.924 9.751 2.145 1.00 0.00 C ATOM 1603 C CYS A 108 4.086 9.043 1.446 1.00 0.00 C ATOM 1604 O CYS A 108 4.007 7.849 1.159 1.00 0.00 O ATOM 1605 CB CYS A 108 2.170 10.683 1.195 1.00 0.00 C ATOM 1606 SG CYS A 108 0.946 9.854 0.118 1.00 0.00 S ATOM 0 H CYS A 108 3.221 11.461 3.319 1.00 0.00 H new ATOM 0 HA CYS A 108 2.196 9.011 2.477 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.658 11.443 1.785 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.894 11.201 0.566 1.00 0.00 H new ATOM 1611 N MET A 109 5.137 9.808 1.192 1.00 0.00 N ATOM 1612 CA MET A 109 6.314 9.268 0.533 1.00 0.00 C ATOM 1613 C MET A 109 7.440 9.019 1.538 1.00 0.00 C ATOM 1614 O MET A 109 8.491 8.490 1.180 1.00 0.00 O ATOM 1615 CB MET A 109 6.793 10.250 -0.539 1.00 0.00 C ATOM 1616 CG MET A 109 6.984 11.650 0.045 1.00 0.00 C ATOM 1617 SD MET A 109 8.243 12.525 -0.869 1.00 0.00 S ATOM 1618 CE MET A 109 9.704 11.932 -0.033 1.00 0.00 C ATOM 0 H MET A 109 5.198 10.798 1.431 1.00 0.00 H new ATOM 0 HA MET A 109 6.047 8.316 0.074 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.733 9.899 -0.965 1.00 0.00 H new ATOM 0 HB3 MET A 109 6.069 10.287 -1.353 1.00 0.00 H new ATOM 0 HG2 MET A 109 6.044 12.201 0.005 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.268 11.580 1.095 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.589 12.208 -0.607 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.761 12.378 0.960 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.655 10.847 0.059 1.00 0.00 H new ATOM 1628 N LYS A 110 7.183 9.413 2.776 1.00 0.00 N ATOM 1629 CA LYS A 110 8.162 9.239 3.836 1.00 0.00 C ATOM 1630 C LYS A 110 7.961 7.871 4.491 1.00 0.00 C ATOM 1631 O LYS A 110 8.693 6.927 4.199 1.00 0.00 O ATOM 1632 CB LYS A 110 8.099 10.409 4.822 1.00 0.00 C ATOM 1633 CG LYS A 110 9.502 10.882 5.201 1.00 0.00 C ATOM 1634 CD LYS A 110 10.184 11.575 4.019 1.00 0.00 C ATOM 1635 CE LYS A 110 11.431 10.805 3.577 1.00 0.00 C ATOM 1636 NZ LYS A 110 11.881 11.268 2.245 1.00 0.00 N ATOM 0 H LYS A 110 6.311 9.852 3.069 1.00 0.00 H new ATOM 0 HA LYS A 110 9.172 9.251 3.427 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.541 11.233 4.378 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.559 10.105 5.719 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.443 11.569 6.045 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.102 10.031 5.524 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.486 11.652 3.186 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.460 12.592 4.299 1.00 0.00 H new ATOM 0 HE2 LYS A 110 12.229 10.945 4.306 1.00 0.00 H new ATOM 0 HE3 LYS A 110 11.213 9.737 3.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 12.919 11.223 2.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.471 10.658 1.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.570 12.249 2.095 1.00 0.00 H new ATOM 1650 N THR A 111 6.967 7.809 5.364 1.00 0.00 N ATOM 1651 CA THR A 111 6.661 6.571 6.062 1.00 0.00 C ATOM 1652 C THR A 111 6.576 5.407 5.073 1.00 0.00 C ATOM 1653 O THR A 111 7.119 4.333 5.326 1.00 0.00 O ATOM 1654 CB THR A 111 5.373 6.785 6.861 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.542 8.068 7.456 1.00 0.00 O ATOM 1656 CG2 THR A 111 5.259 5.834 8.052 1.00 0.00 C ATOM 0 H THR A 111 6.363 8.595 5.604 1.00 0.00 H new ATOM 0 HA THR A 111 7.454 6.305 6.761 1.00 0.00 H new ATOM 0 HB THR A 111 4.513 6.650 6.205 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.935 8.157 8.220 1.00 0.00 H new ATOM 0 HG21 THR A 111 4.328 6.028 8.585 1.00 0.00 H new ATOM 0 HG22 THR A 111 5.266 4.804 7.697 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.102 5.992 8.725 1.00 0.00 H new ATOM 1664 N ILE A 112 5.892 5.660 3.967 1.00 0.00 N ATOM 1665 CA ILE A 112 5.729 4.648 2.938 1.00 0.00 C ATOM 1666 C ILE A 112 7.089 4.016 2.631 1.00 0.00 C ATOM 1667 O ILE A 112 7.210 2.793 2.572 1.00 0.00 O ATOM 1668 CB ILE A 112 5.033 5.237 1.711 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.360 4.140 0.882 1.00 0.00 C ATOM 1670 CG2 ILE A 112 6.007 6.071 0.875 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.342 3.010 0.569 1.00 0.00 C ATOM 0 H ILE A 112 5.444 6.553 3.761 1.00 0.00 H new ATOM 0 HA ILE A 