USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 939 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 55 HIS : no HE2:sc= -1.28! C(o=-0.83!,f=-6.1!) USER MOD Set 1.2: A 57 HIS : no HE2:sc= 0.445 K(o=-0.83,f=-8.1!) USER MOD Set 2.1: A 41 HIS : no HE2:sc= -2.93 K(o=-4.9,f=-3.9!) USER MOD Set 2.2: A 43 ASN : amide:sc= -2.02! C(o=-4.9!,f=-7.4!) USER MOD Set 3.1: A 16 MET CE :methyl -162:sc= -3.74 (180deg=-3.92) USER MOD Set 3.2: A 20 SER OG : rot 62:sc= 0.941 USER MOD Set 4.1: A 13 GLN : amide:sc= 0.0953 K(o=-0.33,f=-2.5!) USER MOD Set 4.2: A 14 GLN : amide:sc= -0.429 X(o=-0.33,f=-0.51) USER MOD Single : A 1 GLY N :NH3+ -150:sc= -0.484 (180deg=-1.32) USER MOD Single : A 2 GLN : amide:sc= -0.606 K(o=-0.61,f=0) USER MOD Single : A 4 GLN : amide:sc= 0.412 X(o=0.41,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0.0694 USER MOD Single : A 11 ASN : amide:sc= -0.042 K(o=-0.042,f=-0.76) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 37 THR OG1 : rot 46:sc= 0.225 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -2.23 K(o=-2.2,f=-8.6!) USER MOD Single : A 46 TYR OH : rot 81:sc= 1.18 USER MOD Single : A 47 ASN : amide:sc= -1.82! X(o=-1.8!,f=-1.6) USER MOD Single : A 49 TYR OH : rot 180:sc=-0.00821 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 HIS : no HD1:sc= -0.0534 X(o=-0.053,f=0) USER MOD Single : A 58 MET CE :methyl 160:sc= -1.9 (180deg=-4.44!) USER MOD Single : A 59 ASN : amide:sc= -2.62! K(o=-2.6!,f=-0.065) USER MOD Single : A 61 THR OG1 : rot -73:sc= 1.33 USER MOD Single : A 62 GLN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot -65:sc= 0.942 USER MOD Single : A 70 THR OG1 : rot -105:sc= 0.364 USER MOD Single : A 71 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0927) USER MOD Single : A 79 CYS SG : rot -120:sc= -2.17 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -119:sc= 1.13 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 177:sc= 1.25 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.227 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -1.43 K(o=-1.4,f=-0.6) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -139:sc= -0.332 (180deg=-1.29) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.088 13.275 5.213 1.00 0.00 N ATOM 2 CA GLY A 1 -0.250 13.674 5.588 1.00 0.00 C ATOM 3 C GLY A 1 -0.698 14.808 4.727 1.00 0.00 C ATOM 4 O GLY A 1 -1.886 15.003 4.492 1.00 0.00 O ATOM 0 H1 GLY A 1 1.212 12.259 5.399 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.235 13.462 4.201 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.780 13.816 5.769 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.934 12.832 5.482 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.271 13.971 6.637 1.00 0.00 H new ATOM 8 N GLN A 2 0.288 15.588 4.229 1.00 0.00 N ATOM 9 CA GLN A 2 0.113 16.719 3.336 1.00 0.00 C ATOM 10 C GLN A 2 0.941 16.491 2.081 1.00 0.00 C ATOM 11 O GLN A 2 2.065 15.981 2.132 1.00 0.00 O ATOM 12 CB GLN A 2 0.556 18.084 3.960 1.00 0.00 C ATOM 13 CG GLN A 2 -0.320 18.532 5.161 1.00 0.00 C ATOM 14 CD GLN A 2 0.053 19.896 5.773 1.00 0.00 C ATOM 15 OE1 GLN A 2 -0.493 20.300 6.804 1.00 0.00 O ATOM 16 NE2 GLN A 2 0.988 20.638 5.128 1.00 0.00 N ATOM 0 H GLN A 2 1.268 15.425 4.460 1.00 0.00 H new ATOM 0 HA GLN A 2 -0.954 16.783 3.124 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.593 18.005 4.287 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.522 18.854 3.189 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -1.360 18.569 4.837 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -0.256 17.772 5.940 1.00 0.00 H new ATOM 0 HE21 GLN A 2 1.424 20.282 4.278 1.00 0.00 H new ATOM 0 HE22 GLN A 2 1.255 21.552 5.493 1.00 0.00 H new ATOM 25 N ARG A 3 0.381 16.949 0.930 1.00 0.00 N ATOM 26 CA ARG A 3 0.921 17.093 -0.422 1.00 0.00 C ATOM 27 C ARG A 3 1.790 16.009 -1.062 1.00 0.00 C ATOM 28 O ARG A 3 1.384 15.374 -2.031 1.00 0.00 O ATOM 29 CB ARG A 3 1.584 18.496 -0.504 1.00 0.00 C ATOM 30 CG ARG A 3 0.558 19.639 -0.510 1.00 0.00 C ATOM 31 CD ARG A 3 1.204 21.017 -0.705 1.00 0.00 C ATOM 32 NE ARG A 3 0.116 22.057 -0.705 1.00 0.00 N ATOM 33 CZ ARG A 3 0.353 23.387 -0.934 1.00 0.00 C ATOM 34 NH1 ARG A 3 1.617 23.842 -1.174 1.00 0.00 N ATOM 35 NH2 ARG A 3 -0.691 24.267 -0.921 1.00 0.00 N ATOM 0 H ARG A 3 -0.589 17.264 0.947 1.00 0.00 H new ATOM 0 HA ARG A 3 0.045 16.959 -1.056 1.00 0.00 H new ATOM 0 HB2 ARG A 3 2.259 18.624 0.342 1.00 0.00 H new ATOM 0 HB3 ARG A 3 2.191 18.554 -1.407 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -0.166 19.467 -1.306 1.00 0.00 H new ATOM 0 HG3 ARG A 3 0.007 19.631 0.430 1.00 0.00 H new ATOM 0 HD2 ARG A 3 1.919 21.217 0.093 1.00 0.00 H new ATOM 0 HD3 ARG A 3 1.757 21.047 -1.644 1.00 0.00 H new ATOM 0 HE ARG A 3 -0.843 21.758 -0.526 1.00 0.00 H new ATOM 0 HH11 ARG A 3 2.401 23.189 -1.185 1.00 0.00 H new ATOM 0 HH12 ARG A 3 1.778 24.835 -1.343 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -1.638 23.932 -0.742 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -0.524 25.259 -1.090 1.00 0.00 H new ATOM 49 N GLN A 4 3.014 15.778 -0.520 1.00 0.00 N ATOM 50 CA GLN A 4 3.985 14.765 -0.932 1.00 0.00 C ATOM 51 C GLN A 4 3.630 13.399 -0.363 1.00 0.00 C ATOM 52 O GLN A 4 3.964 12.367 -0.948 1.00 0.00 O ATOM 53 CB GLN A 4 5.409 15.159 -0.426 1.00 0.00 C ATOM 54 CG GLN A 4 6.578 14.173 -0.703 1.00 0.00 C ATOM 55 CD GLN A 4 6.800 13.924 -2.192 1.00 0.00 C ATOM 56 OE1 GLN A 4 7.512 14.678 -2.854 1.00 0.00 O ATOM 57 NE2 GLN A 4 6.194 12.838 -2.735 1.00 0.00 N ATOM 0 H GLN A 4 3.357 16.335 0.263 1.00 0.00 H new ATOM 0 HA GLN A 4 3.969 14.712 -2.021 1.00 0.00 H new ATOM 0 HB2 GLN A 4 5.669 16.119 -0.872 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.350 15.314 0.651 1.00 0.00 H new ATOM 0 HG2 GLN A 4 7.494 14.570 -0.265 1.00 0.00 H new ATOM 0 HG3 GLN A 4 6.373 13.224 -0.207 1.00 0.00 H new ATOM 0 HE21 GLN A 4 5.611 12.236 -2.154 1.00 0.00 H new ATOM 0 HE22 GLN A 4 6.322 12.624 -3.724 1.00 0.00 H new ATOM 66 N LEU A 5 2.955 13.432 0.830 1.00 0.00 N ATOM 67 CA LEU A 5 2.509 12.337 1.697 1.00 0.00 C ATOM 68 C LEU A 5 3.713 11.773 2.452 1.00 0.00 C ATOM 69 O LEU A 5 3.937 10.572 2.525 1.00 0.00 O ATOM 70 CB LEU A 5 1.607 11.271 0.994 1.00 0.00 C ATOM 71 CG LEU A 5 0.097 11.635 0.903 1.00 0.00 C ATOM 72 CD1 LEU A 5 -0.614 11.431 2.255 1.00 0.00 C ATOM 73 CD2 LEU A 5 -0.196 13.039 0.337 1.00 0.00 C ATOM 0 H LEU A 5 2.692 14.331 1.233 1.00 0.00 H new ATOM 0 HA LEU A 5 1.817 12.746 2.433 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.986 11.107 -0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.705 10.326 1.529 1.00 0.00 H new ATOM 0 HG LEU A 5 -0.313 10.937 0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -1.667 11.695 2.156 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -0.528 10.387 2.557 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -0.150 12.067 3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.273 13.203 0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.271 13.792 0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 5 0.207 13.116 -0.673 1.00 0.00 H new ATOM 85 N LEU A 6 4.542 12.708 2.983 1.00 0.00 N ATOM 86 CA LEU A 6 5.838 12.497 3.608 1.00 0.00 C ATOM 87 C LEU A 6 5.806 12.154 5.102 1.00 0.00 C ATOM 88 O LEU A 6 6.547 11.303 5.590 1.00 0.00 O ATOM 89 CB LEU A 6 6.711 13.722 3.259 1.00 0.00 C ATOM 90 CG LEU A 6 8.252 13.564 3.176 1.00 0.00 C ATOM 91 CD1 LEU A 6 8.923 13.580 4.554 1.00 0.00 C ATOM 92 CD2 LEU A 6 8.715 12.359 2.342 1.00 0.00 C ATOM 0 H LEU A 6 4.287 13.696 2.976 1.00 0.00 H new ATOM 0 HA LEU A 6 6.280 11.587 3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.370 14.103 2.296 1.00 0.00 H new ATOM 0 HB3 LEU A 6 6.501 14.494 3.999 1.00 0.00 H new ATOM 0 HG LEU A 6 8.587 14.449 2.636 1.00 0.00 H new ATOM 0 HD11 LEU A 6 10.000 13.466 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 6 8.711 14.527 5.051 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.535 12.759 5.157 1.00 0.00 H new ATOM 0 HD21 LEU A 6 9.804 12.319 2.334 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.322 11.441 2.779 1.00 0.00 H new ATOM 0 HD23 LEU A 6 8.348 12.461 1.321 1.00 0.00 H new ATOM 104 N LEU A 7 4.945 12.865 5.885 1.00 0.00 N ATOM 105 CA LEU A 7 4.730 12.693 7.326 1.00 0.00 C ATOM 106 C LEU A 7 5.799 13.200 8.252 1.00 0.00 C ATOM 107 O LEU A 7 5.471 13.763 9.291 1.00 0.00 O ATOM 108 CB LEU A 7 4.193 11.295 7.685 1.00 0.00 C ATOM 109 CG LEU A 7 3.641 11.104 9.112 1.00 0.00 C ATOM 110 CD1 LEU A 7 2.538 12.094 9.524 1.00 0.00 C ATOM 111 CD2 LEU A 7 3.062 9.696 9.184 1.00 0.00 C ATOM 0 H LEU A 7 4.361 13.605 5.496 1.00 0.00 H new ATOM 0 HA LEU A 7 3.931 13.404 7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.401 11.044 6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.996 10.574 7.533 1.00 0.00 H new ATOM 0 HG LEU A 7 4.470 11.280 9.797 1.00 0.00 H new ATOM 0 HD11 LEU A 7 2.217 11.877 10.543 1.00 0.00 H new ATOM 0 HD12 LEU A 7 2.925 13.112 9.475 1.00 0.00 H new ATOM 0 HD13 LEU A 7 1.689 11.996 8.847 1.00 0.00 H new ATOM 0 HD21 LEU A 7 2.659 9.519 10.181 1.00 0.00 H new ATOM 0 HD22 LEU A 7 2.266 9.592 8.447 1.00 0.00 H new ATOM 0 HD23 LEU A 7 3.847 8.969 8.975 1.00 0.00 H new ATOM 123 N ALA A 8 7.090 13.031 7.870 1.00 0.00 N ATOM 124 CA ALA A 8 8.268 13.599 8.500 1.00 0.00 C ATOM 125 C ALA A 8 8.842 12.747 9.629 1.00 0.00 C ATOM 126 O ALA A 8 9.708 13.161 10.395 1.00 0.00 O ATOM 127 CB ALA A 8 7.991 15.078 8.874 1.00 0.00 C ATOM 0 H ALA A 8 7.331 12.456 7.063 1.00 0.00 H new ATOM 0 HA ALA A 8 9.082 13.593 7.775 1.00 0.00 H new ATOM 0 HB1 ALA A 8 8.875 15.505 9.347 1.00 0.00 H new ATOM 0 HB2 ALA A 8 7.753 15.643 7.973 1.00 0.00 H new ATOM 0 HB3 ALA A 8 7.150 15.127 9.566 1.00 0.00 H new ATOM 133 N SER A 9 8.307 11.508 9.706 1.00 0.00 N ATOM 134 CA SER A 9 8.547 10.433 10.651 1.00 0.00 C ATOM 135 C SER A 9 7.591 9.374 10.124 1.00 0.00 C ATOM 136 O SER A 9 7.213 9.458 8.958 1.00 0.00 O ATOM 137 CB SER A 9 8.250 10.824 12.132 1.00 0.00 C ATOM 138 OG SER A 9 8.622 9.796 13.056 1.00 0.00 O ATOM 0 H SER A 9 7.614 11.220 9.015 1.00 0.00 H new ATOM 0 HA SER A 9 9.590 10.120 10.702 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.787 11.740 12.377 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.187 11.039 12.241 1.00 0.00 H new ATOM 0 HG SER A 9 8.419 10.088 13.969 1.00 0.00 H new ATOM 144 N GLU A 10 7.141 8.381 10.927 1.00 0.00 N ATOM 145 CA GLU A 10 6.162 7.380 10.485 1.00 0.00 C ATOM 146 C GLU A 10 4.919 7.386 11.365 1.00 0.00 C ATOM 147 O GLU A 10 4.610 8.353 12.058 1.00 0.00 O ATOM 148 CB GLU A 10 6.702 5.925 10.340 1.00 0.00 C ATOM 149 CG GLU A 10 8.127 5.838 9.762 1.00 0.00 C ATOM 150 CD GLU A 10 8.524 4.373 9.591 1.00 0.00 C ATOM 151 OE1 GLU A 10 8.741 3.947 8.424 1.00 0.00 O ATOM 152 OE2 GLU A 10 8.618 3.659 10.625 1.00 0.00 O ATOM 0 H GLU A 10 7.449 8.258 11.892 1.00 0.00 H new ATOM 0 HA GLU A 10 5.908 7.699 9.474 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.688 5.445 11.318 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.026 5.360 9.698 1.00 0.00 H new ATOM 0 HG2 GLU A 10 8.172 6.352 8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.831 6.340 10.426 1.00 0.00 H new ATOM 159 N ASN A 11 4.167 6.258 11.319 1.00 0.00 N ATOM 160 CA ASN A 11 2.907 5.957 11.984 1.00 0.00 C ATOM 161 C ASN A 11 1.707 6.752 11.441 1.00 0.00 C ATOM 162 O ASN A 11 1.097 7.546 12.160 1.00 0.00 O ATOM 163 CB ASN A 11 3.017 5.991 13.528 1.00 0.00 C ATOM 164 CG ASN A 11 4.094 4.977 13.915 1.00 0.00 C ATOM 165 OD1 ASN A 11 4.093 3.845 13.423 1.00 0.00 O ATOM 166 ND2 ASN A 11 5.057 5.394 14.771 1.00 0.00 N ATOM 0 H ASN A 11 4.473 5.466 10.754 1.00 0.00 H new ATOM 0 HA ASN A 11 2.690 4.921 11.723 1.00 0.00 H new ATOM 0 HB2 ASN A 11 3.283 6.989 13.875 1.00 0.00 H new ATOM 0 HB3 ASN A 11 2.063 5.737 13.990 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.817 4.764 15.030 1.00 0.00 H new ATOM 0 HD22 ASN A 11 5.023 6.338 15.157 1.00 0.00 H new ATOM 173 N PRO A 12 1.323 6.558 10.148 1.00 0.00 N ATOM 174 CA PRO A 12 0.181 7.213 9.501 1.00 0.00 C ATOM 175 C PRO A 12 -1.165 6.633 9.971 1.00 0.00 C ATOM 176 O PRO A 12 -1.864 5.975 9.211 1.00 0.00 O ATOM 177 CB PRO A 12 0.438 6.981 7.996 1.00 0.00 C ATOM 178 CG PRO A 12 1.192 5.651 7.938 1.00 0.00 C ATOM 179 CD PRO A 12 2.032 5.666 9.215 1.00 0.00 C ATOM 0 HA PRO A 12 0.104 8.272 9.749 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -0.496 6.933 7.436 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.027 7.790 7.564 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.509 4.802 7.916 1.00 0.00 H new ATOM 0 HG3 PRO A 12 1.816 5.581 7.047 1.00 0.00 H new ATOM 0 HD2 PRO A 12 2.130 4.663 9.631 1.00 0.00 H new ATOM 0 HD3 PRO A 12 3.040 6.029 9.016 1.00 0.00 H new ATOM 187 N GLN A 13 -1.545 6.921 11.240 1.00 0.00 N ATOM 188 CA GLN A 13 -2.756 6.539 11.957 1.00 0.00 C ATOM 189 C GLN A 13 -3.992 7.281 11.466 1.00 0.00 C ATOM 190 O GLN A 13 -4.997 6.704 11.059 1.00 0.00 O ATOM 191 CB GLN A 13 -2.579 6.809 13.477 1.00 0.00 C ATOM 192 CG GLN A 13 -1.421 6.069 14.198 1.00 0.00 C ATOM 193 CD GLN A 13 -1.247 6.695 15.589 1.00 0.00 C ATOM 194 OE1 GLN A 13 -1.654 7.844 15.797 1.00 0.00 O ATOM 195 NE2 GLN A 13 -0.651 5.960 16.565 1.00 0.00 N ATOM 0 H GLN A 13 -0.939 7.485 11.835 1.00 0.00 H new ATOM 0 HA GLN A 13 -2.909 5.476 11.768 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.433 7.880 13.615 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -3.511 6.547 13.978 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -1.644 5.006 14.285 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -0.498 6.155 13.624 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -0.325 5.015 16.364 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -0.530 6.354 17.498 1.00 0.00 H new ATOM 204 N GLN A 14 -3.879 8.630 11.451 1.00 0.00 N ATOM 205 CA GLN A 14 -4.881 9.602 11.024 1.00 0.00 C ATOM 206 C GLN A 14 -4.911 9.756 9.504 1.00 0.00 C ATOM 207 O GLN A 14 -5.784 10.425 8.958 1.00 0.00 O ATOM 208 CB GLN A 14 -4.634 10.984 11.708 1.00 0.00 C ATOM 209 CG GLN A 14 -5.092 11.079 13.189 1.00 0.00 C ATOM 210 CD GLN A 14 -4.450 10.044 14.117 1.00 0.00 C ATOM 211 OE1 GLN A 14 -5.124 9.139 14.615 1.00 0.00 O ATOM 212 NE2 GLN A 14 -3.120 10.177 14.361 1.00 0.00 N ATOM 0 H GLN A 14 -3.021 9.087 11.761 1.00 0.00 H new ATOM 0 HA GLN A 14 -5.855 9.224 11.336 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -3.569 11.211 11.658 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -5.151 11.753 11.134 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -4.863 12.077 13.564 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -6.175 10.963 13.230 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -2.596 10.939 13.930 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -2.645 9.515 14.975 1.00 0.00 H new ATOM 221 N PHE A 15 -3.949 9.112 8.790 1.00 0.00 N ATOM 222 CA PHE A 