USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 777 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 63 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 64 GLN : amide:sc= -0.0192 X(o=-0.019,f=-0.19) USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.131 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.18 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 49:sc= 0.0343 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.205 X(o=-0.2,f=-0.2) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.066 K(o=-0.066,f=-1.6!) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.552 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= -1.82 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 92:sc= 0.922 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= 0.0393 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 ASN :FLIP amide:sc= -0.547 F(o=-1.4,f=-0.55) USER MOD Single : A 75 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00468) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 40:sc= 0.737 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.636 -2.789 -4.812 1.00 0.00 N ATOM 2 CA GLY A 1 20.269 -3.259 -4.958 1.00 0.00 C ATOM 3 C GLY A 1 19.603 -2.634 -6.186 1.00 0.00 C ATOM 4 O GLY A 1 20.197 -1.791 -6.857 1.00 0.00 O ATOM 0 H1 GLY A 1 22.285 -3.602 -4.818 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.870 -2.153 -5.600 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.732 -2.276 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.262 -4.345 -5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.698 -3.010 -4.064 1.00 0.00 H new ATOM 8 N SER A 2 18.380 -3.072 -6.443 1.00 0.00 N ATOM 9 CA SER A 2 17.627 -2.567 -7.578 1.00 0.00 C ATOM 10 C SER A 2 16.563 -1.576 -7.101 1.00 0.00 C ATOM 11 O SER A 2 15.925 -1.792 -6.071 1.00 0.00 O ATOM 12 CB SER A 2 16.976 -3.709 -8.360 1.00 0.00 C ATOM 13 OG SER A 2 15.796 -4.189 -7.721 1.00 0.00 O ATOM 0 H SER A 2 17.891 -3.772 -5.884 1.00 0.00 H new ATOM 0 HA SER A 2 18.319 -2.054 -8.246 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.730 -3.366 -9.365 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.688 -4.527 -8.468 1.00 0.00 H new ATOM 0 HG SER A 2 15.409 -4.916 -8.252 1.00 0.00 H new ATOM 19 N SER A 3 16.403 -0.511 -7.872 1.00 0.00 N ATOM 20 CA SER A 3 15.427 0.513 -7.541 1.00 0.00 C ATOM 21 C SER A 3 15.350 1.546 -8.668 1.00 0.00 C ATOM 22 O SER A 3 16.344 1.810 -9.342 1.00 0.00 O ATOM 23 CB SER A 3 15.773 1.197 -6.217 1.00 0.00 C ATOM 24 OG SER A 3 16.828 2.143 -6.365 1.00 0.00 O ATOM 0 H SER A 3 16.933 -0.335 -8.725 1.00 0.00 H new ATOM 0 HA SER A 3 14.454 0.034 -7.428 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.888 1.699 -5.826 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.062 0.444 -5.484 1.00 0.00 H new ATOM 0 HG SER A 3 17.018 2.559 -5.498 1.00 0.00 H new ATOM 30 N GLY A 4 14.159 2.102 -8.836 1.00 0.00 N ATOM 31 CA GLY A 4 13.939 3.100 -9.869 1.00 0.00 C ATOM 32 C GLY A 4 12.873 4.110 -9.439 1.00 0.00 C ATOM 33 O GLY A 4 12.419 4.088 -8.296 1.00 0.00 O ATOM 0 H GLY A 4 13.337 1.880 -8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.873 3.620 -10.082 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.630 2.610 -10.792 1.00 0.00 H new ATOM 37 N SER A 5 12.505 4.970 -10.377 1.00 0.00 N ATOM 38 CA SER A 5 11.501 5.985 -10.109 1.00 0.00 C ATOM 39 C SER A 5 10.998 6.584 -11.424 1.00 0.00 C ATOM 40 O SER A 5 11.749 7.251 -12.134 1.00 0.00 O ATOM 41 CB SER A 5 12.058 7.085 -9.203 1.00 0.00 C ATOM 42 OG SER A 5 11.521 7.014 -7.885 1.00 0.00 O ATOM 0 H SER A 5 12.884 4.985 -11.324 1.00 0.00 H new ATOM 0 HA SER A 5 10.667 5.512 -9.590 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.144 7.002 -9.157 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.831 8.060 -9.635 1.00 0.00 H new ATOM 0 HG SER A 5 11.589 6.094 -7.553 1.00 0.00 H new ATOM 48 N SER A 6 9.730 6.324 -11.709 1.00 0.00 N ATOM 49 CA SER A 6 9.118 6.830 -12.926 1.00 0.00 C ATOM 50 C SER A 6 7.684 6.309 -13.046 1.00 0.00 C ATOM 51 O SER A 6 7.436 5.118 -12.867 1.00 0.00 O ATOM 52 CB SER A 6 9.932 6.431 -14.158 1.00 0.00 C ATOM 53 OG SER A 6 10.151 5.024 -14.221 1.00 0.00 O ATOM 0 H SER A 6 9.110 5.770 -11.118 1.00 0.00 H new ATOM 0 HA SER A 6 9.099 7.919 -12.873 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.411 6.757 -15.058 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.892 6.947 -14.141 1.00 0.00 H new ATOM 0 HG SER A 6 10.673 4.810 -15.022 1.00 0.00 H new ATOM 59 N GLY A 7 6.779 7.228 -13.348 1.00 0.00 N ATOM 60 CA GLY A 7 5.376 6.876 -13.493 1.00 0.00 C ATOM 61 C GLY A 7 4.733 6.610 -12.131 1.00 0.00 C ATOM 62 O GLY A 7 5.051 5.620 -11.473 1.00 0.00 O ATOM 0 H GLY A 7 6.989 8.215 -13.496 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.845 7.683 -13.998 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.283 5.991 -14.122 1.00 0.00 H new ATOM 66 N LEU A 8 3.840 7.510 -11.747 1.00 0.00 N ATOM 67 CA LEU A 8 3.150 7.384 -10.475 1.00 0.00 C ATOM 68 C LEU A 8 2.777 5.919 -10.245 1.00 0.00 C ATOM 69 O LEU A 8 3.351 5.256 -9.382 1.00 0.00 O ATOM 70 CB LEU A 8 1.956 8.339 -10.417 1.00 0.00 C ATOM 71 CG LEU A 8 2.292 9.826 -10.277 1.00 0.00 C ATOM 72 CD1 LEU A 8 1.019 10.669 -10.189 1.00 0.00 C ATOM 73 CD2 LEU A 8 3.224 10.068 -9.088 1.00 0.00 C ATOM 0 H LEU A 8 3.578 8.330 -12.295 1.00 0.00 H new ATOM 0 HA LEU A 8 3.805 7.679 -9.655 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.364 8.204 -11.322 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.325 8.049 -9.577 1.00 0.00 H new ATOM 0 HG LEU A 8 2.826 10.142 -11.173 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.286 11.721 -10.090 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.426 10.528 -11.093 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.437 10.359 -9.321 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.447 11.132 -9.011 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.739 9.732 -8.171 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.151 9.513 -9.233 1.00 0.00 H new ATOM 85 N ARG A 9 1.817 5.455 -11.032 1.00 0.00 N ATOM 86 CA ARG A 9 1.361 4.079 -10.924 1.00 0.00 C ATOM 87 C ARG A 9 2.545 3.145 -10.670 1.00 0.00 C ATOM 88 O ARG A 9 2.484 2.283 -9.795 1.00 0.00 O ATOM 89 CB ARG A 9 0.636 3.639 -12.198 1.00 0.00 C ATOM 90 CG ARG A 9 -0.540 2.718 -11.869 1.00 0.00 C ATOM 91 CD ARG A 9 -1.194 2.185 -13.146 1.00 0.00 C ATOM 92 NE ARG A 9 -2.061 3.226 -13.742 1.00 0.00 N ATOM 93 CZ ARG A 9 -1.628 4.172 -14.586 1.00 0.00 C ATOM 94 NH1 ARG A 9 -0.336 4.215 -14.939 1.00 0.00 N ATOM 95 NH2 ARG A 9 -2.487 5.075 -15.078 1.00 0.00 N ATOM 0 H ARG A 9 1.343 6.007 -11.747 1.00 0.00 H new ATOM 0 HA ARG A 9 0.666 4.024 -10.086 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.276 4.515 -12.737 1.00 0.00 H new ATOM 0 HB3 ARG A 9 1.333 3.123 -12.858 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -0.194 1.884 -11.258 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -1.277 3.261 -11.278 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -0.427 1.886 -13.860 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -1.782 1.296 -12.920 1.00 0.00 H new ATOM 0 HE ARG A 9 -3.051 3.223 -13.495 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.318 3.527 -14.565 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -0.007 4.935 -15.582 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -3.471 5.042 -14.810 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -2.157 