112 5.077 3.848 3.290 1.00 0.00 H new ATOM 0 HB ILE A 112 4.247 5.909 2.055 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.503 3.742 1.426 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.979 4.563 -0.047 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.486 6.478 0.008 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.398 6.889 1.480 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.831 5.441 0.540 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.839 2.244 -0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.186 3.407 0.004 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.702 2.573 1.500 1.00 0.00 H new ATOM 1683 N ASP A 113 8.077 4.879 2.444 1.00 0.00 N ATOM 1684 CA ASP A 113 9.423 4.421 2.145 1.00 0.00 C ATOM 1685 C ASP A 113 9.729 3.172 2.973 1.00 0.00 C ATOM 1686 O ASP A 113 10.070 2.126 2.423 1.00 0.00 O ATOM 1687 CB ASP A 113 10.459 5.489 2.500 1.00 0.00 C ATOM 1688 CG ASP A 113 11.635 5.599 1.526 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.370 5.526 0.307 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.771 5.752 2.023 1.00 0.00 O ATOM 0 H ASP A 113 7.972 5.892 2.494 1.00 0.00 H new ATOM 0 HA ASP A 113 9.477 4.207 1.078 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.959 6.456 2.552 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.850 5.278 3.495 1.00 0.00 H new ATOM 1695 N VAL A 114 9.595 3.322 4.283 1.00 0.00 N ATOM 1696 CA VAL A 114 9.852 2.219 5.192 1.00 0.00 C ATOM 1697 C VAL A 114 8.657 1.265 5.182 1.00 0.00 C ATOM 1698 O VAL A 114 8.827 0.051 5.066 1.00 0.00 O ATOM 1699 CB VAL A 114 10.175 2.756 6.589 1.00 0.00 C ATOM 1700 CG1 VAL A 114 9.222 3.891 6.973 1.00 0.00 C ATOM 1701 CG2 VAL A 114 10.140 1.634 7.630 1.00 0.00 C ATOM 0 H VAL A 114 9.312 4.191 4.736 1.00 0.00 H new ATOM 0 HA VAL A 114 10.724 1.652 4.866 1.00 0.00 H new ATOM 0 HB VAL A 114 11.187 3.160 6.567 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.472 4.255 7.969 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.318 4.705 6.255 1.00 0.00 H new ATOM 0 HG13 VAL A 114 8.196 3.522 6.969 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.373 2.043 8.613 1.00 0.00 H new ATOM 0 HG22 VAL A 114 9.146 1.186 7.649 1.00 0.00 H new ATOM 0 HG23 VAL A 114 10.876 0.873 7.370 1.00 0.00 H new ATOM 1711 N ALA A 115 7.473 1.847 5.303 1.00 0.00 N ATOM 1712 CA ALA A 115 6.250 1.062 5.307 1.00 0.00 C ATOM 1713 C ALA A 115 6.293 0.052 4.161 1.00 0.00 C ATOM 1714 O ALA A 115 5.641 -0.991 4.222 1.00 0.00 O ATOM 1715 CB ALA A 115 5.044 1.999 5.215 1.00 0.00 C ATOM 0 H ALA A 115 7.334 2.853 5.399 1.00 0.00 H new ATOM 0 HA ALA A 115 6.157 0.500 6.236 1.00 0.00 H new ATOM 0 HB1 ALA A 115 4.126 1.412 5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 115 5.044 2.677 6.069 1.00 0.00 H new ATOM 0 HB3 ALA A 115 5.102 2.577 4.293 1.00 0.00 H new ATOM 1721 N MET A 116 7.066 0.394 3.140 1.00 0.00 N ATOM 1722 CA MET A 116 7.202 -0.471 1.982 1.00 0.00 C ATOM 1723 C MET A 116 8.495 -1.287 2.056 1.00 0.00 C ATOM 1724 O MET A 116 8.553 -2.410 1.558 1.00 0.00 O ATOM 1725 CB MET A 116 7.205 0.377 0.709 1.00 0.00 C ATOM 1726 CG MET A 116 6.089 -0.057 -0.244 1.00 0.00 C ATOM 1727 SD MET A 116 4.513 0.021 0.590 1.00 0.00 S ATOM 1728 CE MET A 116 3.423 -0.339 -0.777 1.00 0.00 C ATOM 0 H MET A 116 7.604 1.259 3.092 1.00 0.00 H new ATOM 0 HA MET A 116 6.359 -1.162 1.967 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.078 1.428 0.968 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.170 0.286 0.210 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.078 0.588 -1.122 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.274 -1.072 -0.596 1.00 0.00 H new ATOM 0 HE1 MET A 116 2.851 0.553 -1.031 1.00 0.00 H new ATOM 0 HE2 MET A 116 4.012 -0.650 -1.640 1.00 0.00 H new ATOM 0 HE3 MET A 116 2.740 -1.140 -0.496 1.00 0.00 H new ATOM 1738 N CYS A 117 9.498 -0.690 2.680 1.00 0.00 N ATOM 1739 CA CYS A 117 10.787 -1.347 2.825 1.00 0.00 C ATOM 1740 C CYS A 117 10.540 -2.823 3.147 1.00 0.00 C ATOM 1741 O CYS A 117 11.124 -3.704 2.520 1.00 0.00 O ATOM 1742 CB CYS A 117 11.650 -0.668 3.889 1.00 0.00 C ATOM 1743 SG CYS A 117 13.440 -1.040 3.777 1.00 0.00 S ATOM 0 H CYS A 117 