15 -3.812 9.107 7.338 1.00 0.00 C ATOM 223 C PHE A 15 -3.908 7.679 6.818 1.00 0.00 C ATOM 224 O PHE A 15 -3.548 7.399 5.676 1.00 0.00 O ATOM 225 CB PHE A 15 -2.515 9.796 6.812 1.00 0.00 C ATOM 226 CG PHE A 15 -2.265 11.066 7.583 1.00 0.00 C ATOM 227 CD1 PHE A 15 -2.986 12.214 7.302 1.00 0.00 C ATOM 228 CD2 PHE A 15 -1.380 11.082 8.647 1.00 0.00 C ATOM 229 CE1 PHE A 15 -2.824 13.352 8.065 1.00 0.00 C ATOM 230 CE2 PHE A 15 -1.228 12.214 9.422 1.00 0.00 C ATOM 231 CZ PHE A 15 -1.946 13.356 9.129 1.00 0.00 C ATOM 0 H PHE A 15 -3.222 8.562 9.248 1.00 0.00 H new ATOM 0 HA PHE A 15 -4.635 9.708 6.951 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.665 9.122 6.918 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -2.615 10.018 5.750 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -3.683 12.219 6.477 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -0.802 10.198 8.873 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.387 14.243 7.828 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.546 12.206 10.259 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.821 14.246 9.728 1.00 0.00 H new ATOM 241 N MET A 16 -4.469 6.736 7.651 1.00 0.00 N ATOM 242 CA MET A 16 -4.762 5.320 7.376 1.00 0.00 C ATOM 243 C MET A 16 -5.919 5.207 6.427 1.00 0.00 C ATOM 244 O MET A 16 -6.003 4.249 5.672 1.00 0.00 O ATOM 245 CB MET A 16 -5.095 4.543 8.693 1.00 0.00 C ATOM 246 CG MET A 16 -5.792 3.142 8.665 1.00 0.00 C ATOM 247 SD MET A 16 -7.637 3.181 8.613 1.00 0.00 S ATOM 248 CE MET A 16 -8.204 1.438 8.565 1.00 0.00 C ATOM 0 H MET A 16 -4.742 6.987 8.601 1.00 0.00 H new ATOM 0 HA MET A 16 -3.873 4.878 6.927 1.00 0.00 H new ATOM 0 HB2 MET A 16 -4.156 4.418 9.233 1.00 0.00 H new ATOM 0 HB3 MET A 16 -5.725 5.197 9.296 1.00 0.00 H new ATOM 0 HG2 MET A 16 -5.432 2.592 7.795 1.00 0.00 H new ATOM 0 HG3 MET A 16 -5.481 2.582 9.547 1.00 0.00 H new ATOM 0 HE1 MET A 16 -9.236 1.401 8.217 1.00 0.00 H new ATOM 0 HE2 MET A 16 -7.571 0.868 7.885 1.00 0.00 H new ATOM 0 HE3 MET A 16 -8.142 1.008 9.565 1.00 0.00 H new ATOM 258 N ASP A 17 -6.823 6.229 6.404 1.00 0.00 N ATOM 259 CA ASP A 17 -7.994 6.360 5.525 1.00 0.00 C ATOM 260 C ASP A 17 -7.657 6.461 4.032 1.00 0.00 C ATOM 261 O ASP A 17 -8.381 5.953 3.182 1.00 0.00 O ATOM 262 CB ASP A 17 -8.872 7.578 5.927 1.00 0.00 C ATOM 263 CG ASP A 17 -9.275 7.455 7.401 1.00 0.00 C ATOM 264 OD1 ASP A 17 -8.863 8.335 8.204 1.00 0.00 O ATOM 265 OD2 ASP A 17 -9.994 6.477 7.739 1.00 0.00 O ATOM 0 H ASP A 17 -6.737 7.022 7.040 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.546 5.431 5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.322 8.505 5.766 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -9.761 7.622 5.298 1.00 0.00 H new ATOM 270 N TYR A 18 -6.486 7.085 3.706 1.00 0.00 N ATOM 271 CA TYR A 18 -5.911 7.237 2.373 1.00 0.00 C ATOM 272 C TYR A 18 -5.395 5.916 1.774 1.00 0.00 C ATOM 273 O TYR A 18 -5.784 5.512 0.684 1.00 0.00 O ATOM 274 CB TYR A 18 -4.765 8.305 2.476 1.00 0.00 C ATOM 275 CG TYR A 18 -4.157 8.674 1.138 1.00 0.00 C ATOM 276 CD1 TYR A 18 -4.928 9.216 0.126 1.00 0.00 C ATOM 277 CD2 TYR A 18 -2.831 8.373 0.879 1.00 0.00 C ATOM 278 CE1 TYR A 18 -4.392 9.430 -1.131 1.00 0.00 C ATOM 279 CE2 TYR A 18 -2.298 8.569 -0.379 1.00 0.00 C ATOM 280 CZ TYR A 18 -3.077 9.106 -1.384 1.00 0.00 C ATOM 281 OH TYR A 18 -2.545 9.324 -2.672 1.00 0.00 O ATOM 0 H TYR A 18 -5.900 7.513 4.422 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.692 7.565 1.687 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -5.160 9.205 2.947 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -3.981 7.922 3.129 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -5.959 9.475 0.319 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.207 7.981 1.669 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -5.005 9.851 -1.914 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -1.270 8.302 -0.577 1.00 0.00 H new ATOM 0 HH TYR A 18 -1.606 9.046 -2.689 1.00 0.00 H new ATOM 291 N PHE A 19 -4.534 5.190 2.529 1.00 0.00 N ATOM 292 CA PHE A 19 -3.913 3.900 2.234 1.00 0.00 C ATOM 293 C PHE A 19 -4.881 2.724 2.343 1.00 0.00 C ATOM 294 O PHE A 19 -4.850 1.788 1.544 1.00 0.00 O ATOM 295 CB PHE A 19 -2.669 3.727 3.147 1.00 0.00 C ATOM 296 CG PHE A 19 -1.622 4.771 2.826 1.00 0.00 C ATOM 297 CD1 PHE A 19 -1.088 4.874 1.554 1.00 0.00 C ATOM 298 CD2 PHE A 19 -1.148 5.633 3.801 1.00 0.00 C ATOM 299 CE1 PHE A 19 -0.131 5.821 1.252 1.00 0.00 C ATOM 300 CE2 PHE A 19 -0.180 6.577 3.512 1.00 0.00 C ATOM 301 CZ PHE A 19 0.327 6.677 2.231 1.00 0.00 C ATOM 0 H PHE A 19 -4.237 5.536 3.442 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.601 3.899 1.190 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.965 3.811 4.193 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.249 2.730 3.013 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.427 4.199 0.782 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.541 5.567 4.805 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.260 5.892 0.248 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.180 7.236 4.288 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.076 7.420 1.998 1.00 0.00 H new ATOM 311 N SER A 20 -5.852 2.814 3.298 1.00 0.00 N ATOM 312 CA SER A 20 -6.969 1.875 3.487 1.00 0.00 C ATOM 313 C SER A 20 -8.018 1.943 2.403 1.00 0.00 C ATOM 314 O SER A 20 -8.643 0.937 2.107 1.00 0.00 O ATOM 315 CB SER A 20 -7.611 1.803 4.876 1.00 0.00 C ATOM 316 OG SER A 20 -6.554 1.735 5.814 1.00 0.00 O ATOM 0 H SER A 20 -5.867 3.576 3.976 1.00 0.00 H new ATOM 0 HA SER A 20 -6.440 0.926 3.397 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.234 2.678 5.059 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.257 0.929 4.958 1.00 0.00 H new ATOM 0 HG SER A 20 -6.014 2.551 5.758 1.00 0.00 H new ATOM 322 N GLU A 21 -8.239 3.123 1.744 1.00 0.00 N ATOM 323 CA GLU A 21 -9.113 3.265 0.566 1.00 0.00 C ATOM 324 C GLU A 21 -8.598 2.501 -0.665 1.00 0.00 C ATOM 325 O GLU A 21 -9.366 1.850 -1.362 1.00 0.00 O ATOM 326 CB GLU A 21 -9.353 4.757 0.214 1.00 0.00 C ATOM 327 CG GLU A 21 -10.385 5.054 -0.897 1.00 0.00 C ATOM 328 CD GLU A 21 -11.751 4.465 -0.543 1.00 0.00 C ATOM 329 OE1 GLU A 21 -12.328 4.888 0.495 1.00 0.00 O ATOM 330 OE2 GLU A 21 -12.235 3.585 -1.305 1.00 0.00 O ATOM 0 H GLU A 21 -7.805 4.001 2.029 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.064 2.812 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.671 5.273 1.120 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.399 5.194 -0.083 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.474 6.131 -1.038 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.038 4.637 -1.842 1.00 0.00 H new ATOM 337 N GLU A 22 -7.258 2.514 -0.921 1.00 0.00 N ATOM 338 CA GLU A 22 -6.570 1.706 -1.929 1.00 0.00 C ATOM 339 C GLU A 22 -6.425 0.233 -1.513 1.00 0.00 C ATOM 340 O GLU A 22 -6.816 -0.672 -2.254 1.00 0.00 O ATOM 341 CB GLU A 22 -5.179 2.335 -2.245 1.00 0.00 C ATOM 342 CG GLU A 22 -5.207 3.396 -3.369 1.00 0.00 C ATOM 343 CD GLU A 22 -6.065 4.607 -3.004 1.00 0.00 C ATOM 344 OE1 GLU A 22 -7.189 4.732 -3.561 1.00 0.00 O ATOM 345 OE2 GLU A 22 -5.600 5.431 -2.173 1.00 0.00 O ATOM 0 H GLU A 22 -6.618 3.116 -0.402 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.185 1.709 -2.829 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.785 2.793 -1.338 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -4.488 1.540 -2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.190 3.725 -3.580 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -5.592 2.943 -4.283 1.00 0.00 H new ATOM 352 N PHE A 23 -5.917 -0.037 -0.268 1.00 0.00 N ATOM 353 CA PHE A 23 -5.690 -1.377 0.280 1.00 0.00 C ATOM 354 C PHE A 23 -6.956 -2.189 0.532 1.00 0.00 C ATOM 355 O PHE A 23 -7.095 -3.273 -0.005 1.00 0.00 O ATOM 356 CB PHE A 23 -4.880 -1.246 1.615 1.00 0.00 C ATOM 357 CG PHE A 23 -4.435 -2.519 2.307 1.00 0.00 C ATOM 358 CD1 PHE A 23 -3.942 -3.577 1.576 1.00 0.00 C ATOM 359 CD2 PHE A 23 -4.500 -2.648 3.688 1.00 0.00 C ATOM 360 CE1 PHE A 23 -3.509 -4.722 2.195 1.00 0.00 C ATOM 361 CE2 PHE A 23 -4.065 -3.799 4.313 1.00 0.00 C ATOM 362 CZ PHE A 23 -3.592 -4.851 3.557 1.00 0.00 C ATOM 0 H PHE A 23 -5.654 0.704 0.382 1.00 0.00 H new ATOM 0 HA PHE A 23 -5.136 -1.928 -0.481 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.991 -0.650 1.409 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -5.488 -0.678 2.320 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.896 -3.504 0.499 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -4.896 -1.837 4.281 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -3.099 -5.528 1.604 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -4.095 -3.876 5.390 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.289 -5.771 4.035 1.00 0.00 H new ATOM 372 N ARG A 24 -7.964 -1.661 1.275 1.00 0.00 N ATOM 373 CA ARG A 24 -9.236 -2.335 1.563 1.00 0.00 C ATOM 374 C ARG A 24 -10.131 -2.573 0.356 1.00 0.00 C ATOM 375 O ARG A 24 -10.679 -3.656 0.204 1.00 0.00 O ATOM 376 CB ARG A 24 -9.888 -1.793 2.863 1.00 0.00 C ATOM 377 CG ARG A 24 -10.997 -2.690 3.464 1.00 0.00 C ATOM 378 CD ARG A 24 -10.556 -3.980 4.205 1.00 0.00 C ATOM 379 NE ARG A 24 -9.054 -4.054 4.402 1.00 0.00 N ATOM 380 CZ ARG A 24 -8.210 -4.869 3.690 1.00 0.00 C ATOM 381 NH1 ARG A 24 -8.676 -5.877 2.911 1.00 0.00 N ATOM 382 NH2 ARG A 24 -6.876 -4.627 3.705 1.00 0.00 N ATOM 0 H ARG A 24 -7.903 -0.733 1.695 1.00 0.00 H new ATOM 0 HA ARG A 24 -9.010 -3.373 1.805 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.108 -1.655 3.612 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.310 -0.809 2.657 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.578 -2.085 4.160 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -11.669 -2.980 2.656 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.049 -4.023 5.176 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -10.888 -4.851 3.640 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.641 -3.454 5.116 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.679 -6.046 2.842 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.023 -6.466 2.394 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.506 -3.843 4.243 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.243 -5.228 3.178 1.00 0.00 H new ATOM 396 N ASN A 25 -10.230 -1.632 -0.618 1.00 0.00 N ATOM 397 CA ASN A 25 -10.945 -1.825 -1.856 1.00 0.00 C ATOM 398 C ASN A 25 -10.295 -2.794 -2.850 1.00 0.00 C ATOM 399 O ASN A 25 -10.942 -3.725 -3.310 1.00 0.00 O ATOM 400 CB ASN A 25 -10.987 -0.423 -2.470 1.00 0.00 C ATOM 401 CG ASN A 25 -12.179 -0.211 -3.370 1.00 0.00 C ATOM 402 OD1 ASN A 25 -13.148 -0.967 -3.455 1.00 0.00 O ATOM 403 ND2 ASN A 25 -12.143 0.966 -4.033 1.00 0.00 N ATOM 0 H ASN A 25 -9.799 -0.711 -0.540 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.914 -2.278 -1.648 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.006 0.318 -1.671 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.073 -0.254 -3.040 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -12.929 1.245 -4.620 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -11.329 1.575 -3.947 1.00 0.00 H new ATOM 410 N ASP A 26 -8.977 -2.611 -3.174 1.00 0.00 N ATOM 411 CA ASP A 26 -8.244 -3.455 -4.135 1.00 0.00 C ATOM 412 C ASP A 26 -7.880 -4.838 -3.611 1.00 0.00 C ATOM 413 O ASP A 26 -8.026 -5.824 -4.335 1.00 0.00 O ATOM 414 CB ASP A 26 -6.972 -2.760 -4.693 1.00 0.00 C ATOM 415 CG ASP A 26 -7.367 -1.560 -5.560 1.00 0.00 C ATOM 416 OD1 ASP A 26 -6.961 -0.417 -5.219 1.00 0.00 O ATOM 417 OD2 ASP A 26 -8.073 -1.776 -6.581 1.00 0.00 O ATOM 0 H ASP A 26 -8.406 -1.870 -2.768 1.00 0.00 H new ATOM 0 HA ASP A 26 -8.958 -3.598 -4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -6.337 -2.431 -3.870 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.389 -3.468 -5.282 1.00 0.00 H new ATOM 422 N PHE A 27 -7.464 -4.960 -2.308 1.00 0.00 N ATOM 423 CA PHE A 27 -7.149 -6.218 -1.615 1.00 0.00 C ATOM 424 C PHE A 27 -8.380 -7.062 -1.430 1.00 0.00 C ATOM 425 O PHE A 27 -8.316 -8.241 -1.750 1.00 0.00 O ATOM 426 CB PHE A 27 -6.465 -5.982 -0.243 1.00 0.00 C ATOM 427 CG PHE A 27 -5.883 -7.141 0.523 1.00 0.00 C ATOM 428 CD1 PHE A 27 -6.659 -7.910 1.381 1.00 0.00 C ATOM 429 CD2 PHE A 27 -4.515 -7.270 0.568 1.00 0.00 C ATOM 430 CE1 PHE A 27 -6.071 -8.695 2.352 1.00 0.00 C ATOM 431 CE2 PHE A 27 -3.928 -8.008 1.570 1.00 0.00 C ATOM 432 CZ PHE A 27 -4.701 -8.697 2.469 1.00 0.00 C ATOM 0 H PHE A 27 -7.340 -4.145 -1.707 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.444 -6.750 -2.254 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.661 -5.263 -0.402 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -7.198 -5.502 0.405 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -7.735 -7.893 1.287 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -3.902 -6.793 -0.182 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.678 -9.299 3.010 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.852 -8.045 1.649 1.00 0.00 H new ATOM 0 HZ PHE A 27 -4.231 -9.244 3.273 1.00 0.00 H new ATOM 442 N LEU A 28 -9.552 -6.484 -0.991 1.00 0.00 N ATOM 443 CA LEU A 28 -10.819 -7.193 -0.946 1.00 0.00 C ATOM 444 C LEU A 28 -11.346 -7.546 -2.327 1.00 0.00 C ATOM 445 O LEU A 28 -11.839 -8.648 -2.493 1.00 0.00 O ATOM 446 CB LEU A 28 -11.881 -6.498 -0.081 1.00 0.00 C ATOM 447 CG LEU A 28 -11.587 -6.496 1.440 1.00 0.00 C ATOM 448 CD1 LEU A 28 -12.865 -6.111 2.188 1.00 0.00 C ATOM 449 CD2 LEU A 28 -10.996 -7.790 2.060 1.00 0.00 C ATOM 0 H LEU A 28 -9.611 -5.519 -0.667 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.598 -8.135 -0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.984 -5.466 -0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -12.841 -6.985 -0.250 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.784 -5.768 1.556 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -12.671 -6.106 3.261 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -13.186 -5.118 1.873 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -13.649 -6.834 1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.842 -7.644 3.129 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -11.688 -8.618 1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.042 -8.019 1.584 1.00 0.00 H new ATOM 461 N GLU A 29 -11.150 -6.687 -3.371 1.00 0.00 N ATOM 462 CA GLU A 29 -11.477 -7.011 -4.771 1.00 0.00 C ATOM 463 C GLU A 29 -10.739 -8.209 -5.355 1.00 0.00 C ATOM 464 O GLU A 29 -11.365 -9.159 -5.811 1.00 0.00 O ATOM 465 CB GLU A 29 -11.176 -5.788 -5.683 1.00 0.00 C ATOM 466 CG GLU A 29 -12.467 -5.067 -6.061 1.00 0.00 C ATOM 467 CD GLU A 29 -12.147 -3.747 -6.756 1.00 0.00 C ATOM 468 OE1 GLU A 29 -11.542 -3.789 -7.861 1.00 0.00 O ATOM 469 OE2 GLU A 29 -12.501 -2.677 -6.191 1.00 0.00 O ATOM 0 H GLU A 29 -10.760 -5.752 -3.252 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.536 -7.270 -4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.507 -5.099 -5.167 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.661 -6.118 -6.585 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.065 -5.697 -6.719 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.064 -4.881 -5.168 1.00 0.00 H new ATOM 476 N LEU A 30 -9.378 -8.208 -5.286 1.00 0.00 N ATOM 477 CA LEU A 30 -8.492 -9.280 -5.755 1.00 0.00 C ATOM 478 C LEU A 30 -8.536 -10.547 -4.927 1.00 0.00 C ATOM 479 O LEU A 30 -8.472 -11.647 -5.468 1.00 0.00 O ATOM 480 CB LEU A 30 -7.062 -8.781 -6.029 1.00 0.00 C ATOM 481 CG LEU A 30 -5.929 -9.214 -5.073 1.00 0.00 C ATOM 482 CD1 LEU A 30 -4.932 -8.079 -4.981 1.00 0.00 C ATOM 483 CD2 LEU A 30 -5.177 -10.495 -5.503 1.00 0.00 C ATOM 0 H LEU A 30 -8.862 -7.425 -4.885 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.906 -9.584 -6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -6.787 -9.102 -7.034 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.088 -7.691 -6.038 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.399 -9.445 -4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.121 -8.361 -4.310 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.528 -7.869 -5.971 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.429 -7.189 -4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.400 -10.723 -4.773 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.878 -11.327 -5.558 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -4.722 -10.339 -6.481 1.00 0.00 H new ATOM 495 N LEU A 31 -8.722 -10.414 -3.573 1.00 0.00 N ATOM 496 CA LEU A 31 -8.983 -11.482 -2.604 1.00 0.00 C ATOM 497 C LEU A 31 -10.247 -12.200 -2.933 1.00 0.00 C ATOM 498 O LEU A 31 -10.256 -13.422 -3.084 1.00 0.00 O ATOM 499 CB LEU A 31 -9.189 -10.912 -1.178 1.00 0.00 C ATOM 500 CG LEU A 31 -9.853 -11.739 -0.039 1.00 0.00 C ATOM 501 CD1 LEU A 31 -11.310 -11.362 0.282 1.00 0.00 C ATOM 502 CD2 LEU A 31 -9.531 -13.247 0.047 1.00 0.00 C ATOM 0 H LEU A 31 -8.688 -9.498 -3.125 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.118 -12.144 -2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -8.205 -10.614 -0.815 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -9.778 -10.001 -1.287 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.283 -11.373 0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -11.681 -11.995 1.088 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.356 -10.318 0.590 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -11.927 -11.506 -0.605 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.066 -13.686 0.889 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.840 -13.738 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.459 -13.383 0.188 1.00 0.00 H new ATOM 514 N ARG A 32 -11.357 -11.419 -3.074 1.00 0.00 N ATOM 515 CA ARG A 32 -12.677 -11.952 -3.315 1.00 0.00 C ATOM 516 C ARG A 32 -12.840 -12.711 -4.649 1.00 0.00 C ATOM 517 O ARG A 32 -13.497 -13.746 -4.676 1.00 0.00 O ATOM 518 CB ARG A 32 -13.778 -10.888 -3.240 1.00 0.00 C ATOM 519 CG ARG A 32 -14.168 -10.489 -1.812 1.00 0.00 C ATOM 520 CD ARG A 32 -15.270 -9.414 -1.824 1.00 0.00 C ATOM 521 NE ARG A 32 -14.788 -8.184 -2.538 1.00 0.00 N ATOM 522 CZ ARG A 32 -15.537 -7.045 -2.667 1.00 0.00 C ATOM 523 NH1 ARG A 32 -16.800 -6.978 -2.158 1.00 0.00 N ATOM 524 NH2 ARG A 32 -15.005 -5.965 -3.311 1.00 0.00 N ATOM 0 H ARG A 32 -11.332 -10.401 -3.019 1.00 0.00 H new ATOM 0 HA ARG A 32 -12.790 -12.669 -2.502 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.446 -9.999 -3.776 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -14.663 -11.260 -3.756 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.516 -11.366 -1.267 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.292 -10.112 -1.283 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -16.162 -9.803 -2.316 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.554 -9.162 -0.802 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.854 -8.198 -2.948 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.198 -7.783 -1.674 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.347 -6.123 -2.261 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.059 -6.012 -3.690 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.553 -5.111 -3.413 1.00 0.00 H new ATOM 538 N ARG A 33 -12.211 -12.251 -5.781 1.00 0.00 N ATOM 539 CA ARG A 33 -12.049 -13.062 -6.987 1.00 0.00 C ATOM 540 C ARG A 33 -11.069 -14.185 -6.920 1.00 0.00 C ATOM 541 O ARG A 33 -11.375 -15.275 -7.385 1.00 0.00 O ATOM 542 CB ARG A 33 -11.695 -12.357 -8.318 1.00 0.00 C ATOM 543 CG ARG A 33 -11.045 -10.984 -8.176 1.00 0.00 C ATOM 544 CD ARG A 33 -10.569 -10.333 -9.479 1.00 0.00 C ATOM 545 NE ARG A 33 -10.008 -8.979 -9.122 1.00 0.00 N ATOM 546 CZ ARG A 33 -8.883 -8.428 -9.673 1.00 0.00 C ATOM 547 NH1 ARG A 33 -8.180 -9.075 -10.646 1.00 0.00 N ATOM 548 NH2 ARG A 33 -8.455 -7.209 -9.231 1.00 0.00 N ATOM 0 H ARG A 33 -11.814 -11.315 -5.859 1.00 0.00 H new ATOM 0 HA ARG A 33 -13.083 -13.406 -7.000 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -11.023 -13.002 -8.884 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.606 -12.250 -8.907 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.758 -10.313 -7.696 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.191 -11.075 -7.504 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.810 -10.949 -9.962 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.395 -10.234 -10.184 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.504 -8.433 -8.417 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -8.490 -9.989 -10.977 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.344 -8.645 -11.043 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.972 -6.721 -8.499 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.618 -6.786 -9.632 1.00 0.00 H new ATOM 562 N ARG A 34 -9.805 -13.948 -6.483 1.00 0.00 N ATOM 563 CA ARG A 34 -8.787 -14.960 -6.675 1.00 0.00 C ATOM 564 C ARG A 34 -8.825 -16.107 -5.649 1.00 0.00 C ATOM 565 O ARG A 34 -8.426 -17.232 -5.933 1.00 0.00 O ATOM 566 CB ARG A 34 -7.368 -14.335 -6.787 1.00 0.00 C ATOM 567 CG ARG A 34 -7.216 -13.289 -7.919 1.00 0.00 C ATOM 568 CD ARG A 34 -7.475 -13.844 -9.329 1.00 0.00 C ATOM 569 NE ARG A 34 -7.297 -12.732 -10.328 1.00 0.00 N ATOM 570 CZ ARG A 34 -7.695 -12.835 -11.635 1.00 0.00 C ATOM 571 NH1 ARG A 34 -8.306 -13.964 -12.097 1.00 0.00 N ATOM 572 NH2 ARG A 34 -7.478 -11.789 -12.486 1.00 0.00 N ATOM 0 H ARG A 34 -9.495 -13.096 -6.017 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.030 -15.427 -7.629 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.116 -13.863 -5.837 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.644 -15.134 -6.948 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -7.906 -12.466 -7.733 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -6.208 -12.875 -7.883 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -6.786 -14.660 -9.546 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -8.483 -14.252 -9.395 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.861 -11.864 -10.018 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -8.473 -14.748 -11.466 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.596 -14.024 -13.073 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -7.023 -10.941 -12.147 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -7.770 -11.856 -13.461 1.00 0.00 H new ATOM 586 N PHE A 35 -9.313 -15.805 -4.417 1.00 0.00 N ATOM 587 CA PHE A 35 -9.355 -16.721 -3.288 1.00 0.00 C ATOM 588 C PHE A 35 -10.790 -17.007 -2.825 1.00 0.00 C ATOM 589 O PHE A 35 -11.053 -18.082 -2.278 1.00 0.00 O ATOM 590 CB PHE A 35 -8.508 -16.182 -2.080 1.00 0.00 C ATOM 591 CG PHE A 35 -7.103 -15.785 -2.443 1.00 0.00 C ATOM 592 CD1 PHE A 35 -6.036 -16.547 -2.013 1.00 0.00 C ATOM 593 CD2 PHE A 35 -6.829 -14.620 -3.135 1.00 0.00 C ATOM 594 CE1 PHE A 35 -4.746 -16.165 -2.285 1.00 0.00 C ATOM 595 CE2 PHE A 35 -5.542 -14.244 -3.438 1.00 0.00 C ATOM 596 CZ PHE A 35 -4.489 -15.014 -2.994 1.00 0.00 C ATOM 0 H PHE A 35 -9.695 -14.886 -4.194 1.00 0.00 H new ATOM 0 HA PHE A 35 -8.919 -17.656 -3.638 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -9.018 -15.320 -1.649 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -8.469 -16.949 -1.307 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -6.218 -17.454 -1.456 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -7.648 -13.988 -3.446 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.924 -16.774 -1.939 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.358 -13.353 -4.019 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.471 -14.717 -3.201 1.00 0.00 H new ATOM 606 N GLY A 36 -11.757 -16.034 -2.960 1.00 0.00 N ATOM 607 CA GLY A 36 -13.122 -16.120 -2.459 1.00 0.00 C ATOM 608 C GLY A 36 -13.232 -15.929 -0.988 1.00 0.00 C ATOM 609 O GLY A 36 -12.863 -14.894 -0.439 1.00 0.00 O ATOM 0 H GLY A 36 -11.572 -15.153 -3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -13.732 -15.369 -2.961 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -13.536 -17.094 -2.722 1.00 0.00 H new ATOM 613 N THR A 37 -13.696 -16.986 -0.303 1.00 0.00 N ATOM 614 CA THR A 37 -13.670 -17.056 1.136 1.00 0.00 C ATOM 615 C THR A 37 -12.921 -18.351 1.340 1.00 0.00 C ATOM 616 O THR A 37 -13.460 -19.434 1.142 1.00 0.00 O ATOM 617 CB THR A 37 -15.088 -17.104 1.717 1.00 0.00 C ATOM 618 OG1 THR A 37 -15.944 -17.969 0.970 1.00 0.00 O ATOM 619 CG2 THR A 37 -15.677 -15.689 1.649 1.00 0.00 C ATOM 0 H THR A 37 -14.098 -17.811 -0.749 1.00 0.00 H new ATOM 0 HA THR A 37 -13.214 -16.198 1.631 1.00 0.00 H new ATOM 0 HB THR A 37 -15.025 -17.479 2.738 1.00 0.00 H new ATOM 0 HG1 THR A 37 -15.480 -18.813 0.790 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.688 -15.696 2.057 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.055 -15.008 2.230 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.707 -15.357 0.611 1.00 0.00 H new ATOM 627 N LYS A 38 -11.672 -18.235 1.799 1.00 0.00 N ATOM 628 CA LYS A 38 -10.728 -19.307 1.999 1.00 0.00 C ATOM 629 C LYS A 38 -9.759 -18.764 2.996 1.00 0.00 C ATOM 630 O LYS A 38 -9.397 -17.592 2.928 1.00 0.00 O ATOM 631 CB LYS A 38 -9.923 -19.628 0.708 1.00 0.00 C ATOM 632 CG LYS A 38 -9.178 -20.980 0.755 1.00 0.00 C ATOM 633 CD LYS A 38 -7.672 -20.849 0.473 1.00 0.00 C ATOM 634 CE LYS A 38 -7.317 -20.289 -0.916 1.00 0.00 C ATOM 635 NZ LYS A 38 -7.784 -21.186 -1.999 1.00 0.00 N ATOM 0 H LYS A 38 -11.281 -17.328 2.053 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.246 -20.217 2.303 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.605 -19.629 -0.143 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.199 -18.831 0.535 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.320 -21.432 1.737 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.621 -21.658 0.025 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -7.230 -20.204 1.232 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.211 -21.831 0.581 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.768 -19.304 -1.038 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.238 -20.157 -0.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.529 -20.779 -2.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.335 -22.118 -1.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.817 -21.291 -1.941 1.00 0.00 H new ATOM 649 N ARG A 39 -9.267 -19.598 3.942 1.00 0.00 N ATOM 650 CA ARG A 39 -8.248 -19.248 4.914 1.00 0.00 C ATOM 651 C ARG A 39 -6.853 -19.083 4.261 1.00 0.00 C ATOM 652 O ARG A 39 -6.214 -20.023 3.798 1.00 0.00 O ATOM 653 CB ARG A 39 -8.257 -20.256 6.106 1.00 0.00 C ATOM 654 CG ARG A 39 -7.730 -21.689 5.874 1.00 0.00 C ATOM 655 CD ARG A 39 -8.519 -22.551 4.868 1.00 0.00 C ATOM 656 NE ARG A 39 -7.992 -23.963 4.883 1.00 0.00 N ATOM 657 CZ ARG A 39 -6.921 -24.389 4.142 1.00 0.00 C ATOM 658 NH1 ARG A 39 -6.233 -23.529 3.335 1.00 0.00 N ATOM 659 NH2 ARG A 39 -6.537 -25.697 4.212 1.00 0.00 N ATOM 0 H ARG A 39 -9.590 -20.561 4.038 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.490 -18.268 5.326 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.672 -19.816 6.914 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -9.284 -20.336 6.463 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.697 -21.623 5.532 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.716 -22.208 6.832 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -9.579 -22.546 5.123 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.430 -22.130 3.866 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.461 -24.643 5.481 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -6.514 -22.550 3.276 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -5.438 -23.865 2.791 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -7.046 -26.347 4.812 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.741 -26.025 3.665 1.00 0.00 H new ATOM 673 N VAL A 40 -6.377 -17.830 4.160 1.00 0.00 N ATOM 674 CA VAL A 40 -5.124 -17.475 3.513 1.00 0.00 C ATOM 675 C VAL A 40 -4.502 -16.390 4.336 1.00 0.00 C ATOM 676 O VAL A 40 -5.179 -15.544 4.912 1.00 0.00 O ATOM 677 CB VAL A 40 -5.265 -17.071 2.037 1.00 0.00 C ATOM 678 CG1 VAL A 40 -6.248 -15.899 1.835 1.00 0.00 C ATOM 679 CG2 VAL A 40 -3.905 -16.797 1.345 1.00 0.00 C ATOM 0 H VAL A 40 -6.873 -17.023 4.539 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.485 -18.357 3.472 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.694 -17.942 1.541 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.310 -15.655 0.775 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.235 -16.185 2.200 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -5.895 -15.029 2.388 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -4.076 -16.517 0.306 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.392 -15.985 1.860 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.290 -17.696 1.382 1.00 0.00 H new ATOM 689 N HIS A 41 -3.152 -16.404 4.394 1.00 0.00 N ATOM 690 CA HIS A 41 -2.285 -15.499 5.112 1.00 0.00 C ATOM 691 C HIS A 41 -2.292 -14.090 4.527 1.00 0.00 C ATOM 692 O HIS A 41 -2.252 -13.916 3.308 1.00 0.00 O ATOM 693 CB HIS A 41 -0.869 -16.121 5.128 1.00 0.00 C ATOM 694 CG HIS A 41 0.045 -15.545 6.154 1.00 0.00 C ATOM 695 ND1 HIS A 41 0.795 -14.398 6.042 1.00 0.00 N ATOM 696 CD2 HIS A 41 0.231 -15.991 7.418 1.00 0.00 C ATOM 697 CE1 HIS A 41 1.384 -14.201 7.249 1.00 0.00 C ATOM 698 NE2 HIS A 41 1.054 -15.131 8.112 1.00 0.00 N ATOM 0 H HIS A 41 -2.617 -17.113 3.893 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.649 -15.376 6.132 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -0.959 -17.194 5.300 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -0.418 -15.993 4.144 1.00 0.00 H new ATOM 0 HD1 HIS A 41 0.890 -13.810 5.214 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -0.204 -16.892 7.825 1.00 0.00 H new ATOM 0 