5.795 -15.721 1.00 0.00 H new ATOM 109 N GLU A 10 3.596 3.348 -11.451 1.00 0.00 N ATOM 110 CA GLU A 10 4.793 2.535 -11.322 1.00 0.00 C ATOM 111 C GLU A 10 5.442 2.759 -9.954 1.00 0.00 C ATOM 112 O GLU A 10 5.840 1.805 -9.288 1.00 0.00 O ATOM 113 CB GLU A 10 5.781 2.829 -12.452 1.00 0.00 C ATOM 114 CG GLU A 10 5.689 1.768 -13.551 1.00 0.00 C ATOM 115 CD GLU A 10 7.082 1.357 -14.034 1.00 0.00 C ATOM 116 OE1 GLU A 10 7.795 2.252 -14.537 1.00 0.00 O ATOM 117 OE2 GLU A 10 7.402 0.158 -13.889 1.00 0.00 O ATOM 0 H GLU A 10 3.643 4.064 -12.176 1.00 0.00 H new ATOM 0 HA GLU A 10 4.506 1.486 -11.399 1.00 0.00 H new ATOM 0 HB2 GLU A 10 5.575 3.813 -12.873 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.795 2.859 -12.054 1.00 0.00 H new ATOM 0 HG2 GLU A 10 5.158 0.894 -13.174 1.00 0.00 H new ATOM 0 HG3 GLU A 10 5.109 2.156 -14.389 1.00 0.00 H new ATOM 124 N GLN A 11 5.528 4.026 -9.577 1.00 0.00 N ATOM 125 CA GLN A 11 6.122 4.388 -8.301 1.00 0.00 C ATOM 126 C GLN A 11 5.474 3.589 -7.168 1.00 0.00 C ATOM 127 O GLN A 11 6.155 2.863 -6.447 1.00 0.00 O ATOM 128 CB GLN A 11 6.004 5.892 -8.048 1.00 0.00 C ATOM 129 CG GLN A 11 7.224 6.637 -8.594 1.00 0.00 C ATOM 130 CD GLN A 11 7.556 7.854 -7.728 1.00 0.00 C ATOM 131 OE1 GLN A 11 8.272 7.771 -6.744 1.00 0.00 O ATOM 132 NE2 GLN A 11 6.998 8.986 -8.148 1.00 0.00 N ATOM 0 H GLN A 11 5.196 4.815 -10.132 1.00 0.00 H new ATOM 0 HA GLN A 11 7.183 4.141 -8.333 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.099 6.274 -8.520 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.908 6.078 -6.978 1.00 0.00 H new ATOM 0 HG2 GLN A 11 8.081 5.964 -8.626 1.00 0.00 H new ATOM 0 HG3 GLN A 11 7.031 6.957 -9.618 1.00 0.00 H new ATOM 0 HE21 GLN A 11 6.409 8.986 -8.980 1.00 0.00 H new ATOM 0 HE22 GLN A 11 7.160 9.854 -7.638 1.00 0.00 H new ATOM 141 N VAL A 12 4.164 3.751 -7.047 1.00 0.00 N ATOM 142 CA VAL A 12 3.416 3.054 -6.015 1.00 0.00 C ATOM 143 C VAL A 12 3.571 1.545 -6.210 1.00 0.00 C ATOM 144 O VAL A 12 3.795 0.811 -5.249 1.00 0.00 O ATOM 145 CB VAL A 12 1.957 3.513 -6.026 1.00 0.00 C ATOM 146 CG1 VAL A 12 1.216 3.016 -4.783 1.00 0.00 C ATOM 147 CG2 VAL A 12 1.861 5.034 -6.151 1.00 0.00 C ATOM 0 H VAL A 12 3.602 4.355 -7.647 1.00 0.00 H new ATOM 0 HA VAL A 12 3.810 3.295 -5.028 1.00 0.00 H new ATOM 0 HB VAL A 12 1.475 3.075 -6.900 1.00 0.00 H new ATOM 0 HG11 VAL A 12 0.181 3.356 -4.816 1.00 0.00 H new ATOM 0 HG12 VAL A 12 1.239 1.927 -4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.699 3.411 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.813 5.333 -6.156 1.00 0.00 H new ATOM 0 HG22 VAL A 12 2.367 5.501 -5.306 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.334 5.353 -7.080 1.00 0.00 H new ATOM 157 N GLN A 13 3.445 1.126 -7.461 1.00 0.00 N ATOM 158 CA GLN A 13 3.567 -0.283 -7.794 1.00 0.00 C ATOM 159 C GLN A 13 4.878 -0.847 -7.242 1.00 0.00 C ATOM 160 O GLN A 13 4.988 -2.048 -7.002 1.00 0.00 O ATOM 161 CB GLN A 13 3.472 -0.498 -9.306 1.00 0.00 C ATOM 162 CG GLN A 13 2.090 -1.025 -9.699 1.00 0.00 C ATOM 163 CD GLN A 13 2.181 -2.454 -10.239 1.00 0.00 C ATOM 164 OE1 GLN A 13 1.834 -3.419 -9.578 1.00 0.00 O ATOM 165 NE2 GLN A 13 2.667 -2.535 -11.474 1.00 0.00 N ATOM 0 H GLN A 13 3.260 1.738 -8.256 1.00 0.00 H new ATOM 0 HA GLN A 13 2.739 -0.820 -7.330 1.00 0.00 H new ATOM 0 HB2 GLN A 13 3.668 0.441 -9.824 1.00 0.00 H new ATOM 0 HB3 GLN A 13 4.239 -1.204 -9.625 1.00 0.00 H new ATOM 0 HG2 GLN A 13 1.428 -1.001 -8.833 1.00 0.00 H new ATOM 0 HG3 GLN A 13 1.650 -0.374 -10.455 1.00 0.00 H new ATOM 0 HE21 GLN A 13 2.939 -1.687 -11.972 1.00 0.00 H new ATOM 0 HE22 GLN A 13 2.768 -3.445 -11.924 1.00 0.00 H new ATOM 174 N ASP A 14 5.838 0.047 -7.056 1.00 0.00 N ATOM 175 CA ASP A 14 7.136 -0.347 -6.537 1.00 0.00 C ATOM 176 C ASP A 14 7.149 -0.167 -5.017 1.00 0.00 C ATOM 177 O ASP A 14 7.671 -1.014 -4.293 1.00 0.00 O ATOM 178 CB ASP A 14 8.251 0.521 -7.124 1.00 0.00 C ATOM 179 CG ASP A 14 9.631 -0.138 -7.163 1.00 0.00 C ATOM 180 OD1 ASP A 14 9.803 -1.139 -6.435 1.00 0.00 O ATOM 181 OD2 ASP A 14 10.483 0.374 -7.921 1.00 0.00 O ATOM 0 H ASP A 14 5.743 1.043 -7.256 1.00 0.00 H new ATOM 0 HA ASP A 14 7.306 -1.388 -6.811 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.973 0.807 -8.138 1.00 0.00 H new ATOM 0 HB3 ASP A 14 8.320 1.440 -6.542 1.00 0.00 H new ATOM 186 N LEU A 15 6.567 0.940 -4.580 1.00 0.00 N ATOM 187 CA LEU A 15 6.504 1.241 -3.159 1.00 0.00 C ATOM 188 C LEU A 15 6.038 -0.002 -2.399 1.00 0.00 C ATOM 189 O LEU A 15 6.823 -0.635 -1.696 1.00 0.00 O ATOM 190 CB LEU A 15 5.636 2.476 -2.911 1.00 0.00 C ATOM 191 CG LEU A 15 5.362 2.820 -1.446 1.00 0.00 C ATOM 192 CD1 LEU A 15 6.657 3.184 -0.717 1.00 0.00 C ATOM 193 CD2 LEU A 15 4.309 3.923 -1.329 1.00 0.00 C ATOM 0 H LEU A 15 6.135 1.639 -5.184 1.00 0.00 H new ATOM 0 HA LEU A 15 7.494 1.495 -2.779 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.117 3.334 -3.381 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.680 2.331 -3.414 1.00 0.00 H new ATOM 0 HG LEU A 15 4.955 1.934 -0.958 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.434 3.424 0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.345 2.340 -0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.115 4.048 -1.199 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.133 4.148 -0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.663 4.820 -1.838 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.379 3.588 -1.789 1.00 0.00 H new ATOM 205 N PHE A 16 4.761 -0.314 -2.566 1.00 0.00 N ATOM 206 CA PHE A 16 4.180 -1.470 -1.905 1.00 0.00 C ATOM 207 C PHE A 16 5.089 -2.694 -2.040 1.00 0.00 C ATOM 208 O PHE A 16 5.366 -3.378 -1.056 1.00 0.00 O ATOM 209 CB PHE A 16 2.848 -1.760 -2.598 1.00 0.00 C ATOM 210 CG PHE A 16 1.752 -0.736 -2.295 1.00 0.00 C ATOM 211 CD1 PHE A 16 2.050 0.389 -1.591 1.00 0.00 C ATOM 212 CD2 PHE A 16 0.482 -0.950 -2.731 1.00 0.00 C ATOM 213 CE1 PHE A 16 1.033 1.340 -1.310 1.00 0.00 C ATOM 214 CE2 PHE A 16 -0.535 0.001 -2.450 1.00 0.00 C ATOM 215 CZ PHE A 16 -0.237 1.126 -1.745 1.00 0.00 C ATOM 0 H PHE A 16 4.112 0.214 -3.150 1.00 0.00 H new ATOM 0 HA PHE A 16 4.049 -1.264 -0.843 1.00 0.00 H new ATOM 0 HB2 PHE A 16 3.011 -1.794 -3.675 1.00 0.00 H new ATOM 0 HB3 PHE A 16 2.501 -2.748 -2.296 1.00 0.00 H new ATOM 0 HD1 PHE A 16 3.059 0.559 -1.246 1.00 0.00 H new ATOM 0 HD2 PHE A 16 0.247 -1.843 -3.291 1.00 0.00 H new ATOM 0 HE1 PHE A 16 1.269 2.233 -0.751 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.544 -0.169 -2.796 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.010 1.849 -1.531 1.00 0.00 H new ATOM 225 N ASN A 17 5.528 -2.932 -3.267 1.00 0.00 N ATOM 226 CA ASN A 17 6.400 -4.061 -3.544 1.00 0.00 C ATOM 227 C ASN A 17 7.646 -3.966 -2.662 1.00 0.00 C ATOM 228 O ASN A 17 8.149 -4.980 -2.181 1.00 0.00 O ATOM 229 CB ASN A 17 6.854 -4.061 -5.005 1.00 0.00 C ATOM 230 CG ASN A 17 5.881 -4.854 -5.881 1.00 0.00 C ATOM 231 OD1 ASN A 17 4.816 -5.267 -5.454 1.00 0.00 O ATOM 232 ND2 ASN A 17 6.307 -5.042 -7.127 1.00 0.00 N ATOM 0 H ASN A 17 5.296 -2.362 -4.081 1.00 0.00 H new ATOM 0 HA ASN A 17 5.843 -4.975 -3.339 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.923 -3.036 -5.368 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.852 -4.494 -5.080 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.730 -5.559 -7.790 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.210 -4.669 -7.419 1.00 0.00 H new ATOM 239 N LYS A 18 8.109 -2.738 -2.477 1.00 0.00 N ATOM 240 CA LYS A 18 9.287 -2.497 -1.661 1.00 0.00 C ATOM 241 C LYS A 18 8.919 -2.651 -0.184 1.00 0.00 C ATOM 242 O LYS A 18 9.445 -3.526 0.503 1.00 0.00 O ATOM 243 CB LYS A 18 9.906 -1.140 -2.002 1.00 0.00 C ATOM 244 CG LYS A 18 11.421 -1.259 -2.181 1.00 0.00 C ATOM 245 CD LYS A 18 12.156 -0.217 -1.335 1.00 0.00 C ATOM 246 CE LYS A 18 13.449 -0.795 -0.754 1.00 0.00 C ATOM 247 NZ LYS A 18 14.601 0.070 -1.092 1.00 0.00 N ATOM 0 H LYS A 18 7.689 -1.899 -2.878 1.00 0.00 H new ATOM 0 HA LYS A 18 10.058 -3.237 -1.877 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.457 -0.751 -2.916 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.685 -0.426 -1.209 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.747 -2.259 -1.896 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.678 -1.127 -3.232 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.386 0.656 -1.946 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.509 0.122 -0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.360 -0.885 0.329 1.00 0.00 H new ATOM 0 HE3 LYS A 18 13.613 -1.799 -1.