9.446 0.242 3.092 1.00 0.00 H new ATOM 0 HA CYS A 117 11.346 -1.268 1.893 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.512 0.411 3.815 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.292 -0.968 4.874 1.00 0.00 H new ATOM 1748 N PHE A 118 9.672 -3.045 4.124 1.00 0.00 N ATOM 1749 CA PHE A 118 9.340 -4.399 4.536 1.00 0.00 C ATOM 1750 C PHE A 118 8.580 -5.137 3.432 1.00 0.00 C ATOM 1751 O PHE A 118 8.871 -6.298 3.144 1.00 0.00 O ATOM 1752 CB PHE A 118 8.441 -4.283 5.769 1.00 0.00 C ATOM 1753 CG PHE A 118 7.254 -5.248 5.764 1.00 0.00 C ATOM 1754 CD1 PHE A 118 7.441 -6.555 5.440 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.011 -4.799 6.086 1.00 0.00 C ATOM 1756 CE1 PHE A 118 6.340 -7.451 5.437 1.00 0.00 C ATOM 1757 CE2 PHE A 118 4.909 -5.694 6.083 1.00 0.00 C ATOM 1758 CZ PHE A 118 5.097 -7.002 5.759 1.00 0.00 C ATOM 0 H PHE A 118 9.189 -2.311 4.642 1.00 0.00 H new ATOM 0 HA PHE A 118 10.251 -4.958 4.748 1.00 0.00 H new ATOM 0 HB2 PHE A 118 9.040 -4.464 6.661 1.00 0.00 H new ATOM 0 HB3 PHE A 118 8.066 -3.262 5.838 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.428 -6.912 5.185 1.00 0.00 H new ATOM 0 HD2 PHE A 118 5.862 -3.761 6.344 1.00 0.00 H new ATOM 0 HE1 PHE A 118 6.489 -8.489 5.179 1.00 0.00 H new ATOM 0 HE2 PHE A 118 3.922 -5.337 6.338 1.00 0.00 H new ATOM 0 HZ PHE A 118 4.259 -7.684 5.757 1.00 0.00 H new ATOM 1768 N LYS A 119 7.623 -4.435 2.844 1.00 0.00 N ATOM 1769 CA LYS A 119 6.820 -5.010 1.779 1.00 0.00 C ATOM 1770 C LYS A 119 7.735 -5.435 0.629 1.00 0.00 C ATOM 1771 O LYS A 119 7.436 -6.389 -0.087 1.00 0.00 O ATOM 1772 CB LYS A 119 5.715 -4.039 1.358 1.00 0.00 C ATOM 1773 CG LYS A 119 4.499 -4.159 2.279 1.00 0.00 C ATOM 1774 CD LYS A 119 3.272 -3.491 1.657 1.00 0.00 C ATOM 1775 CE LYS A 119 2.182 -4.521 1.352 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.005 -4.304 2.222 1.00 0.00 N ATOM 0 H LYS A 119 7.386 -3.473 3.085 1.00 0.00 H new ATOM 0 HA LYS A 119 6.309 -5.907 2.129 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.095 -3.018 1.383 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.418 -4.244 0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.287 -5.211 2.471 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.720 -3.697 3.241 1.00 0.00 H new ATOM 0 HD2 LYS A 119 2.882 -2.734 2.337 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.559 -2.978 0.739 1.00 0.00 H new ATOM 0 HE2 LYS A 119 1.886 -4.447 0.305 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.572 -5.528 1.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.275 -5.011 2.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.288 -4.397 3.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.623 -3.351 2.058 1.00 0.00 H new ATOM 1790 N LYS A 120 8.833 -4.707 0.488 1.00 0.00 N ATOM 1791 CA LYS A 120 9.794 -4.998 -0.563 1.00 0.00 C ATOM 1792 C LYS A 120 10.424 -6.367 -0.307 1.00 0.00 C ATOM 1793 O LYS A 120 10.858 -7.040 -1.241 1.00 0.00 O ATOM 1794 CB LYS A 120 10.814 -3.863 -0.684 1.00 0.00 C ATOM 1795 CG LYS A 120 10.322 -2.782 -1.649 1.00 0.00 C ATOM 1796 CD LYS A 120 11.098 -1.479 -1.455 1.00 0.00 C ATOM 1797 CE LYS A 120 10.247 -0.270 -1.847 1.00 0.00 C ATOM 1798 NZ LYS A 120 10.396 0.814 -0.850 1.00 0.00 N ATOM 0 H LYS A 120 9.079 -3.916 1.084 1.00 0.00 H new ATOM 0 HA LYS A 120 9.296 -5.053 -1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.993 -3.425 0.298 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.766 -4.261 -1.034 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.436 -3.128 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.259 -2.603 -1.489 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.408 -1.388 -0.414 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.006 -1.499 -2.057 1.00 0.00 H new ATOM 0 HE2 LYS A 120 10.547 0.089 -2.831 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.200 -0.563 -1.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 9.518 1.370 -0.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 10.591 0.402 0.