USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1204 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 152 THR OG1 : rot 48:sc= 1.17 USER MOD Set 1.2: A 154 SER OG : rot 71:sc= 0.987 USER MOD Set 2.1: A 20 LYS NZ :NH3+ -128:sc= -2.97! (180deg=-2.04!) USER MOD Set 2.2: A 96 HIS : no HE2:sc= -2.47! C(o=-7.2!,f=-29!) USER MOD Set 2.3: A 123 ASN : amide:sc= -1.78 X(o=-7.2,f=-7.3) USER MOD Set 3.1: A 84 HIS :FLIP no HD1:sc= -1.93 F(o=-4.3!,f=-1.6) USER MOD Set 3.2: A 101 SER OG : rot 76:sc= 0.281 USER MOD Set 4.1: A 32 ASN :FLIP amide:sc= 0.886 F(o=-3.3!,f=2.7) USER MOD Set 4.2: A 58 SER OG : rot -77:sc= 1.85 USER MOD Set 5.1: A 22 MET CE :methyl -177:sc= -3.29! (180deg=-3.41!) USER MOD Set 5.2: A 55 MET CE :methyl -162:sc= -1.32 (180deg=-2.23) USER MOD Set 6.1: A 14 SER OG : rot 180:sc= 0.386 USER MOD Set 6.2: A 43 THR OG1 : rot 142:sc= 0.443 USER MOD Set 7.1: A 11 GLN : amide:sc= -0.214 K(o=-0.45,f=-3.2) USER MOD Set 7.2: A 94 LYS NZ :NH3+ 178:sc= -0.231 (180deg=-0.0537) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 HIS N :NH3+ -175:sc= -0.164 (180deg=-0.185) USER MOD Single : A 2 HIS : no HD1:sc= -0.0426 X(o=-0.043,f=-0.0056) USER MOD Single : A 6 SER OG : rot 180:sc= -0.147 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -110:sc= -3.51! USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -170:sc= -0.0853 USER MOD Single : A 37 THR OG1 : rot -69:sc= 0.458 USER MOD Single : A 39 MET CE :methyl 158:sc= -0.0336 (180deg=-0.369) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -165:sc= -2.3 USER MOD Single : A 48 ASN : amide:sc= -5.82! C(o=-5.8!,f=-12!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.4!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -79:sc= 0.806 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= -0.096 USER MOD Single : A 91 SER OG : rot 180:sc= -0.059 USER MOD Single : A 92 HIS : no HD1:sc= -3.47! C(o=-3.5!,f=-6.1!) USER MOD Single : A 97 TYR OH : rot 180:sc= -0.135 USER MOD Single : A 100 TYR OH : rot 177:sc= 1.06 USER MOD Single : A 106 HIS : no HD1:sc= -1.83! C(o=-1.8!,f=-2.6!) USER MOD Single : A 108 LYS NZ :NH3+ -152:sc= -0.0772 (180deg=-1.28) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 161:sc= -0.0229 (180deg=-0.314) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 132 LYS NZ :NH3+ -118:sc= -0.143 (180deg=-0.75) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 33:sc= 0.8 USER MOD Single : A 143 SER OG : rot 150:sc= 0.254 USER MOD Single : A 149 GLN :FLIP amide:sc= -2.45 F(o=-4.3!,f=-2.5) USER MOD Single : A 150 SER OG : rot -66:sc= 0.88 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 -11.643 -23.144 -6.628 1.00 0.00 N ATOM 2 CA HIS A 1 -11.353 -23.080 -5.167 1.00 0.00 C ATOM 3 C HIS A 1 -11.015 -21.645 -4.779 1.00 0.00 C ATOM 4 O HIS A 1 -10.859 -21.331 -3.599 1.00 0.00 O ATOM 5 CB HIS A 1 -10.173 -23.999 -4.844 1.00 0.00 C ATOM 6 CG HIS A 1 -10.296 -24.496 -3.430 1.00 0.00 C ATOM 7 ND1 HIS A 1 -11.052 -25.611 -3.101 1.00 0.00 N ATOM 8 CD2 HIS A 1 -9.767 -24.041 -2.249 1.00 0.00 C ATOM 9 CE1 HIS A 1 -10.957 -25.788 -1.770 1.00 0.00 C ATOM 10 NE2 HIS A 1 -10.184 -24.859 -1.202 1.00 0.00 N ATOM 0 H1 HIS A 1 -11.956 -24.104 -6.878 1.00 0.00 H new ATOM 0 H2 HIS A 1 -12.393 -22.463 -6.863 1.00 0.00 H new ATOM 0 H3 HIS A 1 -10.783 -22.910 -7.163 1.00 0.00 H new ATOM 0 HA HIS A 1 -12.227 -23.406 -4.604 1.00 0.00 H new ATOM 0 HB2 HIS A 1 -10.154 -24.841 -5.536 1.00 0.00 H new ATOM 0 HB3 HIS A 1 -9.234 -23.461 -4.971 1.00 0.00 H new ATOM 0 HD2 HIS A 1 -9.124 -23.179 -2.147 1.00 0.00 H new ATOM 0 HE1 HIS A 1 -11.446 -26.584 -1.228 1.00 0.00 H new ATOM 0 HE2 HIS A 1 -9.949 -24.768 -0.214 1.00 0.00 H new ATOM 20 N HIS A 2 -10.906 -20.778 -5.780 1.00 0.00 N ATOM 21 CA HIS A 2 -10.586 -19.375 -5.531 1.00 0.00 C ATOM 22 C HIS A 2 -9.375 -19.257 -4.611 1.00 0.00 C ATOM 23 O HIS A 2 -9.501 -19.340 -3.389 1.00 0.00 O ATOM 24 CB HIS A 2 -11.786 -18.673 -4.894 1.00 0.00 C ATOM 25 CG HIS A 2 -12.938 -18.669 -5.861 1.00 0.00 C ATOM 26 ND1 HIS A 2 -13.302 -17.535 -6.572 1.00 0.00 N ATOM 27 CD2 HIS A 2 -13.814 -19.652 -6.248 1.00 0.00 C ATOM 28 CE1 HIS A 2 -14.357 -17.862 -7.342 1.00 0.00 C ATOM 29 NE2 HIS A 2 -14.710 -19.141 -7.182 1.00 0.00 N ATOM 0 H HIS A 2 -11.033 -21.018 -6.763 1.00 0.00 H new ATOM 0 HA HIS A 2 -10.351 -18.899 -6.483 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -12.072 -19.182 -3.974 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -11.521 -17.651 -4.624 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -13.809 -20.668 -5.883 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -14.857 -17.174 -8.008 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -15.472 -19.636 -7.645 1.00 0.00 H new ATOM 37 N LEU A 3 -8.204 -19.066 -5.207 1.00 0.00 N ATOM 38 CA LEU A 3 -6.976 -18.938 -4.430 1.00 0.00 C ATOM 39 C LEU A 3 -6.897 -17.568 -3.768 1.00 0.00 C ATOM 40 O LEU A 3 -6.044 -17.331 -2.914 1.00 0.00 O ATOM 41 CB LEU A 3 -5.761 -19.140 -5.336 1.00 0.00 C ATOM 42 CG LEU A 3 -5.458 -20.635 -5.455 1.00 0.00 C ATOM 43 CD1 LEU A 3 -6.707 -21.373 -5.941 1.00 0.00 C ATOM 44 CD2 LEU A 3 -4.320 -20.847 -6.456 1.00 0.00 C ATOM 0 H LEU A 3 -8.078 -18.997 -6.217 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.981 -19.702 -3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -5.955 -18.717 -6.322 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.898 -18.614 -4.928 1.00 0.00 H new ATOM 0 HG LEU A 3 -5.163 -21.023 -4.480 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -6.491 -22.438 -6.026 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -7.518 -21.223 -5.229 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -7.003 -20.984 -6.915 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -4.104 -21.912 -6.541 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -4.615 -20.458 -7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.429 -20.322 -6.111 1.00 0.00 H new ATOM 56 N LEU A 4 -7.794 -16.671 -4.167 1.00 0.00 N ATOM 57 CA LEU A 4 -7.822 -15.327 -3.604 1.00 0.00 C ATOM 58 C LEU A 4 -7.613 -15.381 -2.090 1.00 0.00 C ATOM 59 O LEU A 4 -8.564 -15.519 -1.322 1.00 0.00 O ATOM 60 CB LEU A 4 -9.166 -14.660 -3.937 1.00 0.00 C ATOM 61 CG LEU A 4 -9.335 -13.357 -3.148 1.00 0.00 C ATOM 62 CD1 LEU A 4 -8.084 -12.488 -3.290 1.00 0.00 C ATOM 63 CD2 LEU A 4 -10.543 -12.589 -3.690 1.00 0.00 C ATOM 0 H LEU A 4 -8.507 -16.850 -4.874 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.014 -14.739 -4.039 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -9.220 -14.453 -5.006 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -9.984 -15.342 -3.703 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.487 -13.597 -2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -8.216 -11.565 -2.725 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.220 -13.029 -2.905 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -7.924 -12.250 -4.342 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -10.666 -11.662 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.385 -12.359 -4.744 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.440 -13.199 -3.582 1.00 0.00 H new ATOM 75 N ALA A 5 -6.351 -15.290 -1.676 1.00 0.00 N ATOM 76 CA ALA A 5 -5.999 -15.336 -0.260 1.00 0.00 C ATOM 77 C ALA A 5 -6.803 -16.393 0.487 1.00 0.00 C ATOM 78 O ALA A 5 -7.963 -16.179 0.837 1.00 0.00 O ATOM 79 CB ALA A 5 -6.242 -13.980 0.393 1.00 0.00 C ATOM 0 H ALA A 5 -5.554 -15.184 -2.303 1.00 0.00 H new ATOM 0 HA ALA A 5 -4.942 -15.595 -0.201 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -5.975 -14.031 1.448 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -5.631 -13.224 -0.100 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -7.295 -13.714 0.298 1.00 0.00 H new ATOM 85 N SER A 6 -6.167 -17.521 0.749 1.00 0.00 N ATOM 86 CA SER A 6 -6.817 -18.601 1.475 1.00 0.00 C ATOM 87 C SER A 6 -7.378 -18.086 2.796 1.00 0.00 C ATOM 88 O SER A 6 -6.775 -17.230 3.444 1.00 0.00 O ATOM 89 CB SER A 6 -5.799 -19.700 1.745 1.00 0.00 C ATOM 90 OG SER A 6 -6.096 -20.323 2.989 1.00 0.00 O ATOM 0 H SER A 6 -5.205 -17.714 0.472 1.00 0.00 H new ATOM 0 HA SER A 6 -7.639 -18.995 0.877 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.821 -20.437 0.942 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.793 -19.282 1.766 1.00 0.00 H new ATOM 0 HG SER A 6 -5.442 -21.032 3.164 1.00 0.00 H new ATOM 96 N ASP A 7 -8.532 -18.609 3.195 1.00 0.00 N ATOM 97 CA ASP A 7 -9.156 -18.187 4.444 1.00 0.00 C ATOM 98 C ASP A 7 -8.385 -18.734 5.641 1.00 0.00 C ATOM 99 O ASP A 7 -7.802 -17.975 6.414 1.00 0.00 O ATOM 100 CB ASP A 7 -10.602 -18.681 4.498 1.00 0.00 C ATOM 101 CG ASP A 7 -10.977 -19.033 5.935 1.00 0.00 C ATOM 102 OD1 ASP A 7 -10.733 -18.216 6.806 1.00 0.00 O ATOM 103 OD2 ASP A 7 -11.502 -20.115 6.140 1.00 0.00 O ATOM 0 H ASP A 7 -9.050 -19.319 2.678 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.142 -17.098 4.485 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -11.273 -17.912 4.116 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -10.721 -19.555 3.857 1.00 0.00 H new ATOM 108 N GLU A 8 -8.392 -20.056 5.785 1.00 0.00 N ATOM 109 CA GLU A 8 -7.694 -20.700 6.894 1.00 0.00 C ATOM 110 C GLU A 8 -6.354 -20.021 7.159 1.00 0.00 C ATOM 111 O GLU A 8 -5.943 -19.868 8.309 1.00 0.00 O ATOM 112 CB GLU A 8 -7.461 -22.179 6.578 1.00 0.00 C ATOM 113 CG GLU A 8 -8.740 -22.971 6.861 1.00 0.00 C ATOM 114 CD GLU A 8 -8.764 -24.242 6.018 1.00 0.00 C ATOM 115 OE1 GLU A 8 -7.719 -24.855 5.878 1.00 0.00 O ATOM 116 OE2 GLU A 8 -9.827 -24.582 5.526 1.00 0.00 O ATOM 0 H GLU A 8 -8.869 -20.699 5.153 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.315 -20.610 7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -7.171 -22.297 5.534 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -6.640 -22.566 7.182 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.793 -23.226 7.919 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.614 -22.359 6.636 1.00 0.00 H new ATOM 123 N GLU A 9 -5.678 -19.615 6.089 1.00 0.00 N ATOM 124 CA GLU A 9 -4.385 -18.954 6.223 1.00 0.00 C ATOM 125 C GLU A 9 -3.908 -18.420 4.877 1.00 0.00 C ATOM 126 O GLU A 9 -4.682 -18.322 3.927 1.00 0.00 O ATOM 127 CB GLU A 9 -3.353 -19.940 6.773 1.00 0.00 C ATOM 128 CG GLU A 9 -3.021 -20.982 5.701 1.00 0.00 C ATOM 129 CD GLU A 9 -2.736 -22.330 6.355 1.00 0.00 C ATOM 130 OE1 GLU A 9 -3.681 -22.966 6.793 1.00 0.00 O ATOM 131 OE2 GLU A 9 -1.578 -22.708 6.407 1.00 0.00 O ATOM 0 H GLU A 9 -6.000 -19.731 5.128 1.00 0.00 H new ATOM 0 HA GLU A 9 -4.498 -18.117 6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -2.449 -19.409 7.071 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.743 -20.431 7.665 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -3.853 -21.076 5.003 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.155 -20.658 5.123 1.00 0.00 H new ATOM 138 N ILE A 10 -2.625 -18.081 4.806 1.00 0.00 N ATOM 139 CA ILE A 10 -2.043 -17.561 3.577 1.00 0.00 C ATOM 140 C ILE A 10 -0.618 -18.084 3.407 1.00 0.00 C ATOM 141 O ILE A 10 0.181 -18.040 4.343 1.00 0.00 O ATOM 142 CB ILE A 10 -2.028 -16.032 3.608 1.00 0.00 C ATOM 143 CG1 ILE A 10 -3.276 -15.513 4.328 1.00 0.00 C ATOM 144 CG2 ILE A 10 -2.018 -15.501 2.176 1.00 0.00 C ATOM 145 CD1 ILE A 10 -3.306 -13.984 4.259 1.00 0.00 C ATOM 0 H ILE A 10 -1.970 -18.157 5.585 1.00 0.00 H new ATOM 0 HA ILE A 10 -2.650 -17.896 2.736 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.139 -15.692 4.138 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -4.173 -15.926 3.867 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -3.272 -15.841 5.368 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.007 -14.411 2.192 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.130 -15.865 1.659 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -2.910 -15.847 1.653 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.194 -13.614 4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -2.415 -13.581 4.740 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -3.330 -13.667 3.216 1.00 0.00 H new ATOM 157 N GLN A 11 -0.309 -18.584 2.212 1.00 0.00 N ATOM 158 CA GLN A 11 1.024 -19.117 1.935 1.00 0.00 C ATOM 159 C GLN A 11 2.097 -18.245 2.578 1.00 0.00 C ATOM 160 O GLN A 11 2.233 -17.070 2.244 1.00 0.00 O ATOM 161 CB GLN A 11 1.257 -19.184 0.424 1.00 0.00 C ATOM 162 CG GLN A 11 2.354 -20.207 0.124 1.00 0.00 C ATOM 163 CD GLN A 11 2.928 -19.962 -1.267 1.00 0.00 C ATOM 164 OE1 GLN A 11 2.436 -20.517 -2.249 1.00 0.00 O ATOM 165 NE2 GLN A 11 3.947 -19.158 -1.410 1.00 0.00 N ATOM 0 H GLN A 11 -0.957 -18.631 1.426 1.00 0.00 H new ATOM 0 HA GLN A 11 1.087 -20.120 2.358 1.00 0.00 H new ATOM 0 HB2 GLN A 11 0.335 -19.463 -0.085 1.00 0.00 H new ATOM 0 HB3 GLN A 11 1.546 -18.203 0.046 1.00 0.00 H new ATOM 0 HG2 GLN A 11 3.145 -20.134 0.871 1.00 0.00 H new ATOM 0 HG3 GLN A 11 1.948 -21.217 0.186 1.00 0.00 H new ATOM 0 HE21 GLN A 11 4.353 -18.699 -0.594 1.00 0.00 H new ATOM 0 HE22 GLN A 11 4.337 -18.989 -2.337 1.00 0.00 H new ATOM 174 N ASP A 12 2.852 -18.828 3.506 1.00 0.00 N ATOM 175 CA ASP A 12 3.907 -18.094 4.199 1.00 0.00 C ATOM 176 C ASP A 12 3.320 -16.882 4.915 1.00 0.00 C ATOM 177 O ASP A 12 2.593 -17.035 5.894 1.00 0.00 O ATOM 178 CB ASP A 12 4.985 -17.644 3.207 1.00 0.00 C ATOM 179 CG ASP A 12 6.098 -16.910 3.947 1.00 0.00 C ATOM 180 OD1 ASP A 12 6.241 -17.134 5.138 1.00 0.00 O ATOM 181 OD2 ASP A 12 6.791 -16.133 3.312 1.00 0.00 O ATOM 0 H ASP A 12 2.754 -19.801 3.794 1.00 0.00 H new ATOM 0 HA ASP A 12 4.363 -18.755 4.936 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.393 -18.508 2.683 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.547 -16.992 2.452 1.00 0.00 H new ATOM 186 N VAL A 13 3.640 -15.687 4.413 1.00 0.00 N ATOM 187 CA VAL A 13 3.145 -14.431 4.990 1.00 0.00 C ATOM 188 C VAL A 13 3.659 -14.217 6.415 1.00 0.00 C ATOM 189 O VAL A 13 4.244 -13.176 6.715 1.00 0.00 O ATOM 190 CB VAL A 13 1.609 -14.390 4.978 1.00 0.00 C ATOM 191 CG1 VAL A 13 1.138 -13.135 5.706 1.00 0.00 C ATOM 192 CG2 VAL A 13 1.092 -14.355 3.534 1.00 0.00 C ATOM 0 H VAL A 13 4.245 -15.561 3.601 1.00 0.00 H new ATOM 0 HA VAL A 13 3.528 -13.623 4.367 1.00 0.00 H new ATOM 0 HB VAL A 13 1.224 -15.281 5.474 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.049 -13.099 5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.496 -13.155 6.735 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.532 -12.253 5.202 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.002 -14.326 3.538 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.477 -13.468 3.031 1.00 0.00 H new ATOM 0 HG23 VAL A 13 1.429 -15.246 3.005 1.00 0.00 H new ATOM 202 N SER A 14 3.443 -15.192 7.288 1.00 0.00 N ATOM 203 CA SER A 14 3.897 -15.072 8.668 1.00 0.00 C ATOM 204 C SER A 14 5.391 -14.768 8.717 1.00 0.00 C ATOM 205 O SER A 14 6.218 -15.680 8.700 1.00 0.00 O ATOM 206 CB SER A 14 3.612 -16.368 9.426 1.00 0.00 C ATOM 207 OG SER A 14 2.251 -16.732 9.238 1.00 0.00 O ATOM 0 H SER A 14 2.962 -16.065 7.070 1.00 0.00 H new ATOM 0 HA SER A 14 3.356 -14.251 9.138 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.266 -17.163 9.068 1.00 0.00 H new ATOM 0 HB3 SER A 14 3.822 -16.236 10.487 1.00 0.00 H new ATOM 0 HG SER A 14 2.065 -17.564 9.722 1.00 0.00 H new ATOM 213 N GLY A 15 5.733 -13.483 8.784 1.00 0.00 N ATOM 214 CA GLY A 15 7.134 -13.082 8.843 1.00 0.00 C ATOM 215 C GLY A 15 7.348 -11.695 8.240 1.00 0.00 C ATOM 216 O GLY A 15 6.407 -10.909 8.104 1.00 0.00 O ATOM 0 H GLY A 15 5.067 -12.711 8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.470 -13.084 9.880 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.744 -13.810 8.308 1.00 0.00 H new ATOM 220 N THR A 16 8.600 -11.402 7.896 1.00 0.00 N ATOM 221 CA THR A 16 8.949 -10.108 7.322 1.00 0.00 C ATOM 222 C THR A 16 8.877 -10.136 5.800 1.00 0.00 C ATOM 223 O THR A 16 9.031 -11.187 5.177 1.00 0.00 O ATOM 224 CB THR A 16 10.359 -9.708 7.760 1.00 0.00 C ATOM 225 OG1 THR A 16 10.447 -9.757 9.176 1.00 0.00 O ATOM 226 CG2 THR A 16 10.660 -8.287 7.277 1.00 0.00 C ATOM 0 H THR A 16 9.387 -12.042 8.005 1.00 0.00 H new ATOM 0 HA THR A 16 8.227 -9.376 7.684 1.00 0.00 H new ATOM 0 HB THR A 16 11.083 -10.399 7.328 1.00 0.00 H new ATOM 0 HG1 THR A 16 11.351 -9.502 9.457 1.00 0.00 H new ATOM 0 HG21 THR A 16 11.665 -8.002 7.589 1.00 0.00 H new ATOM 0 HG22 THR A 16 10.594 -8.251 6.190 1.00 0.00 H new ATOM 0 HG23 THR A 16 9.936 -7.595 7.708 1.00 0.00 H new ATOM 234 N TRP A 17 8.645 -8.968 5.212 1.00 0.00 N ATOM 235 CA TRP A 17 8.554 -8.849 3.763 1.00 0.00 C ATOM 236 C TRP A 17 9.171 -7.530 3.308 1.00 0.00 C ATOM 237 O TRP A 17 9.646 -6.745 4.127 1.00 0.00 O ATOM 238 CB TRP A 17 7.087 -8.904 3.326 1.00 0.00 C ATOM 239 CG TRP A 17 6.577 -10.307 3.436 1.00 0.00 C ATOM 240 CD1 TRP A 17 6.246 -10.929 4.593 1.00 0.00 C ATOM 241 CD2 TRP A 17 6.327 -11.269 2.370 1.00 0.00 C ATOM 242 NE1 TRP A 17 5.814 -12.212 4.303 1.00 0.00 N ATOM 243 CE2 TRP A 17 5.847 -12.468 2.945 1.00 0.00 C ATOM 244 CE3 TRP A 17 6.474 -11.217 0.974 1.00 0.00 C ATOM 245 CZ2 TRP A 17 5.521 -13.576 2.163 1.00 0.00 C ATOM 246 CZ3 TRP A 17 6.146 -12.329 0.181 1.00 0.00 C ATOM 247 CH2 TRP A 17 5.671 -13.505 0.774 1.00 0.00 C ATOM 0 H TRP A 17 8.517 -8.091 5.717 1.00 0.00 H new ATOM 0 HA TRP A 17 9.098 -9.677 3.307 1.00 0.00 H new ATOM 0 HB2 TRP A 17 6.488 -8.240 3.948 1.00 0.00 H new ATOM 0 HB3 TRP A 17 6.991 -8.552 2.299 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.309 -10.495 5.580 1.00 0.00 H new ATOM 0 HE1 TRP A 17 5.509 -12.886 5.005 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.842 -10.315 0.507 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.156 -14.481 2.626 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 6.261 -12.277 -0.892 1.00 0.00 H new ATOM 0 HH2 TRP A 17 5.421 -14.357 0.159 1.00 0.00 H new ATOM 258 N TYR A 18 9.152 -7.288 2.001 1.00 0.00 N ATOM 259 CA TYR A 18 9.702 -6.056 1.454 1.00 0.00 C ATOM 260 C TYR A 18 8.731 -5.470 0.444 1.00 0.00 C ATOM 261 O TYR A 18 7.893 -6.186 -0.088 1.00 0.00 O ATOM 262 CB TYR A 18 11.044 -6.333 0.775 1.00 0.00 C ATOM 263 CG TYR A 18 11.970 -7.021 1.749 1.00 0.00 C ATOM 264 CD1 TYR A 18 11.750 -8.359 2.094 1.00 0.00 C ATOM 265 CD2 TYR A 18 13.047 -6.322 2.305 1.00 0.00 C ATOM 266 CE1 TYR A 18 12.608 -8.999 2.997 1.00 0.00 C ATOM 267 CE2 TYR A 18 13.905 -6.961 3.208 1.00 0.00 C ATOM 268 CZ TYR A 18 13.685 -8.300 3.553 1.00 0.00 C ATOM 269 OH TYR A 18 14.531 -8.931 4.443 1.00 0.00 O ATOM 0 H TYR A 18 8.764 -7.926 1.306 1.00 0.00 H new ATOM 0 HA TYR A 18 9.857 -5.346 2.266 1.00 0.00 H new ATOM 0 HB2 TYR A 18 10.896 -6.958 -0.105 1.00 0.00 H new ATOM 0 HB3 TYR A 18 11.489 -5.399 0.432 1.00 0.00 H new ATOM 0 HD1 TYR A 18 10.919 -8.898 1.664 1.00 0.00 H new ATOM 0 HD2 TYR A 18 13.216 -5.289 2.038 1.00 0.00 H new ATOM 0 HE1 TYR A 18 12.438 -10.032 3.264 1.00 0.00 H new ATOM 0 HE2 TYR A 18 14.736 -6.422 3.638 1.00 0.00 H new ATOM 0 HH TYR A 18 15.227 -8.305 4.733 1.00 0.00 H new ATOM 279 N LEU A 19 8.860 -4.177 0.177 1.00 0.00 N ATOM 280 CA LEU A 19 7.998 -3.500 -0.785 1.00 0.00 C ATOM 281 C LEU A 19 8.788 -3.249 -2.062 1.00 0.00 C ATOM 282 O LEU A 19 9.873 -2.668 -2.020 1.00 0.00 O ATOM 283 CB LEU A 19 7.522 -2.175 -0.194 1.00 0.00 C ATOM 284 CG LEU A 19 6.409 -1.578 -1.071 1.00 0.00 C ATOM 285 CD1 LEU A 19 5.063 -2.233 -0.738 1.00 0.00 C ATOM 286 CD2 LEU A 19 6.298 -0.068 -0.822 1.00 0.00 C ATOM 0 H LEU A 19 9.556 -3.573 0.615 1.00 0.00 H new ATOM 0 HA LEU A 19 7.129 -4.118 -1.011 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.153 -2.331 0.820 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.356 -1.477 -0.126 1.00 0.00 H new ATOM 0 HG LEU A 19 6.658 -1.764 -2.116 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.283 -1.802 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.125 -3.306 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.823 -2.058 0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.507 0.347 -1.447 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.063 0.111 0.227 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.245 0.412 -1.069 1.00 0.00 H new ATOM 298 N LYS A 20 8.262 -3.723 -3.185 1.00 0.00 N ATOM 299 CA LYS A 20 8.959 -3.580 -4.460 1.00 0.00 C ATOM 300 C LYS A 20 8.252 -2.598 -5.394 1.00 0.00 C ATOM 301 O LYS A 20 8.825 -2.163 -6.388 1.00 0.00 O ATOM 302 CB LYS A 20 9.076 -4.954 -5.123 1.00 0.00 C ATOM 303 CG LYS A 20 9.521 -5.981 -4.072 1.00 0.00 C ATOM 304 CD LYS A 20 10.639 -6.857 -4.642 1.00 0.00 C ATOM 305 CE LYS A 20 10.127 -7.625 -5.862 1.00 0.00 C ATOM 306 NZ LYS A 20 10.838 -8.931 -5.953 1.00 0.00 N ATOM 0 H LYS A 20 7.365 -4.205 -3.241 1.00 0.00 H new ATOM 0 HA LYS A 20 9.951 -3.174 -4.263 1.00 0.00 H new ATOM 0 HB2 LYS A 20 8.118 -5.247 -5.553 1.00 0.00 H new ATOM 0 HB3 LYS A 20 9.795 -4.917 -5.941 1.00 0.00 H new ATOM 0 HG2 LYS A 20 9.870 -5.469 -3.175 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.675 -6.602 -3.776 1.00 0.00 H new ATOM 0 HD2 LYS A 20 11.491 -6.238 -4.922 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.989 -7.556 -3.882 1.00 0.00 H new ATOM 0 HE2 LYS A 20 9.052 -7.787 -5.780 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.293 -7.043 -6.