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.470 -0.336 -0.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.695 0.135 -2.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 14.449 1.020 -0.698 1.00 0.00 H new ATOM 261 N LYS A 19 8.018 -1.788 0.262 1.00 0.00 N ATOM 262 CA LYS A 19 7.574 -1.817 1.645 1.00 0.00 C ATOM 263 C LYS A 19 7.329 -3.267 2.067 1.00 0.00 C ATOM 264 O LYS A 19 7.681 -3.662 3.178 1.00 0.00 O ATOM 265 CB LYS A 19 6.359 -0.907 1.837 1.00 0.00 C ATOM 266 CG LYS A 19 6.783 0.559 1.946 1.00 0.00 C ATOM 267 CD LYS A 19 7.207 0.902 3.375 1.00 0.00 C ATOM 268 CE LYS A 19 8.050 2.178 3.406 1.00 0.00 C ATOM 269 NZ LYS A 19 8.984 2.155 4.554 1.00 0.00 N ATOM 0 H LYS A 19 7.583 -1.064 -0.310 1.00 0.00 H new ATOM 0 HA LYS A 19 8.348 -1.420 2.302 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.673 -1.029 0.999 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.819 -1.201 2.737 1.00 0.00 H new ATOM 0 HG2 LYS A 19 7.608 0.755 1.261 1.00 0.00 H new ATOM 0 HG3 LYS A 19 5.958 1.203 1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 19 6.323 1.031 3.999 1.00 0.00 H new ATOM 0 HD3 LYS A 19 7.778 0.075 3.797 1.00 0.00 H new ATOM 0 HE2 LYS A 19 8.610 2.273 2.476 1.00 0.00 H new ATOM 0 HE3 LYS A 19 7.399 3.049 3.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 9.548 3.028 4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 8.444 2.086 5.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.617 1.334 4.470 1.00 0.00 H new ATOM 283 N TYR A 20 6.729 -4.021 1.159 1.00 0.00 N ATOM 284 CA TYR A 20 6.433 -5.419 1.423 1.00 0.00 C ATOM 285 C TYR A 20 7.679 -6.159 1.914 1.00 0.00 C ATOM 286 O TYR A 20 7.704 -6.664 3.035 1.00 0.00 O ATOM 287 CB TYR A 20 5.993 -6.017 0.085 1.00 0.00 C ATOM 288 CG TYR A 20 5.578 -7.487 0.167 1.00 0.00 C ATOM 289 CD1 TYR A 20 4.618 -7.884 1.076 1.00 0.00 C ATOM 290 CD2 TYR A 20 6.164 -8.417 -0.667 1.00 0.00 C ATOM 291 CE1 TYR A 20 4.228 -9.268 1.153 1.00 0.00 C ATOM 292 CE2 TYR A 20 5.774 -9.801 -0.590 1.00 0.00 C ATOM 293 CZ TYR A 20 4.825 -10.158 0.316 1.00 0.00 C ATOM 294 OH TYR A 20 4.456 -11.465 0.389 1.00 0.00 O ATOM 0 H TYR A 20 6.439 -3.690 0.239 1.00 0.00 H new ATOM 0 HA TYR A 20 5.667 -5.511 2.193 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.157 -5.435 -0.304 1.00 0.00 H new ATOM 0 HB3 TYR A 20 6.809 -5.920 -0.631 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.159 -7.157 1.729 1.00 0.00 H new ATOM 0 HD2 TYR A 20 6.916 -8.107 -1.378 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.478 -9.592 1.860 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.225 -10.539 -1.237 1.00 0.00 H new ATOM 0 HH TYR A 20 4.964 -11.985 -0.268 1.00 0.00 H new ATOM 304 N GLY A 21 8.682 -6.201 1.050 1.00 0.00 N ATOM 305 CA GLY A 21 9.928 -6.871 1.381 1.00 0.00 C ATOM 306 C GLY A 21 10.292 -6.656 2.851 1.00 0.00 C ATOM 307 O GLY A 21 10.757 -7.577 3.521 1.00 0.00 O ATOM 0 H GLY A 21 8.657 -5.782 0.121 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.837 -7.938 1.178 1.00 0.00 H new ATOM 0 HA3 GLY A 21 10.729 -6.493 0.745 1.00 0.00 H new ATOM 311 N GLU A 22 10.067 -5.433 3.311 1.00 0.00 N ATOM 312 CA GLU A 22 10.366 -5.085 4.689 1.00 0.00 C ATOM 313 C GLU A 22 9.463 -5.870 5.643 1.00 0.00 C ATOM 314 O GLU A 22 9.948 -6.528 6.562 1.00 0.00 O ATOM 315 CB GLU A 22 10.225 -3.579 4.917 1.00 0.00 C ATOM 316 CG GLU A 22 11.131 -2.793 3.966 1.00 0.00 C ATOM 317 CD GLU A 22 10.929 -1.286 4.136 1.00 0.00 C ATOM 318 OE1 GLU A 22 10.751 -0.865 5.299 1.00 0.00 O ATOM 319 OE2 GLU A 22 10.957 -0.590 3.098 1.00 0.00 O ATOM 0 H GLU A 22 9.681 -4.671 2.753 1.00 0.00 H new ATOM 0 HA GLU A 22 11.402 -5.355 4.895 1.00 0.00 H new ATOM 0 HB2 GLU A 22 9.188 -3.280 4.766 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.479 -3.338 5.949 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.173 -3.048 4.158 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.917 -3.078 2.936 1.00 0.00 H new ATOM 326 N ALA A 23 8.166 -5.776 5.390 1.00 0.00 N ATOM 327 CA ALA A 23 7.191 -6.469 6.215 1.00 0.00 C ATOM 328 C ALA A 23 7.659 -7.907 6.450 1.00 0.00 C ATOM 329 O ALA A 23 7.304 -8.522 7.455 1.00 0.00 O ATOM 330 CB ALA A 23 5.817 -6.406 5.544 1.00 0.00 C ATOM 0 H ALA A 23 7.768 -5.231 4.626 1.00 0.00 H new ATOM 0 HA ALA A 23 7.101 -5.988 7.189 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.086 -6.926 6.163 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.517 -5.365 5.425 1.00 0.00 H new ATOM 0 HB3 ALA A 23 5.868 -6.883 4.565 1.00 0.00 H new ATOM 336 N LEU A 24 8.448 -8.400 5.508 1.00 0.00 N ATOM 337 CA LEU A 24 8.968 -9.754 5.600 1.00 0.00 C ATOM 338 C LEU A 24 10.405 -9.709 6.125 1.00 0.00 C ATOM 339 O LEU A 24 10.854 -10.637 6.795 1.00 0.00 O ATOM 340 CB LEU A 24 8.826 -10.475 4.258 1.00 0.00 C ATOM 341 CG LEU A 24 7.405 -10.580 3.701 1.00 0.00 C ATOM 342 CD1 LEU A 24 7.418 -11.094 2.259 1.00 0.00 C ATOM 343 CD2 LEU A 24 6.523 -11.441 4.607 1.00 0.00 C ATOM 0 H LEU A 24 8.740 -7.886 4.677 1.00 0.00 H new ATOM 0 HA LEU A 24 8.386 -10.338 6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 24 9.446 -9.960 3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.229 -11.482 4.365 1.00 0.00 H new ATOM 0 HG LEU A 24 6.971 -9.580 3.684 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.396 -11.159 1.887 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.989 -10.408 1.633 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.879 -12.081 2.229 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.518 -11.499 4.188 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.945 -12.444 4.679 1.00 0.00 H new ATOM 0 HD23 LEU A 24 6.477 -10.995 5.600 1.00 0.00 H new ATOM 355 N GLY A 25 11.086 -8.620 5.800 1.00 0.00 N ATOM 356 CA GLY A 25 12.462 -8.442 6.230 1.00 0.00 C ATOM 357 C GLY A 25 13.427 -8.578 5.050 1.00 0.00 C ATOM 358 O GLY A 25 14.556 -8.093 5.108 1.00 0.00 O ATOM 0 H GLY A 25 10.710 -7.852 5.244 1.00 0.00 H new ATOM 0 HA2 GLY A 25 12.579 -7.460 6.689 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.707 -9.182 6.992 1.00 0.00 H new ATOM 362 N ILE A 26 12.948 -9.240 4.008 1.00 0.00 N ATOM 363 CA ILE A 26 13.754 -9.445 2.816 1.00 0.00 C ATOM 364 C ILE A 26 14.447 -8.134 2.442 1.00 0.00 C ATOM 365 O ILE A 26 14.083 -7.071 2.943 1.00 0.00 O ATOM 366 CB ILE A 26 12.903 -10.035 1.690 1.00 0.00 C ATOM 367 CG1 ILE A 26 12.803 -11.557 1.817 1.00 0.00 C ATOM 368 CG2 