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 11.184 1.433 -1.126 1.00 0.00 H new ATOM 1812 N GLU A 121 10.455 -6.741 0.963 1.00 0.00 N ATOM 1813 CA GLU A 121 11.025 -8.019 1.354 1.00 0.00 C ATOM 1814 C GLU A 121 10.315 -9.162 0.626 1.00 0.00 C ATOM 1815 O GLU A 121 10.936 -10.170 0.292 1.00 0.00 O ATOM 1816 CB GLU A 121 10.958 -8.209 2.871 1.00 0.00 C ATOM 1817 CG GLU A 121 11.681 -7.075 3.599 1.00 0.00 C ATOM 1818 CD GLU A 121 13.197 -7.189 3.423 1.00 0.00 C ATOM 1819 OE1 GLU A 121 13.793 -8.007 4.157 1.00 0.00 O ATOM 1820 OE2 GLU A 121 13.725 -6.455 2.560 1.00 0.00 O ATOM 0 H GLU A 121 10.094 -6.181 1.735 1.00 0.00 H new ATOM 0 HA GLU A 121 12.076 -8.029 1.066 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.917 -8.245 3.191 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.408 -9.164 3.141 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.338 -6.114 3.215 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.431 -7.102 4.660 1.00 0.00 H new ATOM 1827 N ILE A 122 9.024 -8.967 0.403 1.00 0.00 N ATOM 1828 CA ILE A 122 8.224 -9.969 -0.279 1.00 0.00 C ATOM 1829 C ILE A 122 8.675 -10.071 -1.737 1.00 0.00 C ATOM 1830 O ILE A 122 8.752 -11.166 -2.292 1.00 0.00 O ATOM 1831 CB ILE A 122 6.732 -9.663 -0.118 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.448 -9.023 1.242 1.00 0.00 C ATOM 1833 CG2 ILE A 122 5.888 -10.918 -0.348 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.274 -9.688 2.344 1.00 0.00 C ATOM 0 H ILE A 122 8.512 -8.130 0.683 1.00 0.00 H new ATOM 0 HA ILE A 122 8.377 -10.950 0.172 1.00 0.00 H new ATOM 0 HB ILE A 122 6.447 -8.938 -0.881 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.678 -7.958 1.202 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.387 -9.111 1.475 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.833 -10.674 -0.228 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.061 -11.293 -1.357 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.168 -11.683 0.376 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.053 -9.214 3.300 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.023 -10.747 2.397 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.335 -9.577 2.121 1.00 0.00 H new ATOM 1846 N HIS A 123 8.963 -8.914 -2.318 1.00 0.00 N ATOM 1847 CA HIS A 123 9.406 -8.860 -3.700 1.00 0.00 C ATOM 1848 C HIS A 123 10.547 -9.857 -3.912 1.00 0.00 C ATOM 1849 O HIS A 123 10.874 -10.198 -5.048 1.00 0.00 O ATOM 1850 CB HIS A 123 9.785 -7.431 -4.093 1.00 0.00 C ATOM 1851 CG HIS A 123 11.079 -7.330 -4.867 1.00 0.00 C ATOM 1852 ND1 HIS A 123 12.131 -6.527 -4.463 1.00 0.00 N ATOM 1853 CD2 HIS A 123 11.478 -7.940 -6.020 1.00 0.00 C ATOM 1854 CE1 HIS A 123 13.115 -6.654 -5.342 1.00 0.00 C ATOM 1855 NE2 HIS A 123 12.707 -7.529 -6.307 1.00 0.00 N ATOM 0 H HIS A 123 8.898 -8.007 -1.856 1.00 0.00 H new ATOM 0 HA HIS A 123 8.589 -9.151 -4.360 1.00 0.00 H new ATOM 0 HB2 HIS A 123 8.981 -7.004 -4.692 1.00 0.00 H new ATOM 0 HB3 HIS A 123 9.865 -6.826 -3.190 1.00 0.00 H new ATOM 0 HD2 HIS A 123 10.893 -8.638 -6.600 1.00 0.00 H new ATOM 0 HE1 HIS A 123 14.071 -6.153 -5.302 1.00 0.00 H new ATOM 0 HE2 HIS A 123 13.256 -7.819 -7.116 1.00 0.00 H new ATOM 1864 N LYS A 124 11.121 -10.296 -2.802 1.00 0.00 N ATOM 1865 CA LYS A 124 12.219 -11.247 -2.853 1.00 0.00 C ATOM 1866 C LYS A 124 11.670 -12.664 -2.668 1.00 0.00 C ATOM 1867 O LYS A 124 12.392 -13.562 -2.239 1.00 0.00 O ATOM 1868 CB LYS A 124 13.302 -10.870 -1.840 1.00 0.00 C ATOM 1869 CG LYS A 124 13.343 -9.356 -1.619 1.00 0.00 C ATOM 1870 CD LYS A 124 14.511 -8.966 -0.712 1.00 0.00 C ATOM 1871 CE LYS A 124 15.175 -7.676 -1.199 1.00 0.00 C ATOM 1872 NZ LYS A 124 14.835 -6.548 -0.303 1.00 0.00 N ATOM 0 H LYS A 124 10.847 -10.011 -1.862 1.00 0.00 H new ATOM 0 HA LYS A 124 12.704 -11.217 -3.829 1.00 0.00 H new ATOM 0 HB2 LYS A 124 13.110 -11.374 -0.893 1.00 0.00 H new ATOM 0 HB3 LYS A 124 14.273 -11.216 -2.195 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.437 -8.847 -2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.405 -9.024 -1.173 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.154 -8.833 0.309 1.00 0.00 H new ATOM 0 HD3 LYS A 124 15.245 -9.772 -0.691 1.00 0.00 H new ATOM 0 HE2 LYS A 124 16.256 -7.807 -1.234 1.00 0.00 H new ATOM 0 HE3 LYS A 124 14.848 -7.453 -2.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 15.654 -5.912 -0.