HE1 HIS A 41 2.045 -13.377 7.472 1.00 0.00 H new ATOM 706 N ASN A 42 -2.367 -13.026 5.372 1.00 0.00 N ATOM 707 CA ASN A 42 -2.487 -11.631 4.892 1.00 0.00 C ATOM 708 C ASN A 42 -1.290 -11.059 4.119 1.00 0.00 C ATOM 709 O ASN A 42 -1.443 -10.271 3.190 1.00 0.00 O ATOM 710 CB ASN A 42 -2.953 -10.666 6.020 1.00 0.00 C ATOM 711 CG ASN A 42 -4.457 -10.389 5.910 1.00 0.00 C ATOM 712 OD1 ASN A 42 -5.073 -10.711 4.901 1.00 0.00 O ATOM 713 ND2 ASN A 42 -5.043 -9.707 6.920 1.00 0.00 N ATOM 0 H ASN A 42 -2.346 -13.113 6.388 1.00 0.00 H new ATOM 0 HA ASN A 42 -3.267 -11.701 4.134 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -2.729 -11.102 6.994 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.400 -9.729 5.955 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.027 -9.445 6.855 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.501 -9.454 7.747 1.00 0.00 H new ATOM 720 N ASN A 43 -0.057 -11.542 4.432 1.00 0.00 N ATOM 721 CA ASN A 43 1.186 -11.250 3.697 1.00 0.00 C ATOM 722 C ASN A 43 1.201 -11.842 2.271 1.00 0.00 C ATOM 723 O ASN A 43 1.848 -11.292 1.386 1.00 0.00 O ATOM 724 CB ASN A 43 2.503 -11.576 4.463 1.00 0.00 C ATOM 725 CG ASN A 43 2.486 -10.970 5.873 1.00 0.00 C ATOM 726 OD1 ASN A 43 1.880 -11.532 6.785 1.00 0.00 O ATOM 727 ND2 ASN A 43 3.128 -9.791 6.078 1.00 0.00 N ATOM 0 H ASN A 43 0.094 -12.162 5.227 1.00 0.00 H new ATOM 0 HA ASN A 43 1.170 -10.164 3.605 1.00 0.00 H new ATOM 0 HB2 ASN A 43 2.631 -12.656 4.530 1.00 0.00 H new ATOM 0 HB3 ASN A 43 3.356 -11.188 3.907 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.113 -9.356 7.000 1.00 0.00 H new ATOM 0 HD22 ASN A 43 3.625 -9.341 5.310 1.00 0.00 H new ATOM 734 N ILE A 44 0.444 -12.962 2.035 1.00 0.00 N ATOM 735 CA ILE A 44 0.205 -13.657 0.760 1.00 0.00 C ATOM 736 C ILE A 44 -0.784 -12.927 -0.116 1.00 0.00 C ATOM 737 O ILE A 44 -0.526 -12.720 -1.298 1.00 0.00 O ATOM 738 CB ILE A 44 -0.123 -15.137 0.871 1.00 0.00 C ATOM 739 CG1 ILE A 44 0.966 -15.796 1.756 1.00 0.00 C ATOM 740 CG2 ILE A 44 -0.143 -15.743 -0.566 1.00 0.00 C ATOM 741 CD1 ILE A 44 0.872 -17.318 1.760 1.00 0.00 C ATOM 0 H ILE A 44 -0.045 -13.424 2.802 1.00 0.00 H new ATOM 0 HA ILE A 44 1.177 -13.633 0.267 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.098 -15.309 1.327 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.951 -15.497 1.398 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.873 -15.427 2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.377 -16.806 -0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.900 -15.236 -1.164 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.834 -15.611 -1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.657 -17.729 2.395 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.102 -17.621 2.144 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.994 -17.693 0.744 1.00 0.00 H new ATOM 753 N VAL A 45 -1.914 -12.416 0.458 1.00 0.00 N ATOM 754 CA VAL A 45 -2.845 -11.538 -0.279 1.00 0.00 C ATOM 755 C VAL A 45 -2.169 -10.167 -0.521 1.00 0.00 C ATOM 756 O VAL A 45 -2.299 -9.649 -1.625 1.00 0.00 O ATOM 757 CB VAL A 45 -4.282 -11.390 0.286 1.00 0.00 C ATOM 758 CG1 VAL A 45 -5.003 -12.741 0.522 1.00 0.00 C ATOM 759 CG2 VAL A 45 -5.180 -10.580 -0.687 1.00 0.00 C ATOM 0 H VAL A 45 -2.191 -12.602 1.422 1.00 0.00 H new ATOM 0 HA VAL A 45 -3.033 -12.053 -1.221 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.148 -10.883 1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.002 -12.556 0.917 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.081 -13.282 -0.421 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.435 -13.337 1.236 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -6.182 -10.490 -0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.757 -9.586 -0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -5.233 -11.094 -1.647 1.00 0.00 H new ATOM 769 N TYR A 46 -1.348 -9.608 0.453 1.00 0.00 N ATOM 770 CA TYR A 46 -0.561 -8.347 0.326 1.00 0.00 C ATOM 771 C TYR A 46 0.511 -8.467 -0.711 1.00 0.00 C ATOM 772 O TYR A 46 0.473 -7.697 -1.652 1.00 0.00 O ATOM 773 CB TYR A 46 0.052 -7.834 1.685 1.00 0.00 C ATOM 774 CG TYR A 46 0.057 -6.378 2.188 1.00 0.00 C ATOM 775 CD1 TYR A 46 -0.078 -5.180 1.486 1.00 0.00 C ATOM 776 CD2 TYR A 46 0.064 -6.253 3.578 1.00 0.00 C ATOM 777 CE1 TYR A 46 -0.428 -4.011 2.132 1.00 0.00 C ATOM 778 CE2 TYR A 46 -0.425 -5.126 4.192 1.00 0.00 C ATOM 779 CZ TYR A 46 -0.669 -3.988 3.473 1.00 0.00 C ATOM 780 OH TYR A 46 -1.242 -2.845 4.068 1.00 0.00 O ATOM 0 H TYR A 46 -1.225 -10.049 1.365 1.00 0.00 H new ATOM 0 HA TYR A 46 -1.284 -7.596 0.008 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -0.441 -8.413 2.466 1.00 0.00 H new ATOM 0 HB3 TYR A 46 1.097 -8.143 1.671 1.00 0.00 H new ATOM 0 HD1 TYR A 46 0.094 -5.167 0.420 1.00 0.00 H new ATOM 0 HD2 TYR A 46 0.461 -7.056 4.181 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.512 -3.097 1.563 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -0.619 -5.138 5.254 1.00 0.00 H new ATOM 0 HH TYR A 46 -2.212 -2.856 3.931 1.00 0.00 H new ATOM 790 N ASN A 47 1.410 -9.500 -0.704 1.00 0.00 N ATOM 791 CA ASN A 47 2.418 -9.713 -1.763 1.00 0.00 C ATOM 792 C ASN A 47 1.874 -9.907 -3.147 1.00 0.00 C ATOM 793 O ASN A 47 2.509 -9.564 -4.141 1.00 0.00 O ATOM 794 CB ASN A 47 3.386 -10.900 -1.469 1.00 0.00 C ATOM 795 CG ASN A 47 2.916 -12.362 -1.490 1.00 0.00 C ATOM 796 OD1 ASN A 47 2.363 -12.905 -2.445 1.00 0.00 O ATOM 797 ND2 ASN A 47 3.277 -13.079 -0.401 1.00 0.00 N ATOM 0 H ASN A 47 1.446 -10.199 0.038 1.00 0.00 H new ATOM 0 HA ASN A 47 2.957 -8.766 -1.741 1.00 0.00 H new ATOM 0 HB2 ASN A 47 4.203 -10.823 -2.186 1.00 0.00 H new ATOM 0 HB3 ASN A 47 3.811 -10.721 -0.481 1.00 0.00 H new ATOM 0 HD21 ASN A 47 3.091 -14.081 -0.366 1.00 0.00 H new ATOM 0 HD22 ASN A 47 3.735 -12.617 0.385 1.00 0.00 H new ATOM 804 N GLU A 48 0.620 -10.450 -3.184 1.00 0.00 N ATOM 805 CA GLU A 48 -0.125 -10.691 -4.395 1.00 0.00 C ATOM 806 C GLU A 48 -0.699 -9.389 -4.970 1.00 0.00 C ATOM 807 O GLU A 48 -0.599 -9.106 -6.157 1.00 0.00 O ATOM 808 CB GLU A 48 -1.236 -11.766 -4.214 1.00 0.00 C ATOM 809 CG GLU A 48 -1.900 -12.153 -5.550 1.00 0.00 C ATOM 810 CD GLU A 48 -2.526 -13.545 -5.548 1.00 0.00 C ATOM 811 OE1 GLU A 48 -1.817 -14.517 -5.173 1.00 0.00 O ATOM 812 OE2 GLU A 48 -3.710 -13.660 -5.963 1.00 0.00 O ATOM 0 H GLU A 48 0.116 -10.727 -2.341 1.00 0.00 H new ATOM 0 HA GLU A 48 0.585 -11.095 -5.117 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -0.806 -12.656 -3.754 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.996 -11.388 -3.529 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.670 -11.419 -5.788 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.155 -12.101 -6.344 1.00 0.00 H new ATOM 819 N TYR A 49 -1.262 -8.555 -4.059 1.00 0.00 N ATOM 820 CA TYR A 49 -1.834 -7.222 -4.194 1.00 0.00 C ATOM 821 C TYR A 49 -0.835 -6.134 -4.613 1.00 0.00 C ATOM 822 O TYR A 49 -1.066 -5.406 -5.571 1.00 0.00 O ATOM 823 CB TYR A 49 -2.481 -6.971 -2.773 1.00 0.00 C ATOM 824 CG TYR A 49 -2.782 -5.573 -2.343 1.00 0.00 C ATOM 825 CD1 TYR A 49 -1.889 -5.036 -1.459 1.00 0.00 C ATOM 826 CD2 TYR A 49 -3.783 -4.786 -2.855 1.00 0.00 C ATOM 827 CE1 TYR A 49 -1.864 -3.704 -1.156 1.00 0.00 C ATOM 828 CE2 TYR A 49 -3.795 -3.450 -2.518 1.00 0.00 C ATOM 829 CZ TYR A 49 -2.821 -2.891 -1.716 1.00 0.00 C ATOM 830 OH TYR A 49 -2.826 -1.500 -1.503 1.00 0.00 O ATOM 0 H TYR A 49 -1.325 -8.859 -3.087 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.555 -7.168 -5.010 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -3.414 -7.534 -2.734 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -1.815 -7.406 -2.028 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.175 -5.690 -0.981 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.540 -5.202 -3.504 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -1.112 -3.300 -0.494 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -4.590 -2.822 -2.892 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.580 -1.098 -1.983 1.00 0.00 H new ATOM 840 N ILE A 50 0.294 -5.994 -3.884 1.00 0.00 N ATOM 841 CA ILE A 50 1.342 -4.982 -4.110 1.00 0.00 C ATOM 842 C ILE A 50 2.404 -5.181 -5.143 1.00 0.00 C ATOM 843 O ILE A 50 3.175 -4.262 -5.417 1.00 0.00 O ATOM 844 CB ILE A 50 1.873 -4.353 -2.858 1.00 0.00 C ATOM 845 CG1 ILE A 50 1.980 -5.383 -1.735 1.00 0.00 C ATOM 846 CG2 ILE A 50 0.825 -3.287 -2.574 1.00 0.00 C ATOM 847 CD1 ILE A 50 3.059 -5.359 -0.671 1.00 0.00 C ATOM 0 H ILE A 50 0.505 -6.605 -3.095 1.00 0.00 H new ATOM 0 HA ILE A 50 0.711 -4.269 -4.641 1.00 0.00 H new ATOM 0 HB ILE A 50 2.880 -3.946 -2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 50 1.028 -5.358 -1.205 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.050 -6.357 -2.219 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.095 -2.743 -1.669 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.775 -2.593 -3.413 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -0.147 -3.760 -2.436 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.916 -6.197 0.011 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.038 -5.439 -1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.000 -4.424 -0.114 1.00 0.00 H new ATOM 859 N SER A 51 2.415 -6.354 -5.804 1.00 0.00 N ATOM 860 CA SER A 51 3.226 -6.664 -6.986 1.00 0.00 C ATOM 861 C SER A 51 2.412 -6.226 -8.222 1.00 0.00 C ATOM 862 O SER A 51 2.085 -7.006 -9.112 1.00 0.00 O ATOM 863 CB SER A 51 3.646 -8.162 -7.082 1.00 0.00 C ATOM 864 OG SER A 51 4.548 -8.393 -8.168 1.00 0.00 O ATOM 0 H SER A 51 1.834 -7.140 -5.513 1.00 0.00 H new ATOM 0 HA SER A 51 4.169 -6.122 -6.920 1.00 0.00 H new ATOM 0 HB2 SER A 51 4.116 -8.468 -6.148 1.00 0.00 H new ATOM 0 HB3 SER A 51 2.758 -8.781 -7.209 1.00 0.00 H new ATOM 0 HG SER A 51 4.790 -9.342 -8.196 1.00 0.00 H new ATOM 870 N HIS A 52 2.061 -4.924 -8.207 1.00 0.00 N ATOM 871 CA HIS A 52 1.213 -4.142 -9.080 1.00 0.00 C ATOM 872 C HIS A 52 1.777 -2.736 -8.883 1.00 0.00 C ATOM 873 O HIS A 52 2.820 -2.564 -8.253 1.00 0.00 O ATOM 874 CB HIS A 52 -0.267 -4.171 -8.549 1.00 0.00 C ATOM 875 CG HIS A 52 -1.160 -5.320 -8.984 1.00 0.00 C ATOM 876 ND1 HIS A 52 -2.076 -5.236 -10.017 1.00 0.00 N ATOM 877 CD2 HIS A 52 -1.422 -6.511 -8.370 1.00 0.00 C ATOM 878 CE1 HIS A 52 -2.842 -6.357 -9.967 1.00 0.00 C ATOM 879 NE2 HIS A 52 -2.489 -7.155 -8.987 1.00 0.00 N ATOM 0 H HIS A 52 2.430 -4.327 -7.467 1.00 0.00 H new ATOM 0 HA HIS A 52 1.199 -4.491 -10.113 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -0.231 -4.171 -7.460 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -0.748 -3.241 -8.852 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -0.876 -6.899 -7.523 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -3.648 -6.567 -10.654 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -2.906 -8.051 -8.733 1.00 0.00 H new ATOM 887 N ARG A 53 1.061 -1.670 -9.337 1.00 0.00 N ATOM 888 CA ARG A 53 1.393 -0.250 -9.148 1.00 0.00 C ATOM 889 C ARG A 53 1.373 0.289 -7.716 1.00 0.00 C ATOM 890 O ARG A 53 2.045 1.254 -7.366 1.00 0.00 O ATOM 891 CB ARG A 53 0.482 0.683 -9.999 1.00 0.00 C ATOM 892 CG ARG A 53 -1.029 0.520 -9.735 1.00 0.00 C ATOM 893 CD ARG A 53 -1.712 1.453 -8.700 1.00 0.00 C ATOM 894 NE ARG A 53 -3.181 1.114 -8.690 1.00 0.00 N ATOM 895 CZ ARG A 53 -4.054 1.533 -7.718 1.00 0.00 C ATOM 896 NH1 ARG A 53 -3.633 2.326 -6.690 1.00 0.00 N ATOM 897 NH2 ARG A 53 -5.361 1.142 -7.778 1.00 0.00 N ATOM 0 H ARG A 53 0.199 -1.795 -9.868 1.00 0.00 H new ATOM 0 HA ARG A 53 2.432 -0.232 -9.477 1.00 0.00 H new ATOM 0 HB2 ARG A 53 0.762 1.718 -9.804 1.00 0.00 H new ATOM 0 HB3 ARG A 53 0.676 0.494 -11.055 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -1.546 0.648 -10.686 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.199 -0.508 -9.415 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -1.278 1.311 -7.710 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -1.561 2.499 -8.967 1.00 0.00 H new ATOM 0 HE ARG A 53 -3.547 0.540 -9.450 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -2.657 2.616 -6.636 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.295 2.629 -5.975 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.680 0.544 -8.540 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -6.018 1.448 -7.060 1.00 0.00 H new ATOM 911 N GLU A 54 0.494 -0.306 -6.886 1.00 0.00 N ATOM 912 CA GLU A 54 0.042 0.187 -5.602 1.00 0.00 C ATOM 913 C GLU A 54 0.881 -0.022 -4.376 1.00 0.00 C ATOM 914 O GLU A 54 0.349 0.196 -3.295 1.00 0.00 O ATOM 915 CB GLU A 54 -1.361 -0.425 -5.362 1.00 0.00 C ATOM 916 CG GLU A 54 -1.380 -1.960 -5.218 1.00 0.00 C ATOM 917 CD GLU A 54 -2.766 -2.444 -5.643 1.00 0.00 C ATOM 918 OE1 GLU A 54 -2.849 -3.377 -6.484 1.00 0.00 O ATOM 919 OE2 GLU A 54 -3.768 -1.853 -5.159 1.00 0.00 O ATOM 0 H GLU A 54 0.063 -1.199 -7.124 1.00 0.00 H new ATOM 0 HA GLU A 54 0.084 1.271 -5.708 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -1.785 0.016 -4.460 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -2.011 -0.144 -6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -0.608 -2.413 -5.840 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -1.171 -2.251 -4.189 1.00 0.00 H new ATOM 926 N HIS A 55 2.162 -0.482 -4.498 1.00 0.00 N ATOM 927 CA HIS A 55 3.126 -0.856 -3.441 1.00 0.00 C ATOM 928 C HIS A 55 3.124 -0.202 -2.038 1.00 0.00 C ATOM 929 O HIS A 55 4.029 0.515 -1.624 1.00 0.00 O ATOM 930 CB HIS A 55 4.565 -1.138 -3.949 1.00 0.00 C ATOM 931 CG HIS A 55 5.423 -1.849 -2.915 1.00 0.00 C ATOM 932 ND1 HIS A 55 6.598 -1.319 -2.433 1.00 0.00 N ATOM 933 CD2 HIS A 55 5.153 -2.930 -2.125 1.00 0.00 C ATOM 934 CE1 HIS A 55 6.991 -2.095 -1.393 1.00 0.00 C ATOM 935 NE2 HIS A 55 6.140 -3.078 -1.157 1.00 0.00 N ATOM 0 H HIS A 55 2.573 -0.608 -5.423 1.00 0.00 H new ATOM 0 HA HIS A 55 2.612 -1.783 -3.186 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.514 -1.745 -4.853 1.00 0.00 H new ATOM 0 HB3 HIS A 55 5.040 -0.196 -4.224 1.00 0.00 H new ATOM 0 HD1 HIS A 55 7.083 -0.496 -2.791 1.00 0.00 H new ATOM 0 HD2 HIS A 55 4.296 -3.577 -2.236 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.894 -1.929 -0.824 1.00 0.00 H new ATOM 943 N ILE A 56 2.068 -0.573 -1.272 1.00 0.00 N ATOM 944 CA ILE A 56 1.728 -0.311 0.107 1.00 0.00 C ATOM 945 C ILE A 56 2.080 -1.557 0.851 1.00 0.00 C ATOM 946 O ILE A 56 1.655 -2.647 0.501 1.00 0.00 O ATOM 947 CB ILE A 56 0.240 -0.063 0.272 1.00 0.00 C ATOM 948 CG1 ILE A 56 0.034 1.362 -0.249 1.00 0.00 C ATOM 949 CG2 ILE A 56 -0.375 -0.181 1.707 1.00 0.00 C ATOM 950 CD1 ILE A 56 -1.434 1.519 -0.528 1.00 0.00 C ATOM 0 H ILE A 56 1.340 -1.149 -1.695 1.00 0.00 H new ATOM 0 HA ILE A 56 2.256 0.572 0.467 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.280 -0.857 -0.264 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.367 2.094 0.487 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.619 1.530 -1.153 