ILE A 26 13.436 -9.608 0.320 1.00 0.00 C ATOM 369 CD1 ILE A 26 11.551 -12.085 1.115 1.00 0.00 C ATOM 0 H ILE A 26 12.012 -9.642 3.964 1.00 0.00 H new ATOM 0 HA ILE A 26 14.539 -10.176 3.008 1.00 0.00 H new ATOM 0 HB ILE A 26 11.892 -9.638 1.781 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.690 -12.021 1.384 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.779 -11.837 2.870 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.814 -10.041 -0.463 1.00 0.00 H new ATOM 0 HG22 ILE A 26 13.413 -8.521 0.243 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.462 -9.958 0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 26 11.504 -13.169 1.221 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.665 -11.638 1.566 1.00 0.00 H new ATOM 0 HD13 ILE A 26 11.590 -11.825 0.057 1.00 0.00 H new ATOM 381 N LYS A 27 15.432 -8.252 1.564 1.00 0.00 N ATOM 382 CA LYS A 27 16.179 -7.089 1.117 1.00 0.00 C ATOM 383 C LYS A 27 15.826 -6.791 -0.342 1.00 0.00 C ATOM 384 O LYS A 27 15.746 -5.630 -0.740 1.00 0.00 O ATOM 385 CB LYS A 27 17.677 -7.288 1.358 1.00 0.00 C ATOM 386 CG LYS A 27 18.020 -7.124 2.840 1.00 0.00 C ATOM 387 CD LYS A 27 17.933 -8.463 3.575 1.00 0.00 C ATOM 388 CE LYS A 27 19.118 -9.362 3.218 1.00 0.00 C ATOM 389 NZ LYS A 27 18.647 -10.710 2.828 1.00 0.00 N ATOM 0 H LYS A 27 15.730 -9.135 1.150 1.00 0.00 H new ATOM 0 HA LYS A 27 15.900 -6.211 1.699 1.00 0.00 H new ATOM 0 HB2 LYS A 27 17.975 -8.280 1.020 1.00 0.00 H new ATOM 0 HB3 LYS A 27 18.243 -6.567 0.768 1.00 0.00 H new ATOM 0 HG2 LYS A 27 19.025 -6.714 2.941 1.00 0.00 H new ATOM 0 HG3 LYS A 27 17.337 -6.409 3.298 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.914 -8.291 4.651 1.00 0.00 H new ATOM 0 HD3 LYS A 27 17.000 -8.964 3.316 1.00 0.00 H new ATOM 0 HE2 LYS A 27 19.686 -8.918 2.400 1.00 0.00 H new ATOM 0 HE3 LYS A 27 19.794 -9.439 4.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 19.464 -11.307 2.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 18.125 -11.138 3.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 18.021 -10.633 2.001 1.00 0.00 H new ATOM 403 N TYR A 28 15.622 -7.859 -1.098 1.00 0.00 N ATOM 404 CA TYR A 28 15.279 -7.727 -2.504 1.00 0.00 C ATOM 405 C TYR A 28 13.792 -7.413 -2.678 1.00 0.00 C ATOM 406 O TYR A 28 13.003 -7.593 -1.751 1.00 0.00 O ATOM 407 CB TYR A 28 15.579 -9.085 -3.141 1.00 0.00 C ATOM 408 CG TYR A 28 15.018 -10.276 -2.361 1.00 0.00 C ATOM 409 CD1 TYR A 28 13.700 -10.650 -2.528 1.00 0.00 C ATOM 410 CD2 TYR A 28 15.829 -10.975 -1.491 1.00 0.00 C ATOM 411 CE1 TYR A 28 13.172 -11.771 -1.794 1.00 0.00 C ATOM 412 CE2 TYR A 28 15.301 -12.096 -0.757 1.00 0.00 C ATOM 413 CZ TYR A 28 13.999 -12.439 -0.945 1.00 0.00 C ATOM 414 OH TYR A 28 13.500 -13.497 -0.252 1.00 0.00 O ATOM 0 H TYR A 28 15.688 -8.820 -0.764 1.00 0.00 H new ATOM 0 HA TYR A 28 15.845 -6.916 -2.963 1.00 0.00 H new ATOM 0 HB2 TYR A 28 15.169 -9.100 -4.151 1.00 0.00 H new ATOM 0 HB3 TYR A 28 16.659 -9.201 -3.234 1.00 0.00 H new ATOM 0 HD1 TYR A 28 13.065 -10.102 -3.209 1.00 0.00 H new ATOM 0 HD2 TYR A 28 16.860 -10.682 -1.360 1.00 0.00 H new ATOM 0 HE1 TYR A 28 12.143 -12.075 -1.915 1.00 0.00 H new ATOM 0 HE2 TYR A 28 15.925 -12.652 -0.073 1.00 0.00 H new ATOM 0 HH TYR A 28 14.203 -13.878 0.314 1.00 0.00 H new ATOM 424 N PRO A 29 13.445 -6.936 -3.903 1.00 0.00 N ATOM 425 CA PRO A 29 12.066 -6.595 -4.210 1.00 0.00 C ATOM 426 C PRO A 29 11.224 -7.855 -4.424 1.00 0.00 C ATOM 427 O PRO A 29 11.444 -8.598 -5.379 1.00 0.00 O ATOM 428 CB PRO A 29 12.145 -5.717 -5.448 1.00 0.00 C ATOM 429 CG PRO A 29 13.512 -5.977 -6.058 1.00 0.00 C ATOM 430 CD PRO A 29 14.352 -6.710 -5.024 1.00 0.00 C ATOM 0 HA PRO A 29 11.571 -6.068 -3.394 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.350 -5.963 -6.152 1.00 0.00 H new ATOM 0 HB3 PRO A 29 12.027 -4.665 -5.189 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.418 -6.573 -6.966 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.988 -5.038 -6.341 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.735 -7.651 -5.420 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.215 -6.117 -4.722 1.00 0.00 H new ATOM 438 N VAL A 30 10.278 -8.056 -3.518 1.00 0.00 N ATOM 439 CA VAL A 30 9.402 -9.213 -3.596 1.00 0.00 C ATOM 440 C VAL A 30 8.075 -8.801 -4.236 1.00 0.00 C ATOM 441 O VAL A 30 7.721 -7.623 -4.235 1.00 0.00 O ATOM 442 CB VAL A 30 9.230 -9.832 -2.207 1.00 0.00 C ATOM 443 CG1 VAL A 30 8.581 -11.215 -2.300 1.00 0.00 C ATOM 444 CG2 VAL A 30 10.567 -9.903 -1.468 1.00 0.00 C ATOM 0 H VAL A 30 10.099 -7.438 -2.727 1.00 0.00 H new ATOM 0 HA VAL A 30 9.842 -9.984 -4.229 1.00 0.00 H new ATOM 0 HB VAL A 30 8.565 -9.187 -1.633 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.470 -11.633 -1.299 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.600 -11.126 -2.767 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.210 -11.872 -2.900 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.416 -10.347 -0.484 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.266 -10.515 -2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.974 -8.898 -1.354 1.00 0.00 H new ATOM 454 N GLN A 31 7.377 -9.794 -4.767 1.00 0.00 N ATOM 455 CA GLN A 31 6.097 -9.549 -5.409 1.00 0.00 C ATOM 456 C GLN A 31 4.952 -9.835 -4.435 1.00 0.00 C ATOM 457 O GLN A 31 4.695 -10.989 -4.095 1.00 0.00 O ATOM 458 CB GLN A 31 5.954 -10.384 -6.683 1.00 0.00 C ATOM 459 CG GLN A 31 6.523 -9.639 -7.893 1.00 0.00 C ATOM 460 CD GLN A 31 5.495 -9.565 -9.024 1.00 0.00 C ATOM 461 OE1 GLN A 31 5.344 -10.477 -9.820 1.00 0.00 O ATOM 462 NE2 GLN A 31 4.800 -8.432 -9.050 1.00 0.00 N ATOM 0 H GLN A 31 7.674 -10.770 -4.766 1.00 0.00 H new ATOM 0 HA GLN A 31 6.051 -8.498 -5.695 1.00 0.00 H new ATOM 0 HB2 GLN A 31 6.473 -11.334 -6.559 1.00 0.00 H new ATOM 0 HB3 GLN A 31 4.903 -10.615 -6.855 1.00 0.00 H new ATOM 0 HG2 GLN A 31 6.818 -8.632 -7.599 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.422 -10.144 -8.246 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.977 -7.709 -8.353 1.00 0.00 H new ATOM 0 HE22 GLN A 31 4.090 -8.286 -9.767 1.00 0.00 H new ATOM 471 N VAL A 32 4.294 -8.765 -4.014 1.00 0.00 N ATOM 472 CA VAL A 32 3.183 -8.886 -3.086 1.00 0.00 C ATOM 473 C VAL A 32 2.139 -9.840 -3.670 1.00 0.00 C ATOM 474 O VAL A 32 1.873 -9.816 -4.871 1.00 0.00 O ATOM 475 CB VAL A 32 2.615 -7.502 -2.766 1.00 0.00 C ATOM 476 CG1 VAL A 32 1.355 -7.612 -1.905 1.00 0.00 C ATOM 477 CG2 VAL A 32 3.667 -6.621 -2.089 1.00 0.00 C ATOM 0 H VAL A 32 4.509 -7.810 -4.299 1.00 0.00 H new ATOM 0 HA VAL A 32 3.520 -9.311 -2.140 1.00 0.00 H new ATOM 0 HB VAL A 32 2.337 -7.028 -3.707 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.972 -6.614 -1.692 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.598 -8.185 -2.440 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.597 -8.115 -0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.238 -5.643 -1.872 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.990 -7.089 -1.159 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.524 -6.502 -2.752 1.00 0.00 H new ATOM 487 N PRO A 33 1.559 -10.679 -2.770 1.00 0.00 N ATOM 488 CA PRO A 33 0.550 -11.639 -3.184 1.00 0.00 C ATOM 489 C PRO A 33 -0.788 -10.947 -3.452 1.00 0.00 C ATOM 490 O PRO A 33 -1.742 -11.118 -2.695 1.00 0.00 O ATOM 491 CB PRO A 33 0.480 -12.649 -2.050 1.00 0.00 C ATOM 492 CG PRO A 33 1.108 -11.967 -0.845 1.00 0.00 C ATOM 493 CD PRO A 33 1.848 -10.735 -1.340 1.00 0.00 C ATOM 0 HA PRO A 33 0.798 -12.132 -4.124 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.552 -12.934 -1.844 1.00 0.00 H new ATOM 0 HB3 PRO A 33 1.018 -13.562 -2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.342 -11.687 -0.122 1.00 0.00 H new ATOM 0 HG3 PRO A 33 1.793 -12.645 -0.337 1.00 0.00 H new ATOM 0 HD2 PRO A 33 1.504 -9.835 -0.831 1.00 0.00 H new ATOM 0 HD3 PRO A 33 2.919 -10.816 -1.155 1.00 0.00 H new ATOM 501 N TYR A 34 -0.815 -10.179 -4.532 1.00 0.00 N ATOM 502 CA TYR A 34 -2.020 -9.461 -4.909 1.00 0.00 C ATOM 503 C TYR A 34 -3.209 -10.414 -5.038 1.00 0.00 C ATOM 504 O TYR A 34 -4.237 -10.221 -4.390 1.00 0.00 O ATOM 505 CB TYR A 34 -1.729 -8.840 -6.277 1.00 0.00 C ATOM 506 CG TYR A 34 -1.314 -7.368 -6.217 1.00 0.00 C ATOM 507 CD1 TYR A 34 -0.645 -6.885 -5.111 1.00 0.00 C ATOM 508 CD2 TYR A 34 -1.607 -6.525 -7.269 1.00 0.00 C ATOM 509 CE1 TYR A 34 -0.254 -5.500 -5.054 1.00 0.00 C ATOM 510 CE2 TYR A 34 -1.216 -5.140 -7.212 1.00 0.00 C ATOM 511 CZ TYR A 34 -0.559 -4.696 -6.108 1.00 0.00 C ATOM 512 OH TYR A 34 -0.190 -3.388 -6.054 1.00 0.00 O ATOM 0 H TYR A 34 -0.022 -10.039 -5.157 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.274 -8.715 -4.156 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -0.937 -9.411 -6.763 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -2.617 -8.931 -6.902 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.415 -7.545 -4.288 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.129 -6.904 -8.135 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.269 -5.109 -4.194 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.440 -4.469 -8.028 1.00 0.00 H new ATOM 0 HH TYR A 34 -0.472 -2.934 -6.876 1.00 0.00 H new ATOM 522 N LYS A 35 -3.030 -11.423 -5.878 1.00 0.00 N ATOM 523 CA LYS A 35 -4.076 -12.407 -6.099 1.00 0.00 C ATOM 524 C LYS A 35 -4.624 -12.876 -4.750 1.00 0.00 C ATOM 525 O LYS A 35 -5.786 -12.633 -4.429 1.00 0.00 O ATOM 526 CB LYS A 35 -3.562 -13.546 -6.983 1.00 0.00 C ATOM 527 CG LYS A 35 -4.477 -13.758 -8.191 1.00 0.00 C ATOM 528 CD LYS A 35 -5.547 -14.809 -7.891 1.00 0.00 C ATOM 529 CE LYS A 35 -5.857 -15.646 -9.133 1.00 0.00 C ATOM 530 NZ LYS A 35 -7.203 -16.253 -9.027 1.00 0.00 N ATOM 0 H LYS A 35 -2.176 -11.580 -6.414 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.908 -11.961 -6.644 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.551 -13.320 -7.323 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.504 -14.465 -6.400 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -4.954 -12.815 -8.460 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -3.884 -14.072 -9.050 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.207 -15.460 -7.085 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.456 -14.319 -7.543 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.803 -15.020 -10.023 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.107 -16.428 -9.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.397 -16.818 -9.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.242 -16.867 -8.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.917 -15.502 -8.940 1.00 0.00 H new ATOM 544 N ARG A 36 -3.760 -13.539 -3.995 1.00 0.00 N ATOM 545 CA ARG A 36 -4.143 -14.044 -2.687 1.00 0.00 C ATOM 546 C ARG A 36 -4.734 -12.918 -1.836 1.00 0.00 C ATOM 547 O ARG A 36 -5.583 -13.162 -0.981 1.00 0.00 O ATOM 548 CB ARG A 36 -2.942 -14.649 -1.957 1.00 0.00 C ATOM 549 CG ARG A 36 -2.114 -15.527 -2.899 1.00 0.00 C ATOM 550 CD ARG A 36 -1.701 -16.830 -2.212 1.00 0.00 C ATOM 551 NE ARG A 36 -0.238 -16.843 -1.988 1.00 0.00 N ATOM 552 CZ ARG A 36 0.666 -17.087 -2.947 1.00 0.00 C ATOM 553 NH1 ARG A 36 0.263 -17.340 -4.200 1.00 0.00 N ATOM 554 NH2 ARG A 36 1.973 -17.079 -2.652 1.00 0.00 N ATOM 0 H ARG A 36 -2.796 -13.738 -4.264 1.00 0.00 H new ATOM 0 HA ARG A 36 -4.892 -14.822 -2.838 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -2.317 -13.852 -1.554 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -3.287 -15.242 -1.110 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -2.693 -15.752 -3.795 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -1.225 -14.984 -3.221 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -2.224 -16.931 -1.261 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -1.991 -17.682 -2.827 1.00 0.00 H new ATOM 0 HE ARG A 36 0.103 -16.655 -1.045 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -0.732 -17.347 -4.424 1.00 0.00 H new ATOM 0 HH12 ARG A 36 0.951 -17.526 -4.929 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.279 -16.887 -1.698 1.00 0.00 H new ATOM 0 HH22 ARG A 36 2.662 -17.265 -3.381 1.00 0.00 H new ATOM 568 N ILE A 37 -4.260 -11.709 -2.099 1.00 0.00 N ATOM 569 CA ILE A 37 -4.731 -10.545 -1.368 1.00 0.00 C ATOM 570 C ILE A 37 -6.154 -10.207 -1.817 1.00 0.00 C ATOM 571 O ILE A 37 -6.900 -9.555 -1.088 1.00 0.00 O ATOM 572 CB ILE A 37 -3.746 -9.384 -1.519 1.00 0.00 C ATOM 573 CG1 ILE A 37 -2.578 -9.524 -0.540 1.00 0.00 C ATOM 574 CG2 ILE A 37 -4.459 -8.038 -1.371 1.00 0.00 C ATOM 575 CD1 ILE A 37 -1.493 -8.485 -0.830 1.00 0.00 C ATOM 0 H ILE A 37 -3.554 -11.510 -2.808 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.776 -10.758 -0.300 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.328 -9.419 -2.525 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.938 -9.403 0.482 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.156 -10.526 -0.613 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -3.737 -7.229 -1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -5.227 -7.947 -2.139 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -4.922 -7.978 -0.386 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.674 -8.606 -0.120 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.118 -8.624 -1.844 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.913 -7.484 -0.733 1.00 0.00 H new ATOM 587 N LYS A 38 -6.487 -10.667 -3.014 1.00 0.00 N ATOM 588 CA LYS A 38 -7.808 -10.422 -3.568 1.00 0.00 C ATOM 589 C LYS A 38 -8.777 -11.490 -3.058 1.00 0.00 C ATOM 590 O LYS A 38 -9.832 -11.167 -2.513 1.00 0.00 O ATOM 591 CB LYS A 38 -7.740 -10.332 -5.094 1.00 0.00 C ATOM 592 CG LYS A 38 -9.085 -9.893 -5.678 1.00 0.00 C ATOM 593 CD LYS A 38 -9.032 -9.853 -7.206 1.00 0.00 C ATOM 594 CE LYS A 38 -9.520 -11.173 -7.806 1.00 0.00 C ATOM 595 NZ LYS A 38 -8.470 -11.774 -8.660 1.00 0.00 N ATOM 0 H LYS A 38 -5.865 -11.208 -3.615 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.190 -9.458 -3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.964 -9.624 -5.386 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -7.459 -11.301 -5.507 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.867 -10.580 -5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.348 -8.908 -5.294 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.648 -9.032 -7.573 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.011 -9.656 -7.533 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -9.788 -11.865 -7.008 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -10.421 -11.001 -8.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.818 -12.669 -9.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.234 -11.119 -9.