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 14.028 -6.023 -0.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 14.584 -6.915 0.637 1.00 0.00 H new ATOM 1886 N LEU A 125 10.396 -12.818 -3.000 1.00 0.00 N ATOM 1887 CA LEU A 125 9.743 -14.110 -2.875 1.00 0.00 C ATOM 1888 C LEU A 125 10.674 -15.202 -3.409 1.00 0.00 C ATOM 1889 O LEU A 125 11.534 -15.698 -2.684 1.00 0.00 O ATOM 1890 CB LEU A 125 8.372 -14.085 -3.554 1.00 0.00 C ATOM 1891 CG LEU A 125 8.159 -12.982 -4.592 1.00 0.00 C ATOM 1892 CD1 LEU A 125 9.350 -12.889 -5.547 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.840 -13.182 -5.341 1.00 0.00 C ATOM 0 H LEU A 125 9.800 -12.070 -3.355 1.00 0.00 H new ATOM 0 HA LEU A 125 9.550 -14.339 -1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.210 -15.048 -4.038 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.608 -13.984 -2.783 1.00 0.00 H new ATOM 0 HG LEU A 125 8.092 -12.029 -4.067 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.172 -12.097 -6.274 1.00 0.00 H new ATOM 0 HD12 LEU A 125 10.254 -12.665 -4.981 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.474 -13.839 -6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.713 -12.384 -6.073 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.854 -14.145 -5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.012 -13.159 -4.632 1.00 0.00 H new ATOM 1905 N ASN A 126 10.468 -15.543 -4.674 1.00 0.00 N ATOM 1906 CA ASN A 126 11.278 -16.565 -5.313 1.00 0.00 C ATOM 1907 C ASN A 126 12.209 -15.910 -6.333 1.00 0.00 C ATOM 1908 O ASN A 126 13.048 -16.579 -6.936 1.00 0.00 O ATOM 1909 CB ASN A 126 10.401 -17.577 -6.055 1.00 0.00 C ATOM 1910 CG ASN A 126 9.306 -18.129 -5.140 1.00 0.00 C ATOM 1911 OD1 ASN A 126 9.385 -19.234 -4.631 1.00 0.00 O ATOM 1912 ND2 ASN A 126 8.283 -17.299 -4.960 1.00 0.00 N ATOM 0 H ASN A 126 9.752 -15.129 -5.272 1.00 0.00 H new ATOM 0 HA ASN A 126 11.846 -17.078 -4.537 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.948 -17.102 -6.925 1.00 0.00 H new ATOM 0 HB3 ASN A 126 11.018 -18.396 -6.425 1.00 0.00 H new ATOM 0 HD21 ASN A 126 7.501 -17.574 -4.365 1.00 0.00 H new ATOM 0 HD22 ASN A 126 8.280 -16.387 -5.416 1.00 0.00 H new ATOM 1919 N TRP A 127 12.032 -14.607 -6.496 1.00 0.00 N ATOM 1920 CA TRP A 127 12.845 -13.852 -7.434 1.00 0.00 C ATOM 1921 C TRP A 127 14.054 -13.299 -6.673 1.00 0.00 C ATOM 1922 O TRP A 127 14.010 -13.157 -5.453 1.00 0.00 O ATOM 1923 CB TRP A 127 12.022 -12.761 -8.121 1.00 0.00 C ATOM 1924 CG TRP A 127 10.539 -13.106 -8.278 1.00 0.00 C ATOM 1925 CD1 TRP A 127 9.987 -14.318 -8.427 1.00 0.00 C ATOM 1926 CD2 TRP A 127 9.437 -12.176 -8.295 1.00 0.00 C ATOM 1927 NE1 TRP A 127 8.613 -14.236 -8.539 1.00 0.00 N ATOM 1928 CE2 TRP A 127 8.269 -12.893 -8.455 1.00 0.00 C ATOM 1929 CE3 TRP A 127 9.428 -10.775 -8.178 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 7.005 -12.293 -8.515 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 8.156 -10.192 -8.239 1.00 0.00 C ATOM 1932 CH2 TRP A 127 6.970 -10.899 -8.399 1.00 0.00 C ATOM 0 H TRP A 127 11.337 -14.055 -5.994 1.00 0.00 H new ATOM 0 HA TRP A 127 13.203 -14.495 -8.238 1.00 0.00 H new ATOM 0 HB2 TRP A 127 12.111 -11.838 -7.548 1.00 0.00 H new ATOM 0 HB3 TRP A 127 12.446 -12.567 -9.106 1.00 0.00 H new ATOM 0 HD1 TRP A 127 10.546 -15.242 -8.456 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.969 -15.018 -8.661 1.00 0.00 H new ATOM 0 HE3 TRP A 127 10.330 -10.195 -8.051 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 6.105 -12.876 -8.644 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 8.092 -9.117 -8.156 1.00 0.00 H new ATOM 0 HH2 TRP A 127 6.026 -10.375 -8.434 1.00 0.00 H new ATOM 1943 N VAL A 128 15.102 -13.003 -7.426 1.00 0.00 N ATOM 1944 CA VAL A 128 16.319 -12.468 -6.838 1.00 0.00 C ATOM 1945 C VAL A 128 16.356 -10.953 -7.044 1.00 0.00 C ATOM 1946 O VAL A 128 16.386 -10.476 -8.177 1.00 0.00 O ATOM 1947 CB VAL A 128 17.540 -13.181 -7.424 1.00 0.00 C ATOM 1948 CG1 VAL A 128 17.449 -14.693 -7.204 1.00 0.00 C ATOM 1949 CG2 VAL A 128 17.707 -12.853 -8.908 1.00 0.00 C ATOM 0 H VAL A 128 15.134 -13.123 -8.438 1.00 0.00 H new ATOM 0 HA VAL A 128 16.337 -12.651 -5.764 1.00 0.00 H new ATOM 0 HB VAL A 