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.445 0.024 1.662 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.214 -1.189 2.090 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.105 0.540 2.369 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.628 2.524 -0.903 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.743 0.787 -1.275 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.998 1.360 0.391 1.00 0.00 H new ATOM 962 N HIS A 57 2.807 -1.434 1.964 1.00 0.00 N ATOM 963 CA HIS A 57 3.037 -2.523 2.882 1.00 0.00 C ATOM 964 C HIS A 57 2.314 -2.077 4.143 1.00 0.00 C ATOM 965 O HIS A 57 2.023 -0.892 4.315 1.00 0.00 O ATOM 966 CB HIS A 57 4.548 -2.833 3.014 1.00 0.00 C ATOM 967 CG HIS A 57 4.856 -4.217 2.495 1.00 0.00 C ATOM 968 ND1 HIS A 57 5.526 -4.540 1.332 1.00 0.00 N ATOM 969 CD2 HIS A 57 4.486 -5.407 3.043 1.00 0.00 C ATOM 970 CE1 HIS A 57 5.547 -5.898 1.256 1.00 0.00 C ATOM 971 NE2 HIS A 57 4.916 -6.466 2.268 1.00 0.00 N ATOM 0 H HIS A 57 3.252 -0.561 2.245 1.00 0.00 H new ATOM 0 HA HIS A 57 2.648 -3.490 2.564 1.00 0.00 H new ATOM 0 HB2 HIS A 57 5.126 -2.094 2.459 1.00 0.00 H new ATOM 0 HB3 HIS A 57 4.850 -2.755 4.058 1.00 0.00 H new ATOM 0 HD1 HIS A 57 5.928 -3.887 0.660 1.00 0.00 H new ATOM 0 HD2 HIS A 57 3.929 -5.509 3.963 1.00 0.00 H new ATOM 0 HE1 HIS A 57 6.025 -6.449 0.459 1.00 0.00 H new ATOM 979 N MET A 58 1.975 -3.017 5.070 1.00 0.00 N ATOM 980 CA MET A 58 1.135 -2.883 6.288 1.00 0.00 C ATOM 981 C MET A 58 1.435 -1.798 7.277 1.00 0.00 C ATOM 982 O MET A 58 0.635 -1.381 8.103 1.00 0.00 O ATOM 983 CB MET A 58 0.970 -4.246 7.012 1.00 0.00 C ATOM 984 CG MET A 58 1.785 -4.629 8.270 1.00 0.00 C ATOM 985 SD MET A 58 1.295 -3.967 9.893 1.00 0.00 S ATOM 986 CE MET A 58 -0.493 -4.131 9.644 1.00 0.00 C ATOM 0 H MET A 58 2.315 -3.973 4.971 1.00 0.00 H new ATOM 0 HA MET A 58 0.198 -2.536 5.852 1.00 0.00 H new ATOM 0 HB2 MET A 58 -0.082 -4.327 7.287 1.00 0.00 H new ATOM 0 HB3 MET A 58 1.165 -5.019 6.268 1.00 0.00 H new ATOM 0 HG2 MET A 58 1.777 -5.716 8.345 1.00 0.00 H new ATOM 0 HG3 MET A 58 2.818 -4.329 8.094 1.00 0.00 H new ATOM 0 HE1 MET A 58 -0.997 -4.125 10.610 1.00 0.00 H new ATOM 0 HE2 MET A 58 -0.854 -3.298 9.041 1.00 0.00 H new ATOM 0 HE3 MET A 58 -0.704 -5.069 9.130 1.00 0.00 H new ATOM 996 N ASN A 59 2.659 -1.321 7.120 1.00 0.00 N ATOM 997 CA ASN A 59 3.470 -0.349 7.773 1.00 0.00 C ATOM 998 C ASN A 59 3.039 1.084 7.323 1.00 0.00 C ATOM 999 O ASN A 59 3.206 2.068 8.043 1.00 0.00 O ATOM 1000 CB ASN A 59 4.911 -0.886 7.425 1.00 0.00 C ATOM 1001 CG ASN A 59 4.979 -2.431 7.678 1.00 0.00 C ATOM 1002 OD1 ASN A 59 5.070 -2.872 8.822 1.00 0.00 O ATOM 1003 ND2 ASN A 59 4.821 -3.289 6.617 1.00 0.00 N ATOM 0 H ASN A 59 3.205 -1.712 6.353 1.00 0.00 H new ATOM 0 HA ASN A 59 3.393 -0.231 8.854 1.00 0.00 H new ATOM 0 HB2 ASN A 59 5.148 -0.668 6.384 1.00 0.00 H new ATOM 0 HB3 ASN A 59 5.656 -0.375 8.035 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.779 -4.295 6.777 1.00 0.00 H new ATOM 0 HD22 ASN A 59 4.746 -2.920 5.669 1.00 0.00 H new ATOM 1010 N ALA A 60 2.339 1.189 6.133 1.00 0.00 N ATOM 1011 CA ALA A 60 1.622 2.358 5.575 1.00 0.00 C ATOM 1012 C ALA A 60 0.151 2.384 6.050 1.00 0.00 C ATOM 1013 O ALA A 60 -0.783 2.496 5.256 1.00 0.00 O ATOM 1014 CB ALA A 60 1.618 2.356 4.011 1.00 0.00 C ATOM 0 H ALA A 60 2.269 0.386 5.507 1.00 0.00 H new ATOM 0 HA ALA A 60 2.156 3.238 5.934 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.081 3.232 3.647 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.644 2.382 3.644 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.126 1.453 3.650 1.00 0.00 H new ATOM 1020 N THR A 61 -0.063 2.229 7.385 1.00 0.00 N ATOM 1021 CA THR A 61 -1.356 2.122 8.067 1.00 0.00 C ATOM 1022 C THR A 61 -1.248 2.700 9.499 1.00 0.00 C ATOM 1023 O THR A 61 -0.206 3.202 9.916 1.00 0.00 O ATOM 1024 CB THR A 61 -1.937 0.671 8.128 1.00 0.00 C ATOM 1025 OG1 THR A 61 -1.357 -0.177 9.123 1.00 0.00 O ATOM 1026 CG2 THR A 61 -1.862 -0.095 6.786 1.00 0.00 C ATOM 0 H THR A 61 0.716 2.174 8.041 1.00 0.00 H new ATOM 0 HA THR A 61 -2.056 2.702 7.466 1.00 0.00 H new ATOM 0 HB THR A 61 -2.975 0.873 8.393 1.00 0.00 H new ATOM 0 HG1 THR A 61 -0.453 -0.435 8.846 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.284 -1.092 6.912 1.00 0.00 H new ATOM 0 HG22 THR A 61 -2.427 0.445 6.027 1.00 0.00 H new ATOM 0 HG23 THR A 61 -0.821 -0.179 6.473 1.00 0.00 H new ATOM 1034 N GLN A 62 -2.347 2.541 10.301 1.00 0.00 N ATOM 1035 CA GLN A 62 -2.526 2.868 11.722 1.00 0.00 C ATOM 1036 C GLN A 62 -2.120 1.723 12.631 1.00 0.00 C ATOM 1037 O GLN A 62 -1.869 1.866 13.830 1.00 0.00 O ATOM 1038 CB GLN A 62 -4.051 3.105 11.942 1.00 0.00 C ATOM 1039 CG GLN A 62 -4.551 3.449 13.369 1.00 0.00 C ATOM 1040 CD GLN A 62 -5.448 2.356 13.955 1.00 0.00 C ATOM 1041 OE1 GLN A 62 -5.220 1.816 15.039 1.00 0.00 O ATOM 1042 NE2 GLN A 62 -6.543 2.025 13.214 1.00 0.00 N ATOM 0 H GLN A 62 -3.202 2.141 9.915 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.908 3.734 11.960 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -4.359 3.914 11.279 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -4.576 2.208 11.615 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -3.693 3.601 14.024 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -5.101 4.390 13.341 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.712 2.485 12.319 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.194 1.317 13.554 1.00 0.00 H new ATOM 1051 N TRP A 63 -2.088 0.530 12.010 1.00 0.00 N ATOM 1052 CA TRP A 63 -1.807 -0.768 12.572 1.00 0.00 C ATOM 1053 C TRP A 63 -0.299 -1.048 12.626 1.00 0.00 C ATOM 1054 O TRP A 63 0.338 -1.305 11.611 1.00 0.00 O ATOM 1055 CB TRP A 63 -2.562 -1.850 11.732 1.00 0.00 C ATOM 1056 CG TRP A 63 -3.995 -1.488 11.298 1.00 0.00 C ATOM 1057 CD1 TRP A 63 -5.048 -1.107 12.086 1.00 0.00 C ATOM 1058 CD2 TRP A 63 -4.520 -1.541 9.946 1.00 0.00 C ATOM 1059 NE1 TRP A 63 -6.190 -0.963 11.321 1.00 0.00 N ATOM 1060 CE2 TRP A 63 -5.869 -1.235 10.010 1.00 0.00 C ATOM 1061 CE3 TRP A 63 -3.949 -1.847 8.742 1.00 0.00 C ATOM 1062 CZ2 TRP A 63 -6.642 -1.259 8.888 1.00 0.00 C ATOM 1063 CZ3 TRP A 63 -4.718 -1.752 7.589 1.00 0.00 C ATOM 1064 CH2 TRP A 63 -6.068 -1.464 7.648 1.00 0.00 C ATOM 0 H TRP A 63 -2.278 0.464 11.010 1.00 0.00 H new ATOM 0 HA TRP A 63 -2.160 -0.798 13.603 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -1.975 -2.062 10.838 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -2.601 -2.771 12.314 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -4.994 -0.943 13.152 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.112 -0.700 11.668 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.916 -2.158 8.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.710 -1.117 8.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -4.251 -1.906 6.627 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.660 -1.401 6.747 1.00 0.00 H new ATOM 1075 N GLU A 64 0.308 -1.026 13.844 1.00 0.00 N ATOM 1076 CA GLU A 64 1.731 -1.296 14.110 1.00 0.00 C ATOM 1077 C GLU A 64 2.200 -2.754 13.992 1.00 0.00 C ATOM 1078 O GLU A 64 3.386 -3.077 14.062 1.00 0.00 O ATOM 1079 CB GLU A 64 2.090 -0.717 15.490 1.00 0.00 C ATOM 1080 CG GLU A 64 1.385 -1.465 16.616 1.00 0.00 C ATOM 1081 CD GLU A 64 1.452 -0.699 17.931 1.00 0.00 C ATOM 1082 OE1 GLU A 64 2.588 -0.405 18.391 1.00 0.00 O ATOM 1083 OE2 GLU A 64 0.366 -0.397 18.496 1.00 0.00 O ATOM 0 H GLU A 64 -0.210 -0.810 14.696 1.00 0.00 H new ATOM 0 HA GLU A 64 2.272 -0.803 13.302 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.169 -0.770 15.637 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.815 0.337 15.525 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.342 -1.632 16.345 1.00 0.00 H new ATOM 0 HG3 GLU A 64 1.842 -2.446 16.743 1.00 0.00 H new ATOM 1090 N THR A 65 1.223 -3.678 13.861 1.00 0.00 N ATOM 1091 CA THR A 65 1.367 -5.126 13.829 1.00 0.00 C ATOM 1092 C THR A 65 0.255 -5.603 12.906 1.00 0.00 C ATOM 1093 O THR A 65 -0.778 -4.941 12.832 1.00 0.00 O ATOM 1094 CB THR A 65 1.177 -5.769 15.228 1.00 0.00 C ATOM 1095 OG1 THR A 65 -0.049 -5.405 15.863 1.00 0.00 O ATOM 1096 CG2 THR A 65 2.306 -5.351 16.181 1.00 0.00 C ATOM 0 H THR A 65 0.247 -3.397 13.769 1.00 0.00 H new ATOM 0 HA THR A 65 2.366 -5.406 13.496 1.00 0.00 H new ATOM 0 HB THR A 65 1.178 -6.843 15.041 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.107 -5.844 16.737 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.150 -5.815 17.155 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.264 -5.675 15.774 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.306 -4.267 16.291 1.00 0.00 H new ATOM 1104 N LEU A 66 0.351 -6.782 12.209 1.00 0.00 N ATOM 1105 CA LEU A 66 -0.698 -7.333 11.331 1.00 0.00 C ATOM 1106 C LEU A 66 -1.886 -7.955 12.093 1.00 0.00 C ATOM 1107 O LEU A 66 -2.906 -8.322 11.526 1.00 0.00 O ATOM 1108 CB LEU A 66 -0.096 -8.271 10.233 1.00 0.00 C ATOM 1109 CG LEU A 66 -0.766 -8.218 8.824 1.00 0.00 C ATOM 1110 CD1 LEU A 66 0.057 -8.935 7.735 1.00 0.00 C ATOM 1111 CD2 LEU A 66 -2.213 -8.741 8.749 1.00 0.00 C ATOM 0 H LEU A 66 1.180 -7.374 12.254 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.138 -6.484 10.808 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.960 -8.026 10.117 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.147 -9.297 10.596 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.796 -7.145 8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.462 -8.862 6.779 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.037 -8.466 7.652 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.179 -9.985 8.003 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.578 -8.657 7.725 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.239 -9.786 9.059 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.848 -8.151 9.410 1.00 0.00 H new ATOM 1123 N THR A 67 -1.815 -7.993 13.449 1.00 0.00 N ATOM 1124 CA THR A 67 -2.780 -8.431 14.442 1.00 0.00 C ATOM 1125 C THR A 67 -3.766 -7.309 14.647 1.00 0.00 C ATOM 1126 O THR A 67 -4.948 -7.557 14.761 1.00 0.00 O ATOM 1127 CB THR A 67 -2.109 -8.820 15.766 1.00 0.00 C ATOM 1128 OG1 THR A 67 -1.080 -9.776 15.546 1.00 0.00 O ATOM 1129 CG2 THR A 67 -3.146 -9.452 16.705 1.00 0.00 C ATOM 0 H THR A 67 -0.964 -7.672 13.910 1.00 0.00 H new ATOM 0 HA THR A 67 -3.287 -9.328 14.085 1.00 0.00 H new ATOM 0 HB THR A 67 -1.686 -7.917 16.207 1.00 0.00 H new ATOM 0 HG1 THR A 67 -1.473 -10.608 15.208 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.666 -9.727 17.644 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.944 -8.736 16.901 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.565 -10.343 16.237 1.00 0.00 H new ATOM 1137 N ASP A 68 -3.333 -6.019 14.620 1.00 0.00 N ATOM 1138 CA ASP A 68 -4.195 -4.830 14.682 1.00 0.00 C ATOM 1139 C ASP A 68 -5.005 -4.524 13.426 1.00 0.00 C ATOM 1140 O ASP A 68 -6.131 -4.027 13.489 1.00 0.00 O ATOM 1141 CB ASP A 68 -3.375 -3.593 15.159 1.00 0.00 C ATOM 1142 CG ASP A 68 -4.188 -2.676 16.075 1.00 0.00 C ATOM 1143 OD1 ASP A 68 -4.655 -3.164 17.139 1.00 0.00 O ATOM 1144 OD2 ASP A 68 -4.349 -1.477 15.725 1.00 0.00 O ATOM 0 H ASP A 68 -2.343 -5.783 14.552 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.961 -5.074 15.419 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -2.484 -3.932 15.687 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.036 -3.028 14.291 1.00 0.00 H new ATOM 1149 N PHE A 69 -4.458 -4.911 12.239 1.00 0.00 N ATOM 1150 CA PHE A 69 -5.112 -4.880 10.929 1.00 0.00 C ATOM 1151 C PHE A 69 -6.177 -5.988 10.836 1.00 0.00 C ATOM 1152 O PHE A 69 -7.272 -5.827 10.290 1.00 0.00 O ATOM 1153 CB PHE A 69 -3.992 -5.002 9.845 1.00 0.00 C ATOM 1154 CG PHE A 69 -4.418 -5.234 8.410 1.00 0.00 C ATOM 1155 CD1 PHE A 69 -5.655 -4.863 7.911 1.00 0.00 C ATOM 1156 CD2 PHE A 69 -3.589 -5.981 7.600 1.00 0.00 C ATOM 1157 CE1 PHE A 69 -6.124 -5.413 6.744 1.00 0.00 C ATOM 1158 CE2 PHE A 69 -4.059 -6.552 6.441 1.00 0.00 C ATOM 1159 CZ PHE A 69 -5.352 -6.310 6.035 1.00 0.00 C ATOM 0 H PHE A 69 -3.504 -5.267 12.184 1.00 0.00 H new ATOM 0 HA PHE A 69 -5.650 -3.946 10.768 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -3.397 -4.089 9.874 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -3.333 -5.821 10.135 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -6.254 -4.138 8.442 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -2.555 -6.120 7.880 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.103 -5.142 6.379 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -3.416 -7.188 5.851 1.00 0.00 H new ATOM 0 HZ PHE A 69 -5.757 -6.816 5.172 1.00 0.00 H new ATOM 1169 N THR A 70 -5.858 -7.165 11.426 1.00 0.00 N ATOM 1170 CA THR A 70 -6.757 -8.314 11.537 1.00 0.00 C ATOM 1171 C THR A 70 -7.865 -8.079 12.562 1.00 0.00 C ATOM 1172 O THR A 70 -9.019 -8.440 12.336 1.00 0.00 O ATOM 1173 CB THR A 70 -6.011 -9.628 11.667 1.00 0.00 C ATOM 1174 OG1 THR A 70 -4.862 -9.539 12.454 1.00 0.00 O ATOM 1175 CG2 THR A 70 -5.572 -10.091 10.270 1.00 0.00 C ATOM 0 H THR A 70 -4.944 -7.335 11.845 1.00 0.00 H new ATOM 0 HA THR A 70 -7.287 -8.415 10.590 1.00 0.00 H new ATOM 0 HB THR A 70 -6.697 -10.327 12.146 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.069 -9.544 11.878 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.034 -11.036 10.352 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.450 -10.227 9.639 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.919 -9.339 9.826 1.00 0.00 H new ATOM 1183 N LYS A 71 -7.548 -7.344 13.684 1.00 0.00 N ATOM 1184 CA LYS A 71 -8.561 -6.848 14.641 1.00 0.00 C ATOM 1185 C LYS A 71 -9.591 -5.843 14.036 1.00 0.00 C ATOM 1186 O LYS A 71 -10.770 -5.866 14.380 1.00 0.00 O ATOM 1187 CB LYS A 71 -7.970 -6.119 15.892 1.00 0.00 C ATOM 1188 CG LYS A 71 -7.050 -6.916 16.837 1.00 0.00 C ATOM 1189 CD LYS A 71 -7.252 -8.436 16.852 1.00 0.00 C ATOM 1190 CE LYS A 71 -6.602 -9.135 18.052 1.00 0.00 C ATOM 1191 NZ LYS A 71 -7.312 -8.823 19.315 1.00 0.00 N ATOM 0 H LYS A 71 -6.592 -7.091 13.933 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.047 -7.782 14.924 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.412 -5.252 15.538 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.805 -5.742 16.482 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.015 -6.710 16.563 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -7.192 -6.541 17.851 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.321 -8.651 16.853 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.843 -8.857 15.933 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.603 -10.213 17.890 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.560 -8.826 18.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -6.981 -9.461 20.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.119 -7.838 19.