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.620 -11.957 -8.089 1.00 0.00 H new ATOM 609 N SER A 39 -8.385 -12.741 -3.252 1.00 0.00 N ATOM 610 CA SER A 39 -9.206 -13.858 -2.818 1.00 0.00 C ATOM 611 C SER A 39 -9.346 -13.844 -1.294 1.00 0.00 C ATOM 612 O SER A 39 -10.438 -14.047 -0.766 1.00 0.00 O ATOM 613 CB SER A 39 -8.614 -15.190 -3.284 1.00 0.00 C ATOM 614 OG SER A 39 -9.430 -16.297 -2.909 1.00 0.00 O ATOM 0 H SER A 39 -7.510 -13.005 -3.704 1.00 0.00 H new ATOM 0 HA SER A 39 -10.193 -13.752 -3.268 1.00 0.00 H new ATOM 0 HB2 SER A 39 -8.498 -15.176 -4.368 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.618 -15.313 -2.858 1.00 0.00 H new ATOM 0 HG SER A 39 -9.019 -17.128 -3.226 1.00 0.00 H new ATOM 620 N ASN A 40 -8.224 -13.603 -0.631 1.00 0.00 N ATOM 621 CA ASN A 40 -8.208 -13.559 0.821 1.00 0.00 C ATOM 622 C ASN A 40 -7.734 -12.179 1.281 1.00 0.00 C ATOM 623 O ASN A 40 -6.580 -11.812 1.065 1.00 0.00 O ATOM 624 CB ASN A 40 -7.248 -14.604 1.393 1.00 0.00 C ATOM 625 CG ASN A 40 -7.927 -15.971 1.503 1.00 0.00 C ATOM 626 OD1 ASN A 40 -7.768 -16.841 0.663 1.00 0.00 O ATOM 627 ND2 ASN A 40 -8.690 -16.111 2.583 1.00 0.00 N ATOM 0 H ASN A 40 -7.320 -13.436 -1.073 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.218 -13.765 1.175 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -6.367 -14.682 0.755 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -6.902 -14.286 2.376 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -9.185 -16.987 2.747 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -8.780 -15.342 3.247 1.00 0.00 H new ATOM 634 N PRO A 41 -8.672 -11.433 1.923 1.00 0.00 N ATOM 635 CA PRO A 41 -8.362 -10.102 2.415 1.00 0.00 C ATOM 636 C PRO A 41 -7.502 -10.171 3.679 1.00 0.00 C ATOM 637 O PRO A 41 -6.909 -9.173 4.087 1.00 0.00 O ATOM 638 CB PRO A 41 -9.712 -9.445 2.651 1.00 0.00 C ATOM 639 CG PRO A 41 -10.720 -10.580 2.726 1.00 0.00 C ATOM 640 CD PRO A 41 -10.048 -11.836 2.197 1.00 0.00 C ATOM 0 HA PRO A 41 -7.769 -9.521 1.709 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -9.708 -8.865 3.574 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -9.958 -8.757 1.842 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -11.052 -10.729 3.754 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -11.606 -10.344 2.136 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -10.086 -12.643 2.928 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -10.541 -12.199 1.295 1.00 0.00 H new ATOM 648 N GLY A 42 -7.461 -11.359 4.264 1.00 0.00 N ATOM 649 CA GLY A 42 -6.683 -11.572 5.473 1.00 0.00 C ATOM 650 C GLY A 42 -5.266 -12.042 5.138 1.00 0.00 C ATOM 651 O GLY A 42 -4.792 -13.036 5.686 1.00 0.00 O ATOM 0 H GLY A 42 -7.954 -12.184 3.923 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.637 -10.647 6.048 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.177 -12.313 6.101 1.00 0.00 H new ATOM 655 N SER A 43 -4.630 -11.306 4.239 1.00 0.00 N ATOM 656 CA SER A 43 -3.276 -11.635 3.825 1.00 0.00 C ATOM 657 C SER A 43 -2.297 -10.587 4.357 1.00 0.00 C ATOM 658 O SER A 43 -1.587 -10.834 5.331 1.00 0.00 O ATOM 659 CB SER A 43 -3.175 -11.731 2.301 1.00 0.00 C ATOM 660 OG SER A 43 -3.994 -12.773 1.777 1.00 0.00 O ATOM 0 H SER A 43 -5.027 -10.483 3.785 1.00 0.00 H new ATOM 0 HA SER A 43 -3.017 -12.608 4.242 1.00 0.00 H new ATOM 0 HB2 SER A 43 -3.470 -10.780 1.857 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.138 -11.907 2.017 1.00 0.00 H new ATOM 0 HG SER A 43 -4.875 -12.411 1.544 1.00 0.00 H new ATOM 666 N VAL A 44 -2.289 -9.440 3.694 1.00 0.00 N ATOM 667 CA VAL A 44 -1.408 -8.354 4.088 1.00 0.00 C ATOM 668 C VAL A 44 -2.246 -7.119 4.424 1.00 0.00 C ATOM 669 O VAL A 44 -2.978 -6.612 3.575 1.00 0.00 O ATOM 670 CB VAL A 44 -0.374 -8.094 2.990 1.00 0.00 C ATOM 671 CG1 VAL A 44 0.297 -6.733 3.180 1.00 0.00 C ATOM 672 CG2 VAL A 44 0.665 -9.216 2.938 1.00 0.00 C ATOM 0 H VAL A 44 -2.879 -9.239 2.886 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.850 -8.622 4.985 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.897 -8.078 2.034 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.027 -6.573 2.387 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.457 -5.947 3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.800 -6.707 4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.388 -9.006 2.149 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.181 -9.279 3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.167 -10.163 2.732 1.00 0.00 H new ATOM 682 N ILE A 45 -2.111 -6.671 5.664 1.00 0.00 N ATOM 683 CA ILE A 45 -2.848 -5.506 6.122 1.00 0.00 C ATOM 684 C ILE A 45 -2.019 -4.247 5.857 1.00 0.00 C ATOM 685 O ILE A 45 -0.824 -4.214 6.148 1.00 0.00 O ATOM 686 CB ILE A 45 -3.259 -5.674 7.586 1.00 0.00 C ATOM 687 CG1 ILE A 45 -3.555 -7.140 7.908 1.00 0.00 C ATOM 688 CG2 ILE A 45 -4.437 -4.761 7.933 1.00 0.00 C ATOM 689 CD1 ILE A 45 -4.090 -7.291 9.333 1.00 0.00 C ATOM 0 H ILE A 45 -1.502 -7.094 6.365 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.778 -5.400 5.564 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.421 -5.370 8.213 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.284 -7.532 7.199 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.647 -7.732 7.792 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.709 -4.900 8.979 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.153 -3.722 7.767 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.289 -5.010 7.300 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.292 -8.343 9.536 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.349 -6.921 10.041 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.011 -6.717 9.439 1.00 0.00 H new ATOM 701 N ILE A 46 -2.686 -3.243 5.307 1.00 0.00 N ATOM 702 CA ILE A 46 -2.025 -1.986 4.999 1.00 0.00 C ATOM 703 C ILE A 46 -2.653 -0.868 5.834 1.00 0.00 C ATOM 704 O ILE A 46 -3.870 -0.689 5.824 1.00 0.00 O ATOM 705 CB ILE A 46 -2.056 -1.720 3.493 1.00 0.00 C ATOM 706 CG1 ILE A 46 -0.978 -2.531 2.771 1.00 0.00 C ATOM 707 CG2 ILE A 46 -1.941 -0.223 3.198 1.00 0.00 C ATOM 708 CD1 ILE A 46 -1.047 -2.311 1.259 1.00 0.00 C ATOM 0 H ILE A 46 -3.677 -3.274 5.067 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.970 -2.033 5.269 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.020 -2.051 3.107 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.007 -2.243 3.139 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.104 -3.590 2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.966 -0.062 2.120 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.774 0.305 3.663 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.002 0.156 3.600 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.270 -2.899 0.770 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -2.024 -2.623 0.890 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.896 -1.254 1.038 1.00 0.00 H new ATOM 720 N GLU A 47 -1.793 -0.144 6.536 1.00 0.00 N ATOM 721 CA GLU A 47 -2.248 0.952 7.375 1.00 0.00 C ATOM 722 C GLU A 47 -1.315 2.155 7.228 1.00 0.00 C ATOM 723 O GLU A 47 -0.216 2.031 6.689 1.00 0.00 O ATOM 724 CB GLU A 47 -2.354 0.516 8.838 1.00 0.00 C ATOM 725 CG GLU A 47 -3.765 0.022 9.162 1.00 0.00 C ATOM 726 CD GLU A 47 -4.512 1.033 10.035 1.00 0.00 C ATOM 727 OE1 GLU A 47 -3.840 1.655 10.885 1.00 0.00 O ATOM 728 OE2 GLU A 47 -5.739 1.160 9.832 1.00 0.00 O ATOM 0 H GLU A 47 -0.784 -0.295 6.541 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.244 1.247 7.045 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.633 -0.276 9.038 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.099 1.352 9.490 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.318 -0.144 8.237 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.709 -0.937 9.676 1.00 0.00 