128 18.424 -12.818 -6.899 1.00 0.00 H new ATOM 0 HG11 VAL A 128 18.329 -15.176 -7.630 1.00 0.00 H new ATOM 0 HG12 VAL A 128 17.401 -14.903 -6.135 1.00 0.00 H new ATOM 0 HG13 VAL A 128 16.553 -15.078 -7.690 1.00 0.00 H new ATOM 0 HG21 VAL A 128 18.582 -13.372 -9.299 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.820 -13.174 -9.454 1.00 0.00 H new ATOM 0 HG23 VAL A 128 17.839 -11.778 -9.030 1.00 0.00 H new ATOM 1959 N PRO A 129 16.353 -10.218 -5.899 1.00 0.00 N ATOM 1960 CA PRO A 129 16.386 -8.766 -5.943 1.00 0.00 C ATOM 1961 C PRO A 129 17.785 -8.260 -6.304 1.00 0.00 C ATOM 1962 O PRO A 129 18.339 -7.409 -5.610 1.00 0.00 O ATOM 1963 CB PRO A 129 15.933 -8.320 -4.563 1.00 0.00 C ATOM 1964 CG PRO A 129 16.108 -9.529 -3.655 1.00 0.00 C ATOM 1965 CD PRO A 129 16.317 -10.748 -4.539 1.00 0.00 C ATOM 0 HA PRO A 129 15.735 -8.354 -6.714 1.00 0.00 H new ATOM 0 HB2 PRO A 129 16.528 -7.477 -4.210 1.00 0.00 H new ATOM 0 HB3 PRO A 129 14.894 -7.992 -4.580 1.00 0.00 H new ATOM 0 HG2 PRO A 129 16.961 -9.388 -2.991 1.00 0.00 H new ATOM 0 HG3 PRO A 129 15.230 -9.662 -3.022 1.00 0.00 H new ATOM 0 HD2 PRO A 129 17.245 -11.263 -4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 129 15.509 -11.469 -4.416 1.00 0.00 H new ATOM 1973 N ASN A 130 18.313 -8.806 -7.389 1.00 0.00 N ATOM 1974 CA ASN A 130 19.636 -8.420 -7.852 1.00 0.00 C ATOM 1975 C ASN A 130 19.813 -6.910 -7.677 1.00 0.00 C ATOM 1976 O ASN A 130 20.926 -6.434 -7.456 1.00 0.00 O ATOM 1977 CB ASN A 130 19.818 -8.748 -9.335 1.00 0.00 C ATOM 1978 CG ASN A 130 18.505 -8.578 -10.101 1.00 0.00 C ATOM 1979 OD1 ASN A 130 17.858 -7.544 -10.053 1.00 0.00 O ATOM 1980 ND2 ASN A 130 18.147 -9.647 -10.806 1.00 0.00 N ATOM 0 H ASN A 130 17.850 -9.512 -7.961 1.00 0.00 H new ATOM 0 HA ASN A 130 20.372 -8.972 -7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 130 20.580 -8.097 -9.764 1.00 0.00 H new ATOM 0 HB3 ASN A 130 20.176 -9.772 -9.443 1.00 0.00 H new ATOM 0 HD21 ASN A 130 17.285 -9.633 -11.350 1.00 0.00 H new ATOM 0 HD22 ASN A 130 18.735 -10.481 -10.802 1.00 0.00 H new ATOM 1987 N MET A 131 18.700 -6.199 -7.780 1.00 0.00 N ATOM 1988 CA MET A 131 18.718 -4.754 -7.636 1.00 0.00 C ATOM 1989 C MET A 131 18.234 -4.335 -6.247 1.00 0.00 C ATOM 1990 O MET A 131 17.033 -4.307 -5.985 1.00 0.00 O ATOM 1991 CB MET A 131 17.818 -4.123 -8.701 1.00 0.00 C ATOM 1992 CG MET A 131 18.649 -3.392 -9.757 1.00 0.00 C ATOM 1993 SD MET A 131 17.600 -2.317 -10.722 1.00 0.00 S ATOM 1994 CE MET A 131 18.457 -0.767 -10.502 1.00 0.00 C ATOM 0 H MET A 131 17.779 -6.598 -7.962 1.00 0.00 H new ATOM 0 HA MET A 131 19.744 -4.409 -7.763 1.00 0.00 H new ATOM 0 HB2 MET A 131 17.216 -4.896 -9.178 1.00 0.00 H new ATOM 0 HB3 MET A 131 17.126 -3.425 -8.230 1.00 0.00 H new ATOM 0 HG2 MET A 131 19.435 -2.810 -9.275 1.00 0.00 H new ATOM 0 HG3 MET A 131 19.141 -4.114 -10.408 1.00 0.00 H new ATOM 0 HE1 MET A 131 18.324 -0.148 -11.389 1.00 0.00 H new ATOM 0 HE2 MET A 131 18.052 -0.248 -9.633 1.00 0.00 H new ATOM 0 HE3 MET A 131 19.519 -0.957 -10.349 1.00 0.00 H new ATOM 2004 N ASP A 132 19.195 -4.020 -5.390 1.00 0.00 N ATOM 2005 CA ASP A 132 18.883 -3.605 -4.034 1.00 0.00 C ATOM 2006 C ASP A 132 19.561 -2.264 -3.748 1.00 0.00 C ATOM 2007 O ASP A 132 20.735 -2.223 -3.383 1.00 0.00 O ATOM 2008 CB ASP A 132 19.397 -4.622 -3.015 1.00 0.00 C ATOM 2009 CG ASP A 132 19.383 -6.076 -3.488 1.00 0.00 C ATOM 2010 OD1 ASP A 132 20.175 -6.383 -4.405 1.00 0.00 O ATOM 2011 OD2 ASP A 132 18.580 -6.850 -2.922 1.00 0.00 O ATOM 0 H ASP A 132 20.191 -4.044 -5.610 1.00 0.00 H new ATOM 0 HA ASP A 132 17.800 -3.524 -3.946 1.00 0.00 H new ATOM 0 HB2 ASP A 132 20.418 -4.355 -2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 132 18.793 -4.544 -2.111 1.00 0.00 H new ATOM 2016 N LEU A 133 18.793 -1.198 -3.922 1.00 0.00 N ATOM 2017 CA LEU A 133 19.305 0.141 -3.687 1.00 0.00 C ATOM 2018 C LEU A 133 18.174 1.155 -3.875 1.00 0.00 C ATOM 2019 O LEU A 133 17.773 1.439 -5.003 1.00 0.00 O ATOM 2020 CB LEU A 133 20.525 0.410 -4.568 1.00 0.00 C ATOM 2021 CG LEU A 133 20.237 0.985 -5.956 1.00 0.00 C ATOM 2022 CD1 LEU A 133 19.172 0.160 -6.681 1.00 0.00 C ATOM 2023 CD2 LEU A 133 19.855 2.464 -5.870 1.00 0.00 C ATOM 0 