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.335 -8.950 19.179 1.00 0.00 H new ATOM 1205 N TRP A 72 -9.131 -4.961 13.094 1.00 0.00 N ATOM 1206 CA TRP A 72 -9.933 -3.973 12.355 1.00 0.00 C ATOM 1207 C TRP A 72 -10.731 -4.599 11.202 1.00 0.00 C ATOM 1208 O TRP A 72 -11.924 -4.364 11.079 1.00 0.00 O ATOM 1209 CB TRP A 72 -9.083 -2.750 11.861 1.00 0.00 C ATOM 1210 CG TRP A 72 -9.810 -1.637 11.079 1.00 0.00 C ATOM 1211 CD1 TRP A 72 -10.411 -0.485 11.506 1.00 0.00 C ATOM 1212 CD2 TRP A 72 -10.021 -1.695 9.654 1.00 0.00 C ATOM 1213 NE1 TRP A 72 -10.983 0.175 10.436 1.00 0.00 N ATOM 1214 CE2 TRP A 72 -10.759 -0.571 9.290 1.00 0.00 C ATOM 1215 CE3 TRP A 72 -9.616 -2.607 8.720 1.00 0.00 C ATOM 1216 CZ2 TRP A 72 -11.119 -0.361 7.981 1.00 0.00 C ATOM 1217 CZ3 TRP A 72 -9.949 -2.379 7.410 1.00 0.00 C ATOM 1218 CH2 TRP A 72 -10.699 -1.285 7.037 1.00 0.00 C ATOM 0 H TRP A 72 -8.146 -4.931 12.829 1.00 0.00 H new ATOM 0 HA TRP A 72 -10.657 -3.590 13.074 1.00 0.00 H new ATOM 0 HB2 TRP A 72 -8.613 -2.295 12.733 1.00 0.00 H new ATOM 0 HB3 TRP A 72 -8.281 -3.133 11.230 1.00 0.00 H new ATOM 0 HD1 TRP A 72 -10.435 -0.142 12.530 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -11.485 1.062 10.482 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -9.050 -3.481 9.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -11.710 0.497 7.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -9.616 -3.073 6.653 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -10.962 -1.146 5.999 1.00 0.00 H new ATOM 1229 N LEU A 73 -10.123 -5.428 10.310 1.00 0.00 N ATOM 1230 CA LEU A 73 -10.763 -6.135 9.184 1.00 0.00 C ATOM 1231 C LEU A 73 -11.787 -7.190 9.567 1.00 0.00 C ATOM 1232 O LEU A 73 -12.840 -7.366 8.947 1.00 0.00 O ATOM 1233 CB LEU A 73 -9.883 -6.264 7.932 1.00 0.00 C ATOM 1234 CG LEU A 73 -9.662 -7.639 7.238 1.00 0.00 C ATOM 1235 CD1 LEU A 73 -9.319 -7.260 5.803 1.00 0.00 C ATOM 1236 CD2 LEU A 73 -8.553 -8.556 7.745 1.00 0.00 C ATOM 0 H LEU A 73 -9.124 -5.626 10.366 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.503 -5.470 8.739 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.298 -5.592 7.181 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -8.898 -5.879 8.195 1.00 0.00 H new ATOM 0 HG LEU A 73 -10.561 -8.229 7.420 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.142 -8.164 5.220 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -10.148 -6.703 5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.421 -6.642 5.795 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.537 -9.470 7.152 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.592 -8.049 7.656 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.736 -8.805 8.790 1.00 0.00 H new ATOM 1248 N GLY A 74 -11.473 -7.816 10.743 1.00 0.00 N ATOM 1249 CA GLY A 74 -12.387 -8.571 11.605 1.00 0.00 C ATOM 1250 C GLY A 74 -13.570 -7.795 12.170 1.00 0.00 C ATOM 1251 O GLY A 74 -14.627 -8.371 12.399 1.00 0.00 O ATOM 0 H GLY A 74 -10.524 -7.796 11.117 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.772 -9.418 11.038 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -11.815 -8.979 12.438 1.00 0.00 H new ATOM 1255 N ARG A 75 -13.412 -6.456 12.368 1.00 0.00 N ATOM 1256 CA ARG A 75 -14.424 -5.502 12.847 1.00 0.00 C ATOM 1257 C ARG A 75 -15.354 -4.969 11.769 1.00 0.00 C ATOM 1258 O ARG A 75 -16.557 -4.842 11.975 1.00 0.00 O ATOM 1259 CB ARG A 75 -13.720 -4.366 13.601 1.00 0.00 C ATOM 1260 CG ARG A 75 -14.591 -3.393 14.407 1.00 0.00 C ATOM 1261 CD ARG A 75 -14.856 -2.073 13.659 1.00 0.00 C ATOM 1262 NE ARG A 75 -15.527 -1.106 14.596 1.00 0.00 N ATOM 1263 CZ ARG A 75 -15.784 0.197 14.263 1.00 0.00 C ATOM 1264 NH1 ARG A 75 -15.438 0.690 13.038 1.00 0.00 N ATOM 1265 NH2 ARG A 75 -16.394 1.014 15.172 1.00 0.00 N ATOM 0 H ARG A 75 -12.519 -5.999 12.184 1.00 0.00 H new ATOM 0 HA ARG A 75 -15.086 -6.049 13.519 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.999 -4.814 14.284 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.152 -3.784 12.875 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -15.542 -3.871 14.640 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -14.102 -3.176 15.357 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -13.919 -1.653 13.292 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.487 -2.253 12.789 1.00 0.00 H new ATOM 0 HE ARG A 75 -15.803 -1.436 15.521 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -14.981 0.085 12.355 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -15.636 1.663 12.805 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -16.654 0.652 16.089 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -16.590 1.986 14.933 1.00 0.00 H new ATOM 1279 N GLU A 76 -14.802 -4.694 10.558 1.00 0.00 N ATOM 1280 CA GLU A 76 -15.436 -4.232 9.322 1.00 0.00 C ATOM 1281 C GLU A 76 -16.362 -5.251 8.703 1.00 0.00 C ATOM 1282 O GLU A 76 -17.286 -4.899 7.973 1.00 0.00 O ATOM 1283 CB GLU A 76 -14.324 -3.716 8.440 1.00 0.00 C ATOM 1284 CG GLU A 76 -13.505 -2.547 8.962 1.00 0.00 C ATOM 1285 CD GLU A 76 -14.277 -1.231 8.926 1.00 0.00 C ATOM 1286 OE1 GLU A 76 -14.454 -0.620 10.014 1.00 0.00 O ATOM 1287 OE2 GLU A 76 -14.694 -0.812 7.812 1.00 0.00 O ATOM 0 H GLU A 76 -13.797 -4.806 10.423 1.00 0.00 H new ATOM 0 HA GLU A 76 -16.135 -3.417 9.510 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -13.642 -4.542 8.239 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -14.760 -3.423 7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -13.194 -2.754 9.986 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.597 -2.449 8.366 1.00 0.00 H new ATOM 1294 N GLY A 77 -16.172 -6.541 9.086 1.00 0.00 N ATOM 1295 CA GLY A 77 -17.147 -7.610 8.848 1.00 0.00 C ATOM 1296 C GLY A 77 -16.891 -8.300 7.558 1.00 0.00 C ATOM 1297 O GLY A 77 -17.720 -9.020 7.015 1.00 0.00 O ATOM 0 H GLY A 77 -15.332 -6.858 9.569 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -17.104 -8.332 9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -18.154 -7.192 8.845 1.00 0.00 H new ATOM 1301 N LEU A 78 -15.671 -8.060 7.035 1.00 0.00 N ATOM 1302 CA LEU A 78 -15.190 -8.577 5.768 1.00 0.00 C ATOM 1303 C LEU A 78 -14.406 -9.819 5.954 1.00 0.00 C ATOM 1304 O LEU A 78 -14.381 -10.665 5.083 1.00 0.00 O ATOM 1305 CB LEU A 78 -14.293 -7.559 5.017 1.00 0.00 C ATOM 1306 CG LEU A 78 -15.007 -6.211 4.868 1.00 0.00 C ATOM 1307 CD1 LEU A 78 -14.489 -5.282 5.932 1.00 0.00 C ATOM 1308 CD2 LEU A 78 -16.510 -6.324 4.529 1.00 0.00 C ATOM 0 H LEU A 78 -14.981 -7.479 7.511 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.083 -8.777 5.176 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.358 -7.422 5.560 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.036 -7.950 4.033 1.00 0.00 H new ATOM 0 HG LEU A 78 -14.751 -5.684 3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.985 -4.315 5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.692 -5.706 6.915 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.414 -5.151 5.809 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.939 -5.326 4.441 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.631 -6.856 3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.022 -6.870 5.321 1.00 0.00 H new ATOM 1320 N CYS A 79 -13.687 -10.001 7.070 1.00 0.00 N ATOM 1321 CA CYS A 79 -12.867 -11.198 7.240 1.00 0.00 C ATOM 1322 C CYS A 79 -12.881 -11.771 8.635 1.00 0.00 C ATOM 1323 O CYS A 79 -12.930 -11.059 9.627 1.00 0.00 O ATOM 1324 CB CYS A 79 -11.420 -11.049 6.702 1.00 0.00 C ATOM 1325 SG CYS A 79 -11.205 -9.996 5.223 1.00 0.00 S ATOM 0 H CYS A 79 -13.659 -9.346 7.852 1.00 0.00 H new ATOM 0 HA CYS A 79 -13.364 -11.933 6.607 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -10.798 -10.646 7.501 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -11.037 -12.043 6.472 1.00 0.00 H new ATOM 0 HG CYS A 79 -10.694 -10.702 4.258 1.00 0.00 H new ATOM 1331 N LYS A 80 -12.790 -13.117 8.721 1.00 0.00 N ATOM 1332 CA LYS A 80 -12.685 -13.951 9.899 1.00 0.00 C ATOM 1333 C LYS A 80 -11.216 -14.305 10.072 1.00 0.00 C ATOM 1334 O LYS A 80 -10.488 -14.436 9.099 1.00 0.00 O ATOM 1335 CB LYS A 80 -13.593 -15.204 9.722 1.00 0.00 C ATOM 1336 CG LYS A 80 -14.987 -15.014 10.331 1.00 0.00 C ATOM 1337 CD LYS A 80 -16.003 -16.071 9.876 1.00 0.00 C ATOM 1338 CE LYS A 80 -17.383 -15.885 10.520 1.00 0.00 C ATOM 1339 NZ LYS A 80 -18.337 -16.906 10.026 1.00 0.00 N ATOM 0 H LYS A 80 -12.790 -13.685 7.873 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.028 -13.441 10.799 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -13.692 -15.429 8.660 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.112 -16.065 10.186 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.907 -15.042 11.418 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.360 -14.025 10.065 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.104 -16.028 8.792 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.623 -17.063 10.121 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.296 -15.957 11.604 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.762 -14.888 10.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.264 -16.761 10.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.435 -16.819 8.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.983 -17.855 10.262 1.00 0.00 H new ATOM 1353 N VAL A 81 -10.690 -14.394 11.309 1.00 0.00 N ATOM 1354 CA VAL A 81 -9.269 -14.530 11.540 1.00 0.00 C ATOM 1355 C VAL A 81 -8.955 -15.629 12.522 1.00 0.00 C ATOM 1356 O VAL A 81 -9.647 -15.839 13.518 1.00 0.00 O ATOM 1357 CB VAL A 81 -8.687 -13.216 12.055 1.00 0.00 C ATOM 1358 CG1 VAL A 81 -9.733 -12.324 12.742 1.00 0.00 C ATOM 1359 CG2 VAL A 81 -8.043 -12.436 10.911 1.00 0.00 C ATOM 0 H VAL A 81 -11.249 -14.372 12.162 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.816 -14.790 10.583 1.00 0.00 H new ATOM 0 HB VAL A 81 -7.940 -13.485 12.802 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.258 -11.405 13.086 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.525 -12.080 12.034 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -10.159 -12.853 13.594 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.632 -11.502 11.294 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -7.243 -13.031 10.471 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -8.794 -12.218 10.151 1.00 0.00 H new ATOM 1369 N ASP A 82 -7.811 -16.308 12.244 1.00 0.00 N ATOM 1370 CA ASP A 82 -7.218 -17.333 13.107 1.00 0.00 C ATOM 1371 C ASP A 82 -5.694 -17.234 13.076 1.00 0.00 C ATOM 1372 O ASP A 82 -5.099 -16.829 12.077 1.00 0.00 O ATOM 1373 CB ASP A 82 -7.610 -18.790 12.700 1.00 0.00 C ATOM 1374 CG ASP A 82 -9.113 -19.030 12.876 1.00 0.00 C ATOM 1375 OD1 ASP A 82 -9.804 -19.259 11.848 1.00 0.00 O ATOM 1376 OD2 ASP A 82 -9.583 -18.992 14.045 1.00 0.00 O ATOM 0 H ASP A 82 -7.273 -16.146 11.393 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.611 -17.140 14.105 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.330 -18.968 11.662 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -7.052 -19.503 13.307 1.00 0.00 H new ATOM 1381 N GLU A 83 -5.001 -17.625 14.185 1.00 0.00 N ATOM 1382 CA GLU A 83 -3.547 -17.617 14.282 1.00 0.00 C ATOM 1383 C GLU A 83 -3.047 -19.019 14.590 1.00 0.00 C ATOM 1384 O GLU A 83 -3.628 -19.766 15.382 1.00 0.00 O ATOM 1385 CB GLU A 83 -3.026 -16.558 15.283 1.00 0.00 C ATOM 1386 CG GLU A 83 -1.529 -16.200 15.109 1.00 0.00 C ATOM 1387 CD GLU A 83 -0.578 -16.974 16.029 1.00 0.00 C ATOM 1388 OE1 GLU A 83 -1.050 -17.745 16.906 1.00 0.00 O ATOM 1389 OE2 GLU A 83 0.658 -16.781 15.864 1.00 0.00 O ATOM 0 H GLU A 83 -5.460 -17.954 15.034 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.138 -17.317 13.317 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -3.620 -15.650 15.176 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -3.185 -16.924 16.297 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.243 -16.385 14.074 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.400 -15.133 15.290 1.00 0.00 H new ATOM 1396 N THR A 84 -1.935 -19.382 13.894 1.00 0.00 N ATOM 1397 CA THR A 84 -1.280 -20.683 13.894 1.00 0.00 C ATOM 1398 C THR A 84 0.187 -20.558 14.261 1.00 0.00 C ATOM 1399 O THR A 84 0.698 -19.440 14.339 1.00 0.00 O ATOM 1400 CB THR A 84 -1.287 -21.304 12.467 1.00 0.00 C ATOM 1401 OG1 THR A 84 -0.513 -20.625 11.487 1.00 0.00 O ATOM 1402 CG2 THR A 84 -2.695 -21.304 11.866 1.00 0.00 C ATOM 0 H THR A 84 -1.456 -18.718 13.285 1.00 0.00 H new ATOM 0 HA THR A 84 -1.825 -21.296 14.612 1.00 0.00 H new ATOM 0 HB THR A 84 -0.869 -22.293 12.653 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.096 -20.328 10.758 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.665 -21.744 10.869 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.362 -21.888 12.501 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.062 -20.280 11.799 1.00 0.00 H new ATOM 1410 N PRO A 85 0.939 -21.679 14.397 1.00 0.00 N ATOM 1411 CA PRO A 85 2.396 -21.666 14.401 1.00 0.00 C ATOM 1412 C PRO A 85 3.110 -21.226 13.087 1.00 0.00 C ATOM 1413 O PRO A 85 4.330 -21.089 13.107 1.00 0.00 O ATOM 1414 CB PRO A 85 2.777 -23.107 14.817 1.00 0.00 C ATOM 1415 CG PRO A 85 1.530 -23.653 15.514 1.00 0.00 C ATOM 1416 CD PRO A 85 0.421 -23.022 14.679 1.00 0.00 C ATOM 0 HA PRO A 85 2.745 -20.890 15.082 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.043 -23.712 13.950 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.638 -23.112 15.485 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.491 -24.742 15.493 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.479 -23.352 16.560 1.00 0.00 H new ATOM 0 HD2 PRO A 85 0.237 -23.584 13.763 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -0.522 -22.984 15.224 1.00 0.00 H new ATOM 1424 N LYS A 86 2.374 -21.003 11.961 1.00 0.00 N ATOM 1425 CA LYS A 86 2.857 -20.588 10.659 1.00 0.00 C ATOM 1426 C LYS A 86 2.245 -19.254 10.223 1.00 0.00 C ATOM 1427 O LYS A 86 2.121 -18.987 9.025 1.00 0.00 O ATOM 1428 CB LYS A 86 2.523 -21.677 9.613 1.00 0.00 C ATOM 1429 CG LYS A 86 3.281 -22.984 9.883 1.00 0.00 C ATOM 1430 CD LYS A 86 3.262 -23.927 8.677 1.00 0.00 C ATOM 1431 CE LYS A 86 3.970 -25.262 8.951 1.00 0.00 C ATOM 1432 NZ LYS A 86 3.949 -26.129 7.751 1.00 0.00 N ATOM 0 H LYS A 86 1.361 -21.123 11.965 1.00 0.00 H new ATOM 0 HA LYS A 86 3.936 -20.452 10.730 1.00 0.00 H new ATOM 0 HB2 LYS A 86 1.450 -21.871 9.622 1.00 0.00 H new ATOM 0 HB3 LYS A 86 2.773 -21.312 8.617 1.00 0.00 H new ATOM 0 HG2 LYS A 86 4.314 -22.755 10.146 1.00 0.00 H new ATOM 0 HG3 LYS A 86 2.838 -23.488 10.742 1.00 0.00 H new ATOM 0 HD2 LYS A 86 2.228 -24.122 8.391 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.740 -23.435 7.830 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.001 -25.076 9.252 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.483 -25.773 9.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 4.433 -27.025 7.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 2.964 -26.323 7.