H new ATOM 735 N GLY A 48 -1.786 3.293 7.717 1.00 0.00 N ATOM 736 CA GLY A 48 -1.008 4.518 7.646 1.00 0.00 C ATOM 737 C GLY A 48 -1.334 5.303 6.375 1.00 0.00 C ATOM 738 O GLY A 48 -0.929 6.455 6.231 1.00 0.00 O ATOM 0 H GLY A 48 -2.697 3.392 8.164 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.214 5.135 8.521 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.055 4.279 7.667 1.00 0.00 H new ATOM 742 N LEU A 49 -2.064 4.648 5.484 1.00 0.00 N ATOM 743 CA LEU A 49 -2.450 5.270 4.229 1.00 0.00 C ATOM 744 C LEU A 49 -3.039 6.654 4.511 1.00 0.00 C ATOM 745 O LEU A 49 -3.394 6.962 5.647 1.00 0.00 O ATOM 746 CB LEU A 49 -3.387 4.352 3.441 1.00 0.00 C ATOM 747 CG LEU A 49 -2.714 3.380 2.470 1.00 0.00 C ATOM 748 CD1 LEU A 49 -3.718 2.359 1.933 1.00 0.00 C ATOM 749 CD2 LEU A 49 -2.004 4.134 1.344 1.00 0.00 C ATOM 0 H LEU A 49 -2.398 3.692 5.607 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.577 5.418 3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.979 3.774 4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -4.083 4.973 2.878 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.951 2.824 3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.214 1.680 1.245 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.137 1.790 2.763 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -4.520 2.878 1.408 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.534 3.420 0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.730 4.732 0.793 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.242 4.788 1.768 1.00 0.00 H new ATOM 761 N PRO A 50 -3.126 7.472 3.428 1.00 0.00 N ATOM 762 CA PRO A 50 -3.665 8.816 3.548 1.00 0.00 C ATOM 763 C PRO A 50 -5.188 8.785 3.690 1.00 0.00 C ATOM 764 O PRO A 50 -5.813 7.744 3.491 1.00 0.00 O ATOM 765 CB PRO A 50 -3.200 9.540 2.294 1.00 0.00 C ATOM 766 CG PRO A 50 -2.816 8.452 1.304 1.00 0.00 C ATOM 767 CD PRO A 50 -2.715 7.142 2.067 1.00 0.00 C ATOM 0 HA PRO A 50 -3.315 9.331 4.442 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -3.991 10.173 1.892 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.351 10.189 2.510 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.561 8.376 0.512 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -1.866 8.689 0.826 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.362 6.380 1.632 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.699 6.748 2.045 1.00 0.00 H new ATOM 775 N PRO A 51 -5.757 9.969 4.042 1.00 0.00 N ATOM 776 CA PRO A 51 -7.195 10.088 4.213 1.00 0.00 C ATOM 777 C PRO A 51 -7.908 10.108 2.860 1.00 0.00 C ATOM 778 O PRO A 51 -7.616 10.950 2.013 1.00 0.00 O ATOM 779 CB PRO A 51 -7.392 11.368 5.008 1.00 0.00 C ATOM 780 CG PRO A 51 -6.103 12.158 4.853 1.00 0.00 C ATOM 781 CD PRO A 51 -5.048 11.223 4.286 1.00 0.00 C ATOM 0 HA PRO A 51 -7.628 9.238 4.740 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.244 11.934 4.632 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -7.592 11.149 6.057 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -6.255 13.009 4.189 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -5.782 12.557 5.815 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -4.619 11.621 3.366 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.225 11.083 4.987 1.00 0.00 H new ATOM 789 N GLY A 52 -8.831 9.170 2.699 1.00 0.00 N ATOM 790 CA GLY A 52 -9.588 9.070 1.464 1.00 0.00 C ATOM 791 C GLY A 52 -9.030 7.963 0.567 1.00 0.00 C ATOM 792 O GLY A 52 -9.608 7.651 -0.473 1.00 0.00 O ATOM 0 H GLY A 52 -9.071 8.473 3.404 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.635 8.867 1.690 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.555 10.023 0.935 1.00 0.00 H new ATOM 796 N ILE A 53 -7.911 7.401 1.001 1.00 0.00 N ATOM 797 CA ILE A 53 -7.268 6.336 0.250 1.00 0.00 C ATOM 798 C ILE A 53 -7.206 5.075 1.114 1.00 0.00 C ATOM 799 O ILE A 53 -6.329 4.945 1.967 1.00 0.00 O ATOM 800 CB ILE A 53 -5.904 6.795 -0.268 1.00 0.00 C ATOM 801 CG1 ILE A 53 -5.997 8.184 -0.903 1.00 0.00 C ATOM 802 CG2 ILE A 53 -5.307 5.764 -1.228 1.00 0.00 C ATOM 803 CD1 ILE A 53 -4.651 8.607 -1.495 1.00 0.00 C ATOM 0 H ILE A 53 -7.433 7.663 1.863 1.00 0.00 H new ATOM 0 HA ILE A 53 -7.852 6.087 -0.636 1.00 0.00 H new ATOM 0 HB ILE A 53 -5.225 6.875 0.581 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -6.757 8.181 -1.684 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -6.313 8.910 -0.154 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -4.337 6.115 -1.582 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -5.182 4.814 -0.709 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.976 5.628 -2.078 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.744 9.598 -1.940 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -3.899 8.633 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.350 7.892 -2.261 1.00 0.00 H new ATOM 815 N PRO A 54 -8.173 4.154 0.857 1.00 0.00 N ATOM 816 CA PRO A 54 -8.236 2.907 1.601 1.00 0.00 C ATOM 817 C PRO A 54 -7.143 1.939 1.142 1.00 0.00 C ATOM 818 O PRO A 54 -6.471 2.185 0.142 1.00 0.00 O ATOM 819 CB PRO A 54 -9.640 2.376 1.360 1.00 0.00 C ATOM 820 CG PRO A 54 -10.152 3.098 0.124 1.00 0.00 C ATOM 821 CD PRO A 54 -9.228 4.274 -0.146 1.00 0.00 C ATOM 0 HA PRO A 54 -8.054 3.043 2.667 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.628 1.297 1.205 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -10.283 2.568 2.219 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.171 2.423 -0.732 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.174 3.444 0.280 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -8.821 4.234 -1.156 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -9.757 5.223 -0.053 1.00 0.00 H new ATOM 829 N PHE A 55 -7.000 0.859 1.897 1.00 0.00 N ATOM 830 CA PHE A 55 -6.000 -0.147 1.581 1.00 0.00 C ATOM 831 C PHE A 55 -6.454 -1.021 0.410 1.00 0.00 C ATOM 832 O PHE A 55 -7.044 -2.080 0.614 1.00 0.00 O ATOM 833 CB PHE A 55 -5.839 -1.023 2.824 1.00 0.00 C ATOM 834 CG PHE A 55 -5.346 -2.441 2.526 1.00 0.00 C ATOM 835 CD1 PHE A 55 -4.541 -2.670 1.455 1.00 0.00 C ATOM 836 CD2 PHE A 55 -5.713 -3.472 3.334 1.00 0.00 C ATOM 837 CE1 PHE A 55 -4.083 -3.985 1.179 1.00 0.00 C ATOM 838 CE2 PHE A 55 -5.256 -4.787 3.058 1.00 0.00 C ATOM 839 CZ PHE A 55 -4.450 -5.016 1.986 1.00 0.00 C ATOM 0 H PHE A 55 -7.560 0.659 2.726 1.00 0.00 H new ATOM 0 HA PHE A 55 -5.063 0.334 1.299 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -5.139 -0.542 3.507 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -6.797 -1.083 3.340 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -4.250 -1.851 0.814 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.352 -3.290 4.185 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.443 -4.167 0.328 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.548 -5.606 3.699 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.102 -6.017 1.776 1.00 0.00 H new ATOM 849 N ARG A 56 -6.160 -0.545 -0.791 1.00 0.00 N ATOM 850 CA ARG A 56 -6.530 -1.271 -1.995 1.00 0.00 C ATOM 851 C ARG A 56 -5.471 -1.071 -3.081 1.00 0.00 C ATOM 852 O ARG A 56 -4.479 -0.376 -2.866 1.00 0.00 O ATOM 853 CB ARG A 56 -7.887 -0.804 -2.524 1.00 0.00 C ATOM 854 CG ARG A 56 -9.032 -1.439 -1.732 1.00 0.00 C ATOM 855 CD ARG A 56 -9.425 -2.793 -2.326 1.00 0.00 C ATOM 856 NE ARG A 56 -10.427 -3.454 -1.461 1.00 0.00 N ATOM 857 CZ ARG A 56 -10.122 -4.177 -0.375 1.00 0.00 C ATOM 858 NH1 ARG A 56 -8.842 -4.337 -0.014 1.00 0.00 N ATOM 