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.236 -9.044 -6.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 11.606 -8.958 -5.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 10.169 -9.704 -5.764 1.00 0.00 H new ATOM 320 N ALA A 21 7.013 -2.251 -5.083 1.00 0.00 N ATOM 321 CA ALA A 21 6.275 -1.314 -5.927 1.00 0.00 C ATOM 322 C ALA A 21 5.074 -0.749 -5.186 1.00 0.00 C ATOM 323 O ALA A 21 4.381 -1.474 -4.475 1.00 0.00 O ATOM 324 CB ALA A 21 5.798 -2.013 -7.197 1.00 0.00 C ATOM 0 H ALA A 21 6.502 -2.594 -4.270 1.00 0.00 H new ATOM 0 HA ALA A 21 6.947 -0.496 -6.189 1.00 0.00 H new ATOM 0 HB1 ALA A 21 5.249 -1.305 -7.818 1.00 0.00 H new ATOM 0 HB2 ALA A 21 6.658 -2.390 -7.750 1.00 0.00 H new ATOM 0 HB3 ALA A 21 5.145 -2.844 -6.931 1.00 0.00 H new ATOM 330 N MET A 22 4.835 0.549 -5.339 1.00 0.00 N ATOM 331 CA MET A 22 3.714 1.183 -4.657 1.00 0.00 C ATOM 332 C MET A 22 3.250 2.407 -5.433 1.00 0.00 C ATOM 333 O MET A 22 4.070 3.134 -5.988 1.00 0.00 O ATOM 334 CB MET A 22 4.147 1.591 -3.250 1.00 0.00 C ATOM 335 CG MET A 22 2.940 2.079 -2.448 1.00 0.00 C ATOM 336 SD MET A 22 3.379 2.150 -0.692 1.00 0.00 S ATOM 337 CE MET A 22 2.965 3.890 -0.419 1.00 0.00 C ATOM 0 H MET A 22 5.393 1.174 -5.920 1.00 0.00 H new ATOM 0 HA MET A 22 2.885 0.478 -4.594 1.00 0.00 H new ATOM 0 HB2 MET A 22 4.611 0.744 -2.744 1.00 0.00 H new ATOM 0 HB3 MET A 22 4.898 2.379 -3.307 1.00 0.00 H new ATOM 0 HG2 MET A 22 2.630 3.064 -2.798 1.00 0.00 H new ATOM 0 HG3 MET A 22 2.094 1.408 -2.597 1.00 0.00 H new ATOM 0 HE1 MET A 22 3.213 4.167 0.606 1.00 0.00 H new ATOM 0 HE2 MET A 22 3.533 4.512 -1.111 1.00 0.00 H new ATOM 0 HE3 MET A 22 1.899 4.041 -0.587 1.00 0.00 H new ATOM 347 N THR A 23 1.938 2.644 -5.456 1.00 0.00 N ATOM 348 CA THR A 23 1.399 3.803 -6.168 1.00 0.00 C ATOM 349 C THR A 23 0.892 4.857 -5.188 1.00 0.00 C ATOM 350 O THR A 23 0.023 4.581 -4.362 1.00 0.00 O ATOM 351 CB THR A 23 0.251 3.361 -7.076 1.00 0.00 C ATOM 352 OG1 THR A 23 -0.520 4.495 -7.446 1.00 0.00 O ATOM 353 CG2 THR A 23 -0.630 2.364 -6.330 1.00 0.00 C ATOM 0 H THR A 23 1.239 2.060 -4.998 1.00 0.00 H new ATOM 0 HA THR A 23 2.198 4.240 -6.766 1.00 0.00 H new ATOM 0 HB THR A 23 0.654 2.888 -7.972 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.395 4.453 -7.006 1.00 0.00 H new ATOM 0 HG21 THR A 23 -1.449 2.048 -6.976 1.00 0.00 H new ATOM 0 HG22 THR A 23 -0.036 1.495 -6.046 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.035 2.835 -5.435 1.00 0.00 H new ATOM 361 N VAL A 24 1.446 6.066 -5.283 1.00 0.00 N ATOM 362 CA VAL A 24 1.036 7.153 -4.381 1.00 0.00 C ATOM 363 C VAL A 24 1.250 8.532 -5.010 1.00 0.00 C ATOM 364 O VAL A 24 2.316 9.122 -4.856 1.00 0.00 O ATOM 365 CB VAL A 24 1.842 7.077 -3.081 1.00 0.00 C ATOM 366 CG1 VAL A 24 1.011 6.402 -1.988 1.00 0.00 C ATOM 367 CG2 VAL A 24 3.121 6.273 -3.325 1.00 0.00 C ATOM 0 H VAL A 24 2.166 6.319 -5.960 1.00 0.00 H new ATOM 0 HA VAL A 24 -0.028 7.027 -4.183 1.00 0.00 H new ATOM 0 HB VAL A 24 2.099 8.086 -2.758 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.592 6.352 -1.067 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.103 6.979 -1.813 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.745 5.393 -2.304 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.697 6.217 -2.401 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.861 5.266 -3.652 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.717 6.762 -4.095 1.00 0.00 H new ATOM 377 N ASP A 25 0.221 9.044 -5.690 1.00 0.00 N ATOM 378 CA ASP A 25 0.279 10.364 -6.331 1.00 0.00 C ATOM 379 C ASP A 25 -0.709 10.404 -7.489 1.00 0.00 C ATOM 380 O ASP A 25 -0.346 10.152 -8.640 1.00 0.00 O ATOM 381 CB ASP A 25 1.685 10.668 -6.861 1.00 0.00 C ATOM 382 CG ASP A 25 1.615 11.712 -7.970 1.00 0.00 C ATOM 383 OD1 ASP A 25 1.071 12.775 -7.725 1.00 0.00 O ATOM 384 OD2 ASP A 25 2.109 11.433 -9.051 1.00 0.00 O ATOM 0 H ASP A 25 -0.669 8.562 -5.812 1.00 0.00 H new ATOM 0 HA ASP A 25 0.024 11.116 -5.584 1.00 0.00 H new ATOM 0 HB2 ASP A 25 2.317 11.030 -6.050 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.144 9.755 -7.240 1.00 0.00 H new ATOM 389 N ARG A 26 -1.967 10.693 -7.173 1.00 0.00 N ATOM 390 CA ARG A 26 -3.013 10.737 -8.191 1.00 0.00 C ATOM 391 C ARG A 26 -3.794 12.045 -8.110 1.00 0.00 C ATOM 392 O ARG A 26 -3.712 12.882 -9.009 1.00 0.00 O ATOM 393 CB ARG A 26 -3.969 9.556 -7.996 1.00 0.00 C ATOM 394 CG ARG A 26 -3.163 8.284 -7.707 1.00 0.00 C ATOM 395 CD ARG A 26 -3.098 8.046 -6.198 1.00 0.00 C ATOM 396 NE ARG A 26 -4.441 7.882 -5.654 1.00 0.00 N ATOM 397 CZ ARG A 26 -4.637 7.714 -4.352 1.00 0.00 C ATOM 398 NH1 ARG A 26 -5.847 7.571 -3.887 1.00 0.00 N ATOM 399 NH2 ARG A 26 -3.618 7.690 -3.535 1.00 0.00 N ATOM 0 H ARG A 26 -2.287 10.899 -6.227 1.00 0.00 H new ATOM 0 HA ARG A 26 -2.543 10.674 -9.173 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -4.652 9.761 -7.172 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -4.579 9.417 -8.889 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -3.626 7.429 -8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -2.156 8.380 -8.113 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -2.502 7.158 -5.988 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -2.601 8.885 -5.712 1.00 0.00 H new ATOM 0 HE ARG A 26 -5.243 7.897 -6.284 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -6.643 7.588 -4.524 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -5.997 7.442 -2.886 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -2.671 7.800 -3.897 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -3.769 7.561 -2.535 1.00 0.00 H new ATOM 413 N GLU A 27 -4.552 12.213 -7.031 1.00 0.00 N ATOM 414 CA GLU A 27 -5.345 13.424 -6.850 1.00 0.00 C ATOM 415 C GLU A 27 -4.656 14.375 -5.876 1.00 0.00 C ATOM 416 O GLU A 27 -4.902 15.581 -5.898 1.00 0.00 O ATOM 417 CB GLU A 27 -6.734 13.064 -6.320 1.00 0.00 C ATOM 418 CG GLU A 27 -7.796 13.509 -7.327 1.00 0.00 C ATOM 419 CD GLU A 27 -9.179 13.079 -6.850 1.00 0.00 C ATOM 420 OE1 GLU A 27 -9.269 12.543 -5.759 1.00 0.00 O ATOM 421 OE2 GLU A 27 -10.130 13.291 -7.585 1.00 0.00 O ATOM 0 H GLU A 27 -4.634 11.533 -6.275 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.443 13.920 -7.816 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.804 11.989 -6.153 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -6.904 13.548 -5.358 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.764 14.592 -7.447 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.588 13.074 -8.304 1.00 0.00 H new ATOM 428 N PHE A 28 -3.804 13.821 -5.017 1.00 0.00 N ATOM 429 CA PHE A 28 -3.088 14.623 -4.026 1.00 0.00 C ATOM 430 C PHE A 28 -1.580 14.620 -4.303 1.00 0.00 C ATOM 431 O PHE A 28 -0.836 13.842 -3.707 1.00 0.00 O ATOM 432 CB PHE A 28 -3.355 14.061 -2.625 1.00 0.00 C ATOM 433 CG PHE A 28 -4.778 13.558 -2.550 1.00 0.00 C ATOM 434 CD1 PHE A 28 -5.039 12.236 -2.171 1.00 0.00 C ATOM 435 CD2 PHE A 28 -5.838 14.418 -2.862 1.00 0.00 C ATOM 436 CE1 PHE A 28 -6.359 11.773 -2.105 1.00 0.00 C ATOM 437 CE2 PHE A 28 -7.158 13.955 -2.796 1.00 0.00 C ATOM 438 CZ PHE A 28 -7.417 12.634 -2.416 1.00 0.00 C ATOM 0 H PHE A 28 -3.592 12.824 -4.986 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.446 15.651 -4.088 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.659 13.251 -2.407 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -3.190 14.833 -1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.222 11.573 -1.929 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -5.638 15.438 -3.154 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -6.560 10.752 -1.814 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -7.976 14.618 -3.038 1.00 0.00 H new ATOM 0 HZ PHE A 28 -8.435 12.278 -2.363 1.00 0.00 H new ATOM 448 N PRO A 29 -1.110 15.468 -5.189 1.00 0.00 N ATOM 449 CA PRO A 29 0.337 15.547 -5.527 1.00 0.00 C ATOM 450 C PRO A 29 1.118 16.380 -4.514 1.00 0.00 C ATOM 451 O PRO A 29 1.103 17.610 -4.562 1.00 0.00 O ATOM 452 CB PRO A 29 0.343 16.208 -6.902 1.00 0.00 C ATOM 453 CG PRO A 29 -0.880 17.065 -6.933 1.00 0.00 C ATOM 454 CD PRO A 29 -1.896 16.441 -5.968 1.00 0.00 C ATOM 0 HA PRO A 29 0.819 14.570 -5.516 1.00 0.00 H new ATOM 0 HB2 PRO A 29 1.244 16.803 -7.048 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.321 15.462 -7.697 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.642 18.086 -6.634 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -1.289 17.116 -7.942 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.347 17.195 -5.323 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -2.709 15.955 -6.507 1.00 0.00 H new ATOM 462 N GLU A 30 1.800 15.698 -3.600 1.00 0.00 N ATOM 463 CA GLU A 30 2.588 16.375 -2.578 1.00 0.00 C ATOM 464 C GLU A 30 3.380 15.353 -1.771 1.00 0.00 C ATOM 465 O GLU A 30 4.603 15.273 -1.883 1.00 0.00 O ATOM 466 CB GLU A 30 1.669 17.168 -1.649 1.00 0.00 C ATOM 467 CG GLU A 30 2.396 17.447 -0.334 1.00 0.00 C ATOM 468 CD GLU A 30 1.774 18.655 0.360 1.00 0.00 C ATOM 469 OE1 GLU A 30 2.122 19.766 -0.005 1.00 0.00 O ATOM 470 OE2 GLU A 30 0.962 18.452 1.246 1.00 0.00 O ATOM 0 H GLU A 30 1.823 14.680 -3.546 1.00 0.00 H new ATOM 0 HA GLU A 30 3.281 17.062 -3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 30 1.377 18.106 -2.122 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.754 16.608 -1.460 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.337 16.574 0.316 1.00 0.00 H new ATOM 0 HG3 GLU A 30 3.453 17.632 -0.525 1.00 0.00 H new ATOM 477 N MET A 31 2.672 14.560 -0.972 1.00 0.00 N ATOM 478 CA MET A 31 3.316 13.534 -0.169 1.00 0.00 C ATOM 479 C MET A 31 3.764 12.396 -1.072 1.00 0.00 C ATOM 480 O MET A 31 2.944 11.744 -1.719 1.00 0.00 O ATOM 481 CB MET A 31 2.353 13.008 0.898 1.00 0.00 C ATOM 482 CG MET A 31 1.144 12.352 0.227 1.00 0.00 C ATOM 483 SD MET A 31 -0.263 12.380 1.365 1.00 0.00 S ATOM 484 CE MET A 31 0.255 10.989 2.399 1.00 0.00 C ATOM 0 H MET A 31 1.659 14.610 -0.866 1.00 0.00 H new ATOM 0 HA MET A 31 4.183 13.965 0.332 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.862 12.286 1.536 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.025 13.826 1.540 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.893 12.881 -0.692 1.00 0.00 H new ATOM 0 HG3 MET A 31 1.381 11.325 -0.051 1.00 0.00 H new ATOM 0 HE1 MET A 31 -0.483 10.825 3.184 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.339 10.091 1.786 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.222 11.212 2.851 1.00 0.00 H new ATOM 494 N ASN A 32 5.069 12.179 -1.124 1.00 0.00 N ATOM 495 CA ASN A 32 5.628 11.128 -1.965 1.00 0.00 C ATOM 496 C ASN A 32 6.557 10.227 -1.165 1.00 0.00 C ATOM 497 O ASN A 32 7.343 10.696 -0.343 1.00 0.00 O ATOM 498 CB ASN A 32 6.399 11.750 -3.130 1.00 0.00 C ATOM 499 CG ASN A 32 7.646 12.458 -2.611 1.00 0.00 C ATOM 500 OD1 ASN A 32 7.521 13.428 -1.748 1.00 0.00 O flip ATOM 501 ND2 ASN A 32 8.762 12.118 -3.002 1.00 0.00 N flip ATOM 0 H ASN A 32 5.760 12.713 -0.597 1.00 0.00 H new ATOM 0 HA ASN A 32 4.805 10.525 -2.349 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.681 10.977 -3.845 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.763 12.458 -3.661 1.00 0.00 H new ATOM 0 HD21 ASN A 32 8.857 11.359 -3.677 1.00 0.00 H new ATOM 0 HD22 ASN A 32 9.593 12.595 -2.651 1.00 0.00 H new ATOM 508 N LEU A 33 6.462 8.930 -1.424 1.00 0.00 N ATOM 509 CA LEU A 33 7.297 7.959 -0.739 1.00 0.00 C ATOM 510 C LEU A 33 8.725 8.042 -1.267 1.00 0.00 C ATOM 511 O LEU A 33 8.962 7.897 -2.466 1.00 0.00 O ATOM 512 CB LEU A 33 6.735 6.552 -0.966 1.00 0.00 C ATOM 513 CG LEU A 33 6.879 5.706 0.302 1.00 0.00 C ATOM 514 CD1 LEU A 33 6.250 4.329 0.062 1.00 0.00 C ATOM 515 CD2 LEU A 33 8.359 5.531 0.654 1.00 0.00 C ATOM 0 H LEU A 33 5.815 8.528 -2.103 1.00 0.00 H new ATOM 0 HA LEU A 33 7.303 8.175 0.329 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.685 6.615 -1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.261 6.073 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 33 6.374 6.209 1.127 1.00 0.00 H new ATOM 0 HD11 LEU A 33 6.349 3.722 0.962 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.194 4.449 -0.180 1.00 0.00 H new ATOM 0 HD13 LEU A 33 6.759 3.836 -0.766 1.00 0.00 H new ATOM 0 HD21 LEU A 33 8.449 4.928 1.557 1.00 0.00 H new ATOM 0 HD22 LEU A 33 8.872 5.032 -0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.811 6.508 0.824 1.00 0.00 H new ATOM 527 N GLU A 34 9.666 8.298 -0.370 1.00 0.00 N ATOM 528 CA GLU A 34 11.068 8.417 -0.759 1.00 0.00 C ATOM 529 C GLU A 34 11.820 7.111 -0.503 1.00 0.00 C ATOM 530 O GLU A 34 12.674 6.713 -1.297 1.00 0.00 O ATOM 531 CB GLU A 34 11.731 9.552 0.018 1.00 0.00 C ATOM 532 CG GLU A 34 11.723 10.824 -0.832 1.00 0.00 C ATOM 533 CD GLU A 34 12.279 11.994 -0.027 1.00 0.00 C ATOM 534 OE1 GLU A 34 11.530 12.563 0.747 1.00 0.00 O ATOM 535 OE2 GLU A 34 13.449 12.299 -0.195 1.00 0.00 O ATOM 0 H GLU A 34 9.489 8.427 0.626 1.00 0.00 H new ATOM 0 HA GLU A 34 11.107 8.635 -1.826 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.201 9.724 0.955 1.00 0.00 H new ATOM 0 HB3 GLU A 34 12.755 9.281 0.276 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.321 10.674 -1.731 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.707 11.047 -1.158 1.00 0.00 H new ATOM 542 N SER A 35 11.493 6.443 0.601 1.00 0.00 N ATOM 543 CA SER A 35 12.142 5.179 0.940 1.00 0.00 C ATOM 544 C SER A 35 11.226 4.364 1.821 1.00 0.00 C ATOM 545 O SER A 35 10.337 4.915 2.471 1.00 0.00 O ATOM 546 CB SER A 35 13.463 5.422 1.676 1.00 0.00 C ATOM 547 OG SER A 35 13.231 5.394 3.077 1.00 0.00 O ATOM 0 H SER A 35 10.789 6.752 1.271 1.00 0.00 H new ATOM 0 HA SER A 35 12.351 4.641 0.015 1.00 0.00 H new ATOM 0 HB2 SER A 35 14.192 4.659 1.401 1.00 0.00 H new ATOM 0 HB3 SER A 35 13.884 6.384 1.384 1.00 0.00 H new ATOM 0 HG SER A 35 14.033 5.703 3.548 1.00 0.00 H new ATOM 553 N VAL A 36 11.420 3.052 1.827 1.00 0.00 N ATOM 554 CA VAL A 36 10.567 2.190 2.622 1.00 0.00 C ATOM 555 C VAL A 36 11.374 1.163 3.406 1.00 0.00 C ATOM 556 O VAL A 36 12.437 0.731 2.975 1.00 0.00 O ATOM 557 CB VAL A 36 9.600 1.483 1.680 1.00 0.00 C ATOM 558 CG1 VAL A 36 10.392 0.627 0.680 1.00 0.00 C ATOM 559 CG2 VAL A 36 8.647 0.600 2.493 1.00 0.00 C ATOM 0 H VAL A 36 12.148 2.571 1.299 1.00 0.00 H new ATOM 0 HA VAL A 36 10.028 2.797 3.349 1.00 0.00 H new ATOM 0 HB VAL A 36 9.017 2.222 1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.700 0.121 0.006 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.059 1.266 0.102 1.00 0.00 H new ATOM 0 HG13 VAL A 36 10.979 -0.115 1.221 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.955 0.094 1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.222 -0.142 3.047 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.085 1.219 3.192 1.00 0.00 H new ATOM 569 N THR A 37 10.852 0.761 4.558 1.00 0.00 N ATOM 570 CA THR A 37 11.528 -0.232 5.380 1.00 0.00 C ATOM 571 C THR A 37 10.839 -1.591 5.227 1.00 0.00 C ATOM 572 O THR A 37 9.627 -1.642 5.022 1.00 0.00 O ATOM 573 CB THR A 37 11.455 0.172 6.848 1.00 0.00 C ATOM 574 OG1 THR A 37 10.108 0.090 7.282 1.00 0.00 O ATOM 575 CG2 THR A 37 11.971 1.599 7.017 1.00 0.00 C ATOM 0 H THR A 37 9.971 1.104 4.941 1.00 0.00 H new ATOM 0 HA THR A 37 12.567 -0.297 5.058 1.00 0.00 H new ATOM 0 HB THR A 37 12.073 -0.498 7.446 1.00 0.00 H new ATOM 0 HG1 THR A 37 9.580 0.789 6.843 1.00 0.00 H new ATOM 0 HG21 THR A 37 11.917 1.883 8.068 1.00 0.00 H new ATOM 0 HG22 THR A 37 13.006 1.654 6.679 1.00 0.00 H new ATOM 0 HG23 THR A 37 11.359 2.280 6.425 1.00 0.00 H new ATOM 583 N PRO A 38 11.552 -2.686 5.355 1.00 0.00 N ATOM 584 CA PRO A 38 10.933 -4.033 5.262 1.00 0.00 C ATOM 585 C PRO A 38 9.614 -4.060 6.024 1.00 0.00 C ATOM 586 O PRO A 38 9.519 -3.498 7.115 1.00 0.00 O ATOM 587 CB PRO A 38 11.966 -4.942 5.920 1.00 0.00 C ATOM 588 CG PRO A 38 13.280 -4.274 5.688 1.00 0.00 C ATOM 589 CD PRO A 38 13.002 -2.771 5.598 1.00 0.00 C ATOM 0 HA PRO A 38 10.699 -4.334 4.241 1.00 0.00 H new ATOM 0 HB2 PRO A 38 11.766 -5.059 6.985 1.00 0.00 H new ATOM 0 HB3 PRO A 38 11.949 -5.940 5.481 1.00 0.00 H new ATOM 0 HG2 PRO A 38 13.973 -4.491 6.501 1.00 0.00 H new ATOM 0 HG3 PRO A 38 13.742 -4.637 4.770 1.00 0.00 H new ATOM 0 HD2 PRO A 38 13.282 -2.258 6.518 1.00 0.00 H new ATOM 0 HD3 PRO A 38 13.569 -2.309 4.790 1.00 0.00 H new ATOM 597 N MET A 39 8.594 -4.682 5.452 1.00 0.00 N ATOM 598 CA MET A 39 7.302 -4.723 6.107 1.00 0.00 C ATOM 599 C MET A 39 7.151 -5.983 6.938 1.00 0.00 C ATOM 600 O MET A 39 7.585 -7.060 6.535 1.00 0.00 O ATOM 601 CB MET A 39 6.187 -4.655 5.065 1.00 0.00 C ATOM 602 CG MET A 39 4.852 -4.930 5.747 1.00 0.00 C ATOM 603 SD MET A 39 3.524 -4.093 4.845 1.00 0.00 S ATOM 604 CE MET A 39 3.654 -5.042 3.310 1.00 0.00 C ATOM 0 H MET A 39 8.636 -5.157 4.550 1.00 0.00 H new ATOM 0 HA MET A 39 7.231 -3.863 6.773 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.173 -3.673 4.592 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.364 -5.386 4.276 1.00 0.00 H new ATOM 0 HG2 MET A 39 4.663 -6.003 5.779 1.00 0.00 H new ATOM 0 HG3 MET A 39 4.881 -4.580 6.779 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.713 -4.980 2.763 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.458 -4.634 2.697 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.870 -6.085 3.544 1.00 0.00 H new ATOM 614 N THR A 40 6.535 -5.834 8.101 1.00 0.00 N ATOM 615 CA THR A 40 6.330 -6.962 8.994 1.00 0.00 C ATOM 616 C THR A 40 4.871 -7.403 8.981 1.00 0.00 C ATOM 617 O THR A 40 3.998 -6.692 9.474 1.00 0.00 O ATOM 618 CB THR A 40 6.740 -6.584 10.419 1.00 0.00 C ATOM 619 OG1 THR A 40 7.891 -5.753 10.376 1.00 0.00 O ATOM 620 CG2 THR A 40 7.052 -7.853 11.215 1.00 0.00 C ATOM 0 H THR A 40 6.170 -4.946 8.447 1.00 0.00 H new ATOM 0 HA THR A 40 6.948 -7.790 8.646 1.00 0.00 H new ATOM 0 HB THR A 40 5.924 -6.047 10.902 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.153 -5.509 11.288 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.344 -7.583 12.230 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.167 -8.488 11.249 1.00 0.00 H new ATOM 0 HG23 THR A 40 7.868 -8.393 10.734 1.00 0.00 H new ATOM 628 N LEU A 41 4.615 -8.585 8.423 1.00 0.00 N ATOM 629 CA LEU A 41 3.254 -9.111 8.365 1.00 0.00 C ATOM 630 C LEU A 41 3.078 -10.215 9.406 1.00 0.00 C ATOM 631 O LEU A 41 3.580 -11.326 9.230 1.00 0.00 O ATOM 632 CB LEU A 41 2.975 -9.682 6.975 1.00 0.00 C ATOM 633 CG LEU A 41 1.876 -8.871 6.273 1.00 0.00 C ATOM 634 CD1 LEU A 41 2.448 -7.554 5.755 1.00 0.00 C ATOM 635 CD2 LEU A 41 1.344 -9.681 5.104 1.00 0.00 C ATOM 0 H LEU A 41 5.324 -9.190 8.009 1.00 0.00 H new ATOM 0 HA LEU A 41 2.555 -8.300 8.572 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.887 -9.664 6.378 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.669 -10.725 7.058 1.00 0.00 H new ATOM 0 HG LEU A 41 1.074 -8.656 6.979 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.661 -6.986 5.259 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.842 -6.975 6.590 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.250 -7.759 5.046 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.562 -9.116 4.596 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.155 -9.887 4.405 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.933 -10.622 5.470 1.00 0.00 H new ATOM 647 N THR A 42 2.367 -9.910 10.486 1.00 0.00 N ATOM 648 CA THR A 42 2.148 -10.896 11.531 1.00 0.00 C ATOM 649 C THR A 42 0.808 -11.571 11.315 1.00 0.00 C ATOM 650 O THR A 42 -0.233 -10.916 11.277 1.00 0.00 O ATOM 651 CB THR A 42 2.190 -10.245 12.916 1.00 0.00 C ATOM 652 OG1 THR A 42 0.868 -10.112 13.416 1.00 0.00 O ATOM 653 CG2 THR A 42 2.852 -8.869 12.819 1.00 0.00 C ATOM 0 H THR A 42 1.939 -9.000 10.657 1.00 0.00 H new ATOM 0 HA THR A 42 2.944 -11.639 11.482 1.00 0.00 H new ATOM 0 HB THR A 42 2.770 -10.871 13.595 1.00 0.00 H new ATOM 0 HG1 THR A 42 0.866 -9.493 14.176 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.880 -8.408 13.806 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.868 -8.980 12.441 1.00 0.00 H new ATOM 0 HG23 THR A 42 2.280 -8.237 12.140 1.00 0.00 H new ATOM 661 N THR A 43 0.843 -12.881 11.171 1.00 0.00 N ATOM 662 CA THR A 43 -0.378 -13.630 10.950 1.00 0.00 C ATOM 663 C THR A 43 -0.971 -14.096 12.265 1.00 0.00 C ATOM 664 O THR A 43 -0.530 -15.089 12.842 1.00 0.00 O ATOM 665 CB THR A 43 -0.112 -14.831 10.040 1.00 0.00 C ATOM 666 OG1 THR A 43 0.592 -14.399 8.884 1.00 0.00 O ATOM 667 CG2 THR A 43 -1.445 -15.460 9.622 1.00 0.00 C ATOM 0 H THR A 43 1.693 -13.444 11.202 1.00 0.00 H new ATOM 0 HA THR A 43 -1.095 -12.970 10.462 1.00 0.00 H new ATOM 0 HB THR A 43 0.485 -15.569 10.575 1.00 0.00 H new ATOM 0 HG1 THR A 43 1.252 -15.077 8.631 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.256 -16.316 8.974 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.986 -15.789 10.509 1.00 0.00 H new ATOM 0 HG23 THR A 43 -2.043 -14.723 9.085 1.00 0.00 H new ATOM 675 N LEU A 44 -1.991 -13.382 12.725 1.00 0.00 N ATOM 676 CA LEU A 44 -2.639 -13.760 13.956 1.00 0.00 C ATOM 677 C LEU A 44 -3.442 -15.017 13.695 1.00 0.00 C ATOM 678 O LEU A 44 -4.675 -14.984 13.623 1.00 0.00 O ATOM 679 CB LEU A 44 -3.526 -12.632 14.480 1.00 0.00 C ATOM 680 CG LEU A 44 -2.852 -11.284 14.205 1.00 0.00 C ATOM 681 CD1 LEU A 44 -3.656 -10.165 14.870 1.00 0.00 C ATOM 682 CD2 LEU A 44 -1.431 -11.300 14.774 1.00 0.00 C ATOM 0 H LEU A 44 -2.375 -12.555 12.268 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.893 -13.952 14.727 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.502 -12.668 13.997 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.695 -12.755 15.550 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.811 -11.111 13.130 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.176 -9.206 14.674 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -4.668 -10.154 14.465 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -3.698 -10.337 15.946 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.950 -10.341 14.579 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.472 -11.474 15.849 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.858 -12.097 14.299 1.00 0.00 H new ATOM 694 N GLU A 45 -2.692 -16.111 13.526 1.00 0.00 N ATOM 695 CA GLU A 45 -3.264 -17.423 13.245 1.00 0.00 C ATOM 696 C GLU A 45 -4.358 -17.736 14.246 1.00 0.00 C ATOM 697 O GLU A 45 -4.150 -18.487 15.199 1.00 0.00 O ATOM 698 CB GLU A 45 -2.176 -18.498 13.323 1.00 0.00 C ATOM 699 CG GLU A 45 -1.055 -18.168 12.333 1.00 0.00 C ATOM 700 CD GLU A 45 -1.021 -19.209 11.218 1.00 0.00 C ATOM 701 OE1 GLU A 45 -0.619 -20.327 11.491 1.00 0.00 O ATOM 702 OE2 GLU A 45 -1.396 -18.870 10.108 1.00 0.00 O ATOM 0 H GLU A 45 -1.673 -16.107 13.581 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.687 -17.413 12.240 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.776 -18.552 14.336 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -2.600 -19.476 13.095 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.212 -17.176 11.911 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.096 -18.146 12.851 1.00 0.00 H new ATOM 709 N GLY A 46 -5.520 -17.146 14.032 1.00 0.00 N ATOM 710 CA GLY A 46 -6.633 -17.356 14.928 1.00 0.00 C ATOM 711 C GLY A 46 -7.655 -16.245 14.803 1.00 0.00 C ATOM 712 O GLY A 46 -8.797 -16.397 15.236 1.00 0.00 O ATOM 0 H GLY A 46 -5.713 -16.522 13.249 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.105 -18.314 14.708 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -6.272 -17.407 15.955 1.00 0.00 H new ATOM 716 N GLY A 47 -7.251 -15.117 14.226 1.00 0.00 N ATOM 717 CA GLY A 47 -8.178 -14.012 14.093 1.00 0.00 C ATOM 718 C GLY A 47 -7.925 -13.181 12.848 1.00 0.00 C ATOM 719 O GLY A 47 -8.792 -13.080 11.979 1.00 0.00 O ATOM 0 H GLY A 47 -6.316 -14.951 13.855 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.197 -14.399 14.066 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.103 -13.373 14.973 1.00 0.00 H new ATOM 723 N ASN A 48 -6.774 -12.518 12.785 1.00 0.00 N ATOM 724 CA ASN A 48 -6.509 -11.630 11.646 1.00 0.00 C ATOM 725 C ASN A 48 -5.025 -11.501 11.295 1.00 0.00 C ATOM 726 O ASN A 48 -4.202 -12.319 11.700 1.00 0.00 O ATOM 727 CB ASN A 48 -7.054 -10.248 11.995 1.00 0.00 C ATOM 728 CG ASN A 48 -8.466 -10.383 12.557 1.00 0.00 C ATOM 729 OD1 ASN A 48 -9.402 -10.690 11.817 1.00 0.00 O ATOM 730 ND2 ASN A 48 -8.678 -10.180 13.828 1.00 0.00 N ATOM 0 H ASN A 48 -6.030 -12.571 13.480 1.00 0.00 H new ATOM 0 HA ASN A 48 -6.996 -12.064 10.773 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -6.406 -9.764 12.725 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -7.064 -9.615 11.108 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -9.619 -10.275 14.210 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -7.903 -9.926 14.440 1.00 0.00 H new ATOM 737 N LEU A 49 -4.705 -10.462 10.504 1.00 0.00 N ATOM 738 CA LEU A 49 -3.330 -10.214 10.064 1.00 0.00 C ATOM 739 C LEU A 49 -2.902 -8.797 10.447 1.00 0.00 C ATOM 740 O LEU A 49 -3.673 -7.855 10.283 1.00 0.00 O ATOM 741 CB LEU A 49 -3.260 -10.353 8.537 1.00 0.00 C ATOM 742 CG LEU A 49 -2.192 -11.377 8.134 1.00 0.00 C ATOM 743 CD1 LEU A 49 -2.280 -11.646 6.629 1.00 0.00 C ATOM 744 CD2 LEU A 49 -0.799 -10.827 8.457 1.00 0.00 C ATOM 0 H LEU A 49 -5.383 -9.783 10.159 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.668 -10.935 10.544 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -4.231 -10.662 8.150 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -3.031 -9.386 8.089 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.361 -12.301 8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.520 -12.374 6.344 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.268 -12.039 6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.115 -10.717 6.083 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.043 -11.558 8.169 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.637 -9.901 7.906 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.724 -10.630 9.527 1.00 0.00 H new ATOM 756 N GLU A 50 -1.672 -8.648 10.945 1.00 0.00 N ATOM 757 CA GLU A 50 -1.169 -7.336 11.324 1.00 0.00 C ATOM 758 C GLU A 50 0.018 -6.976 10.452 1.00 0.00 C ATOM 759 O GLU A 50 0.953 -7.762 10.313 1.00 0.00 O ATOM 760 CB GLU A 50 -0.764 -7.323 12.799 1.00 0.00 C ATOM 761 CG GLU A 50 -0.377 -5.902 13.218 1.00 0.00 C ATOM 762 CD GLU A 50 -0.379 -5.793 14.740 1.00 0.00 C ATOM 763 OE1 GLU A 50 0.657 -6.040 15.334 1.00 0.00 O ATOM 764 OE2 GLU A 50 -1.418 -5.463 15.289 1.00 0.00 O ATOM 0 H GLU A 50 -1.016 -9.415 11.092 1.00 0.00 H new ATOM 0 HA GLU A 50 -1.959 -6.599 11.179 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.588 -7.682 13.415 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.074 -8.001 12.962 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.610 -5.654 12.828 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -1.078 -5.184 12.792 1.00 0.00 H new ATOM 771 N ALA A 51 -0.036 -5.797 9.848 1.00 0.00 N ATOM 772 CA ALA A 51 1.036 -5.353 8.973 1.00 0.00 C ATOM 773 C ALA A 51 1.665 -4.069 9.496 1.00 0.00 C ATOM 774 O ALA A 51 0.982 -3.060 9.676 1.00 0.00 O ATOM 775 CB ALA A 51 0.496 -5.149 7.559 1.00 0.00 C ATOM 0 H ALA A 51 -0.806 -5.136 9.948 1.00 0.00 H new ATOM 0 HA ALA A 51 1.810 -6.120 8.950 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.303 -4.816 6.906 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.091 -6.089 7.185 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.292 -4.396 7.575 1.00 0.00 H new ATOM 781 N LYS A 52 2.972 -4.122 9.747 1.00 0.00 N ATOM 782 CA LYS A 52 3.694 -2.965 10.265 1.00 0.00 C ATOM 783 C LYS A 52 4.891 -2.630 9.385 1.00 0.00 C ATOM 784 O LYS A 52 5.767 -3.469 9.172 1.00 0.00 O ATOM 785 CB LYS A 52 4.176 -3.243 11.690 1.00 0.00 C ATOM 786 CG LYS A 52 3.012 -3.762 12.538 1.00 0.00 C ATOM 787 CD LYS A 52 3.520 -4.154 13.927 1.00 0.00 C ATOM 788 CE LYS A 52 4.132 -2.933 14.619 1.00 0.00 C ATOM 789 NZ LYS A 52 4.010 -3.086 16.096 1.00 0.00 N ATOM 0 H LYS A 52 3.549 -4.950 9.600 1.00 0.00 H new ATOM 0 HA LYS A 52 3.012 -2.115 10.267 1.00 0.00 H new ATOM 0 HB2 LYS A 52 4.982 -3.976 11.675 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.582 -2.332 12.131 1.00 0.00 H new ATOM 0 HG2 LYS A 52 2.242 -2.995 12.625 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.551 -4.622 12.053 1.00 0.00 H new ATOM 0 HD2 LYS A 52 2.700 -4.550 14.526 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.264 -4.946 13.842 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.180 -2.830 14.339 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.625 -2.025 14.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 4.426 -2.257 16.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 3.006 -3.164 16.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.513 -3.944 16.399 1.00 0.00 H new ATOM 803 N VAL A 53 4.924 -1.403 8.872 1.00 0.00 N ATOM 804 CA VAL A 53 6.017 -0.983 8.017 1.00 0.00 C ATOM 805 C VAL A 53 6.262 0.504 8.184 1.00 0.00 C ATOM 806 O VAL A 53 5.339 1.265 8.477 1.00 0.00 O ATOM 807 CB VAL A 53 5.679 -1.276 6.555 1.00 0.00 C ATOM 808 CG1 VAL A 53 4.406 -0.522 6.164 1.00 0.00 C ATOM 809 CG2 VAL A 53 6.836 -0.814 5.663 1.00 0.00 C ATOM 0 H VAL A 53 4.211 -0.692 9.035 1.00 0.00 H new ATOM 0 HA VAL A 53 6.914 -1.534 8.300 1.00 0.00 H new ATOM 0 HB VAL A 53 5.522 -2.347 6.426 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.165 -0.731 5.122 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.582 -0.846 6.799 1.00 0.00 H new ATOM 0 HG13 VAL A 53 4.563 0.549 6.292 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.597 -1.022 4.620 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.990 0.257 5.793 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.745 -1.348 5.940 1.00 0.00 H new ATOM 819 N THR A 54 7.504 0.913 7.981 1.00 0.00 N ATOM 820 CA THR A 54 7.859 2.316 8.095 1.00 0.00 C ATOM 821 C THR A 54 8.183 2.870 6.722 1.00 0.00 C ATOM 822 O THR A 54 8.992 2.303 5.991 1.00 0.00 O ATOM 823 CB THR A 54 9.070 2.489 9.009 1.00 0.00 C ATOM 824 OG1 THR A 54 8.774 1.966 10.295 1.00 0.00 O ATOM 825 CG2 THR A 54 9.425 3.971 9.124 1.00 0.00 C ATOM 0 H THR A 54 8.279 0.296 7.738 1.00 0.00 H new ATOM 0 HA THR A 54 7.014 2.856 8.523 1.00 0.00 H new ATOM 0 HB THR A 54 9.919 1.951 8.587 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.552 2.076 10.880 1.00 0.00 H new ATOM 0 HG21 THR A 54 10.290 4.088 9.777 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.660 4.366 8.136 1.00 0.00 H new ATOM 0 HG23 THR A 54 8.579 4.517 9.541 1.00 0.00 H new ATOM 833 N MET A 55 7.536 3.971 6.380 1.00 0.00 N ATOM 834 CA MET A 55 7.756 4.592 5.085 1.00 0.00 C ATOM 835 C MET A 55 8.408 5.947 5.268 1.00 0.00 C ATOM 836 O MET A 55 8.201 6.615 6.279 1.00 0.00 O ATOM 837 CB MET A 55 6.435 4.745 4.309 1.00 0.00 C ATOM 838 CG MET A 55 5.250 4.209 5.127 1.00 0.00 C ATOM 839 SD MET A 55 3.833 3.913 4.038 1.00 0.00 S ATOM 840 CE MET A 55 3.827 5.516 3.207 1.00 0.00 C ATOM 0 H MET A 55 6.860 4.450 6.975 1.00 0.00 H new ATOM 0 HA MET A 55 8.416 3.946 4.506 1.00 0.00 H new ATOM 0 HB2 MET A 55 6.270 5.795 4.069 1.00 0.00 H new ATOM 0 HB3 MET A 55 6.501 4.208 3.363 1.00 0.00 H new ATOM 0 HG2 MET A 55 5.533 3.284 5.630 1.00 0.00 H new ATOM 0 HG3 MET A 55 4.980 4.924 5.904 1.00 0.00 H new ATOM 0 HE1 MET A 55 2.860 5.675 2.730 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.006 6.305 3.937 1.00 0.00 H new ATOM 0 HE3 MET A 55 4.612 5.537 2.451 1.00 0.00 H new ATOM 850 N LEU A 56 9.164 6.355 4.264 1.00 0.00 N ATOM 851 CA LEU A 56 9.812 7.661 4.301 1.00 0.00 C ATOM 852 C LEU A 56 9.066 8.602 3.370 1.00 0.00 C ATOM 853 O LEU A 56 9.415 8.752 2.200 1.00 0.00 O ATOM 854 CB LEU A 56 11.287 7.562 3.886 1.00 0.00 C ATOM 855 CG LEU A 56 11.942 8.955 3.938 1.00 0.00 C ATOM 856 CD1 LEU A 56 11.875 9.509 5.363 1.00 0.00 C ATOM 857 CD2 LEU A 56 13.410 8.848 3.514 1.00 0.00 C ATOM 0 H LEU A 56 9.345 5.811 3.421 1.00 0.00 H new ATOM 0 HA LEU A 56 9.784 8.044 5.321 1.00 0.00 H new ATOM 0 HB2 LEU A 56 11.815 6.877 4.550 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.364 7.152 2.879 1.00 0.00 H new ATOM 0 HG LEU A 56 11.408 9.623 3.261 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.340 10.494 5.393 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.833 9.590 5.673 1.00 0.00 H new ATOM 0 HD13 LEU A 56 12.404 8.838 6.040 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.872 9.834 3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.936 8.175 4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.468 8.458 2.498 1.00 0.00 H new ATOM 869 N ILE A 57 8.019 9.210 3.903 1.00 0.00 N ATOM 870 CA ILE A 57 7.194 10.115 3.128 1.00 0.00 C ATOM 871 C ILE A 57 7.797 11.513 3.112 1.00 0.00 C ATOM 872 O ILE A 57 7.914 12.169 4.143 1.00 0.00 O ATOM 873 CB ILE A 57 5.785 10.147 3.719 1.00 0.00 C ATOM 874 CG1 ILE A 57 5.114 8.780 3.507 1.00 0.00 C ATOM 875 CG2 ILE A 57 4.968 11.241 3.036 1.00 0.00 C ATOM 876 CD1 ILE A 57 4.375 8.753 2.163 1.00 0.00 C ATOM 0 H ILE A 57 7.722 9.091 4.871 1.00 0.00 H new ATOM 0 HA ILE A 57 7.145 9.760 2.099 1.00 0.00 H new ATOM 0 HB ILE A 57 5.839 10.360 4.787 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.865 7.991 3.533 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.414 8.581 4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.963 11.262 3.459 1.00 0.00 H new ATOM 0 HG22 ILE A 57 5.449 12.206 3.194 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.908 11.036 1.967 1.00 0.00 H new ATOM 0 HD11 ILE A 57 3.905 7.779 2.026 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.611 9.530 2.152 1.00 0.00 H new ATOM 0 HD13 ILE A 57 5.084 8.930 1.354 1.00 0.00 H new ATOM 888 N SER A 58 8.151 11.959 1.920 1.00 0.00 N ATOM 889 CA SER A 58 8.727 13.287 1.733 1.00 0.00 C ATOM 890 C SER A 58 9.658 13.657 2.888 1.00 0.00 C ATOM 891 O SER A 58 9.563 14.751 3.443 1.00 0.00 O ATOM 892 CB SER A 58 7.609 14.325 1.630 1.00 0.00 C ATOM 893 OG SER A 58 6.656 13.893 0.668 1.00 0.00 O ATOM 0 H SER A 58 8.051 11.420 1.060 1.00 0.00 H new ATOM 0 HA SER A 58 9.310 13.275 0.812 1.00 0.00 H new ATOM 0 HB2 SER A 58 7.130 14.458 2.600 1.00 0.00 H new ATOM 0 HB3 SER A 58 8.020 15.293 1.343 1.00 0.00 H new ATOM 0 HG SER A 58 7.004 14.057 -0.233 1.00 0.00 H new ATOM 899 N GLY A 59 10.570 