H LEU A 133 17.819 -1.235 -4.223 1.00 0.00 H new ATOM 0 HA LEU A 133 19.655 0.240 -2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 133 21.184 1.100 -4.041 1.00 0.00 H new ATOM 0 HB3 LEU A 133 21.073 -0.524 -4.690 1.00 0.00 H new ATOM 0 HG LEU A 133 21.151 0.923 -6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 133 18.986 0.590 -7.665 1.00 0.00 H new ATOM 0 HD12 LEU A 133 19.521 -0.866 -6.794 1.00 0.00 H new ATOM 0 HD13 LEU A 133 18.249 0.168 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 133 19.656 2.847 -6.871 1.00 0.00 H new ATOM 0 HD22 LEU A 133 18.962 2.574 -5.255 1.00 0.00 H new ATOM 0 HD23 LEU A 133 20.675 3.026 -5.423 1.00 0.00 H new ATOM 2035 N VAL A 134 17.693 1.671 -2.754 1.00 0.00 N ATOM 2036 CA VAL A 134 16.617 2.648 -2.782 1.00 0.00 C ATOM 2037 C VAL A 134 17.124 3.977 -2.220 1.00 0.00 C ATOM 2038 O VAL A 134 16.483 5.011 -2.389 1.00 0.00 O ATOM 2039 CB VAL A 134 15.400 2.106 -2.028 1.00 0.00 C ATOM 2040 CG1 VAL A 134 15.006 0.721 -2.544 1.00 0.00 C ATOM 2041 CG2 VAL A 134 15.658 2.077 -0.520 1.00 0.00 C ATOM 0 H VAL A 134 18.028 1.432 -1.821 1.00 0.00 H new ATOM 0 HA VAL A 134 16.294 2.831 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 134 14.564 2.781 -2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 134 14.139 0.360 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 134 14.760 0.784 -3.604 1.00 0.00 H new ATOM 0 HG13 VAL A 134 15.838 0.031 -2.405 1.00 0.00 H new ATOM 0 HG21 VAL A 134 14.778 1.688 -0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 134 16.514 1.435 -0.310 1.00 0.00 H new ATOM 0 HG23 VAL A 134 15.866 3.087 -0.167 1.00 0.00 H new ATOM 2051 N ILE A 135 18.274 3.905 -1.564 1.00 0.00 N ATOM 2052 CA ILE A 135 18.876 5.089 -0.976 1.00 0.00 C ATOM 2053 C ILE A 135 20.099 5.497 -1.800 1.00 0.00 C ATOM 2054 O ILE A 135 20.538 6.644 -1.739 1.00 0.00 O ATOM 2055 CB ILE A 135 19.181 4.856 0.506 1.00 0.00 C ATOM 2056 CG1 ILE A 135 19.767 3.461 0.731 1.00 0.00 C ATOM 2057 CG2 ILE A 135 17.942 5.104 1.367 1.00 0.00 C ATOM 2058 CD1 ILE A 135 18.660 2.432 0.963 1.00 0.00 C ATOM 0 H ILE A 135 18.804 3.044 -1.427 1.00 0.00 H new ATOM 0 HA ILE A 135 18.178 5.926 -1.006 1.00 0.00 H new ATOM 0 HB ILE A 135 19.937 5.577 0.817 1.00 0.00 H new ATOM 0 HG12 ILE A 135 20.364 3.170 -0.133 1.00 0.00 H new ATOM 0 HG13 ILE A 135 20.438 3.479 1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 135 18.187 4.931 2.415 1.00 0.00 H new ATOM 0 HG22 ILE A 135 17.609 6.134 1.237 1.00 0.00 H new ATOM 0 HG23 ILE A 135 17.146 4.424 1.064 1.00 0.00 H new ATOM 0 HD11 ILE A 135 19.104 1.449 1.120 1.00 0.00 H new ATOM 0 HD12 ILE A 135 18.080 2.713 1.842 1.00 0.00 H new ATOM 0 HD13 ILE A 135 18.005 2.399 0.092 1.00 0.00 H new ATOM 2070 N GLY A 136 20.614 4.534 -2.550 1.00 0.00 N ATOM 2071 CA GLY A 136 21.778 4.778 -3.385 1.00 0.00 C ATOM 2072 C GLY A 136 23.028 5.000 -2.532 1.00 0.00 C ATOM 2073 O GLY A 136 23.990 5.620 -2.984 1.00 0.00 O ATOM 0 H GLY A 136 20.247 3.584 -2.597 1.00 0.00 H new ATOM 0 HA2 GLY A 136 21.935 3.931 -4.053 1.00 0.00 H new ATOM 0 HA3 GLY A 136 21.603 5.651 -4.013 1.00 0.00 H new ATOM 2077 N GLU A 137 22.974 4.482 -1.315 1.00 0.00 N ATOM 2078 CA GLU A 137 24.089 4.616 -0.394 1.00 0.00 C ATOM 2079 C GLU A 137 24.464 3.251 0.189 1.00 0.00 C ATOM 2080 O GLU A 137 23.786 2.257 -0.064 1.00 0.00 O ATOM 2081 CB GLU A 137 23.767 5.617 0.719 1.00 0.00 C ATOM 2082 CG GLU A 137 24.932 6.584 0.940 1.00 0.00 C ATOM 2083 CD GLU A 137 24.428 8.018 1.110 1.00 0.00 C ATOM 2084 OE1 GLU A 137 23.935 8.319 2.220 1.00 0.00 O ATOM 2085 OE2 GLU A 137 24.547 8.782 0.128 1.00 0.00 O ATOM 0 H GLU A 137 22.175 3.968 -0.945 1.00 0.00 H new ATOM 0 HA GLU A 137 24.945 5.002 -0.947 1.00 0.00 H new ATOM 0 HB2 GLU A 137 22.869 6.177 0.460 1.00 0.00 H new ATOM 0 HB3 GLU A 137 23.554 5.082 1.644 1.00 0.00 H new ATOM 0 HG2 GLU A 137 25.495 6.285 1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 137 25.617 6.533 0.094 1.00 0.00 H new ATOM 2092 N VAL A 138 25.542 3.247 0.959 1.00 0.00 N ATOM 2093 CA VAL A 138 26.014 2.021 1.580 1.00 0.00 C ATOM 2094 C VAL A 138 24.976 1.534 2.593 1.00 0.00 C ATOM 2095 O VAL A 138 24.884 2.065 3.699 1.00 0.00 O ATOM 2096 CB VAL