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.435 -25.649 6.967 1.00 0.00 H new ATOM 1446 N GLY A 87 1.816 -18.376 11.178 1.00 0.00 N ATOM 1447 CA GLY A 87 1.318 -17.029 10.878 1.00 0.00 C ATOM 1448 C GLY A 87 -0.118 -16.705 11.186 1.00 0.00 C ATOM 1449 O GLY A 87 -0.835 -17.470 11.838 1.00 0.00 O ATOM 0 H GLY A 87 1.812 -18.598 12.174 1.00 0.00 H new ATOM 0 HA2 GLY A 87 1.941 -16.318 11.420 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.477 -16.847 9.815 1.00 0.00 H new ATOM 1453 N TRP A 88 -0.551 -15.527 10.641 1.00 0.00 N ATOM 1454 CA TRP A 88 -1.878 -14.910 10.676 1.00 0.00 C ATOM 1455 C TRP A 88 -2.612 -15.243 9.372 1.00 0.00 C ATOM 1456 O TRP A 88 -2.280 -14.760 8.287 1.00 0.00 O ATOM 1457 CB TRP A 88 -1.831 -13.353 10.910 1.00 0.00 C ATOM 1458 CG TRP A 88 -1.876 -12.947 12.384 1.00 0.00 C ATOM 1459 CD1 TRP A 88 -0.890 -12.838 13.323 1.00 0.00 C ATOM 1460 CD2 TRP A 88 -3.111 -12.706 13.077 1.00 0.00 C ATOM 1461 NE1 TRP A 88 -1.443 -12.562 14.565 1.00 0.00 N ATOM 1462 CE2 TRP A 88 -2.819 -12.550 14.426 1.00 0.00 C ATOM 1463 CE3 TRP A 88 -4.391 -12.622 12.626 1.00 0.00 C ATOM 1464 CZ2 TRP A 88 -3.823 -12.389 15.339 1.00 0.00 C ATOM 1465 CZ3 TRP A 88 -5.381 -12.406 13.553 1.00 0.00 C ATOM 1466 CH2 TRP A 88 -5.121 -12.283 14.891 1.00 0.00 C ATOM 0 H TRP A 88 0.101 -14.942 10.118 1.00 0.00 H new ATOM 0 HA TRP A 88 -2.416 -15.321 11.530 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -0.921 -12.955 10.461 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -2.671 -12.892 10.390 1.00 0.00 H new ATOM 0 HD1 TRP A 88 0.166 -12.950 13.127 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -0.926 -12.397 15.429 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -4.621 -12.722 11.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -3.602 -12.346 16.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -6.403 -12.330 13.213 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -5.926 -12.105 15.589 1.00 0.00 H new ATOM 1477 N TYR A 89 -3.661 -16.106 9.488 1.00 0.00 N ATOM 1478 CA TYR A 89 -4.515 -16.622 8.428 1.00 0.00 C ATOM 1479 C TYR A 89 -5.856 -15.976 8.588 1.00 0.00 C ATOM 1480 O TYR A 89 -6.420 -15.914 9.678 1.00 0.00 O ATOM 1481 CB TYR A 89 -4.733 -18.167 8.454 1.00 0.00 C ATOM 1482 CG TYR A 89 -3.429 -18.793 8.105 1.00 0.00 C ATOM 1483 CD1 TYR A 89 -3.136 -19.130 6.801 1.00 0.00 C ATOM 1484 CD2 TYR A 89 -2.454 -18.898 9.065 1.00 0.00 C ATOM 1485 CE1 TYR A 89 -1.851 -19.489 6.443 1.00 0.00 C ATOM 1486 CE2 TYR A 89 -1.166 -19.209 8.710 1.00 0.00 C ATOM 1487 CZ TYR A 89 -0.848 -19.480 7.397 1.00 0.00 C ATOM 1488 OH TYR A 89 0.502 -19.690 7.040 1.00 0.00 O ATOM 0 H TYR A 89 -3.935 -16.474 10.399 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.018 -16.396 7.485 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -5.067 -18.493 9.439 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -5.505 -18.460 7.742 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -3.916 -19.113 6.054 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -2.702 -18.735 10.104 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -1.630 -19.775 5.425 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -0.395 -19.242 9.466 1.00 0.00 H new ATOM 0 HH TYR A 89 1.068 -19.600 7.835 1.00 0.00 H new ATOM 1498 N ILE A 90 -6.401 -15.464 7.484 1.00 0.00 N ATOM 1499 CA ILE A 90 -7.675 -14.800 7.393 1.00 0.00 C ATOM 1500 C ILE A 90 -8.497 -15.543 6.372 1.00 0.00 C ATOM 1501 O ILE A 90 -8.041 -15.892 5.284 1.00 0.00 O ATOM 1502 CB ILE A 90 -7.602 -13.294 7.055 1.00 0.00 C ATOM 1503 CG1 ILE A 90 -7.502 -12.890 5.552 1.00 0.00 C ATOM 1504 CG2 ILE A 90 -6.409 -12.680 7.808 1.00 0.00 C ATOM 1505 CD1 ILE A 90 -7.895 -11.438 5.267 1.00 0.00 C ATOM 0 H ILE A 90 -5.926 -15.511 6.583 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.134 -14.824 8.381 1.00 0.00 H new ATOM 0 HB ILE A 90 -8.572 -12.907 7.368 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.480 -13.052 5.211 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -8.142 -13.550 4.966 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -6.343 -11.616 7.580 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.548 -12.813 8.881 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.489 -13.175 7.497 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -7.798 -11.238 4.200 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -8.928 -11.273 5.575 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -7.239 -10.768 5.823 1.00 0.00 H new ATOM 1517 N GLN A 91 -9.782 -15.755 6.669 1.00 0.00 N ATOM 1518 CA GLN A 91 -10.760 -16.288 5.773 1.00 0.00 C ATOM 1519 C GLN A 91 -11.834 -15.230 5.753 1.00 0.00 C ATOM 1520 O GLN A 91 -12.343 -14.844 6.792 1.00 0.00 O ATOM 1521 CB GLN A 91 -11.261 -17.673 6.251 1.00 0.00 C ATOM 1522 CG GLN A 91 -12.602 -18.079 5.615 1.00 0.00 C ATOM 1523 CD GLN A 91 -12.889 -19.558 5.812 1.00 0.00 C ATOM 1524 OE1 GLN A 91 -12.815 -20.075 6.930 1.00 0.00 O ATOM 1525 NE2 GLN A 91 -13.247 -20.261 4.703 1.00 0.00 N ATOM 0 H GLN A 91 -10.167 -15.543 7.590 1.00 0.00 H new ATOM 0 HA GLN A 91 -10.378 -16.484 4.771 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.510 -18.427 6.014 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.369 -17.660 7.336 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.407 -17.490 6.054 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -12.584 -17.850 4.549 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.296 -19.795 3.797 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -13.467 -21.254 4.778 1.00 0.00 H new ATOM 1534 N TYR A 92 -12.213 -14.730 4.561 1.00 0.00 N ATOM 1535 CA TYR A 92 -13.246 -13.740 4.293 1.00 0.00 C ATOM 1536 C TYR A 92 -14.678 -14.194 4.688 1.00 0.00 C ATOM 1537 O TYR A 92 -15.012 -15.378 4.670 1.00 0.00 O ATOM 1538 CB TYR A 92 -13.019 -13.193 2.865 1.00 0.00 C ATOM 1539 CG TYR A 92 -13.943 -12.085 2.340 1.00 0.00 C ATOM 1540 CD1 TYR A 92 -15.190 -12.229 1.734 1.00 0.00 C ATOM 1541 CD2 TYR A 92 -13.490 -10.794 2.469 1.00 0.00 C ATOM 1542 CE1 TYR A 92 -15.984 -11.132 1.431 1.00 0.00 C ATOM 1543 CE2 TYR A 92 -14.260 -9.717 2.136 1.00 0.00 C ATOM 1544 CZ TYR A 92 -15.542 -9.860 1.695 1.00 0.00 C ATOM 1545 OH TYR A 92 -16.349 -8.711 1.549 1.00 0.00 O ATOM 0 H TYR A 92 -11.762 -15.040 3.700 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.156 -12.885 4.964 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -11.996 -12.821 2.813 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -13.088 -14.034 2.175 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -15.547 -13.220 1.494 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -12.492 -10.626 2.846 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -16.956 -11.280 0.985 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -13.842 -8.725 2.224 1.00 0.00 H new ATOM 0 HH TYR A 92 -15.832 -7.915 1.792 1.00 0.00 H new ATOM 1555 N ILE A 93 -15.531 -13.234 5.116 1.00 0.00 N ATOM 1556 CA ILE A 93 -16.936 -13.306 5.505 1.00 0.00 C ATOM 1557 C ILE A 93 -17.598 -12.944 4.199 1.00 0.00 C ATOM 1558 O ILE A 93 -17.537 -11.785 3.805 1.00 0.00 O ATOM 1559 CB ILE A 93 -17.278 -12.211 6.539 1.00 0.00 C ATOM 1560 CG1 ILE A 93 -16.392 -12.325 7.806 1.00 0.00 C ATOM 1561 CG2 ILE A 93 -18.799 -12.098 6.810 1.00 0.00 C ATOM 1562 CD1 ILE A 93 -17.004 -11.854 9.124 1.00 0.00 C ATOM 0 H ILE A 93 -15.195 -12.275 5.203 1.00 0.00 H new ATOM 0 HA ILE A 93 -17.225 -14.260 5.947 1.00 0.00 H new ATOM 0 HB ILE A 93 -17.021 -11.247 6.100 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -16.099 -13.369 7.922 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -15.479 -11.755 7.633 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -18.980 -11.313 7.544 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -19.317 -11.854 5.882 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -19.172 -13.047 7.194 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -16.281 -11.988 9.929 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -17.269 -10.800 9.046 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -17.899 -12.438 9.339 1.00 0.00 H new ATOM 1574 N ASP A 94 -18.214 -13.920 3.479 1.00 0.00 N ATOM 1575 CA ASP A 94 -18.695 -13.839 2.091 1.00 0.00 C ATOM 1576 C ASP A 94 -19.558 -12.706 1.601 1.00 0.00 C ATOM 1577 O ASP A 94 -19.586 -12.360 0.422 1.00 0.00 O ATOM 1578 CB ASP A 94 -19.268 -15.191 1.579 1.00 0.00 C ATOM 1579 CG ASP A 94 -20.372 -15.763 2.479 1.00 0.00 C ATOM 1580 OD1 ASP A 94 -20.114 -16.817 3.122 1.00 0.00 O ATOM 1581 OD2 ASP A 94 -21.481 -15.168 2.532 1.00 0.00 O ATOM 0 H ASP A 94 -18.395 -14.837 3.887 1.00 0.00 H new ATOM 0 HA ASP A 94 -17.739 -13.571 1.642 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -19.665 -15.052 0.573 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -18.458 -15.916 1.505 1.00 0.00 H new ATOM 1586 N ARG A 95 -20.302 -12.132 2.553 1.00 0.00 N ATOM 1587 CA ARG A 95 -21.236 -11.038 2.419 1.00 0.00 C ATOM 1588 C ARG A 95 -22.499 -11.562 1.746 1.00 0.00 C ATOM 1589 O ARG A 95 -23.348 -12.165 2.392 1.00 0.00 O ATOM 1590 CB ARG A 95 -20.524 -9.767 1.895 1.00 0.00 C ATOM 1591 CG ARG A 95 -19.350 -9.375 2.837 1.00 0.00 C ATOM 1592 CD ARG A 95 -19.302 -7.882 3.167 1.00 0.00 C ATOM 1593 NE ARG A 95 -20.649 -7.404 3.643 1.00 0.00 N ATOM 1594 CZ ARG A 95 -20.866 -6.156 4.161 1.00 0.00 C ATOM 1595 NH1 ARG A 95 -19.848 -5.257 4.283 1.00 0.00 N ATOM 1596 NH2 ARG A 95 -22.124 -5.809 4.566 1.00 0.00 N ATOM 0 H ARG A 95 -20.252 -12.460 3.518 1.00 0.00 H new ATOM 0 HA ARG A 95 -21.618 -10.653 3.364 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -20.147 -9.943 0.888 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -21.236 -8.944 1.830 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -19.435 -9.941 3.765 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -18.409 -9.666 2.371 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -18.551 -7.697 3.936 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -19.000 -7.318 2.285 1.00 0.00 H new ATOM 0 HE ARG A 95 -21.441 -8.044 3.576 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -18.906 -5.510 3.986 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -20.029 -4.331 4.671 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -22.890 -6.477 4.481 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -22.297 -4.882 4.954 1.00 0.00 H new ATOM 1610 N ASP A 96 -22.566 -11.463 0.407 1.00 0.00 N ATOM 1611 CA ASP A 96 -23.436 -12.246 -0.451 1.00 0.00 C ATOM 1612 C ASP A 96 -22.522 -13.313 -1.064 1.00 0.00 C ATOM 1613 O ASP A 96 -21.618 -12.884 -1.778 1.00 0.00 O ATOM 1614 CB ASP A 96 -24.010 -11.390 -1.590 1.00 0.00 C ATOM 1615 CG ASP A 96 -24.991 -10.356 -1.038 1.00 0.00 C ATOM 1616 OD1 ASP A 96 -26.043 -10.775 -0.487 1.00 0.00 O ATOM 1617 OD2 ASP A 96 -24.700 -9.136 -1.161 1.00 0.00 O ATOM 0 H ASP A 96 -21.988 -10.806 -0.116 1.00 0.00 H new ATOM 0 HA ASP A 96 -24.276 -12.655 0.111 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -23.200 -10.887 -2.118 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -24.515 -12.029 -2.315 1.00 0.00 H new ATOM 1622 N PRO A 97 -22.617 -14.655 -0.951 1.00 0.00 N ATOM 1623 CA PRO A 97 -21.667 -15.628 -1.527 1.00 0.00 C ATOM 1624 C PRO A 97 -21.800 -15.784 -3.043 1.00 0.00 C ATOM 1625 O PRO A 97 -20.914 -16.328 -3.698 1.00 0.00 O ATOM 1626 CB PRO A 97 -21.899 -16.909 -0.744 1.00 0.00 C ATOM 1627 CG PRO A 97 -23.374 -16.799 -0.365 1.00 0.00 C ATOM 1628 CD PRO A 97 -23.672 -15.301 -0.208 1.00 0.00 C ATOM 0 HA PRO A 97 -20.635 -15.293 -1.427 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -21.699 -17.795 -1.346 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -21.257 -16.970 0.135 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -24.006 -17.242 -1.134 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -23.577 -17.335 0.562 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -24.654 -15.046 -0.606 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -23.664 -15.000 0.840 1.00 0.00 H new ATOM 1636 N GLU A 98 -22.859 -15.172 -3.631 1.00 0.00 N ATOM 1637 CA GLU A 98 -23.089 -14.959 -5.043 1.00 0.00 C ATOM 1638 C GLU A 98 -22.116 -13.909 -5.569 1.00 0.00 C ATOM 1639 O GLU A 98 -21.670 -13.979 -6.702 1.00 0.00 O ATOM 1640 CB GLU A 98 -24.537 -14.494 -5.291 1.00 0.00 C ATOM 1641 CG GLU A 98 -25.579 -15.546 -4.865 1.00 0.00 C ATOM 1642 CD GLU A 98 -27.008 -15.091 -5.178 1.00 0.00 C ATOM 1643 OE1 GLU A 98 -27.190 -13.959 -5.701 1.00 0.00 O ATOM 1644 OE2 GLU A 98 -27.943 -15.887 -4.894 1.00 0.00 O ATOM 0 H GLU A 98 -23.621 -14.793 -3.068 1.00 0.00 H new ATOM 0 HA GLU A 98 -22.930 -15.901 -5.568 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -24.716 -13.568 -4.744 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -24.666 -14.268 -6.350 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -25.377 -16.486 -5.378 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -25.485 -15.739 -3.796 1.00 0.00 H new ATOM 1651 N THR A 99 -21.656 -12.949 -4.704 1.00 0.00 N ATOM 1652 CA THR A 99 -20.630 -11.947 -5.037 1.00 0.00 C ATOM 1653 C THR A 99 -19.253 -12.591 -5.228 1.00 0.00 C ATOM 1654 O THR A 99 -18.497 -12.210 -6.109 1.00 0.00 O ATOM 1655 CB THR A 99 -20.590 -10.771 -4.027 1.00 0.00 C ATOM 1656 OG1 THR A 99 -20.476 -9.511 -4.666 1.00 0.00 O ATOM 1657 CG2 THR A 99 -19.449 -10.827 -3.001 1.00 0.00 C ATOM 0 H THR A 99 -22.002 -12.863 -3.748 1.00 0.00 H new ATOM 0 HA THR A 99 -20.919 -11.512 -5.994 1.00 0.00 H new ATOM 0 HB THR A 99 -21.542 -10.883 -3.509 1.00 0.00 H new ATOM 0 HG1 THR A 99 -20.456 -8.802 -3.990 1.00 0.00 H new ATOM 0 HG21 THR A 99 -19.510 -9.961 -2.342 1.00 0.00 H new ATOM 0 HG22 THR A 99 -19.535 -11.739 -2.411 1.00 0.00 H new ATOM 0 HG23 THR A 99 -18.491 -10.821 -3.521 1.00 0.00 H new ATOM 1665 N ILE A 100 -18.936 -13.608 -4.374 1.00 0.00 N ATOM 1666 CA ILE A 100 -17.715 -14.419 -4.278 1.00 0.00 C ATOM 1667 C ILE A 100 -17.651 -15.404 -5.426 1.00 0.00 C ATOM 1668 O ILE A 100 -16.706 -15.400 -6.208 1.00 0.00 O ATOM 1669 CB ILE A 100 -17.808 -15.182 -2.950 1.00 0.00 C ATOM 1670 CG1 ILE A 100 -17.969 -14.229 -1.745 1.00 0.00 C ATOM 1671 CG2 ILE A 100 -16.562 -16.055 -2.746 1.00 0.00 C ATOM 1672 CD1 ILE A 100 -16.902 -13.145 -1.587 1.00 0.00 C ATOM 0 H ILE A 100 -19.611 -13.899 -3.667 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.823 -13.794 -4.322 1.00 0.00 H new ATOM 0 HB ILE A 100 -18.696 -15.812 -3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -18.941 -13.742 -1.822 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -17.984 -14.829 -0.835 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -16.643 -16.590 -1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -16.483 -16.773 -3.563 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.674 -15.423 -2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -17.124 -12.541 -0.707 