12.750 3.233 1.00 0.00 N ATOM 900 CA GLY A 59 11.523 13.013 4.311 1.00 0.00 C ATOM 901 C GLY A 59 10.888 12.826 5.686 1.00 0.00 C ATOM 902 O GLY A 59 11.438 13.268 6.693 1.00 0.00 O ATOM 0 H GLY A 59 10.670 11.837 2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.378 12.344 4.211 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.902 14.031 4.221 1.00 0.00 H new ATOM 906 N ARG A 60 9.736 12.166 5.718 1.00 0.00 N ATOM 907 CA ARG A 60 9.035 11.919 6.974 1.00 0.00 C ATOM 908 C ARG A 60 8.875 10.420 7.197 1.00 0.00 C ATOM 909 O ARG A 60 8.344 9.710 6.343 1.00 0.00 O ATOM 910 CB ARG A 60 7.654 12.582 6.956 1.00 0.00 C ATOM 911 CG ARG A 60 7.778 14.029 6.471 1.00 0.00 C ATOM 912 CD ARG A 60 6.383 14.634 6.322 1.00 0.00 C ATOM 913 NE ARG A 60 5.629 14.474 7.560 1.00 0.00 N ATOM 914 CZ ARG A 60 5.762 15.336 8.562 1.00 0.00 C ATOM 915 NH1 ARG A 60 5.079 15.170 9.662 1.00 0.00 N ATOM 916 NH2 ARG A 60 6.577 16.350 8.447 1.00 0.00 N ATOM 0 H ARG A 60 9.268 11.793 4.892 1.00 0.00 H new ATOM 0 HA ARG A 60 9.623 12.346 7.786 1.00 0.00 H new ATOM 0 HB2 ARG A 60 6.982 12.026 6.302 1.00 0.00 H new ATOM 0 HB3 ARG A 60 7.217 12.560 7.954 1.00 0.00 H new ATOM 0 HG2 ARG A 60 8.366 14.613 7.179 1.00 0.00 H new ATOM 0 HG3 ARG A 60 8.304 14.061 5.517 1.00 0.00 H new ATOM 0 HD2 ARG A 60 6.462 15.692 6.070 1.00 0.00 H new ATOM 0 HD3 ARG A 60 5.855 14.150 5.501 1.00 0.00 H new ATOM 0 HE ARG A 60 4.988 13.686 7.658 1.00 0.00 H new ATOM 0 HH11 ARG A 60 4.443 14.378 9.753 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.182 15.832 10.431 1.00 0.00 H new ATOM 0 HH21 ARG A 60 7.111 16.480 7.588 1.00 0.00 H new ATOM 0 HH22 ARG A 60 6.679 17.012 9.216 1.00 0.00 H new ATOM 930 N CYS A 61 9.334 9.945 8.348 1.00 0.00 N ATOM 931 CA CYS A 61 9.233 8.528 8.666 1.00 0.00 C ATOM 932 C CYS A 61 7.832 8.197 9.166 1.00 0.00 C ATOM 933 O CYS A 61 7.500 8.442 10.327 1.00 0.00 O ATOM 934 CB CYS A 61 10.266 8.158 9.731 1.00 0.00 C ATOM 935 SG CYS A 61 11.124 6.650 9.228 1.00 0.00 S ATOM 0 H CYS A 61 9.776 10.514 9.070 1.00 0.00 H new ATOM 0 HA CYS A 61 9.429 7.951 7.762 1.00 0.00 H new ATOM 0 HB2 CYS A 61 10.980 8.971 9.860 1.00 0.00 H new ATOM 0 HB3 CYS A 61 9.776 8.008 10.693 1.00 0.00 H new ATOM 940 N GLN A 62 7.005 7.658 8.279 1.00 0.00 N ATOM 941 CA GLN A 62 5.640 7.315 8.640 1.00 0.00 C ATOM 942 C GLN A 62 5.538 5.859 9.072 1.00 0.00 C ATOM 943 O GLN A 62 5.542 4.951 8.240 1.00 0.00 O ATOM 944 CB GLN A 62 4.709 7.560 7.451 1.00 0.00 C ATOM 945 CG GLN A 62 4.038 8.928 7.600 1.00 0.00 C ATOM 946 CD GLN A 62 2.947 8.861 8.664 1.00 0.00 C ATOM 947 OE1 GLN A 62 2.278 7.836 8.805 1.00 0.00 O ATOM 948 NE2 GLN A 62 2.727 9.896 9.426 1.00 0.00 N ATOM 0 H GLN A 62 7.255 7.451 7.312 1.00 0.00 H new ATOM 0 HA GLN A 62 5.342 7.947 9.477 1.00 0.00 H new ATOM 0 HB2 GLN A 62 5.273 7.520 6.519 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.953 6.776 7.400 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.780 9.678 7.875 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.609 9.238 6.647 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.282 10.744 9.308 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.000 9.858 10.140 1.00 0.00 H new ATOM 957 N GLU A 63 5.415 5.644 10.376 1.00 0.00 N ATOM 958 CA GLU A 63 5.275 4.297 10.905 1.00 0.00 C ATOM 959 C GLU A 63 3.847 3.837 10.690 1.00 0.00 C ATOM 960 O GLU A 63 2.916 4.413 11.254 1.00 0.00 O ATOM 961 CB GLU A 63 5.606 4.276 12.398 1.00 0.00 C ATOM 962 CG GLU A 63 7.024 4.810 12.616 1.00 0.00 C ATOM 963 CD GLU A 63 6.977 6.095 13.436 1.00 0.00 C ATOM 964 OE1 GLU A 63 6.537 6.033 14.572 1.00 0.00 O ATOM 965 OE2 GLU A 63 7.384 7.121 12.918 1.00 0.00 O ATOM 0 H GLU A 63 5.410 6.381 11.081 1.00 0.00 H new ATOM 0 HA GLU A 63 5.965 3.629 10.389 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.889 4.884 12.949 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.525 3.260 12.785 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.628 4.062 13.130 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.502 4.999 11.655 1.00 0.00 H new ATOM 972 N VAL A 64 3.669 2.805 9.876 1.00 0.00 N ATOM 973 CA VAL A 64 2.331 2.292 9.604 1.00 0.00 C ATOM 974 C VAL A 64 2.094 0.981 10.345 1.00 0.00 C ATOM 975 O VAL A 64 2.997 0.156 10.455 1.00 0.00 O ATOM 976 CB VAL A 64 2.173 2.061 8.102 1.00 0.00 C ATOM 977 CG1 VAL A 64 0.698 2.166 7.721 1.00 0.00 C ATOM 978 CG2 VAL A 64 2.976 3.117 7.340 1.00 0.00 C ATOM 0 H VAL A 64 4.423 2.311 9.398 1.00 0.00 H new ATOM 0 HA VAL A 64 1.600 3.024 9.949 1.00 0.00 H new ATOM 0 HB VAL A 64 2.541 1.068 7.845 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.586 2.001 6.649 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.127 1.414 8.265 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.326 3.158 7.976 1.00 0.00 H new ATOM 0 HG21 VAL A 64 2.865 2.955 6.268 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.607 4.110 7.597 1.00 0.00 H new ATOM 0 HG23 VAL A 64 4.029 3.040 7.612 1.00 0.00 H new ATOM 988 N LYS A 65 0.878 0.800 10.858 1.00 0.00 N ATOM 989 CA LYS A 65 0.524 -0.412 11.591 1.00 0.00 C ATOM 990 C LYS A 65 -0.966 -0.694 11.412 1.00 0.00 C ATOM 991 O LYS A 65 -1.802 -0.129 12.116 1.00 0.00 O ATOM 992 CB LYS A 65 0.863 -0.238 13.076 1.00 0.00 C ATOM 993 CG LYS A 65 0.432 -1.485 13.864 1.00 0.00 C ATOM 994 CD LYS A 65 -0.712 -1.152 14.832 1.00 0.00 C ATOM 995 CE LYS A 65 -1.474 -2.435 15.155 1.00 0.00 C ATOM 996 NZ LYS A 65 -2.438 -2.181 16.264 1.00 0.00 N ATOM 0 H LYS A 65 0.121 1.479 10.779 1.00 0.00 H new ATOM 0 HA LYS A 65 1.094 -1.256 11.202 1.00 0.00 H new ATOM 0 HB2 LYS A 65 1.934 -0.074 13.196 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.359 0.644 13.471 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.113 -2.265 13.173 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.282 -1.880 14.421 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.316 -0.708 15.746 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.382 -0.417 14.385 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.006 -2.786 14.271 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.776 -3.222 15.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.955 -3.057 16.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.920 -1.866 17.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -3.112 -1.443 15.976 1.00 0.00 H new ATOM 1010 N ALA A 66 -1.290 -1.541 10.434 1.00 0.00 N ATOM 1011 CA ALA A 66 -2.674 -1.855 10.141 1.00 0.00 C ATOM 1012 C ALA A 66 -2.992 -3.295 10.487 1.00 0.00 C ATOM 1013 O ALA A 66 -2.111 -4.154 10.516 1.00 0.00 O ATOM 1014 CB ALA A 66 -2.955 -1.618 8.657 1.00 0.00 C ATOM 0 H ALA A 66 -0.611 -2.016 9.839 1.00 0.00 H new ATOM 0 HA ALA A 66 -3.304 -1.205 10.748 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -3.997 -1.855 8.442 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -2.763 -0.573 8.413 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -2.306 -2.256 8.057 1.00 0.00 H new ATOM 1020 N VAL A 67 -4.267 -3.538 10.731 1.00 0.00 N ATOM 1021 CA VAL A 67 -4.740 -4.867 11.057 1.00 0.00 C ATOM 1022 C VAL A 67 -5.789 -5.292 10.047 1.00 0.00 C ATOM 1023 O VAL A 67 -6.829 -4.648 9.912 1.00 0.00 O ATOM 1024 CB VAL A 67 -5.333 -4.900 12.465 1.00 0.00 C ATOM 1025 CG1 VAL A 67 -5.327 -6.340 12.980 1.00 0.00 C ATOM 1026 CG2 VAL A 67 -4.487 -4.028 13.391 1.00 0.00 C ATOM 0 H VAL A 67 -4.996 -2.825 10.709 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.897 -5.557 11.023 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.355 -4.523 12.442 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -5.749 -6.369 13.984 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.924 -6.966 12.317 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -4.303 -6.713 13.006 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.908 -4.050 14.396 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.466 -4.409 13.417 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -4.483 -3.003 13.022 1.00 0.00 H new ATOM 1036 N LEU A 68 -5.505 -6.364 9.325 1.00 0.00 N ATOM 1037 CA LEU A 68 -6.424 -6.848 8.316 1.00 0.00 C ATOM 1038 C LEU A 68 -7.474 -7.744 8.936 1.00 0.00 C ATOM 1039 O LEU A 68 -7.347 -8.966 8.907 1.00 0.00 O ATOM 1040 CB LEU A 68 -5.638 -7.628 7.266 1.00 0.00 C ATOM 1041 CG LEU A 68 -4.394 -6.833 6.877 1.00 0.00 C ATOM 1042 CD1 LEU A 68 -3.662 -7.575 5.764 1.00 0.00 C ATOM 1043 CD2 LEU A 68 -4.816 -5.455 6.375 1.00 0.00 C ATOM 0 H LEU A 68 -4.649 -6.911 9.420 1.00 0.00 H new ATOM 0 HA LEU A 68 -6.927 -5.999 7.854 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.352 -8.604 7.659 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.259 -7.807 6.388 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.738 -6.721 7.740 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.771 -7.015 5.478 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.371 -8.565 6.116 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.319 -7.676 4.900 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -3.931 -4.883 6.096 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.465 -5.567 5.506 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.354 -4.929 7.164 1.00 0.00 H new ATOM 1055 N GLU A 69 -8.520 -7.141 9.493 1.00 0.00 N ATOM 1056 CA GLU A 69 -9.577 -7.918 10.111 1.00 0.00 C ATOM 1057 C GLU A 69 -10.310 -8.734 9.062 1.00 0.00 C ATOM 1058 O GLU A 69 -10.772 -8.194 8.058 1.00 0.00 O ATOM 1059 CB GLU A 69 -10.558 -6.986 10.822 1.00 0.00 C ATOM 1060 CG GLU A 69 -9.824 -6.231 11.931 1.00 0.00 C ATOM 1061 CD GLU A 69 -9.943 -6.991 13.247 1.00 0.00 C ATOM 1062 OE1 GLU A 69 -9.084 -7.813 13.513 1.00 0.00 O ATOM 1063 OE2 GLU A 69 -10.894 -6.738 13.970 1.00 0.00 O ATOM 0 H GLU A 69 -8.654 -6.130 9.527 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.135 -8.597 10.840 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -10.989 -6.282 10.111 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.384 -7.560 11.242 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.774 -6.109 11.666 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.243 -5.231 12.040 1.00 0.00 H new ATOM 1070 N LYS A 70 -10.418 -10.035 9.305 1.00 0.00 N ATOM 1071 CA LYS A 70 -11.103 -10.919 8.374 1.00 0.00 C ATOM 1072 C LYS A 70 -12.596 -10.611 8.346 1.00 0.00 C ATOM 1073 O LYS A 70 -13.211 -10.390 9.390 1.00 0.00 O ATOM 1074 CB LYS A 70 -10.883 -12.378 8.786 1.00 0.00 C ATOM 1075 CG LYS A 70 -11.638 -13.301 7.828 1.00 0.00 C ATOM 1076 CD LYS A 70 -12.860 -13.887 8.540 1.00 0.00 C ATOM 1077 CE LYS A 70 -13.610 -14.819 7.586 1.00 0.00 C ATOM 1078 NZ LYS A 70 -13.207 -16.229 7.850 1.00 0.00 N ATOM 0 H LYS A 70 -10.042 -10.497 10.133 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.694 -10.759 7.376 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.819 -12.614 8.772 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.230 -12.534 9.807 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.951 -12.747 6.943 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -10.983 -14.103 7.487 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.548 -14.435 9.429 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.518 -13.085 8.874 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.686 -14.706 7.721 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.388 -14.554 6.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -13.717 -16.863 7.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.183 -16.331 7.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -13.440 -16.478 8.832 1.00 0.00 H new ATOM 1092 N THR A 71 -13.170 -10.600 7.147 1.00 0.00 N ATOM 1093 CA THR A 71 -14.593 -10.322 6.990 1.00 0.00 C ATOM 1094 C THR A 71 -15.330 -11.571 6.532 1.00 0.00 C ATOM 1095 O THR A 71 -14.747 -12.651 6.439 1.00 0.00 O ATOM 1096 CB THR A 71 -14.804 -9.213 5.957 1.00 0.00 C ATOM 1097 OG1 THR A 71 -14.259 -9.620 4.710 1.00 0.00 O ATOM 1098 CG2 THR A 71 -14.116 -7.933 6.426 1.00 0.00 C ATOM 0 H THR A 71 -12.674 -10.779 6.274 1.00 0.00 H new ATOM 0 HA THR A 71 -14.986 -10.003 7.955 1.00 0.00 H new ATOM 0 HB THR A 71 -15.871 -9.023 5.842 1.00 0.00 H new ATOM 0 HG1 THR A 71 -13.286 -9.505 4.725 1.00 0.00 H new ATOM 0 HG21 THR A 71 -14.269 -7.146 5.687 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.539 -7.621 7.381 1.00 0.00 H new ATOM 0 HG23 THR A 71 -13.048 -8.116 6.545 1.00 0.00 H new ATOM 1106 N ASP A 72 -16.614 -11.413 6.239 1.00 0.00 N ATOM 1107 CA ASP A 72 -17.421 -12.534 5.783 1.00 0.00 C ATOM 1108 C ASP A 72 -17.141 -12.821 4.312 1.00 0.00 C ATOM 1109 O ASP A 72 -17.791 -13.673 3.706 1.00 0.00 O ATOM 1110 CB ASP A 72 -18.906 -12.223 5.975 1.00 0.00 C ATOM 1111 CG ASP A 72 -19.115 -11.458 7.278 1.00 0.00 C ATOM 1112 OD1 ASP A 72 -18.321 -11.645 8.185 1.00 0.00 O ATOM 1113 OD2 ASP A 72 -20.065 -10.698 7.349 1.00 0.00 O ATOM 0 H ASP A 72 -17.115 -10.527 6.308 1.00 0.00 H new ATOM 0 HA ASP A 72 -17.161 -13.414 6.372 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -19.274 -11.634 5.135 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -19.481 -13.149 5.991 1.00 0.00 H new ATOM 1118 N GLU A 73 -16.166 -12.107 3.747 1.00 0.00 N ATOM 1119 CA GLU A 73 -15.802 -12.293 2.345 1.00 0.00 C ATOM 1120 C GLU A 73 -14.309 -12.638 2.233 1.00 0.00 C ATOM 1121 O GLU A 73 -13.491 -12.045 2.937 1.00 0.00 O ATOM 1122 CB GLU A 73 -16.085 -11.003 1.571 1.00 0.00 C ATOM 1123 CG GLU A 73 -17.193 -11.242 0.542 1.00 0.00 C ATOM 1124 CD GLU A 73 -17.638 -9.913 -0.060 1.00 0.00 C ATOM 1125 OE1 GLU A 73 -16.977 -8.918 0.194 1.00 0.00 O ATOM 1126 OE2 GLU A 73 -18.634 -9.907 -0.764 1.00 0.00 O ATOM 0 H GLU A 73 -15.618 -11.399 4.237 1.00 0.00 H new ATOM 0 HA GLU A 73 -16.391 -13.110 1.927 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -16.382 -10.213 2.261 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -15.179 -10.664 1.069 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -16.834 -11.905 -0.245 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -18.040 -11.739 1.015 1.00 0.00 H new ATOM 1133 N PRO A 74 -13.925 -13.570 1.383 1.00 0.00 N ATOM 1134 CA PRO A 74 -12.491 -13.952 1.225 1.00 0.00 C ATOM 1135 C PRO A 74 -11.688 -12.900 0.461 1.00 0.00 C ATOM 1136 O PRO A 74 -12.137 -12.390 -0.566 1.00 0.00 O ATOM 1137 CB PRO A 74 -12.550 -15.262 0.440 1.00 0.00 C ATOM 1138 CG PRO A 74 -13.814 -15.184 -0.348 1.00 0.00 C ATOM 1139 CD PRO A 74 -14.792 -14.358 0.485 1.00 0.00 C ATOM 0 HA PRO A 74 -11.988 -14.045 2.188 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -11.684 -15.370 -0.213 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -12.554 -16.123 1.109 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.639 -14.717 -1.317 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.213 -16.180 -0.541 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.405 -13.713 -0.144 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.474 -14.996 1.048 1.00 0.00 H new ATOM 1147 N GLY A 75 -10.500 -12.586 0.966 1.00 0.00 N ATOM 1148 CA GLY A 75 -9.639 -11.602 0.321 1.00 0.00 C ATOM 1149 C GLY A 75 -10.087 -10.182 0.632 1.00 0.00 C ATOM 1150 O GLY A 75 -9.580 -9.228 0.054 1.00 0.00 O ATOM 0 H GLY A 75 -10.113 -12.996 1.816 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -8.611 -11.742 0.655 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.648 -11.760 -0.757 1.00 0.00 H new ATOM 1154 N LYS A 76 -11.040 -10.052 1.544 1.00 0.00 N ATOM 1155 CA LYS A 76 -11.551 -8.742 1.925 1.00 0.00 C ATOM 1156 C LYS A 76 -11.334 -8.501 3.412 1.00 0.00 C ATOM 1157 O LYS A 76 -11.997 -9.117 4.246 1.00 0.00 O ATOM 1158 CB LYS A 76 -13.048 -8.659 1.614 1.00 0.00 C ATOM 1159 CG LYS A 76 -13.544 -7.229 1.852 1.00 0.00 C ATOM 1160 CD LYS A 76 -15.060 -7.160 1.644 1.00 0.00 C ATOM 1161 CE LYS A 76 -15.648 -6.078 2.552 1.00 0.00 C ATOM 1162 NZ LYS A 76 -16.906 -5.555 1.949 1.00 0.00 N ATOM 0 H LYS A 76 -11.474 -10.835 2.033 1.00 0.00 H new ATOM 0 HA LYS A 76 -11.015 -7.982 1.358 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -13.232 -8.951 0.580 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -13.600 -9.356 2.245 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.292 -6.912 2.864 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.043 -6.543 1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -15.285 -6.937 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -15.514 -8.125 1.869 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -15.849 -6.488 3.542 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -14.930 -5.268 2.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -17.307 -4.819 2.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.700 -5.149 1.