A 138 27.394 2.247 2.202 1.00 0.00 C ATOM 2097 CG1 VAL A 138 28.375 2.805 1.169 1.00 0.00 C ATOM 2098 CG2 VAL A 138 27.303 3.162 3.423 1.00 0.00 C ATOM 0 H VAL A 138 26.102 4.074 1.167 1.00 0.00 H new ATOM 0 HA VAL A 138 26.132 1.236 0.833 1.00 0.00 H new ATOM 0 HB VAL A 138 27.773 1.281 2.537 1.00 0.00 H new ATOM 0 HG11 VAL A 138 29.348 2.957 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 138 28.475 2.100 0.344 1.00 0.00 H new ATOM 0 HG13 VAL A 138 28.002 3.757 0.790 1.00 0.00 H new ATOM 0 HG21 VAL A 138 28.298 3.306 3.845 1.00 0.00 H new ATOM 0 HG22 VAL A 138 26.893 4.127 3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 138 26.654 2.707 4.171 1.00 0.00 H new ATOM 2108 N LEU A 139 24.218 0.530 2.177 1.00 0.00 N ATOM 2109 CA LEU A 139 23.188 -0.035 3.034 1.00 0.00 C ATOM 2110 C LEU A 139 22.505 -1.195 2.308 1.00 0.00 C ATOM 2111 O LEU A 139 22.594 -2.342 2.742 1.00 0.00 O ATOM 2112 CB LEU A 139 22.221 1.056 3.499 1.00 0.00 C ATOM 2113 CG LEU A 139 21.691 0.918 4.928 1.00 0.00 C ATOM 2114 CD1 LEU A 139 21.137 -0.486 5.175 1.00 0.00 C ATOM 2115 CD2 LEU A 139 22.765 1.300 5.949 1.00 0.00 C ATOM 0 H LEU A 139 24.296 0.093 1.259 1.00 0.00 H new ATOM 0 HA LEU A 139 23.630 -0.445 3.942 1.00 0.00 H new ATOM 0 HB2 LEU A 139 22.722 2.020 3.410 1.00 0.00 H new ATOM 0 HB3 LEU A 139 21.371 1.075 2.817 1.00 0.00 H new ATOM 0 HG LEU A 139 20.863 1.616 5.055 1.00 0.00 H new ATOM 0 HD11 LEU A 139 20.767 -0.556 6.198 1.00 0.00 H new ATOM 0 HD12 LEU A 139 20.321 -0.683 4.480 1.00 0.00 H new ATOM 0 HD13 LEU A 139 21.928 -1.221 5.024 1.00 0.00 H new ATOM 0 HD21 LEU A 139 22.363 1.193 6.957 1.00 0.00 H new ATOM 0 HD22 LEU A 139 23.628 0.645 5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 139 23.069 2.334 5.787 1.00 0.00 H new ATOM 2127 N ALA A 140 21.839 -0.856 1.214 1.00 0.00 N ATOM 2128 CA ALA A 140 21.142 -1.854 0.422 1.00 0.00 C ATOM 2129 C ALA A 140 22.162 -2.678 -0.367 1.00 0.00 C ATOM 2130 O ALA A 140 23.330 -2.304 -0.457 1.00 0.00 O ATOM 2131 CB ALA A 140 20.122 -1.165 -0.486 1.00 0.00 C ATOM 0 H ALA A 140 21.768 0.097 0.857 1.00 0.00 H new ATOM 0 HA ALA A 140 20.593 -2.540 1.067 1.00 0.00 H new ATOM 0 HB1 ALA A 140 19.599 -1.914 -1.080 1.00 0.00 H new ATOM 0 HB2 ALA A 140 19.402 -0.619 0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 140 20.637 -0.470 -1.150 1.00 0.00 H new ATOM 2137 N GLU A 141 21.683 -3.783 -0.919 1.00 0.00 N ATOM 2138 CA GLU A 141 22.539 -4.662 -1.697 1.00 0.00 C ATOM 2139 C GLU A 141 22.853 -4.031 -3.056 1.00 0.00 C ATOM 2140 O GLU A 141 22.176 -4.310 -4.045 1.00 0.00 O ATOM 2141 CB GLU A 141 21.897 -6.041 -1.869 1.00 0.00 C ATOM 2142 CG GLU A 141 22.655 -7.101 -1.065 1.00 0.00 C ATOM 2143 CD GLU A 141 23.471 -8.008 -1.988 1.00 0.00 C ATOM 2144 OE1 GLU A 141 22.831 -8.769 -2.748 1.00 0.00 O ATOM 2145 OE2 GLU A 141 24.715 -7.923 -1.913 1.00 0.00 O ATOM 0 H GLU A 141 20.713 -4.090 -0.843 1.00 0.00 H new ATOM 0 HA GLU A 141 23.475 -4.798 -1.156 1.00 0.00 H new ATOM 0 HB2 GLU A 141 20.858 -6.006 -1.543 1.00 0.00 H new ATOM 0 HB3 GLU A 141 21.891 -6.315 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 141 23.317 -6.615 -0.348 1.00 0.00 H new ATOM 0 HG3 GLU A 141 21.949 -7.701 -0.491 1.00 0.00 H new ATOM 2152 N VAL A 142 23.878 -3.193 -3.060 1.00 0.00 N ATOM 2153 CA VAL A 142 24.290 -2.520 -4.280 1.00 0.00 C ATOM 2154 C VAL A 142 25.416 -3.317 -4.942 1.00 0.00 C ATOM 2155 O VAL A 142 25.204 -4.442 -5.392 1.00 0.00 O ATOM 2156 CB VAL A 142 24.682 -1.074 -3.973 1.00 0.00 C ATOM 2157 CG1 VAL A 142 25.993 -1.017 -3.187 1.00 0.00 C ATOM 2158 CG2 VAL A 142 24.777 -0.248 -5.257 1.00 0.00 C ATOM 0 H VAL A 142 24.436 -2.964 -2.237 1.00 0.00 H new ATOM 0 HA VAL A 142 23.463 -2.475 -4.989 1.00 0.00 H new ATOM 0 HB VAL A 142 23.899 -0.639 -3.352 1.00 0.00 H new ATOM 0 HG11 VAL A 142 26.249 0.022 -2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 142 25.877 -1.555 -2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 142 26.789 -1.478 -3.772 1.00 0.00 H new ATOM 0 HG21 VAL A 142 25.057 0.776 -5.011 1.00 0.00 H new ATOM 0 HG22 VAL A 142 25.530 -0.682 -5.914 1.00 0.00 H new ATOM 0 HG23 VAL A 142 23.811 -0.248 -5.762 1.00 0.00 H new TER 2168 VAL A 142