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -15.924 -13.612 -1.469 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -16.896 -12.508 -2.472 1.00 0.00 H new ATOM 1684 N ARG A 101 -18.738 -16.190 -5.674 1.00 0.00 N ATOM 1685 CA ARG A 101 -18.882 -17.122 -6.807 1.00 0.00 C ATOM 1686 C ARG A 101 -18.948 -16.426 -8.174 1.00 0.00 C ATOM 1687 O ARG A 101 -18.387 -16.904 -9.160 1.00 0.00 O ATOM 1688 CB ARG A 101 -20.113 -18.054 -6.627 1.00 0.00 C ATOM 1689 CG ARG A 101 -20.003 -19.010 -5.422 1.00 0.00 C ATOM 1690 CD ARG A 101 -21.217 -19.938 -5.259 1.00 0.00 C ATOM 1691 NE ARG A 101 -22.403 -19.105 -4.853 1.00 0.00 N ATOM 1692 CZ ARG A 101 -23.611 -19.645 -4.500 1.00 0.00 C ATOM 1693 NH1 ARG A 101 -23.823 -20.991 -4.570 1.00 0.00 N ATOM 1694 NH2 ARG A 101 -24.612 -18.826 -4.066 1.00 0.00 N ATOM 0 H ARG A 101 -19.557 -16.184 -5.066 1.00 0.00 H new ATOM 0 HA ARG A 101 -17.972 -17.722 -6.800 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -21.007 -17.441 -6.511 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -20.246 -18.643 -7.534 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -19.104 -19.617 -5.532 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -19.881 -18.422 -4.512 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -21.423 -20.460 -6.193 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -21.013 -20.700 -4.506 1.00 0.00 H new ATOM 0 HE ARG A 101 -22.302 -18.090 -4.840 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -23.077 -21.609 -4.888 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -24.728 -21.379 -4.304 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -24.458 -17.820 -4.006 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -25.515 -19.220 -3.801 1.00 0.00 H new ATOM 1708 N ARG A 102 -19.577 -15.209 -8.240 1.00 0.00 N ATOM 1709 CA ARG A 102 -19.618 -14.343 -9.426 1.00 0.00 C ATOM 1710 C ARG A 102 -18.284 -13.629 -9.634 1.00 0.00 C ATOM 1711 O ARG A 102 -17.924 -13.324 -10.769 1.00 0.00 O ATOM 1712 CB ARG A 102 -20.778 -13.299 -9.473 1.00 0.00 C ATOM 1713 CG ARG A 102 -22.229 -13.825 -9.674 1.00 0.00 C ATOM 1714 CD ARG A 102 -22.463 -15.345 -9.583 1.00 0.00 C ATOM 1715 NE ARG A 102 -23.949 -15.601 -9.614 1.00 0.00 N ATOM 1716 CZ ARG A 102 -24.592 -16.507 -8.809 1.00 0.00 C ATOM 1717 NH1 ARG A 102 -23.898 -17.308 -7.949 1.00 0.00 N ATOM 1718 NH2 ARG A 102 -25.953 -16.600 -8.863 1.00 0.00 N ATOM 0 H ARG A 102 -20.075 -14.811 -7.443 1.00 0.00 H new ATOM 0 HA ARG A 102 -19.819 -15.038 -10.241 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -20.755 -12.732 -8.542 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -20.563 -12.597 -10.279 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -22.865 -13.344 -8.931 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -22.573 -13.492 -10.653 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -21.973 -15.854 -10.413 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -22.029 -15.741 -8.665 1.00 0.00 H new ATOM 0 HE ARG A 102 -24.512 -15.066 -10.276 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -22.882 -17.240 -7.896 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -24.396 -17.975 -7.359 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -26.480 -16.000 -9.497 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -26.442 -17.270 -8.269 1.00 0.00 H new ATOM 1732 N GLN A 103 -17.494 -13.427 -8.541 1.00 0.00 N ATOM 1733 CA GLN A 103 -16.137 -12.897 -8.585 1.00 0.00 C ATOM 1734 C GLN A 103 -15.112 -13.864 -9.140 1.00 0.00 C ATOM 1735 O GLN A 103 -14.247 -13.485 -9.918 1.00 0.00 O ATOM 1736 CB GLN A 103 -15.651 -12.222 -7.295 1.00 0.00 C ATOM 1737 CG GLN A 103 -16.018 -10.732 -7.365 1.00 0.00 C ATOM 1738 CD GLN A 103 -15.850 -10.056 -6.032 1.00 0.00 C ATOM 1739 OE1 GLN A 103 -15.111 -9.098 -5.814 1.00 0.00 O ATOM 1740 NE2 GLN A 103 -16.600 -10.596 -5.062 1.00 0.00 N ATOM 0 H GLN A 103 -17.808 -13.639 -7.594 1.00 0.00 H new ATOM 0 HA GLN A 103 -16.227 -12.088 -9.310 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -16.114 -12.687 -6.425 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.573 -12.343 -7.185 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -15.391 -10.237 -8.106 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -17.050 -10.626 -7.699 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -17.205 -11.391 -5.268 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -16.566 -10.212 -4.118 1.00 0.00 H new ATOM 1749 N LEU A 104 -15.195 -15.165 -8.769 1.00 0.00 N ATOM 1750 CA LEU A 104 -14.287 -16.196 -9.275 1.00 0.00 C ATOM 1751 C LEU A 104 -14.651 -16.672 -10.680 1.00 0.00 C ATOM 1752 O LEU A 104 -13.815 -16.725 -11.575 1.00 0.00 O ATOM 1753 CB LEU A 104 -14.112 -17.472 -8.385 1.00 0.00 C ATOM 1754 CG LEU A 104 -14.513 -17.422 -6.903 1.00 0.00 C ATOM 1755 CD1 LEU A 104 -14.258 -18.783 -6.228 1.00 0.00 C ATOM 1756 CD2 LEU A 104 -13.823 -16.311 -6.115 1.00 0.00 C ATOM 0 H LEU A 104 -15.893 -15.517 -8.114 1.00 0.00 H new ATOM 0 HA LEU A 104 -13.338 -15.659 -9.268 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -14.682 -18.276 -8.851 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -13.062 -17.760 -8.430 1.00 0.00 H new ATOM 0 HG LEU A 104 -15.579 -17.193 -6.890 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -14.548 -18.729 -5.179 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -14.846 -19.553 -6.728 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -13.199 -19.032 -6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -14.157 -16.340 -5.078 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -12.743 -16.455 -6.153 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -14.076 -15.345 -6.551 1.00 0.00 H new ATOM 1768 N GLU A 105 -15.927 -17.107 -10.874 1.00 0.00 N ATOM 1769 CA GLU A 105 -16.440 -17.709 -12.106 1.00 0.00 C ATOM 1770 C GLU A 105 -16.906 -16.792 -13.241 1.00 0.00 C ATOM 1771 O GLU A 105 -16.449 -16.908 -14.376 1.00 0.00 O ATOM 1772 CB GLU A 105 -17.560 -18.736 -11.773 1.00 0.00 C ATOM 1773 CG GLU A 105 -17.193 -19.674 -10.600 1.00 0.00 C ATOM 1774 CD GLU A 105 -18.242 -20.772 -10.403 1.00 0.00 C ATOM 1775 OE1 GLU A 105 -18.033 -21.610 -9.484 1.00 0.00 O ATOM 1776 OE2 GLU A 105 -19.257 -20.794 -11.147 1.00 0.00 O ATOM 0 H GLU A 105 -16.638 -17.040 -10.145 1.00 0.00 H new ATOM 0 HA GLU A 105 -15.546 -18.173 -12.523 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -18.476 -18.199 -11.528 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -17.770 -19.336 -12.658 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.221 -20.129 -10.789 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -17.100 -19.091 -9.684 1.00 0.00 H new ATOM 1783 N LEU A 106 -17.888 -15.886 -12.967 1.00 0.00 N ATOM 1784 CA LEU A 106 -18.586 -15.007 -13.910 1.00 0.00 C ATOM 1785 C LEU A 106 -17.764 -13.853 -14.466 1.00 0.00 C ATOM 1786 O LEU A 106 -17.779 -13.571 -15.661 1.00 0.00 O ATOM 1787 CB LEU A 106 -19.831 -14.400 -13.218 1.00 0.00 C ATOM 1788 CG LEU A 106 -21.151 -14.401 -14.027 1.00 0.00 C ATOM 1789 CD1 LEU A 106 -21.031 -13.818 -15.447 1.00 0.00 C ATOM 1790 CD2 LEU A 106 -21.769 -15.815 -14.049 1.00 0.00 C ATOM 0 H LEU A 106 -18.224 -15.753 -12.013 1.00 0.00 H new ATOM 0 HA LEU A 106 -18.833 -15.649 -14.755 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -20.002 -14.944 -12.289 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -19.600 -13.370 -12.947 1.00 0.00 H new ATOM 0 HG LEU A 106 -21.822 -13.721 -13.503 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -22.002 -13.859 -15.940 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -20.697 -12.782 -15.388 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -20.309 -14.400 -16.019 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -22.696 -15.798 -14.622 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -21.069 -16.511 -14.512 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -21.979 -16.136 -13.029 1.00 0.00 H new ATOM 1802 N GLU A 107 -16.971 -13.178 -13.574 1.00 0.00 N ATOM 1803 CA GLU A 107 -16.057 -12.043 -13.799 1.00 0.00 C ATOM 1804 C GLU A 107 -14.867 -12.337 -14.737 1.00 0.00 C ATOM 1805 O GLU A 107 -13.972 -11.530 -14.968 1.00 0.00 O ATOM 1806 CB GLU A 107 -15.608 -11.500 -12.409 1.00 0.00 C ATOM 1807 CG GLU A 107 -14.916 -10.125 -12.403 1.00 0.00 C ATOM 1808 CD GLU A 107 -14.750 -9.641 -10.965 1.00 0.00 C ATOM 1809 OE1 GLU A 107 -15.369 -8.604 -10.607 1.00 0.00 O ATOM 1810 OE2 GLU A 107 -13.996 -10.305 -10.205 1.00 0.00 O ATOM 0 H GLU A 107 -16.966 -13.452 -12.592 1.00 0.00 H new ATOM 0 HA GLU A 107 -16.607 -11.277 -14.346 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -16.485 -11.444 -11.764 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -14.929 -12.226 -11.961 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -13.943 -10.195 -12.889 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -15.506 -9.407 -12.973 1.00 0.00 H new ATOM 1817 N LYS A 108 -14.916 -13.544 -15.333 1.00 0.00 N ATOM 1818 CA LYS A 108 -14.015 -14.119 -16.318 1.00 0.00 C ATOM 1819 C LYS A 108 -14.657 -14.233 -17.702 1.00 0.00 C ATOM 1820 O LYS A 108 -13.972 -14.458 -18.693 1.00 0.00 O ATOM 1821 CB LYS A 108 -13.575 -15.553 -15.911 1.00 0.00 C ATOM 1822 CG LYS A 108 -12.830 -15.633 -14.569 1.00 0.00 C ATOM 1823 CD LYS A 108 -12.177 -17.005 -14.324 1.00 0.00 C ATOM 1824 CE LYS A 108 -10.977 -17.302 -15.237 1.00 0.00 C ATOM 1825 NZ LYS A 108 -10.343 -18.591 -14.874 1.00 0.00 N ATOM 0 H LYS A 108 -15.667 -14.196 -15.105 1.00 0.00 H new ATOM 0 HA LYS A 108 -13.162 -13.441 -16.357 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -14.458 -16.190 -15.861 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -12.933 -15.959 -16.693 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -12.061 -14.861 -14.540 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -13.528 -15.419 -13.759 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -11.852 -17.060 -13.285 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -12.928 -17.783 -14.464 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -11.304 -17.333 -16.276 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -10.246 -16.497 -15.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -9.535 -18.770 -15.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -10.011 -18.550 -13.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -11.037 -19.359 -14.974 1.00 0.00 H new ATOM 1839 N LYS A 109 -16.008 -14.129 -17.798 1.00 0.00 N ATOM 1840 CA LYS A 109 -16.812 -14.371 -18.993 1.00 0.00 C ATOM 1841 C LYS A 109 -17.263 -13.117 -19.735 1.00 0.00 C ATOM 1842 O LYS A 109 -18.023 -13.185 -20.701 1.00 0.00 O ATOM 1843 CB LYS A 109 -18.061 -15.204 -18.614 1.00 0.00 C ATOM 1844 CG LYS A 109 -17.700 -16.501 -17.876 1.00 0.00 C ATOM 1845 CD LYS A 109 -18.921 -17.405 -17.720 1.00 0.00 C ATOM 1846 CE LYS A 109 -18.660 -18.616 -16.812 1.00 0.00 C ATOM 1847 NZ LYS A 109 -19.879 -19.447 -16.675 1.00 0.00 N ATOM 0 H LYS A 109 -16.580 -13.860 -16.997 1.00 0.00 H new ATOM 0 HA LYS A 109 -16.155 -14.906 -19.679 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -18.718 -14.603 -17.985 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -18.620 -15.447 -19.518 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.920 -17.030 -18.424 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -17.293 -16.262 -16.893 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -19.747 -16.823 -17.311 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -19.234 -17.756 -18.703 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -17.850 -19.217 -17.225 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.335 -18.275 -15.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -19.678 -20.259 -16.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -20.643 -18.877 -16.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -20.173 -19.789 -17.612 1.00 0.00 H new ATOM 1861 N LYS A 110 -16.815 -11.910 -19.308 1.00 0.00 N ATOM 1862 CA LYS A 110 -17.212 -10.599 -19.827 1.00 0.00 C ATOM 1863 C LYS A 110 -16.591 -10.168 -21.166 1.00 0.00 C ATOM 1864 O LYS A 110 -16.008 -9.093 -21.297 1.00 0.00 O ATOM 1865 CB LYS A 110 -17.001 -9.527 -18.723 1.00 0.00 C ATOM 1866 CG LYS A 110 -17.909 -9.767 -17.503 1.00 0.00 C ATOM 1867 CD LYS A 110 -17.721 -8.722 -16.390 1.00 0.00 C ATOM 1868 CE LYS A 110 -18.844 -8.742 -15.336 1.00 0.00 C ATOM 1869 NZ LYS A 110 -18.952 -10.065 -14.675 1.00 0.00 N ATOM 0 H LYS A 110 -16.133 -11.833 -18.554 1.00 0.00 H new ATOM 0 HA LYS A 110 -18.268 -10.697 -20.080 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -15.958 -9.534 -18.406 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -17.202 -8.538 -19.135 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -18.950 -9.760 -17.826 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -17.708 -10.759 -17.098 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -16.766 -8.897 -15.895 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -17.671 -7.730 -16.838 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -18.653 -7.975 -14.586 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -19.793 -8.494 -15.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -19.955 -10.313 -14.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -18.484 -10.785 -15.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -18.492 -10.026 -13.743 1.00 0.00 H new ATOM 1883 N LYS A 111 -16.752 -11.027 -22.211 1.00 0.00 N ATOM 1884 CA LYS A 111 -16.348 -10.876 -23.611 1.00 0.00 C ATOM 1885 C LYS A 111 -14.848 -10.756 -23.882 1.00 0.00 C ATOM 1886 O LYS A 111 -14.350 -11.207 -24.914 1.00 0.00 O ATOM 1887 CB LYS A 111 -17.166 -9.767 -24.334 1.00 0.00 C ATOM 1888 CG LYS A 111 -17.154 -9.855 -25.871 1.00 0.00 C ATOM 1889 CD LYS A 111 -18.114 -8.855 -26.534 1.00 0.00 C ATOM 1890 CE LYS A 111 -18.151 -9.000 -28.063 1.00 0.00 C ATOM 1891 NZ LYS A 111 -19.109 -8.043 -28.665 1.00 0.00 N ATOM 0 H LYS A 111 -17.214 -11.925 -22.065 1.00 0.00 H new ATOM 0 HA LYS A 111 -16.600 -11.841 -24.051 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -18.199 -9.814 -23.989 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -16.775 -8.794 -24.037 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -16.142 -9.674 -26.232 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -17.424 -10.866 -26.174 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -19.118 -9.000 -26.134 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -17.812 -7.840 -26.276 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -17.155 -8.829 -28.472 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -18.434 -10.019 -28.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -19.115 -8.161 -29.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -20.062 -8.224 -28.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -18.823 -7.071 -28.430 1.00 0.00 H new TER 1905 LYS A 111