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -17.591 -6.331 1.846 1.00 0.00 H new ATOM 1176 N TYR A 77 -10.412 -7.596 3.739 1.00 0.00 N ATOM 1177 CA TYR A 77 -10.136 -7.280 5.138 1.00 0.00 C ATOM 1178 C TYR A 77 -10.429 -5.821 5.422 1.00 0.00 C ATOM 1179 O TYR A 77 -10.485 -5.006 4.507 1.00 0.00 O ATOM 1180 CB TYR A 77 -8.674 -7.561 5.480 1.00 0.00 C ATOM 1181 CG TYR A 77 -8.294 -8.957 5.053 1.00 0.00 C ATOM 1182 CD1 TYR A 77 -7.941 -9.210 3.724 1.00 0.00 C ATOM 1183 CD2 TYR A 77 -8.284 -9.997 5.990 1.00 0.00 C ATOM 1184 CE1 TYR A 77 -7.579 -10.504 3.330 1.00 0.00 C ATOM 1185 CE2 TYR A 77 -7.921 -11.290 5.597 1.00 0.00 C ATOM 1186 CZ TYR A 77 -7.568 -11.543 4.267 1.00 0.00 C ATOM 1187 OH TYR A 77 -7.211 -12.819 3.879 1.00 0.00 O ATOM 0 H TYR A 77 -9.851 -7.076 3.064 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.780 -7.911 5.751 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -8.031 -6.834 4.983 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.516 -7.446 6.552 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -7.948 -8.407 3.001 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.557 -9.801 7.017 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.308 -10.700 2.303 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.913 -12.092 6.320 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.255 -13.420 4.652 1.00 0.00 H new ATOM 1197 N THR A 78 -10.598 -5.501 6.701 1.00 0.00 N ATOM 1198 CA THR A 78 -10.869 -4.125 7.107 1.00 0.00 C ATOM 1199 C THR A 78 -9.873 -3.680 8.161 1.00 0.00 C ATOM 1200 O THR A 78 -9.349 -4.499 8.915 1.00 0.00 O ATOM 1201 CB THR A 78 -12.280 -3.994 7.675 1.00 0.00 C ATOM 1202 OG1 THR A 78 -12.706 -5.246 8.192 1.00 0.00 O ATOM 1203 CG2 THR A 78 -13.227 -3.542 6.568 1.00 0.00 C ATOM 0 H THR A 78 -10.553 -6.170 7.470 1.00 0.00 H new ATOM 0 HA THR A 78 -10.777 -3.494 6.223 1.00 0.00 H new ATOM 0 HB THR A 78 -12.284 -3.258 8.479 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.611 -5.158 8.557 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.236 -3.447 6.969 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.899 -2.578 6.179 1.00 0.00 H new ATOM 0 HG23 THR A 78 -13.224 -4.278 5.764 1.00 0.00 H new ATOM 1211 N ALA A 79 -9.607 -2.382 8.209 1.00 0.00 N ATOM 1212 CA ALA A 79 -8.658 -1.866 9.188 1.00 0.00 C ATOM 1213 C ALA A 79 -9.352 -1.518 10.509 1.00 0.00 C ATOM 1214 O ALA A 79 -9.367 -0.359 10.924 1.00 0.00 O ATOM 1215 CB ALA A 79 -7.964 -0.625 8.628 1.00 0.00 C ATOM 0 H ALA A 79 -10.023 -1.680 7.597 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.921 -2.644 9.388 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -7.255 -0.242 9.362 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.433 -0.887 7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.708 0.140 8.409 1.00 0.00 H new ATOM 1221 N ASP A 80 -9.910 -2.532 11.173 1.00 0.00 N ATOM 1222 CA ASP A 80 -10.585 -2.332 12.456 1.00 0.00 C ATOM 1223 C ASP A 80 -11.511 -1.119 12.432 1.00 0.00 C ATOM 1224 O ASP A 80 -11.497 -0.307 13.356 1.00 0.00 O ATOM 1225 CB ASP A 80 -9.544 -2.151 13.564 1.00 0.00 C ATOM 1226 CG ASP A 80 -10.207 -2.268 14.931 1.00 0.00 C ATOM 1227 OD1 ASP A 80 -11.228 -2.931 15.018 1.00 0.00 O ATOM 1228 OD2 ASP A 80 -9.686 -1.694 15.873 1.00 0.00 O ATOM 0 H ASP A 80 -9.908 -3.498 10.844 1.00 0.00 H new ATOM 0 HA ASP A 80 -11.193 -3.216 12.648 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -8.762 -2.904 13.465 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.064 -1.177 13.467 1.00 0.00 H new ATOM 1233 N GLY A 81 -12.303 -0.990 11.375 1.00 0.00 N ATOM 1234 CA GLY A 81 -13.206 0.144 11.263 1.00 0.00 C ATOM 1235 C GLY A 81 -12.424 1.342 10.773 1.00 0.00 C ATOM 1236 O GLY A 81 -12.742 2.489 11.088 1.00 0.00 O ATOM 0 H GLY A 81 -12.338 -1.646 10.595 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -14.017 -0.086 10.572 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.662 0.360 12.229 1.00 0.00 H new ATOM 1240 N GLY A 82 -11.398 1.051 9.987 1.00 0.00 N ATOM 1241 CA GLY A 82 -10.556 2.095 9.432 1.00 0.00 C ATOM 1242 C GLY A 82 -11.098 2.501 8.080 1.00 0.00 C ATOM 1243 O GLY A 82 -10.346 2.873 7.183 1.00 0.00 O ATOM 0 H GLY A 82 -11.131 0.103 9.721 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.533 2.955 10.101 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.530 1.739 9.335 1.00 0.00 H new ATOM 1247 N LYS A 83 -12.421 2.458 7.969 1.00 0.00 N ATOM 1248 CA LYS A 83 -13.099 2.843 6.737 1.00 0.00 C ATOM 1249 C LYS A 83 -12.265 2.464 5.521 1.00 0.00 C ATOM 1250 O LYS A 83 -12.331 3.127 4.485 1.00 0.00 O ATOM 1251 CB LYS A 83 -13.353 4.353 6.734 1.00 0.00 C ATOM 1252 CG LYS A 83 -13.981 4.776 8.067 1.00 0.00 C ATOM 1253 CD LYS A 83 -15.373 4.150 8.220 1.00 0.00 C ATOM 1254 CE LYS A 83 -16.335 5.184 8.804 1.00 0.00 C ATOM 1255 NZ LYS A 83 -17.652 4.543 9.074 1.00 0.00 N ATOM 0 H LYS A 83 -13.046 2.160 8.718 1.00 0.00 H new ATOM 0 HA LYS A 83 -14.050 2.312 6.687 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -12.417 4.888 6.576 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -14.015 4.618 5.909 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.342 4.465 8.893 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -14.056 5.862 8.113 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -15.737 3.805 7.252 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -15.321 3.277 8.871 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -15.925 5.598 9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -16.459 6.014 8.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -18.306 5.247 9.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -18.044 4.168 8.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -17.527 3.765 9.753 1.00 0.00 H new ATOM 1269 N HIS A 84 -11.484 1.394 5.653 1.00 0.00 N ATOM 1270 CA HIS A 84 -10.650 0.938 4.561 1.00 0.00 C ATOM 1271 C HIS A 84 -10.804 -0.554 4.373 1.00 0.00 C ATOM 1272 O HIS A 84 -10.911 -1.309 5.340 1.00 0.00 O ATOM 1273 CB HIS A 84 -9.178 1.275 4.807 1.00 0.00 C ATOM 1274 CG HIS A 84 -8.781 2.411 3.904 1.00 0.00 C ATOM 1275 ND1 HIS A 84 -8.381 2.435 2.593 1.00 0.00 N flip ATOM 1276 CD2 HIS A 84 -8.785 3.730 4.325 1.00 0.00 C flip ATOM 1277 CE1 HIS A 84 -8.139 3.748 2.202 1.00 0.00 C flip ATOM 1278 NE2 HIS A 84 -8.399 4.488 3.283 1.00 0.00 N flip ATOM 0 H HIS A 84 -11.416 0.834 6.503 1.00 0.00 H new ATOM 0 HA HIS A 84 -10.975 1.454 3.658 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -9.024 1.551 5.850 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -8.554 0.403 4.612 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -9.050 4.085 5.310 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.811 4.094 1.233 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -8.315 5.504 3.315 1.00 0.00 H new ATOM 1286 N VAL A 85 -10.804 -0.962 3.118 1.00 0.00 N ATOM 1287 CA VAL A 85 -10.939 -2.371 2.783 1.00 0.00 C ATOM 1288 C VAL A 85 -9.699 -2.863 2.046 1.00 0.00 C ATOM 1289 O VAL A 85 -9.462 -2.500 0.896 1.00 0.00 O ATOM 1290 CB VAL A 85 -12.161 -2.591 1.901 1.00 0.00 C ATOM 1291 CG1 VAL A 85 -12.533 -4.072 1.920 1.00 0.00 C ATOM 1292 CG2 VAL A 85 -13.332 -1.760 2.430 1.00 0.00 C ATOM 0 H VAL A 85 -10.712 -0.341 2.314 1.00 0.00 H new ATOM 0 HA VAL A 85 -11.055 -2.930 3.711 1.00 0.00 H new ATOM 0 HB VAL A 85 -11.936 -2.283 0.880 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -13.407 -4.236 1.290 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -11.698 -4.662 1.542 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -12.760 -4.377 2.942 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -14.206 -1.919 1.798 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.563 -2.065 3.451 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -13.063 -0.704 2.419 1.00 0.00 H new ATOM 1302 N ALA A 86 -8.900 -3.671 2.728 1.00 0.00 N ATOM 1303 CA ALA A 86 -7.674 -4.182 2.145 1.00 0.00 C ATOM 1304 C ALA A 86 -7.883 -5.539 1.508 1.00 0.00 C ATOM 1305 O ALA A 86 -8.624 -6.377 2.025 1.00 0.00 O ATOM 1306 CB ALA A 86 -6.589 -4.292 3.209 1.00 0.00 C ATOM 0 H ALA A 86 -9.080 -3.984 3.682 1.00 0.00 H new ATOM 0 HA ALA A 86 -7.365 -3.480 1.371 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.674 -4.677 2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.397 -3.308 3.636 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.919 -4.970 3.996 1.00 0.00 H new ATOM 1312 N TYR A 87 -7.202 -5.751 0.391 1.00 0.00 N ATOM 1313 CA TYR A 87 -7.282 -7.013 -0.319 1.00 0.00 C ATOM 1314 C TYR A 87 -5.880 -7.591 -0.499 1.00 0.00 C ATOM 1315 O TYR A 87 -4.975 -6.903 -0.970 1.00 0.00 O ATOM 1316 CB TYR A 87 -7.933 -6.815 -1.691 1.00 0.00 C ATOM 1317 CG TYR A 87 -9.404 -6.524 -1.525 1.00 0.00 C ATOM 1318 CD1 TYR A 87 -9.822 -5.255 -1.113 1.00 0.00 C ATOM 1319 CD2 TYR A 87 -10.346 -7.522 -1.793 1.00 0.00 C ATOM 1320 CE1 TYR A 87 -11.187 -4.983 -0.966 1.00 0.00 C ATOM 1321 CE2 TYR A 87 -11.713 -7.251 -1.645 1.00 0.00 C ATOM 1322 CZ TYR A 87 -12.132 -5.981 -1.232 1.00 0.00 C ATOM 1323 OH TYR A 87 -13.479 -5.712 -1.087 1.00 0.00 O ATOM 0 H TYR A 87 -6.587 -5.062 -0.042 1.00 0.00 H new ATOM 0 HA TYR A 87 -7.892 -7.704 0.264 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -7.448 -5.993 -2.218 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -7.797 -7.709 -2.300 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -9.092 -4.485 -0.908 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -10.020 -8.501 -2.114 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -11.511 -4.003 -0.647 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -12.442 -8.021 -1.849 1.00 0.00 H new ATOM 0 HH TYR A 87 -13.998 -6.512 -1.312 1.00 0.00 H new ATOM 1333 N ILE A 88 -5.709 -8.852 -0.116 1.00 0.00 N ATOM 1334 CA ILE A 88 -4.412 -9.510 -0.234 1.00 0.00 C ATOM 1335 C ILE A 88 -4.456 -10.575 -1.320 1.00 0.00 C ATOM 1336 O ILE A 88 -5.193 -11.555 -1.206 1.00 0.00 O ATOM 1337 CB ILE A 88 -4.024 -10.167 1.092 1.00 0.00 C ATOM 1338 CG1 ILE A 88 -4.464 -9.285 2.260 1.00 0.00 C ATOM 1339 CG2 ILE A 88 -2.504 -10.349 1.151 1.00 0.00 C ATOM 1340 CD1 ILE A 88 -4.029 -9.939 3.571 1.00 0.00 C ATOM 0 H ILE A 88 -6.447 -9.436 0.277 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.672 -8.754 -0.495 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.516 -11.137 1.162 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -4.022 -8.293 2.170 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.546 -9.154 2.246 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.230 -10.817 2.096 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.181 -10.983 0.325 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.018 -9.377 1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.339 -9.315 4.409 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.492 -10.922 3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -2.944 -10.047 3.581 1.00 0.00 H new ATOM 1352 N ILE A 89 -3.667 -10.373 -2.370 1.00 0.00 N ATOM 1353 CA ILE A 89 -3.624 -11.324 -3.476 1.00 0.00 C ATOM 1354 C ILE A 89 -2.234 -11.933 -3.609 1.00 0.00 C ATOM 1355 O ILE A 89 -1.237 -11.338 -3.207 1.00 0.00 O ATOM 1356 CB ILE A 89 -3.980 -10.638 -4.808 1.00 0.00 C ATOM 1357 CG1 ILE A 89 -4.782 -9.357 -4.555 1.00 0.00 C ATOM 1358 CG2 ILE A 89 -4.799 -11.581 -5.702 1.00 0.00 C ATOM 1359 CD1 ILE A 89 -6.099 -9.694 -3.856 1.00 0.00 C ATOM 0 H ILE A 89 -3.053 -9.566 -2.479 1.00 0.00 H new ATOM 0 HA ILE A 89 -4.353 -12.104 -3.259 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.048 -10.386 -5.314 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.200 -8.669 -3.941 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.981 -8.850 -5.499 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -5.040 -11.077 -6.638 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -4.218 -12.479 -5.913 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.721 -11.857 -5.191 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.662 -8.778 -3.680 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.684 -10.364 -4.486 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -5.891 -10.181 -2.903 1.00 0.00 H new ATOM 1371 N ARG A 90 -2.184 -13.105 -4.224 1.00 0.00 N ATOM 1372 CA ARG A 90 -0.922 -13.786 -4.461 1.00 0.00 C ATOM 1373 C ARG A 90 -0.488 -13.561 -5.905 1.00 0.00 C ATOM 1374 O ARG A 90 -1.035 -14.167 -6.824 1.00 0.00 O ATOM 1375 CB ARG A 90 -1.070 -15.286 -4.190 1.00 0.00 C ATOM 1376 CG ARG A 90 0.295 -15.967 -4.325 1.00 0.00 C ATOM 1377 CD ARG A 90 0.154 -17.464 -4.040 1.00 0.00 C ATOM 1378 NE ARG A 90 -0.127 -18.186 -5.275 1.00 0.00 N ATOM 1379 CZ ARG A 90 -0.002 -19.508 -5.342 1.00 0.00 C ATOM 1380 NH1 ARG A 90 -0.260 -20.131 -6.459 1.00 0.00 N ATOM 1381 NH2 ARG A 90 0.379 -20.182 -4.292 1.00 0.00 N ATOM 0 H ARG A 90 -3.004 -13.604 -4.568 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.167 -13.383 -3.787 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.471 -15.448 -3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.778 -15.725 -4.893 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.691 -15.814 -5.329 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.006 -15.520 -3.630 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.070 -17.844 -3.588 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.648 -17.631 -3.322 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.425 -17.668 -6.102 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.557 -19.604 -7.280 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.164 -21.145 -6.511 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.581 -19.695 -3.419 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.475 -21.196 -4.344 1.00 0.00 H new ATOM 1395 N SER A 91 0.482 -12.669 -6.092 1.00 0.00 N ATOM 1396 CA SER A 91 0.973 -12.353 -7.426 1.00 0.00 C ATOM 1397 C SER A 91 1.069 -13.609 -8.277 1.00 0.00 C ATOM 1398 O SER A 91 1.029 -14.728 -7.766 1.00 0.00 O ATOM 1399 CB SER A 91 2.348 -11.694 -7.334 1.00 0.00 C ATOM 1400 OG SER A 91 2.516 -10.804 -8.430 1.00 0.00 O ATOM 0 H SER A 91 0.940 -12.156 -5.339 1.00 0.00 H new ATOM 0 HA SER A 91 0.269 -11.665 -7.894 1.00 0.00 H new ATOM 0 HB2 SER A 91 2.442 -11.152 -6.393 1.00 0.00 H new ATOM 0 HB3 SER A 91 3.130 -12.454 -7.344 1.00 0.00 H new ATOM 0 HG SER A 91 3.397 -10.378 -8.373 1.00 0.00 H new ATOM 1406 N HIS A 92 1.219 -13.415 -9.577 1.00 0.00 N ATOM 1407 CA HIS A 92 1.341 -14.540 -10.491 1.00 0.00 C ATOM 1408 C HIS A 92 2.725 -15.157 -10.358 1.00 0.00 C ATOM 1409 O HIS A 92 3.015 -16.195 -10.952 1.00 0.00 O ATOM 1410 CB HIS A 92 1.117 -14.075 -11.931 1.00 0.00 C ATOM 1411 CG HIS A 92 -0.329 -13.711 -12.122 1.00 0.00 C ATOM 1412 ND1 HIS A 92 -1.062 -13.057 -11.144 1.00 0.00 N ATOM 1413 CD2 HIS A 92 -1.193 -13.905 -13.171 1.00 0.00 C ATOM 1414 CE1 HIS A 92 -2.309 -12.882 -11.621 1.00 0.00 C ATOM 1415 NE2 HIS A 92 -2.442 -13.381 -12.853 1.00 0.00 N ATOM 0 H HIS A 92 1.259 -12.498 -10.021 1.00 0.00 H new ATOM 0 HA HIS A 92 0.587 -15.286 -10.241 1.00 0.00 H new ATOM 0 HB2 HIS A 92 1.751 -13.216 -12.150 1.00 0.00 H new ATOM 0 HB3 HIS A 92 1.399 -14.865 -12.627 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -0.941 -14.391 -14.102 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -3.104 -12.397 -11.074 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -3.279 -13.378 -13.435 1.00 0.00 H new ATOM 1423 N VAL A 93 3.573 -14.500 -9.572 1.00 0.00 N ATOM 1424 CA VAL A 93 4.932 -14.975 -9.356 1.00 0.00 C ATOM 1425 C VAL A 93 5.098 -15.480 -7.926 1.00 0.00 C ATOM 1426 O VAL A 93 4.336 -15.110 -7.034 1.00 0.00 O ATOM 1427 CB VAL A 93 5.921 -13.839 -9.621 1.00 0.00 C ATOM 1428 CG1 VAL A 93 7.353 -14.370 -9.553 1.00 0.00 C ATOM 1429 CG2 VAL A 93 5.661 -13.259 -11.015 1.00 0.00 C ATOM 0 H VAL A 93 3.342 -13.639 -9.076 1.00 0.00 H new ATOM 0 HA VAL A 93 5.131 -15.798 -10.043 1.00 0.00 H new ATOM 0 HB VAL A 93 5.790 -13.063 -8.867 1.00 0.00 H new ATOM 0 HG11 VAL A 93 8.052 -13.556 -9.743 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.540 -14.786 -8.563 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.489 -15.147 -10.305 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.364 -12.449 -11.209 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.792 -14.040 -11.764 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.642 -12.875 -11.065 1.00 0.00 H new ATOM 1439 N LYS A 94 6.091 -16.336 -7.720 1.00 0.00 N ATOM 1440 CA LYS A 94 6.344 -16.899 -6.399 1.00 0.00 C ATOM 1441 C LYS A 94 7.023 -15.881 -5.485 1.00 0.00 C ATOM 1442 O LYS A 94 7.800 -15.040 -5.938 1.00 0.00 O ATOM 1443 CB LYS A 94 7.231 -18.139 -6.525 1.00 0.00 C ATOM 1444 CG LYS A 94 6.767 -19.207 -5.531 1.00 0.00 C ATOM 1445 CD LYS A 94 5.543 -19.938 -6.091 1.00 0.00 C ATOM 1446 CE LYS A 94 4.544 -20.199 -4.962 1.00 0.00 C ATOM 1447 NZ LYS A 94 3.808 -18.942 -4.653 1.00 0.00 N ATOM 0 H LYS A 94 6.732 -16.655 -8.447 1.00 0.00 H new ATOM 0 HA LYS A 94 5.385 -17.172 -5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.185 -18.530 -7.542 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.271 -17.876 -6.332 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.572 -19.917 -5.344 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.521 -18.745 -4.575 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.076 -19.340 -6.874 1.00 0.00 H new ATOM 0 HD3 LYS A 94 5.846 -20.880 -6.548 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.843 -20.981 -5.255 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.067 -20.555 -4.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.105 -19.125 -3.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.479 -18.219 -4.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.325 -18.603 -5.510 1.00 0.00 H new ATOM 1461 N ASP A 95 6.728 -15.977 -4.192 1.00 0.00 N ATOM 1462 CA ASP A 95 7.315 -15.078 -3.206 1.00 0.00 C ATOM 1463 C ASP A 95 6.883 -13.634 -3.444 1.00 0.00 C ATOM 1464 O ASP A 95 7.602 -12.702 -3.089 1.00 0.00 O ATOM 1465 CB ASP A 95 8.841 -15.169 -3.262 1.00 0.00 C ATOM 1466 CG ASP A 95 9.272 -16.622 -3.438 1.00 0.00 C ATOM 1467 OD1 ASP A 95 9.182 -17.366 -2.476 1.00 0.00 O ATOM 1468 OD2 ASP A 95 9.686 -16.967 -4.532 1.00 0.00 O ATOM 0 H ASP A 95 6.086 -16.668 -3.804 1.00 0.00 H new ATOM 0 HA ASP A 95 6.962 -15.384 -2.221 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.219 -14.566 -4.088 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.271 -14.762 -2.347 1.00 0.00 H new ATOM 1473 N HIS A 96 5.713 -13.452 -4.049 1.00 0.00 N ATOM 1474 CA HIS A 96 5.209 -12.109 -4.329 1.00 0.00 C ATOM 1475 C HIS A 96 3.722 -12.004 -3.992 1.00 0.00 C ATOM 1476 O HIS A 96 2.951 -12.927 -4.254 1.00 0.00 O ATOM 1477 CB HIS A 96 5.422 -11.774 -5.805 1.00 0.00 C ATOM 1478 CG HIS A 96 6.842 -11.330 -6.022 1.00 0.00 C ATOM 1479 ND1 HIS A 96 7.889 -12.230 -6.133 1.00 0.00 N ATOM 1480 CD2 HIS A 96 7.402 -10.084 -6.164 1.00 0.00 C ATOM 1481 CE1 HIS A 96 9.015 -11.519 -6.337 1.00 0.00 C ATOM 1482 NE2 HIS A 96 8.773 -10.206 -6.363 1.00 0.00 N ATOM 0 H HIS A 96 5.100 -14.209 -4.353 1.00 0.00 H new ATOM 0 HA HIS A 96 5.757 -11.401 -3.708 1.00 0.00 H new ATOM 0 HB2 HIS A 96 5.205 -12.647 -6.421 1.00 0.00 H new ATOM 0 HB3 HIS A 96 4.733 -10.987 -6.113 1.00 0.00 H new ATOM 0 HD1 HIS A 96 7.820 -13.246 -6.072 1.00 0.00 H new ATOM 0 HD2 HIS A 96 6.860 -9.151 -6.127 1.00 0.00 H new ATOM 0 HE1 HIS A 96 9.994 -11.957 -6.464 1.00 0.00 H new ATOM 1490 N TYR A 97 3.326 -10.870 -3.412 1.00 0.00 N ATOM 1491 CA TYR A 97 1.926 -10.657 -3.050 1.00 0.00 C ATOM 1492 C TYR A 97 1.496 -9.228 -3.367 1.00 0.00 C ATOM 1493 O TYR A 97 2.229 -8.273 -3.111 1.00 0.00 O ATOM 1494 CB TYR A 97 1.718 -10.938 -1.558 1.00 0.00 C ATOM 1495 CG TYR A 97 1.314 -12.379 -1.376 1.00 0.00 C ATOM 1496 CD1 TYR A 97 2.279 -13.385 -1.477 1.00 0.00 C ATOM 1497 CD2 TYR A 97 -0.021 -12.711 -1.115 1.00 0.00 C ATOM 1498 CE1 TYR A 97 1.910 -14.726 -1.316 1.00 0.00 C ATOM 1499 CE2 TYR A 97 -0.392 -14.049 -0.954 1.00 0.00 C ATOM 1500 CZ TYR A 97 0.573 -15.059 -1.056 1.00 0.00 C ATOM 1501 OH TYR A 97 0.210 -16.381 -0.898 1.00 0.00 O ATOM 0 H TYR A 97 3.948 -10.094 -3.185 1.00 0.00 H new ATOM 0 HA TYR A 97 1.315 -11.344 -3.636 1.00 0.00 H new ATOM 0 HB2 TYR A 97 2.635 -10.733 -1.006 1.00 0.00 H new ATOM 0 HB3 TYR A 97 0.949 -10.279 -1.155 1.00 0.00 H new ATOM 0 HD1 TYR A 97 3.308 -13.128 -1.679 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -0.765 -11.932 -1.038 1.00 0.00 H new ATOM 0 HE1 TYR A 97 2.655 -15.504 -1.392 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -1.422 -14.304 -0.751 1.00 0.00 H new ATOM 0 HH TYR A 97 -0.753 -16.437 -0.723 1.00 0.00 H new ATOM 1511 N ILE A 98 0.292 -9.090 -3.920 1.00 0.00 N ATOM 1512 CA ILE A 98 -0.240 -7.785 -4.266 1.00 0.00 C ATOM 1513 C ILE A 98 -1.128 -7.323 -3.139 1.00 0.00 C ATOM 1514 O ILE A 98 -2.030 -8.051 -2.720 1.00 0.00 O ATOM 1515 CB ILE A 98 -1.078 -7.859 -5.558 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -0.375 -8.728 -6.616 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -1.333 -6.453 -6.121 1.00 0.00 C ATOM 1518 CD1 ILE A 98 0.875 -8.029 -7.163 1.00 0.00 C ATOM 0 H ILE A 98 -0.329 -9.870 -4.136 1.00 0.00 H new ATOM 0 HA ILE A 98 0.587 -7.093 -4.426 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.036 -8.317 -5.310 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -0.097 -9.686 -6.177 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -1.064 -8.940 -7.434 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -1.926 -6.528 -7.033 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.874 -5.859 -5.384 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -0.381 -5.973 -6.346 1.00 0.00 H new ATOM 0 HD11 ILE A 98 1.351 -8.666 -7.908 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.591 -7.082 -7.623 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.573 -7.841 -6.347 1.00 0.00 H new ATOM 1530 N PHE A 99 -0.891 -6.116 -2.660 1.00 0.00 N ATOM 1531 CA PHE A 99 -1.697 -5.569 -1.593 1.00 0.00 C ATOM 1532 C PHE A 99 -2.459 -4.373 -2.131 1.00 0.00 C ATOM 1533 O PHE A 99 -1.875 -3.481 -2.743 1.00 0.00 O ATOM 1534 CB PHE A 99 -0.804 -5.141 -0.428 1.00 0.00 C ATOM 1535 CG PHE A 99 -1.664 -4.751 0.747 1.00 0.00 C ATOM 1536 CD1 PHE A 99 -1.801 -5.625 1.828 1.00 0.00 C ATOM 1537 CD2 PHE A 99 -2.328 -3.517 0.755 1.00 0.00 C ATOM 1538 CE1 PHE A 99 -2.601 -5.269 2.918 1.00 0.00 C ATOM 1539 CE2 PHE A 99 -3.127 -3.160 1.846 1.00 0.00 C ATOM 1540 CZ PHE A 99 -3.264 -4.037 2.927 1.00 0.00 C ATOM 0 H PHE A 99 -0.149 -5.500 -2.993 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.396 -6.323 -1.231 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.136 -5.956 -0.149 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.175 -4.302 -0.727 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.289 -6.576 1.822 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.223 -2.842 -0.081 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -2.707 -5.945 3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.638 -2.208 1.854 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.882 -3.763 3.769 1.00 0.00 H new ATOM 1550 N TYR A 100 -3.762 -4.369 -1.920 1.00 0.00 N ATOM 1551 CA TYR A 100 -4.598 -3.285 -2.409 1.00 0.00 C ATOM 1552 C TYR A 100 -5.506 -2.805 -1.294 1.00 0.00 C ATOM 1553 O TYR A 100 -5.853 -3.568 -0.397 1.00 0.00 O ATOM 1554 CB TYR A 100 -5.416 -3.791 -3.598 1.00 0.00 C ATOM 1555 CG TYR A 100 -6.505 -2.809 -3.943 1.00 0.00 C ATOM 1556 CD1 TYR A 100 -6.174 -1.509 -4.343 1.00 0.00 C ATOM 1557 CD2 TYR A 100 -7.847 -3.203 -3.880 1.00 0.00 C ATOM 1558 CE1 TYR A 100 -7.186 -0.603 -4.681 1.00 0.00 C ATOM 1559 CE2 TYR A 100 -8.857 -2.299 -4.214 1.00 0.00 C ATOM 1560 CZ TYR A 100 -8.528 -0.997 -4.615 1.00 0.00 C ATOM 1561 OH TYR A 100 -9.527 -0.105 -4.949 1.00 0.00 O ATOM 0 H TYR A 100 -4.264 -5.100 -1.416 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.982 -2.447 -2.734 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.764 -3.938 -4.459 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -5.854 -4.760 -3.360 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -5.139 -1.205 -4.391 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -8.101 -4.207 -3.573 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.932 0.399 -4.993 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -9.892 -2.603 -4.163 1.00 0.00 H new ATOM 0 HH TYR A 100 -10.397 -0.553 -4.896 1.00 0.00 H new ATOM 1571 N SER A 101 -5.881 -1.539 -1.349 1.00 0.00 N ATOM 1572 CA SER A 101 -6.739 -0.984 -0.320 1.00 0.00 C ATOM 1573 C SER A 101 -7.520 0.196 -0.850 1.00 0.00 C ATOM 1574 O SER A 101 -7.026 0.947 -1.679 1.00 0.00 O ATOM 1575 CB SER A 101 -5.898 -0.552 0.880 1.00 0.00 C ATOM 1576 OG SER A 101 -6.203 0.796 1.209 1.00 0.00 O ATOM 0 H SER A 101 -5.610 -0.885 -2.084 1.00 0.00 H new ATOM 0 HA SER A 101 -7.446 -1.754 -0.009 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.100 -1.201 1.732 1.00 0.00 H new ATOM 0 HB3 SER A 101 -4.837 -0.651 0.649 1.00 0.00 H new ATOM 0 HG SER A 101 -7.070 0.833 1.665 1.00 0.00 H new ATOM 1582 N GLU A 102 -8.742 0.342 -0.363 1.00 0.00 N ATOM 1583 CA GLU A 102 -9.604 1.437 -0.789 1.00 0.00 C ATOM 1584 C GLU A 102 -10.319 2.037 0.407 1.00 0.00 C ATOM 1585 O GLU A 102 -10.555 1.360 1.402 1.00 0.00 O ATOM 1586 CB GLU A 102 -10.635 0.937 -1.798 1.00 0.00 C ATOM 1587 CG GLU A 102 -10.557 -0.585 -1.890 1.00 0.00 C ATOM 1588 CD GLU A 102 -11.593 -1.101 -2.880 1.00 0.00 C ATOM 1589 OE1 GLU A 102 -11.716 -0.512 -3.942 1.00 0.00 O ATOM 1590 OE2 GLU A 102 -12.253 -2.077 -2.563 1.00 0.00 O ATOM 0 H GLU A 102 -9.160 -0.282 0.327 1.00 0.00 H new ATOM 0 HA GLU A 102 -8.984 2.201 -1.258 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.636 1.243 -1.494 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -10.449 1.382 -2.776 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.558 -0.888 -2.205 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -10.729 -1.026 -0.908 1.00 0.00 H new ATOM 1597 N GLY A 103 -10.669 3.305 0.291 1.00 0.00 N ATOM 1598 CA GLY A 103 -11.371 3.995 1.364 1.00 0.00 C ATOM 1599 C GLY A 103 -11.693 5.432 0.977 1.00 0.00 C ATOM 1600 O GLY A 103 -11.971 5.726 -0.186 1.00 0.00 O ATOM 0 H GLY A 103 -10.481 3.878 -0.531 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -12.293 3.464 1.599 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -10.759 3.987 2.266 1.00 0.00 H new ATOM 1604 N GLU A 104 -11.646 6.321 1.960 1.00 0.00 N ATOM 1605 CA GLU A 104 -11.927 7.728 1.722 1.00 0.00 C ATOM 1606 C GLU A 104 -10.945 8.598 2.499 1.00 0.00 C ATOM 1607 O GLU A 104 -10.588 8.282 3.634 1.00 0.00 O ATOM 1608 CB GLU A 104 -13.358 8.062 2.157 1.00 0.00 C ATOM 1609 CG GLU A 104 -14.202 8.433 0.934 1.00 0.00 C ATOM 1610 CD GLU A 104 -14.333 7.232 0.004 1.00 0.00 C ATOM 1611 OE1 GLU A 104 -14.201 6.118 0.485 1.00 0.00 O ATOM 1612 OE2 GLU A 104 -14.568 7.443 -1.174 1.00 0.00 O ATOM 0 H GLU A 104 -11.416 6.092 2.927 1.00 0.00 H new ATOM 0 HA GLU A 104 -11.819 7.927 0.656 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.800 7.208 2.669 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.348 8.889 2.867 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -15.190 8.766 1.252 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.740 9.265 0.403 1.00 0.00 H new ATOM 1619 N LEU A 105 -10.516 9.696 1.884 1.00 0.00 N ATOM 1620 CA LEU A 105 -9.581 10.610 2.527 1.00 0.00 C ATOM 1621 C LEU A 105 -10.076 12.044 2.380 1.00 0.00 C ATOM 1622 O LEU A 105 -9.996 12.631 1.301 1.00 0.00 O ATOM 1623 CB LEU A 105 -8.194 10.477 1.895 1.00 0.00 C ATOM 1624 CG LEU A 105 -7.155 11.135 2.803 1.00 0.00 C ATOM 1625 CD1 LEU A 105 -6.607 10.100 3.788 1.00 0.00 C ATOM 1626 CD2 LEU A 105 -6.006 11.682 1.951 1.00 0.00 C ATOM 0 H LEU A 105 -10.800 9.973 0.944 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.514 10.358 3.585 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.949 9.425 1.747 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -8.184 10.948 0.912 1.00 0.00 H new ATOM 0 HG LEU A 105 -7.622 11.951 3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.866 10.570 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.423 9.708 4.395 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.141 9.284 3.236 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.265 12.151 2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.541 10.865 1.400 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.393 12.420 1.248 1.00 0.00 H new ATOM 1638 N HIS A 106 -10.597 12.590 3.473 1.00 0.00 N ATOM 1639 CA HIS A 106 -11.118 13.953 3.476 1.00 0.00 C ATOM 1640 C HIS A 106 -12.360 14.066 2.604 1.00 0.00 C ATOM 1641 O HIS A 106 -12.631 15.118 2.025 1.00 0.00 O ATOM 1642 CB HIS A 106 -10.053 14.945 3.000 1.00 0.00 C ATOM 1643 CG HIS A 106 -8.749 14.647 3.687 1.00 0.00 C ATOM 1644 ND1 HIS A 106 -8.675 13.849 4.816 1.00 0.00 N ATOM 1645 CD2 HIS A 106 -7.461 15.038 3.418 1.00 0.00 C ATOM 1646 CE1 HIS A 106 -7.382 13.785 5.185 1.00 0.00 C ATOM 1647 NE2 HIS A 106 -6.600 14.493 4.366 1.00 0.00 N ATOM 0 H HIS A 106 -10.670 12.109 4.370 1.00 0.00 H new ATOM 0 HA HIS A 106 -11.392 14.199 4.502 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -9.932 14.874 1.919 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -10.367 15.965 3.219 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -7.162 15.672 2.596 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -7.021 13.230 6.038 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -5.588 14.609 4.423 1.00 0.00 H new ATOM 1655 N GLY A 107 -13.118 12.979 2.521 1.00 0.00 N ATOM 1656 CA GLY A 107 -14.336 12.973 1.726 1.00 0.00 C ATOM 1657 C GLY A 107 -14.030 12.717 0.257 1.00 0.00 C ATOM 1658 O GLY A 107 -14.852 13.001 -0.614 1.00 0.00 O ATOM 0 H GLY A 107 -12.912 12.098 2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -15.014 12.205 2.099 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -14.848 13.929 1.833 1.00 0.00 H new ATOM 1662 N LYS A 108 -12.851 12.159 -0.007 1.00 0.00 N ATOM 1663 CA LYS A 108 -12.449 11.846 -1.378 1.00 0.00 C ATOM 1664 C LYS A 108 -12.022 10.373 -1.462 1.00 0.00 C ATOM 1665 O LYS A 108 -11.401 9.867 -0.535 1.00 0.00 O ATOM 1666 CB LYS A 108 -11.278 12.739 -1.797 1.00 0.00 C ATOM 1667 CG LYS A 108 -11.668 14.213 -1.651 1.00 0.00 C ATOM 1668 CD LYS A 108 -12.821 14.551 -2.601 1.00 0.00 C ATOM 1669 CE LYS A 108 -12.633 15.971 -3.140 1.00 0.00 C ATOM 1670 NZ LYS A 108 -12.201 16.870 -2.033 1.00 0.00 N ATOM 0 H LYS A 108 -12.161 11.915 0.704 1.00 0.00 H new ATOM 0 HA LYS A 108 -13.292 12.024 -2.046 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -10.405 12.522 -1.181 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -11.000 12.528 -2.830 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -11.963 14.419 -0.622 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -10.809 14.847 -1.869 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -12.849 13.838 -3.425 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -13.774 14.472 -2.078 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -11.889 15.974 -3.936 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -13.565 16.333 -3.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -12.517 17.841 -2.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -12.620 16.545 -1.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -11.164 16.852 -1.956 1.00 0.00 H new ATOM 1684 N PRO A 109 -12.335 9.675 -2.530 1.00 0.00 N ATOM 1685 CA PRO A 109 -11.960 8.234 -2.673 1.00 0.00 C ATOM 1686 C PRO A 109 -10.454 8.039 -2.825 1.00 0.00 C ATOM 1687 O PRO A 109 -9.804 8.741 -3.599 1.00 0.00 O ATOM 1688 CB PRO A 109 -12.702 7.780 -3.931 1.00 0.00 C ATOM 1689 CG PRO A 109 -12.940 9.023 -4.721 1.00 0.00 C ATOM 1690 CD PRO A 109 -13.064 10.164 -3.714 1.00 0.00 C ATOM 0 HA PRO A 109 -12.229 7.657 -1.788 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -12.110 7.061 -4.498 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -13.642 7.290 -3.677 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -12.118 9.205 -5.413 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -13.847 8.934 -5.319 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -12.627 11.086 -4.099 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -14.107 10.379 -3.480 1.00 0.00 H new ATOM 1698 N VAL A 110 -9.907 7.083 -2.073 1.00 0.00 N ATOM 1699 CA VAL A 110 -8.477 6.810 -2.126 1.00 0.00 C ATOM 1700 C VAL A 110 -8.216 5.317 -2.245 1.00 0.00 C ATOM 1701 O VAL A 110 -8.758 4.518 -1.483 1.00 0.00 O ATOM 1702 CB VAL A 110 -7.797 7.361 -0.867 1.00 0.00 C ATOM 1703 CG1 VAL A 110 -8.763 7.273 0.315 1.00 0.00 C ATOM 1704 CG2 VAL A 110 -6.534 6.553 -0.549 1.00 0.00 C ATOM 0 H VAL A 110 -10.430 6.492 -1.427 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.063 7.302 -3.006 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.520 8.401 -1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.280 7.665 1.210 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -9.656 7.859 0.099 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.043 6.232 0.480 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -6.061 6.955 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.802 5.510 -0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -5.839 6.619 -1.386 1.00 0.00 H new ATOM 1714 N ARG A 111 -7.373 4.951 -3.204 1.00 0.00 N ATOM 1715 CA ARG A 111 -7.033 3.550 -3.415 1.00 0.00 C ATOM 1716 C ARG A 111 -5.561 3.414 -3.800 1.00 0.00 C ATOM 1717 O ARG A 111 -5.047 4.213 -4.582 1.00 0.00 O ATOM 1718 CB ARG A 111 -7.908 2.944 -4.519 1.00 0.00 C ATOM 1719 CG ARG A 111 -8.978 3.949 -4.956 1.00 0.00 C ATOM 1720 CD ARG A 111 -9.817 3.342 -6.080 1.00 0.00 C ATOM 1721 NE ARG A 111 -11.132 3.972 -6.127 1.00 0.00 N ATOM 1722 CZ ARG A 111 -11.304 5.160 -6.697 1.00 0.00 C ATOM 1723 NH1 ARG A 111 -12.491 5.701 -6.729 1.00 0.00 N ATOM 1724 NH2 ARG A 111 -10.288 5.784 -7.224 1.00 0.00 N ATOM 0 H ARG A 111 -6.915 5.601 -3.844 1.00 0.00 H new ATOM 0 HA ARG A 111 -7.213 3.013 -2.484 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.289 2.666 -5.372 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -8.382 2.031 -4.158 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.616 4.208 -4.111 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -8.508 4.872 -5.296 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -9.308 3.475 -7.035 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -9.926 2.269 -5.923 1.00 0.00 H new ATOM 0 HE ARG A 111 -11.933 3.493 -5.715 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -13.286 5.212 -6.317 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -12.624 6.613 -7.166 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -9.360 5.360 -7.199 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -10.421 6.696 -7.661 1.00 0.00 H new ATOM 1738 N GLY A 112 -4.875 2.414 -3.238 1.00 0.00 N ATOM 1739 CA GLY A 112 -3.459 2.234 -3.543 1.00 0.00 C ATOM 1740 C GLY A 112 -3.071 0.767 -3.611 1.00 0.00 C ATOM 1741 O GLY A 112 -3.642 -0.078 -2.921 1.00 0.00 O ATOM 0 H GLY A 112 -5.267 1.734 -2.586 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -3.230 2.714 -4.495 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -2.859 2.732 -2.782 1.00 0.00 H new ATOM 1745 N VAL A 113 -2.091 0.482 -4.458 1.00 0.00 N ATOM 1746 CA VAL A 113 -1.607 -0.874 -4.640 1.00 0.00 C ATOM 1747 C VAL A 113 -0.148 -0.979 -4.237 1.00 0.00 C ATOM 1748 O VAL A 113 0.653 -0.112 -4.582 1.00 0.00 O ATOM 1749 CB VAL A 113 -1.702 -1.256 -6.112 1.00 0.00 C ATOM 1750 CG1 VAL A 113 -1.862 -2.770 -6.235 1.00 0.00 C ATOM 1751 CG2 VAL A 113 -2.896 -0.555 -6.756 1.00 0.00 C ATOM 0 H VAL A 113 -1.615 1.178 -5.032 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.215 -1.534 -4.022 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.791 -0.945 -6.624 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -1.930 -3.044 -7.288 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -1.001 -3.265 -5.786 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.770 -3.083 -5.719 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.957 -0.833 -7.808 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -3.812 -0.855 -6.247 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -2.772 0.525 -6.673 1.00 0.00 H new ATOM 1761 N LYS A 114 0.198 -2.043 -3.523 1.00 0.00 N ATOM 1762 CA LYS A 114 1.573 -2.248 -3.100 1.00 0.00 C ATOM 1763 C LYS A 114 2.042 -3.668 -3.435 1.00 0.00 C ATOM 1764 O LYS A 114 1.371 -4.645 -3.105 1.00 0.00 O ATOM 1765 CB LYS A 114 1.665 -2.005 -1.599 1.00 0.00 C ATOM 1766 CG LYS A 114 0.354 -1.367 -1.132 1.00 0.00 C ATOM 1767 CD LYS A 114 0.438 -1.025 0.349 1.00 0.00 C ATOM 1768 CE LYS A 114 -0.442 0.194 0.631 1.00 0.00 C ATOM 1769 NZ LYS A 114 -0.847 0.197 2.065 1.00 0.00 N ATOM 0 H LYS A 114 -0.452 -2.772 -3.227 1.00 0.00 H new ATOM 0 HA LYS A 114 2.220 -1.550 -3.631 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.839 -2.944 -1.073 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.507 -1.351 -1.371 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.153 -0.465 -1.711 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.476 -2.051 -1.309 1.00 0.00 H new ATOM 0 HD2 LYS A 114 0.110 -1.873 0.950 1.00 0.00 H new ATOM 0 HD3 LYS A 114 1.471 -0.816 0.629 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.100 1.109 0.394 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.326 0.173 -0.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.445 1.026 2.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.380 -0.670 2.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.001 0.237 2.665 1.00 0.00 H new ATOM 1783 N LEU A 115 3.210 -3.776 -4.073 1.00 0.00 N ATOM 1784 CA LEU A 115 3.774 -5.079 -4.422 1.00 0.00 C ATOM 1785 C LEU A 115 4.802 -5.445 -3.380 1.00 0.00 C ATOM 1786 O LEU A 115 5.748 -4.692 -3.155 1.00 0.00 O ATOM 1787 CB LEU A 115 4.451 -5.033 -5.803 1.00 0.00 C ATOM 1788 CG LEU A 115 5.237 -6.332 -6.071 1.00 0.00 C ATOM 1789 CD1 LEU A 115 4.334 -7.543 -5.850 1.00 0.00 C ATOM 1790 CD2 LEU A 115 5.736 -6.338 -7.523 1.00 0.00 C ATOM 0 H LEU A 115 3.780 -2.979 -4.357 1.00 0.00 H new ATOM 0 HA LEU A 115 2.973 -5.818 -4.457 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.697 -4.892 -6.578 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.125 -4.178 -5.854 1.00 0.00 H new ATOM 0 HG LEU A 115 6.084 -6.382 -5.387 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.897 -8.456 -6.041 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.976 -7.547 -4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.484 -7.492 -6.530 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.292 -7.256 -7.713 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.884 -6.283 -8.201 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.387 -5.479 -7.688 1.00 0.00 H new ATOM 1802 N VAL A 116 4.608 -6.587 -2.741 1.00 0.00 N ATOM 1803 CA VAL A 116 5.537 -7.015 -1.714 1.00 0.00 C ATOM 1804 C VAL A 116 6.106 -8.391 -2.020 1.00 0.00 C ATOM 1805 O VAL A 116 5.396 -9.287 -2.477 1.00 0.00 O ATOM 1806 CB VAL A 116 4.848 -7.012 -0.350 1.00 0.00 C ATOM 1807 CG1 VAL A 116 3.783 -5.913 -0.318 1.00 0.00 C ATOM 1808 CG2 VAL A 116 4.171 -8.357 -0.104 1.00 0.00 C ATOM 0 H VAL A 116 3.829 -7.223 -2.912 1.00 0.00 H new ATOM 0 HA VAL A 116 6.368 -6.310 -1.694 1.00 0.00 H new ATOM 0 HB VAL A 116 5.596 -6.832 0.422 1.00 0.00 H new ATOM 0 HG11 VAL A 116 3.292 -5.911 0.655 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.254 -4.945 -0.489 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.044 -6.100 -1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.683 -8.346 0.870 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.428 -8.538 -0.880 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.919 -9.150 -0.126 1.00 0.00 H new ATOM 1818 N GLY A 117 7.403 -8.543 -1.777 1.00 0.00 N ATOM 1819 CA GLY A 117 8.077 -9.807 -2.038 1.00 0.00 C ATOM 1820 C GLY A 117 9.009 -10.183 -0.891 1.00 0.00 C ATOM 1821 O GLY A 117 9.588 -9.315 -0.239 1.00 0.00 O ATOM 0 H GLY A 117 8.005 -7.810 -1.402 1.00 0.00 H new ATOM 0 HA2 GLY A 117 7.337 -10.594 -2.181 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.647 -9.734 -2.964 1.00 0.00 H new ATOM 1825 N ARG A 118 9.140 -11.483 -0.649 1.00 0.00 N ATOM 1826 CA ARG A 118 9.995 -11.971 0.427 1.00 0.00 C ATOM 1827 C ARG A 118 11.461 -11.962 0.007 1.00 0.00 C ATOM 1828 O ARG A 118 12.355 -12.094 0.842 1.00 0.00 O ATOM 1829 CB ARG A 118 9.582 -13.394 0.809 1.00 0.00 C ATOM 1830 CG ARG A 118 10.048 -13.698 2.234 1.00 0.00 C ATOM 1831 CD ARG A 118 10.052 -15.211 2.455 1.00 0.00 C ATOM 1832 NE ARG A 118 8.807 -15.794 1.970 1.00 0.00 N ATOM 1833 CZ ARG A 118 8.729 -17.082 1.654 1.00 0.00 C ATOM 1834 NH1 ARG A 118 7.602 -17.580 1.222 1.00 0.00 N ATOM 1835 NH2 ARG A 118 9.778 -17.850 1.775 1.00 0.00 N ATOM 0 H ARG A 118 8.668 -12.214 -1.180 1.00 0.00 H new ATOM 0 HA ARG A 118 9.877 -11.309 1.285 1.00 0.00 H new ATOM 0 HB2 ARG A 118 8.499 -13.501 0.739 1.00 0.00 H new ATOM 0 HB3 ARG A 118 10.018 -14.110 0.112 1.00 0.00 H new ATOM 0 HG2 ARG A 118 11.047 -13.293 2.396 1.00 0.00 H new ATOM 0 HG3 ARG A 118 9.388 -13.216 2.955 1.00 0.00 H new ATOM 0 HD2 ARG A 118 10.899 -15.659 1.935 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.176 -15.431 3.515 1.00 0.00 H new ATOM 0 HE ARG A 118 7.982 -15.203 1.872 1.00 0.00 H new ATOM 0 HH11 ARG A 118 6.782 -16.980 1.127 1.00 0.00 H new ATOM 0 HH12 ARG A 118 7.541 -18.569 0.979 1.00 0.00 H new ATOM 0 HH21 ARG A 118 10.659 -17.461 2.112 1.00 0.00 H new ATOM 0 HH22 ARG A 118 9.717 -18.839 1.532 1.00 0.00 H new ATOM 1849 N ASP A 119 11.706 -11.808 -1.290 1.00 0.00 N ATOM 1850 CA ASP A 119 13.073 -11.789 -1.795 1.00 0.00 C ATOM 1851 C ASP A 119 13.596 -10.349 -1.869 1.00 0.00 C ATOM 1852 O ASP A 119 12.830 -9.431 -2.157 1.00 0.00 O ATOM 1853 CB ASP A 119 13.122 -12.420 -3.189 1.00 0.00 C ATOM 1854 CG ASP A 119 12.458 -11.495 -4.205 1.00 0.00 C ATOM 1855 OD1 ASP A 119 11.253 -11.323 -4.121 1.00 0.00 O ATOM 1856 OD2 ASP A 119 13.165 -10.969 -5.049 1.00 0.00 O ATOM 0 H ASP A 119 10.985 -11.696 -2.003 1.00 0.00 H new ATOM 0 HA ASP A 119 13.702 -12.361 -1.113 1.00 0.00 H new ATOM 0 HB2 ASP A 119 14.157 -12.606 -3.477 1.00 0.00 H new ATOM 0 HB3 ASP A 119 12.615 -13.385 -3.178 1.00 0.00 H new ATOM 1861 N PRO A 120 14.872 -10.127 -1.628 1.00 0.00 N ATOM 1862 CA PRO A 120 15.461 -8.757 -1.688 1.00 0.00 C ATOM 1863 C PRO A 120 15.662 -8.289 -3.127 1.00 0.00 C ATOM 1864 O PRO A 120 15.740 -7.091 -3.396 1.00 0.00 O ATOM 1865 CB PRO A 120 16.805 -8.914 -0.980 1.00 0.00 C ATOM 1866 CG PRO A 120 17.195 -10.335 -1.213 1.00 0.00 C ATOM 1867 CD PRO A 120 15.891 -11.133 -1.273 1.00 0.00 C ATOM 0 HA PRO A 120 14.815 -8.009 -1.228 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.548 -8.228 -1.386 1.00 0.00 H new ATOM 0 HB3 PRO A 120 16.719 -8.697 0.085 1.00 0.00 H new ATOM 0 HG2 PRO A 120 17.756 -10.437 -2.142 1.00 0.00 H new ATOM 0 HG3 PRO A 120 17.837 -10.699 -0.411 1.00 0.00 H new ATOM 0 HD2 PRO A 120 15.943 -11.928 -2.017 1.00 0.00 H new ATOM 0 HD3 PRO A 120 15.668 -11.606 -0.317 1.00 0.00 H new ATOM 1875 N LYS A 121 15.750 -9.248 -4.043 1.00 0.00 N ATOM 1876 CA LYS A 121 15.948 -8.930 -5.452 1.00 0.00 C ATOM 1877 C LYS A 121 14.698 -8.283 -6.036 1.00 0.00 C ATOM 1878 O LYS A 121 13.968 -7.578 -5.341 1.00 0.00 O ATOM 1879 CB LYS A 121 16.283 -10.204 -6.232 1.00 0.00 C ATOM 1880 CG LYS A 121 17.202 -9.865 -7.410 1.00 0.00 C ATOM 1881 CD LYS A 121 18.662 -9.913 -6.950 1.00 0.00 C ATOM 1882 CE LYS A 121 19.573 -9.472 -8.098 1.00 0.00 C ATOM 1883 NZ LYS A 121 19.401 -8.011 -8.333 1.00 0.00 N ATOM 0 H LYS A 121 15.688 -10.245 -3.837 1.00 0.00 H new ATOM 0 HA LYS A 121 16.777 -8.227 -5.535 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.769 -10.926 -5.576 1.00 0.00 H new ATOM 0 HB3 LYS A 121 15.367 -10.670 -6.596 1.00 0.00 H new ATOM 0 HG2 LYS A 121 17.043 -10.572 -8.224 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.964 -8.874 -7.797 1.00 0.00 H new ATOM 0 HD2 LYS A 121 18.804 -9.262 -6.088 1.00 0.00 H new ATOM 0 HD3 LYS A 121 18.922 -10.923 -6.633 1.00 0.00 H new ATOM 0 HE2 LYS A 121 20.613 -9.693 -7.857 1.00 0.00 H new ATOM 0 HE3 LYS A 121 19.331 -10.028 -9.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 20.217 -7.646 -8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 18.531 -7.847 -8.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 19.335 -7.518 -7.420 1.00 0.00 H new ATOM 1897 N ASN A 122 14.458 -8.526 -7.321 1.00 0.00 N ATOM 1898 CA ASN A 122 13.293 -7.956 -7.987 1.00 0.00 C ATOM 1899 C ASN A 122 12.783 -8.888 -9.083 1.00 0.00 C ATOM 1900 O ASN A 122 13.561 -9.594 -9.724 1.00 0.00 O ATOM 1901 CB ASN A 122 13.653 -6.601 -8.598 1.00 0.00 C ATOM 1902 CG ASN A 122 14.887 -6.741 -9.483 1.00 0.00 C ATOM 1903 OD1 ASN A 122 14.773 -7.090 -10.658 1.00 0.00 O ATOM 1904 ND2 ASN A 122 16.067 -6.489 -8.987 1.00 0.00 N ATOM 0 H ASN A 122 15.048 -9.107 -7.916 1.00 0.00 H new ATOM 0 HA ASN A 122 12.506 -7.826 -7.244 1.00 0.00 H new ATOM 0 HB2 ASN A 122 12.816 -6.223 -9.184 1.00 0.00 H new ATOM 0 HB3 ASN A 122 13.842 -5.875 -7.808 1.00 0.00 H new ATOM 0 HD21 ASN A 122 16.897 -6.581 -9.573 1.00 0.00 H new ATOM 0 HD22 ASN A 122 16.160 -6.200 -8.013 1.00 0.00 H new ATOM 1911 N ASN A 123 11.469 -8.870 -9.295 1.00 0.00 N ATOM 1912 CA ASN A 123 10.848 -9.697 -10.315 1.00 0.00 C ATOM 1913 C ASN A 123 10.110 -8.801 -11.301 1.00 0.00 C ATOM 1914 O ASN A 123 9.167 -8.099 -10.935 1.00 0.00 O ATOM 1915 CB ASN A 123 9.879 -10.682 -9.662 1.00 0.00 C ATOM 1916 CG ASN A 123 10.646 -11.897 -9.150 1.00 0.00 C ATOM 1917 OD1 ASN A 123 11.495 -11.770 -8.269 1.00 0.00 O ATOM 1918 ND2 ASN A 123 10.398 -13.074 -9.655 1.00 0.00 N ATOM 0 H ASN A 123 10.816 -8.288 -8.770 1.00 0.00 H new ATOM 0 HA ASN A 123 11.612 -10.264 -10.848 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.354 -10.198 -8.838 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.123 -10.995 -10.382 1.00 0.00 H new ATOM 0 HD21 ASN A 123 10.908 -13.891 -9.319 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.694 -13.177 -10.385 1.00 0.00 H new ATOM 1925 N LEU A 124 10.560 -8.816 -12.545 1.00 0.00 N ATOM 1926 CA LEU A 124 9.954 -7.986 -13.578 1.00 0.00 C ATOM 1927 C LEU A 124 8.591 -8.523 -13.961 1.00 0.00 C ATOM 1928 O LEU A 124 7.692 -7.766 -14.327 1.00 0.00 O ATOM 1929 CB LEU A 124 10.856 -7.934 -14.812 1.00 0.00 C ATOM 1930 CG LEU A 124 11.264 -9.353 -15.210 1.00 0.00 C ATOM 1931 CD1 LEU A 124 10.933 -9.584 -16.686 1.00 0.00 C ATOM 1932 CD2 LEU A 124 12.768 -9.531 -14.994 1.00 0.00 C ATOM 0 H LEU A 124 11.340 -9.391 -12.865 1.00 0.00 H new ATOM 0 HA LEU A 124 9.835 -6.978 -13.181 1.00 0.00 H new ATOM 0 HB2 LEU A 124 10.333 -7.450 -15.637 1.00 0.00 H new ATOM 0 HB3 LEU A 124 11.742 -7.335 -14.602 1.00 0.00 H new ATOM 0 HG LEU A 124 10.720 -10.072 -14.597 1.00 0.00 H new ATOM 0 HD11 LEU A 124 11.224 -10.595 -16.970 1.00 0.00 H new ATOM 0 HD12 LEU A 124 9.862 -9.457 -16.843 1.00 0.00 H new ATOM 0 HD13 LEU A 124 11.477 -8.865 -17.298 1.00 0.00 H new ATOM 0 HD21 LEU A 124 13.059 -10.542 -15.278 1.00 0.00 H new ATOM 0 HD22 LEU A 124 13.311 -8.812 -15.607 1.00 0.00 H new ATOM 0 HD23 LEU A 124 13.007 -9.366 -13.943 1.00 0.00 H new ATOM 1944 N GLU A 125 8.438 -9.832 -13.864 1.00 0.00 N ATOM 1945 CA GLU A 125 7.172 -10.451 -14.193 1.00 0.00 C ATOM 1946 C GLU A 125 6.146 -10.104 -13.127 1.00 0.00 C ATOM 1947 O GLU A 125 4.970 -9.897 -13.422 1.00 0.00 O ATOM 1948 CB GLU A 125 7.349 -11.964 -14.296 1.00 0.00 C ATOM 1949 CG GLU A 125 8.243 -12.459 -13.161 1.00 0.00 C ATOM 1950 CD GLU A 125 9.674 -12.624 -13.659 1.00 0.00 C ATOM 1951 OE1 GLU A 125 9.857 -13.287 -14.667 1.00 0.00 O ATOM 1952 OE2 GLU A 125 10.566 -12.084 -13.026 1.00 0.00 O ATOM 0 H GLU A 125 9.167 -10.478 -13.563 1.00 0.00 H new ATOM 0 HA GLU A 125 6.820 -10.077 -15.154 1.00 0.00 H new ATOM 0 HB2 GLU A 125 6.378 -12.457 -14.248 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.791 -12.223 -15.258 1.00 0.00 H new ATOM 0 HG2 GLU A 125 8.217 -11.752 -12.332 1.00 0.00 H new ATOM 0 HG3 GLU A 125 7.869 -13.410 -12.781 1.00 0.00 H new ATOM 1959 N ALA A 126 6.609 -10.027 -11.887 1.00 0.00 N ATOM 1960 CA ALA A 126 5.732 -9.686 -10.785 1.00 0.00 C ATOM 1961 C ALA A 126 5.361 -8.221 -10.887 1.00 0.00 C ATOM 1962 O ALA A 126 4.215 -7.841 -10.648 1.00 0.00 O ATOM 1963 CB ALA A 126 6.424 -9.961 -9.450 1.00 0.00 C ATOM 0 H ALA A 126 7.580 -10.195 -11.624 1.00 0.00 H new ATOM 0 HA ALA A 126 4.831 -10.298 -10.835 1.00 0.00 H new ATOM 0 HB1 ALA A 126 5.753 -9.700 -8.632 1.00 0.00 H new ATOM 0 HB2 ALA A 126 6.682 -11.018 -9.385 1.00 0.00 H new ATOM 0 HB3 ALA A 126 7.332 -9.361 -9.380 1.00 0.00 H new ATOM 1969 N LEU A 127 6.338 -7.399 -11.258 1.00 0.00 N ATOM 1970 CA LEU A 127 6.096 -5.976 -11.400 1.00 0.00 C ATOM 1971 C LEU A 127 5.044 -5.739 -12.463 1.00 0.00 C ATOM 1972 O LEU A 127 4.174 -4.888 -12.304 1.00 0.00 O ATOM 1973 CB LEU A 127 7.393 -5.266 -11.792 1.00 0.00 C ATOM 1974 CG LEU A 127 7.834 -4.311 -10.683 1.00 0.00 C ATOM 1975 CD1 LEU A 127 9.276 -3.872 -10.940 1.00 0.00 C ATOM 1976 CD2 LEU A 127 6.922 -3.083 -10.680 1.00 0.00 C ATOM 0 H LEU A 127 7.293 -7.694 -11.463 1.00 0.00 H new ATOM 0 HA LEU A 127 5.742 -5.578 -10.449 1.00 0.00 H new ATOM 0 HB2 LEU A 127 8.175 -6.002 -11.980 1.00 0.00 H new ATOM 0 HB3 LEU A 127 7.246 -4.713 -12.720 1.00 0.00 H new ATOM 0 HG LEU A 127 7.771 -4.814 -9.718 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.595 -3.191 -10.151 1.00 0.00 H new ATOM 0 HD12 LEU A 127 9.926 -4.747 -10.949 1.00 0.00 H new ATOM 0 HD13 LEU A 127 9.336 -3.365 -11.903 1.00 0.00 H new ATOM 0 HD21 LEU A 127 7.234 -2.400 -9.890 1.00 0.00 H new ATOM 0 HD22 LEU A 127 6.989 -2.578 -11.644 1.00 0.00 H new ATOM 0 HD23 LEU A 127 5.892 -3.395 -10.504 1.00 0.00 H new ATOM 1988 N GLU A 128 5.119 -6.502 -13.548 1.00 0.00 N ATOM 1989 CA GLU A 128 4.145 -6.356 -14.616 1.00 0.00 C ATOM 1990 C GLU A 128 2.774 -6.765 -14.103 1.00 0.00 C ATOM 1991 O GLU A 128 1.771 -6.090 -14.351 1.00 0.00 O ATOM 1992 CB GLU A 128 4.532 -7.230 -15.811 1.00 0.00 C ATOM 1993 CG GLU A 128 4.458 -6.400 -17.095 1.00 0.00 C ATOM 1994 CD GLU A 128 4.739 -7.286 -18.303 1.00 0.00 C ATOM 1995 OE1 GLU A 128 5.694 -8.044 -18.250 1.00 0.00 O ATOM 1996 OE2 GLU A 128 3.996 -7.194 -19.267 1.00 0.00 O ATOM 0 H GLU A 128 5.831 -7.215 -13.708 1.00 0.00 H new ATOM 0 HA GLU A 128 4.121 -5.315 -14.939 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.540 -7.623 -15.677 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.862 -8.087 -15.880 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.472 -5.946 -17.188 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.182 -5.586 -17.054 1.00 0.00 H new ATOM 2003 N ASP A 129 2.743 -7.867 -13.365 1.00 0.00 N ATOM 2004 CA ASP A 129 1.490 -8.347 -12.806 1.00 0.00 C ATOM 2005 C ASP A 129 0.912 -7.285 -11.896 1.00 0.00 C ATOM 2006 O ASP A 129 -0.282 -6.982 -11.940 1.00 0.00 O ATOM 2007 CB ASP A 129 1.713 -9.644 -12.027 1.00 0.00 C ATOM 2008 CG ASP A 129 0.511 -10.567 -12.196 1.00 0.00 C ATOM 2009 OD1 ASP A 129 -0.430 -10.428 -11.433 1.00 0.00 O ATOM 2010 OD2 ASP A 129 0.548 -11.399 -13.087 1.00 0.00 O ATOM 0 H ASP A 129 3.559 -8.437 -13.143 1.00 0.00 H new ATOM 0 HA ASP A 129 0.791 -8.552 -13.617 1.00 0.00 H new ATOM 0 HB2 ASP A 129 2.616 -10.141 -12.382 1.00 0.00 H new ATOM 0 HB3 ASP A 129 1.866 -9.422 -10.971 1.00 0.00 H new ATOM 2015 N PHE A 130 1.773 -6.678 -11.100 1.00 0.00 N ATOM 2016 CA PHE A 130 1.337 -5.621 -10.224 1.00 0.00 C ATOM 2017 C PHE A 130 0.903 -4.440 -11.069 1.00 0.00 C ATOM 2018 O PHE A 130 -0.170 -3.872 -10.871 1.00 0.00 O ATOM 2019 CB PHE A 130 2.492 -5.214 -9.318 1.00 0.00 C ATOM 2020 CG PHE A 130 2.215 -3.858 -8.741 1.00 0.00 C ATOM 2021 CD1 PHE A 130 1.615 -3.763 -7.492 1.00 0.00 C ATOM 2022 CD2 PHE A 130 2.559 -2.701 -9.449 1.00 0.00 C ATOM 2023 CE1 PHE A 130 1.355 -2.518 -6.938 1.00 0.00 C ATOM 2024 CE2 PHE A 130 2.296 -1.443 -8.894 1.00 0.00 C ATOM 2025 CZ PHE A 130 1.693 -1.351 -7.634 1.00 0.00 C ATOM 0 H PHE A 130 2.767 -6.900 -11.046 1.00 0.00 H new ATOM 0 HA PHE A 130 0.503 -5.958 -9.609 1.00 0.00 H new ATOM 0 HB2 PHE A 130 2.616 -5.944 -8.518 1.00 0.00 H new ATOM 0 HB3 PHE A 130 3.424 -5.198 -9.883 1.00 0.00 H new ATOM 0 HD1 PHE A 130 1.350 -4.660 -6.951 1.00 0.00 H new ATOM 0 HD2 PHE A 130 3.026 -2.778 -10.420 1.00 0.00 H new ATOM 0 HE1 PHE A 130 0.890 -2.449 -5.966 1.00 0.00 H new ATOM 0 HE2 PHE A 130 2.557 -0.546 -9.436 1.00 0.00 H new ATOM 0 HZ PHE A 130 1.489 -0.383 -7.200 1.00 0.00 H new ATOM 2035 N GLU A 131 1.751 -4.098 -12.029 1.00 0.00 N ATOM 2036 CA GLU A 131 1.466 -2.997 -12.930 1.00 0.00 C ATOM 2037 C GLU A 131 0.166 -3.268 -13.656 1.00 0.00 C ATOM 2038 O GLU A 131 -0.471 -2.349 -14.178 1.00 0.00 O ATOM 2039 CB GLU A 131 2.604 -2.827 -13.941 1.00 0.00 C ATOM 2040 CG GLU A 131 2.518 -1.441 -14.581 1.00 0.00 C ATOM 2041 CD GLU A 131 3.351 -1.406 -15.857 1.00 0.00 C ATOM 2042 OE1 GLU A 131 3.062 -2.186 -16.750 1.00 0.00 O ATOM 2043 OE2 GLU A 131 4.264 -0.601 -15.923 1.00 0.00 O ATOM 0 H GLU A 131 2.640 -4.568 -12.201 1.00 0.00 H new ATOM 0 HA GLU A 131 1.376 -2.077 -12.353 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.567 -2.950 -13.445 1.00 0.00 H new ATOM 0 HB3 GLU A 131 2.540 -3.598 -14.709 1.00 0.00 H new ATOM 0 HG2 GLU A 131 1.480 -1.199 -14.808 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.876 -0.685 -13.882 1.00 0.00 H new ATOM 2050 N LYS A 132 -0.270 -4.523 -13.628 1.00 0.00 N ATOM 2051 CA LYS A 132 -1.533 -4.857 -14.238 1.00 0.00 C ATOM 2052 C LYS A 132 -2.622 -4.530 -13.239 1.00 0.00 C ATOM 2053 O LYS A 132 -3.673 -4.012 -13.599 1.00 0.00 O ATOM 2054 CB LYS A 132 -1.573 -6.335 -14.624 1.00 0.00 C ATOM 2055 CG LYS A 132 -1.567 -6.460 -16.149 1.00 0.00 C ATOM 2056 CD LYS A 132 -1.493 -7.937 -16.549 1.00 0.00 C ATOM 2057 CE LYS A 132 -2.908 -8.487 -16.726 1.00 0.00 C ATOM 2058 NZ LYS A 132 -3.543 -7.852 -17.915 1.00 0.00 N ATOM 0 H LYS A 132 0.226 -5.304 -13.198 1.00 0.00 H new ATOM 0 HA LYS A 132 -1.677 -4.284 -15.154 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -0.714 -6.856 -14.202 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -2.466 -6.806 -14.213 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -2.467 -6.006 -16.564 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -0.717 -5.918 -16.564 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -0.930 -8.046 -17.476 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -0.963 -8.506 -15.785 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -2.876 -9.569 -16.852 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -3.501 -8.288 -15.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -4.382 -7.316 -17.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -2.864 -7.207 -18.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -3.826 -8.589 -18.592 1.00 0.00 H new ATOM 2072 N ALA A 133 -2.352 -4.833 -11.971 1.00 0.00 N ATOM 2073 CA ALA A 133 -3.320 -4.547 -10.930 1.00 0.00 C ATOM 2074 C ALA A 133 -3.536 -3.049 -10.844 1.00 0.00 C ATOM 2075 O ALA A 133 -4.676 -2.572 -10.872 1.00 0.00 O ATOM 2076 CB ALA A 133 -2.836 -5.088 -9.581 1.00 0.00 C ATOM 0 H ALA A 133 -1.487 -5.268 -11.650 1.00 0.00 H new ATOM 0 HA ALA A 133 -4.262 -5.037 -11.176 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.576 -4.864 -8.812 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.700 -6.167 -9.650 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -1.888 -4.618 -9.320 1.00 0.00 H new ATOM 2082 N ALA A 134 -2.447 -2.293 -10.769 1.00 0.00 N ATOM 2083 CA ALA A 134 -2.571 -0.860 -10.709 1.00 0.00 C ATOM 2084 C ALA A 134 -3.316 -0.403 -11.936 1.00 0.00 C ATOM 2085 O ALA A 134 -4.260 0.377 -11.850 1.00 0.00 O ATOM 2086 CB ALA A 134 -1.191 -0.206 -10.658 1.00 0.00 C ATOM 0 H ALA A 134 -1.491 -2.648 -10.749 1.00 0.00 H new ATOM 0 HA ALA A 134 -3.113 -0.571 -9.808 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -1.303 0.877 -10.613 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -0.657 -0.553 -9.773 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -0.627 -0.476 -11.551 1.00 0.00 H new ATOM 2092 N GLY A 135 -2.916 -0.931 -13.083 1.00 0.00 N ATOM 2093 CA GLY A 135 -3.599 -0.578 -14.305 1.00 0.00 C ATOM 2094 C GLY A 135 -5.071 -0.908 -14.145 1.00 0.00 C ATOM 2095 O GLY A 135 -5.943 -0.067 -14.357 1.00 0.00 O ATOM 0 H GLY A 135 -2.142 -1.588 -13.188 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -3.470 0.483 -14.519 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -3.177 -1.127 -15.147 1.00 0.00 H new ATOM 2099 N ALA A 136 -5.329 -2.151 -13.763 1.00 0.00 N ATOM 2100 CA ALA A 136 -6.688 -2.616 -13.561 1.00 0.00 C ATOM 2101 C ALA A 136 -7.406 -1.709 -12.576 1.00 0.00 C ATOM 2102 O ALA A 136 -8.636 -1.721 -12.494 1.00 0.00 O ATOM 2103 CB ALA A 136 -6.679 -4.050 -13.032 1.00 0.00 C ATOM 0 H ALA A 136 -4.611 -2.854 -13.587 1.00 0.00 H new ATOM 0 HA ALA A 136 -7.213 -2.593 -14.516 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.704 -4.390 -12.884 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.182 -4.700 -13.752 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.145 -4.084 -12.083 1.00 0.00 H new ATOM 2109 N ARG A 137 -6.634 -0.905 -11.848 1.00 0.00 N ATOM 2110 CA ARG A 137 -7.209 0.034 -10.888 1.00 0.00 C ATOM 2111 C ARG A 137 -6.912 1.470 -11.324 1.00 0.00 C ATOM 2112 O ARG A 137 -7.297 2.428 -10.654 1.00 0.00 O ATOM 2113 CB ARG A 137 -6.629 -0.215 -9.496 1.00 0.00 C ATOM 2114 CG ARG A 137 -7.684 -0.892 -8.614 1.00 0.00 C ATOM 2115 CD ARG A 137 -8.170 -2.177 -9.290 1.00 0.00 C ATOM 2116 NE ARG A 137 -9.475 -1.959 -9.908 1.00 0.00 N ATOM 2117 CZ ARG A 137 -10.287 -2.975 -10.175 1.00 0.00 C ATOM 2118 NH1 ARG A 137 -11.446 -2.753 -10.733 1.00 0.00 N ATOM 2119 NH2 ARG A 137 -9.929 -4.195 -9.879 1.00 0.00 N ATOM 0 H ARG A 137 -5.616 -0.885 -11.904 1.00 0.00 H new ATOM 0 HA ARG A 137 -8.288 -0.114 -10.853 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -5.742 -0.844 -9.568 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -6.316 0.728 -9.047 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -7.262 -1.121 -7.635 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -8.523 -0.216 -8.449 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -7.450 -2.494 -10.045 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -8.237 -2.980 -8.556 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.768 -1.010 -10.139 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -11.727 -1.800 -10.963 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -12.071 -3.533 -10.939 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -9.024 -4.369 -9.442 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -10.554 -4.974 -10.085 1.00 0.00 H new ATOM 2133 N GLY A 138 -6.234 1.602 -12.465 1.00 0.00 N ATOM 2134 CA GLY A 138 -5.897 2.919 -13.001 1.00 0.00 C ATOM 2135 C GLY A 138 -4.881 3.629 -12.119 1.00 0.00 C ATOM 2136 O GLY A 138 -4.946 4.843 -11.934 1.00 0.00 O ATOM 0 H GLY A 138 -5.910 0.818 -13.032 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -5.496 2.812 -14.009 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.800 3.524 -13.080 1.00 0.00 H new ATOM 2140 N LEU A 139 -3.941 2.858 -11.586 1.00 0.00 N ATOM 2141 CA LEU A 139 -2.900 3.401 -10.726 1.00 0.00 C ATOM 2142 C LEU A 139 -1.527 3.012 -11.265 1.00 0.00 C ATOM 2143 O LEU A 139 -0.544 2.970 -10.527 1.00 0.00 O ATOM 2144 CB LEU A 139 -3.072 2.866 -9.301 1.00 0.00 C ATOM 2145 CG LEU A 139 -4.504 3.131 -8.819 1.00 0.00 C ATOM 2146 CD1 LEU A 139 -4.730 2.438 -7.476 1.00 0.00 C ATOM 2147 CD2 LEU A 139 -4.735 4.636 -8.653 1.00 0.00 C ATOM 0 H LEU A 139 -3.879 1.851 -11.736 1.00 0.00 H new ATOM 0 HA LEU A 139 -2.981 4.488 -10.710 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -2.861 1.797 -9.276 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -2.358 3.347 -8.633 1.00 0.00 H new ATOM 0 HG LEU A 139 -5.202 2.739 -9.559 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -5.748 2.628 -7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -4.580 1.365 -7.591 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -4.024 2.827 -6.743 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -5.755 4.812 -8.311 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -4.033 5.033 -7.920 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -4.582 5.135 -9.610 1.00 0.00 H new ATOM 2159 N SER A 140 -1.474 2.722 -12.560 1.00 0.00 N ATOM 2160 CA SER A 140 -0.215 2.338 -13.194 1.00 0.00 C ATOM 2161 C SER A 140 0.473 3.554 -13.807 1.00 0.00 C ATOM 2162 O SER A 140 1.261 3.424 -14.744 1.00 0.00 O ATOM 2163 CB SER A 140 -0.475 1.293 -14.280 1.00 0.00 C ATOM 2164 OG SER A 140 -1.256 1.875 -15.313 1.00 0.00 O ATOM 0 H SER A 140 -2.278 2.744 -13.187 1.00 0.00 H new ATOM 0 HA SER A 140 0.438 1.914 -12.431 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.470 0.928 -14.684 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.994 0.433 -13.857 1.00 0.00 H new ATOM 0 HG SER A 140 -1.423 1.208 -16.012 1.00 0.00 H new ATOM 2170 N THR A 141 0.175 4.731 -13.268 1.00 0.00 N ATOM 2171 CA THR A 141 0.775 5.963 -13.767 1.00 0.00 C ATOM 2172 C THR A 141 0.935 6.975 -12.637 1.00 0.00 C ATOM 2173 O THR A 141 1.208 8.152 -12.879 1.00 0.00 O ATOM 2174 CB THR A 141 -0.104 6.563 -14.868 1.00 0.00 C ATOM 2175 OG1 THR A 141 -1.472 6.406 -14.517 1.00 0.00 O ATOM 2176 CG2 THR A 141 0.168 5.850 -16.195 1.00 0.00 C ATOM 0 H THR A 141 -0.474 4.858 -12.491 1.00 0.00 H new ATOM 0 HA THR A 141 1.759 5.728 -14.174 1.00 0.00 H new ATOM 0 HB THR A 141 0.127 7.623 -14.977 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.568 6.460 -13.543 1.00 0.00 H new ATOM 0 HG21 THR A 141 -0.460 6.281 -16.975 1.00 0.00 H new ATOM 0 HG22 THR A 141 1.217 5.972 -16.465 1.00 0.00 H new ATOM 0 HG23 THR A 141 -0.059 4.789 -16.091 1.00 0.00 H new ATOM 2184 N GLU A 142 0.759 6.514 -11.402 1.00 0.00 N ATOM 2185 CA GLU A 142 0.885 7.394 -10.244 1.00 0.00 C ATOM 2186 C GLU A 142 2.351 7.668 -9.931 1.00 0.00 C ATOM 2187 O GLU A 142 3.130 8.027 -10.813 1.00 0.00 O ATOM 2188 CB GLU A 142 0.215 6.762 -9.018 1.00 0.00 C ATOM 2189 CG GLU A 142 -1.109 6.114 -9.416 1.00 0.00 C ATOM 2190 CD GLU A 142 -1.743 6.856 -10.591 1.00 0.00 C ATOM 2191 OE1 GLU A 142 -2.157 7.986 -10.403 1.00 0.00 O ATOM 2192 OE2 GLU A 142 -1.802 6.279 -11.665 1.00 0.00 O ATOM 0 H GLU A 142 0.531 5.545 -11.178 1.00 0.00 H new ATOM 0 HA GLU A 142 0.390 8.336 -10.483 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.876 6.015 -8.578 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.042 7.523 -8.257 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -0.942 5.071 -9.686 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.791 6.118 -8.566 1.00 0.00 H new ATOM 2199 N SER A 143 2.719 7.493 -8.665 1.00 0.00 N ATOM 2200 CA SER A 143 4.098 7.722 -8.240 1.00 0.00 C ATOM 2201 C SER A 143 4.980 6.526 -8.563 1.00 0.00 C ATOM 2202 O SER A 143 6.142 6.692 -8.931 1.00 0.00 O ATOM 2203 CB SER A 143 4.160 7.964 -6.738 1.00 0.00 C ATOM 2204 OG SER A 143 4.267 9.359 -6.482 1.00 0.00 O ATOM 0 H SER A 143 2.088 7.196 -7.920 1.00 0.00 H new ATOM 0 HA SER A 143 4.459 8.598 -8.780 1.00 0.00 H new ATOM 0 HB2 SER A 143 3.267 7.564 -6.258 1.00 0.00 H new ATOM 0 HB3 SER A 143 5.014 7.439 -6.310 1.00 0.00 H new ATOM 0 HG SER A 143 3.845 9.567 -5.622 1.00 0.00 H new ATOM 2210 N ILE A 144 4.440 5.318 -8.417 1.00 0.00 N ATOM 2211 CA ILE A 144 5.207 4.114 -8.688 1.00 0.00 C ATOM 2212 C ILE A 144 6.617 4.217 -8.165 1.00 0.00 C ATOM 2213 O ILE A 144 7.536 4.647 -8.863 1.00 0.00 O ATOM 2214 CB ILE A 144 5.225 3.810 -10.177 1.00 0.00 C ATOM 2215 CG1 ILE A 144 3.807 3.919 -10.738 1.00 0.00 C ATOM 2216 CG2 ILE A 144 5.762 2.396 -10.409 1.00 0.00 C ATOM 2217 CD1 ILE A 144 2.842 3.115 -9.868 1.00 0.00 C ATOM 0 H ILE A 144 3.480 5.152 -8.114 1.00 0.00 H new ATOM 0 HA ILE A 144 4.714 3.295 -8.164 1.00 0.00 H new ATOM 0 HB ILE A 144 5.871 4.527 -10.683 1.00 0.00 H new ATOM 0 HG12 ILE A 144 3.498 4.964 -10.770 1.00 0.00 H new ATOM 0 HG13 ILE A 144 3.782 3.548 -11.763 1.00 0.00 H new ATOM 0 HG21 ILE A 144 5.773 2.182 -11.478 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.775 2.322 -10.013 1.00 0.00 H new ATOM 0 HG23 ILE A 144 5.121 1.675 -9.901 1.00 0.00 H new ATOM 0 HD11 ILE A 144 1.833 3.196 -10.273 1.00 0.00 H new ATOM 0 HD12 ILE A 144 3.146 2.068 -9.859 1.00 0.00 H new ATOM 0 HD13 ILE A 144 2.857 3.506 -8.851 1.00 0.00 H new ATOM 2229 N LEU A 145 6.771 3.763 -6.936 1.00 0.00 N ATOM 2230 CA LEU A 145 8.073 3.737 -6.293 1.00 0.00 C ATOM 2231 C LEU A 145 8.496 2.295 -6.077 1.00 0.00 C ATOM 2232 O LEU A 145 7.801 1.526 -5.412 1.00 0.00 O ATOM 2233 CB LEU A 145 8.039 4.460 -4.940 1.00 0.00 C ATOM 2234 CG LEU A 145 9.459 4.476 -4.301 1.00 0.00 C ATOM 2235 CD1 LEU A 145 10.249 5.671 -4.838 1.00 0.00 C ATOM 2236 CD2 LEU A 145 9.378 4.598 -2.772 1.00 0.00 C ATOM 0 H LEU A 145 6.009 3.406 -6.360 1.00 0.00 H new ATOM 0 HA LEU A 145 8.785 4.250 -6.940 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.681 5.481 -5.074 1.00 0.00 H new ATOM 0 HB3 LEU A 145 7.337 3.962 -4.271 1.00 0.00 H new ATOM 0 HG LEU A 145 9.953 3.539 -4.559 1.00 0.00 H new ATOM 0 HD11 LEU A 145 11.243 5.681 -4.390 1.00 0.00 H new ATOM 0 HD12 LEU A 145 10.340 5.590 -5.921 1.00 0.00 H new ATOM 0 HD13 LEU A 145 9.728 6.595 -4.586 1.00 0.00 H new ATOM 0 HD21 LEU A 145 10.385 4.607 -2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 145 8.867 5.524 -2.507 1.00 0.00 H new ATOM 0 HD23 LEU A 145 8.825 3.750 -2.368 1.00 0.00 H new ATOM 2248 N ILE A 146 9.653 1.953 -6.620 1.00 0.00 N ATOM 2249 CA ILE A 146 10.197 0.614 -6.467 1.00 0.00 C ATOM 2250 C ILE A 146 11.532 0.659 -5.713 1.00 0.00 C ATOM 2251 O ILE A 146 11.832 -0.254 -4.944 1.00 0.00 O ATOM 2252 CB ILE A 146 10.377 -0.061 -7.838 1.00 0.00 C ATOM 2253 CG1 ILE A 146 9.009 -0.194 -8.511 1.00 0.00 C ATOM 2254 CG2 ILE A 146 10.995 -1.456 -7.671 1.00 0.00 C ATOM 2255 CD1 ILE A 146 9.076 0.391 -9.924 1.00 0.00 C ATOM 0 H ILE A 146 10.234 2.585 -7.171 1.00 0.00 H new ATOM 0 HA ILE A 146 9.490 0.023 -5.885 1.00 0.00 H new ATOM 0 HB ILE A 146 11.042 0.548 -8.450 1.00 0.00 H new ATOM 0 HG12 ILE A 146 8.713 -1.242 -8.554 1.00 0.00 H new ATOM 0 HG13 ILE A 146 8.252 0.327 -7.926 1.00 0.00 H new ATOM 0 HG21 ILE A 146 11.116 -1.920 -8.650 1.00 0.00 H new ATOM 0 HG22 ILE A 146 11.969 -1.367 -7.189 1.00 0.00 H new ATOM 0 HG23 ILE A 146 10.340 -2.073 -7.055 1.00 0.00 H new ATOM 0 HD11 ILE A 146 8.102 0.296 -10.404 1.00 0.00 H new ATOM 0 HD12 ILE A 146 9.353 1.444 -9.869 1.00 0.00 H new ATOM 0 HD13 ILE A 146 9.821 -0.150 -10.507 1.00 0.00 H new ATOM 2267 N PRO A 147 12.344 1.680 -5.904 1.00 0.00 N ATOM 2268 CA PRO A 147 13.649 1.783 -5.215 1.00 0.00 C ATOM 2269 C PRO A 147 13.595 2.536 -3.882 1.00 0.00 C ATOM 2270 O PRO A 147 12.595 3.160 -3.528 1.00 0.00 O ATOM 2271 CB PRO A 147 14.494 2.545 -6.227 1.00 0.00 C ATOM 2272 CG PRO A 147 13.539 3.464 -6.917 1.00 0.00 C ATOM 2273 CD PRO A 147 12.141 2.845 -6.790 1.00 0.00 C ATOM 0 HA PRO A 147 14.035 0.802 -4.938 1.00 0.00 H new ATOM 0 HB2 PRO A 147 15.292 3.102 -5.735 1.00 0.00 H new ATOM 0 HB3 PRO A 147 14.969 1.866 -6.935 1.00 0.00 H new ATOM 0 HG2 PRO A 147 13.563 4.455 -6.464 1.00 0.00 H new ATOM 0 HG3 PRO A 147 13.812 3.586 -7.965 1.00 0.00 H new ATOM 0 HD2 PRO A 147 11.429 3.552 -6.363 1.00 0.00 H new ATOM 0 HD3 PRO A 147 11.748 2.544 -7.761 1.00 0.00 H new ATOM 2281 N ARG A 148 14.712 2.421 -3.175 1.00 0.00 N ATOM 2282 CA ARG A 148 14.962 3.011 -1.876 1.00 0.00 C ATOM 2283 C ARG A 148 14.244 2.224 -0.805 1.00 0.00 C ATOM 2284 O ARG A 148 13.086 2.470 -0.467 1.00 0.00 O ATOM 2285 CB ARG A 148 14.638 4.513 -1.833 1.00 0.00 C ATOM 2286 CG ARG A 148 15.891 5.321 -2.192 1.00 0.00 C ATOM 2287 CD ARG A 148 16.190 5.178 -3.684 1.00 0.00 C ATOM 2288 NE ARG A 148 15.077 5.706 -4.469 1.00 0.00 N ATOM 2289 CZ ARG A 148 15.271 6.251 -5.667 1.00 0.00 C ATOM 2290 NH1 ARG A 148 14.259 6.742 -6.330 1.00 0.00 N ATOM 2291 NH2 ARG A 148 16.468 6.286 -6.187 1.00 0.00 N ATOM 0 H ARG A 148 15.509 1.883 -3.516 1.00 0.00 H new ATOM 0 HA ARG A 148 16.032 2.950 -1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 148 13.833 4.742 -2.532 1.00 0.00 H new ATOM 0 HB3 ARG A 148 14.286 4.791 -0.839 1.00 0.00 H new ATOM 0 HG2 ARG A 148 15.742 6.371 -1.941 1.00 0.00 H new ATOM 0 HG3 ARG A 148 16.741 4.971 -1.606 1.00 0.00 H new ATOM 0 HD2 ARG A 148 17.107 5.712 -3.932 1.00 0.00 H new ATOM 0 HD3 ARG A 148 16.355 4.129 -3.931 1.00 0.00 H new ATOM 0 HE ARG A 148 14.131 5.656 -4.091 1.00 0.00 H new ATOM 0 HH11 ARG A 148 13.322 6.707 -5.929 1.00 0.00 H new ATOM 0 HH12 ARG A 148 14.406 7.160 -7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 148 17.258 5.895 -5.675 1.00 0.00 H new ATOM 0 HH22 ARG A 148 16.613 6.705 -7.106 1.00 0.00 H new ATOM 2305 N GLN A 149 14.982 1.247 -0.298 1.00 0.00 N ATOM 2306 CA GLN A 149 14.489 0.351 0.734 1.00 0.00 C ATOM 2307 C GLN A 149 15.350 0.489 1.985 1.00 0.00 C ATOM 2308 O GLN A 149 15.807 -0.505 2.549 1.00 0.00 O ATOM 2309 CB GLN A 149 14.546 -1.106 0.250 1.00 0.00 C ATOM 2310 CG GLN A 149 13.861 -1.254 -1.116 1.00 0.00 C ATOM 2311 CD GLN A 149 12.372 -1.529 -0.933 1.00 0.00 C ATOM 2312 OE1 GLN A 149 11.503 -0.694 -1.429 1.00 0.00 O flip ATOM 2313 NE2 GLN A 149 11.994 -2.528 -0.322 1.00 0.00 N flip ATOM 0 H GLN A 149 15.940 1.054 -0.592 1.00 0.00 H new ATOM 0 HA GLN A 149 13.456 0.616 0.959 1.00 0.00 H new ATOM 0 HB2 GLN A 149 15.584 -1.430 0.178 1.00 0.00 H new ATOM 0 HB3 GLN A 149 14.059 -1.755 0.978 1.00 0.00 H new ATOM 0 HG2 GLN A 149 14.001 -0.345 -1.701 1.00 0.00 H new ATOM 0 HG3 GLN A 149 14.322 -2.068 -1.676 1.00 0.00 H new ATOM 0 HE21 GLN A 149 12.678 -3.179 0.064 1.00 0.00 H new ATOM 0 HE22 GLN A 149 10.997 -2.705 -0.202 1.00 0.00 H new ATOM 2322 N SER A 150 15.579 1.728 2.404 1.00 0.00 N ATOM 2323 CA SER A 150 16.401 1.988 3.580 1.00 0.00 C ATOM 2324 C SER A 150 15.934 1.148 4.763 1.00 0.00 C ATOM 2325 O SER A 150 15.001 1.525 5.470 1.00 0.00 O ATOM 2326 CB SER A 150 16.332 3.470 3.948 1.00 0.00 C ATOM 2327 OG SER A 150 16.211 3.599 5.358 1.00 0.00 O ATOM 0 H SER A 150 15.210 2.564 1.950 1.00 0.00 H new ATOM 0 HA SER A 150 17.430 1.718 3.343 1.00 0.00 H new ATOM 0 HB2 SER A 150 17.227 3.985 3.600 1.00 0.00 H new ATOM 0 HB3 SER A 150 15.482 3.940 3.454 1.00 0.00 H new ATOM 0 HG SER A 150 15.347 3.238 5.647 1.00 0.00 H new ATOM 2333 N GLU A 151 16.584 0.006 4.972 1.00 0.00 N ATOM 2334 CA GLU A 151 16.217 -0.882 6.072 1.00 0.00 C ATOM 2335 C GLU A 151 16.362 -0.187 7.423 1.00 0.00 C ATOM 2336 O GLU A 151 16.203 -0.815 8.470 1.00 0.00 O ATOM 2337 CB GLU A 151 17.099 -2.132 6.046 1.00 0.00 C ATOM 2338 CG GLU A 151 17.020 -2.786 4.666 1.00 0.00 C ATOM 2339 CD GLU A 151 18.337 -2.589 3.922 1.00 0.00 C ATOM 2340 OE1 GLU A 151 19.261 -3.340 4.185 1.00 0.00 O ATOM 2341 OE2 GLU A 151 18.401 -1.690 3.099 1.00 0.00 O ATOM 0 H GLU A 151 17.361 -0.324 4.400 1.00 0.00 H new ATOM 0 HA GLU A 151 15.171 -1.161 5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 151 18.131 -1.866 6.275 1.00 0.00 H new ATOM 0 HB3 GLU A 151 16.773 -2.835 6.812 1.00 0.00 H new ATOM 0 HG2 GLU A 151 16.807 -3.850 4.770 1.00 0.00 H new ATOM 0 HG3 GLU A 151 16.201 -2.351 4.094 1.00 0.00 H new ATOM 2348 N THR A 152 16.664 1.105 7.398 1.00 0.00 N ATOM 2349 CA THR A 152 16.826 1.861 8.628 1.00 0.00 C ATOM 2350 C THR A 152 16.370 3.303 8.436 1.00 0.00 C ATOM 2351 O THR A 152 17.061 4.098 7.796 1.00 0.00 O ATOM 2352 CB THR A 152 18.293 1.842 9.060 1.00 0.00 C ATOM 2353 OG1 THR A 152 19.079 2.511 8.084 1.00 0.00 O ATOM 2354 CG2 THR A 152 18.767 0.395 9.198 1.00 0.00 C ATOM 0 H THR A 152 16.800 1.646 6.544 1.00 0.00 H new ATOM 0 HA THR A 152 16.212 1.399 9.401 1.00 0.00 H new ATOM 0 HB THR A 152 18.398 2.348 10.020 1.00 0.00 H new ATOM 0 HG1 THR A 152 18.656 3.364 7.852 1.00 0.00 H new ATOM 0 HG21 THR A 152 19.813 0.382 9.506 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.162 -0.116 9.947 1.00 0.00 H new ATOM 0 HG23 THR A 152 18.665 -0.114 8.240 1.00 0.00 H new ATOM 2362 N CYS A 153 15.208 3.631 8.995 1.00 0.00 N ATOM 2363 CA CYS A 153 14.664 4.980 8.886 1.00 0.00 C ATOM 2364 C CYS A 153 15.777 6.018 8.971 1.00 0.00 C ATOM 2365 O CYS A 153 16.403 6.187 10.018 1.00 0.00 O ATOM 2366 CB CYS A 153 13.659 5.219 10.013 1.00 0.00 C ATOM 2367 SG CYS A 153 13.011 6.903 9.896 1.00 0.00 S ATOM 0 H CYS A 153 14.627 2.983 9.526 1.00 0.00 H new ATOM 0 HA CYS A 153 14.168 5.077 7.920 1.00 0.00 H new ATOM 0 HB2 CYS A 153 12.844 4.499 9.946 1.00 0.00 H new ATOM 0 HB3 CYS A 153 14.139 5.069 10.980 1.00 0.00 H new ATOM 2372 N SER A 154 16.025 6.709 7.863 1.00 0.00 N ATOM 2373 CA SER A 154 17.073 7.722 7.827 1.00 0.00 C ATOM 2374 C SER A 154 16.648 8.902 6.944 1.00 0.00 C ATOM 2375 O SER A 154 16.597 8.762 5.722 1.00 0.00 O ATOM 2376 CB SER A 154 18.356 7.110 7.267 1.00 0.00 C ATOM 2377 OG SER A 154 18.714 5.974 8.044 1.00 0.00 O ATOM 0 H SER A 154 15.519 6.588 6.985 1.00 0.00 H new ATOM 0 HA SER A 154 17.246 8.082 8.841 1.00 0.00 H new ATOM 0 HB2 SER A 154 18.210 6.821 6.226 1.00 0.00 H new ATOM 0 HB3 SER A 154 19.161 7.845 7.285 1.00 0.00 H new ATOM 0 HG SER A 154 18.080 5.247 7.871 1.00 0.00 H new ATOM 2383 N PRO A 155 16.338 10.054 7.508 1.00 0.00 N ATOM 2384 CA PRO A 155 15.916 11.231 6.702 1.00 0.00 C ATOM 2385 C PRO A 155 17.107 11.946 6.068 1.00 0.00 C ATOM 2386 O PRO A 155 18.258 11.673 6.406 1.00 0.00 O ATOM 2387 CB PRO A 155 15.209 12.128 7.716 1.00 0.00 C ATOM 2388 CG PRO A 155 15.824 11.803 9.037 1.00 0.00 C ATOM 2389 CD PRO A 155 16.355 10.369 8.950 1.00 0.00 C ATOM 0 HA PRO A 155 15.279 10.951 5.863 1.00 0.00 H new ATOM 0 HB2 PRO A 155 15.344 13.181 7.469 1.00 0.00 H new ATOM 0 HB3 PRO A 155 14.136 11.938 7.726 1.00 0.00 H new ATOM 0 HG2 PRO A 155 16.631 12.499 9.267 1.00 0.00 H new ATOM 0 HG3 PRO A 155 15.088 11.893 9.836 1.00 0.00 H new ATOM 0 HD2 PRO A 155 17.362 10.293 9.361 1.00 0.00 H new ATOM 0 HD3 PRO A 155 15.728 9.679 9.514 1.00 0.00 H new ATOM 2397 N GLY A 156 16.820 12.858 5.146 1.00 0.00 N ATOM 2398 CA GLY A 156 17.876 13.601 4.471 1.00 0.00 C ATOM 2399 C GLY A 156 18.306 14.810 5.295 1.00 0.00 C ATOM 2400 O GLY A 156 19.093 14.686 6.232 1.00 0.00 O ATOM 0 H GLY A 156 15.874 13.099 4.851 1.00 0.00 H new ATOM 0 HA2 GLY A 156 18.733 12.949 4.301 1.00 0.00 H new ATOM 0 HA3 GLY A 156 17.526 13.929 3.492 1.00 0.00 H new ATOM 2404 N SER A 157 17.783 15.979 4.938 1.00 0.00 N ATOM 2405 CA SER A 157 18.122 17.206 5.651 1.00 0.00 C ATOM 2406 C SER A 157 17.990 17.005 7.157 1.00 0.00 C ATOM 2407 O SER A 157 16.908 16.704 7.662 1.00 0.00 O ATOM 2408 CB SER A 157 17.198 18.339 5.204 1.00 0.00 C ATOM 2409 OG SER A 157 17.849 19.585 5.417 1.00 0.00 O ATOM 0 H SER A 157 17.128 16.103 4.166 1.00 0.00 H new ATOM 0 HA SER A 157 19.155 17.465 5.420 1.00 0.00 H new ATOM 0 HB2 SER A 157 16.944 18.223 4.150 1.00 0.00 H new ATOM 0 HB3 SER A 157 16.263 18.304 5.763 1.00 0.00 H new ATOM 0 HG SER A 157 17.261 20.315 5.130 1.00 0.00 H new ATOM 2415 N ASP A 158 19.099 17.172 7.870 1.00 0.00 N ATOM 2416 CA ASP A 158 19.097 17.008 9.320 1.00 0.00 C ATOM 2417 C ASP A 158 20.088 17.967 9.970 1.00 0.00 C ATOM 2418 O ASP A 158 20.645 18.785 9.257 1.00 0.00 O ATOM 2419 CB ASP A 158 19.466 15.567 9.682 1.00 0.00 C ATOM 2420 CG ASP A 158 20.983 15.427 9.778 1.00 0.00 C ATOM 2421 OD1 ASP A 158 21.647 15.714 8.795 1.00 0.00 O ATOM 2422 OD2 ASP A 158 21.456 15.035 10.831 1.00 0.00 O ATOM 2423 OXT ASP A 158 20.274 17.871 11.172 1.00 0.00 O ATOM 0 H ASP A 158 20.005 17.419 7.471 1.00 0.00 H new ATOM 0 HA ASP A 158 18.097 17.232 9.691 1.00 0.00 H new ATOM 0 HB2 ASP A 158 19.006 15.292 10.631 1.00 0.00 H new ATOM 0 HB3 ASP A 158 19.076 14.882 8.929 1.00 0.00 H new TER 2428 ASP A 158