859 NH2 ARG A 56 -11.098 -4.740 0.351 1.00 0.00 N ATOM 0 H ARG A 56 -5.670 0.334 -0.957 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.597 -2.328 -1.738 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.953 0.282 -2.458 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.980 -1.066 -3.578 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.732 -1.567 -0.692 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.894 -0.772 -1.735 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.832 -2.655 -3.328 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.543 -3.426 -2.424 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.412 -3.353 -1.707 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.099 -3.908 -0.566 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -8.610 -4.887 0.813 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.073 -4.618 0.077 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -10.866 -5.290 1.178 1.00 0.00 H new ATOM 873 N LYS A 57 -5.718 -1.694 -4.225 1.00 0.00 N ATOM 874 CA LYS A 57 -4.798 -1.593 -5.345 1.00 0.00 C ATOM 875 C LYS A 57 -4.489 -0.120 -5.615 1.00 0.00 C ATOM 876 O LYS A 57 -5.372 0.731 -5.524 1.00 0.00 O ATOM 877 CB LYS A 57 -5.353 -2.338 -6.561 1.00 0.00 C ATOM 878 CG LYS A 57 -4.595 -3.646 -6.796 1.00 0.00 C ATOM 879 CD LYS A 57 -4.910 -4.222 -8.178 1.00 0.00 C ATOM 880 CE LYS A 57 -5.206 -5.721 -8.092 1.00 0.00 C ATOM 881 NZ LYS A 57 -6.094 -6.138 -9.201 1.00 0.00 N ATOM 0 H LYS A 57 -6.541 -2.270 -4.400 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.852 -2.078 -5.106 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -6.412 -2.549 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.277 -1.705 -7.445 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -3.523 -3.470 -6.707 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -4.864 -4.370 -6.027 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.767 -3.702 -8.606 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -4.067 -4.052 -8.848 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -4.274 -6.285 -8.133 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -5.676 -5.951 -7.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -6.285 -7.158 -9.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -6.990 -5.613 -9.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -5.632 -5.937 -10.111 1.00 0.00 H new ATOM 895 N PRO A 58 -3.197 0.144 -5.950 1.00 0.00 N ATOM 896 CA PRO A 58 -2.760 1.501 -6.233 1.00 0.00 C ATOM 897 C PRO A 58 -3.246 1.957 -7.610 1.00 0.00 C ATOM 898 O PRO A 58 -3.883 3.003 -7.732 1.00 0.00 O ATOM 899 CB PRO A 58 -1.244 1.456 -6.124 1.00 0.00 C ATOM 900 CG PRO A 58 -0.861 -0.010 -6.242 1.00 0.00 C ATOM 901 CD PRO A 58 -2.123 -0.838 -6.067 1.00 0.00 C ATOM 0 HA PRO A 58 -3.175 2.231 -5.538 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -0.778 2.046 -6.913 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -0.908 1.872 -5.174 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -0.406 -0.209 -7.212 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -0.123 -0.274 -5.484 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.283 -1.501 -6.918 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.064 -1.468 -5.179 1.00 0.00 H new ATOM 909 N CYS A 59 -2.928 1.151 -8.612 1.00 0.00 N ATOM 910 CA CYS A 59 -3.325 1.459 -9.975 1.00 0.00 C ATOM 911 C CYS A 59 -4.837 1.695 -9.994 1.00 0.00 C ATOM 912 O CYS A 59 -5.347 2.404 -10.860 1.00 0.00 O ATOM 913 CB CYS A 59 -2.908 0.355 -10.949 1.00 0.00 C ATOM 914 SG CYS A 59 -3.439 -1.276 -10.311 1.00 0.00 S ATOM 0 H CYS A 59 -2.400 0.285 -8.507 1.00 0.00 H new ATOM 0 HA CYS A 59 -2.813 2.361 -10.310 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -3.354 0.535 -11.927 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -1.826 0.367 -11.084 1.00 0.00 H new ATOM 0 HG CYS A 59 -3.082 -2.206 -11.146 1.00 0.00 H new ATOM 920 N THR A 60 -5.510 1.087 -9.028 1.00 0.00 N ATOM 921 CA THR A 60 -6.953 1.222 -8.923 1.00 0.00 C ATOM 922 C THR A 60 -7.326 2.647 -8.507 1.00 0.00 C ATOM 923 O THR A 60 -8.504 3.003 -8.486 1.00 0.00 O ATOM 924 CB THR A 60 -7.458 0.154 -7.951 1.00 0.00 C ATOM 925 OG1 THR A 60 -7.902 -0.903 -8.798 1.00 0.00 O ATOM 926 CG2 THR A 60 -8.721 0.590 -7.206 1.00 0.00 C ATOM 0 H THR A 60 -5.083 0.500 -8.311 1.00 0.00 H new ATOM 0 HA THR A 60 -7.437 1.060 -9.886 1.00 0.00 H new ATOM 0 HB THR A 60 -6.675 -0.080 -7.230 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.245 -1.640 -8.250 1.00 0.00 H new ATOM 0 HG21 THR A 60 -9.037 -0.204 -6.530 1.00 0.00 H new ATOM 0 HG22 THR A 60 -8.512 1.493 -6.633 1.00 0.00 H new ATOM 0 HG23 THR A 60 -9.516 0.792 -7.924 1.00 0.00 H new ATOM 934 N PHE A 61 -6.302 3.423 -8.188 1.00 0.00 N ATOM 935 CA PHE A 61 -6.507 4.801 -7.774 1.00 0.00 C ATOM 936 C PHE A 61 -5.935 5.775 -8.806 1.00 0.00 C ATOM 937 O PHE A 61 -5.001 5.437 -9.532 1.00 0.00 O ATOM 938 CB PHE A 61 -5.765 4.986 -6.449 1.00 0.00 C ATOM 939 CG PHE A 61 -6.380 4.217 -5.279 1.00 0.00 C ATOM 940 CD1 PHE A 61 -7.726 4.235 -5.085 1.00 0.00 C ATOM 941 CD2 PHE A 61 -5.581 3.514 -4.432 1.00 0.00 C ATOM 942 CE1 PHE A 61 -8.297 3.521 -3.998 1.00 0.00 C ATOM 943 CE2 PHE A 61 -6.152 2.800 -3.345 1.00 0.00 C ATOM 944 CZ PHE A 61 -7.498 2.819 -3.151 1.00 0.00 C ATOM 0 H PHE A 61 -5.327 3.124 -8.208 1.00 0.00 H new ATOM 0 HA PHE A 61 -7.573 5.004 -7.675 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.730 4.667 -6.576 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.743 6.047 -6.202 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -8.361 4.792 -5.758 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.512 3.499 -4.586 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -9.366 3.536 -3.844 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -5.517 2.242 -2.673 1.00 0.00 H new ATOM 0 HZ PHE A 61 -7.932 2.277 -2.324 1.00 0.00 H new ATOM 954 N GLY A 62 -6.519 6.963 -8.839 1.00 0.00 N ATOM 955 CA GLY A 62 -6.079 7.988 -9.770 1.00 0.00 C ATOM 956 C GLY A 62 -4.709 8.540 -9.371 1.00 0.00 C ATOM 957 O GLY A 62 -4.258 8.337 -8.244 1.00 0.00 O ATOM 0 H GLY A 62 -7.294 7.239 -8.236 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -6.028 7.573 -10.776 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -6.808 8.798 -9.796 1.00 0.00 H new ATOM 961 N SER A 63 -4.084 9.227 -10.316 1.00 0.00 N ATOM 962 CA SER A 63 -2.775 9.809 -10.077 1.00 0.00 C ATOM 963 C SER A 63 -2.786 10.603 -8.769 1.00 0.00 C ATOM 964 O SER A 63 -1.874 10.477 -7.954 1.00 0.00 O ATOM 965 CB SER A 63 -2.351 10.708 -11.240 1.00 0.00 C ATOM 966 OG SER A 63 -3.373 11.634 -11.599 1.00 0.00 O ATOM 0 H SER A 63 -4.461 9.393 -11.249 1.00 0.00 H new ATOM 0 HA SER A 63 -2.050 8.999 -9.997 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.448 11.253 -10.966 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.102 10.091 -12.103 1.00 0.00 H new ATOM 0 HG SER A 63 -3.063 12.191 -12.344 1.00 0.00 H new ATOM 972 N GLN A 64 -3.829 11.405 -8.610 1.00 0.00 N ATOM 973 CA GLN A 64 -3.971 12.220 -7.415 1.00 0.00 C ATOM 974 C GLN A 64 -3.860 11.348 -6.162 1.00 0.00 C ATOM 975 O GLN A 64 -3.036 11.613 -5.289 1.00 0.00 O ATOM 976 CB GLN A 64 -5.293 12.991 -7.432 1.00 0.00 C ATOM 977 CG GLN A 64 -5.191 14.233 -8.319 1.00 0.00 C ATOM 978 CD GLN A 64 -5.706 13.943 -9.730 1.00 0.00 C ATOM 979 OE1 GLN A 64 -6.800 13.441 -9.929 1.00 0.00 O ATOM 980 NE2 GLN A 64 -4.858 14.285 -10.696 1.00 0.00 N ATOM 0 H GLN A 64 -4.584 11.508 -9.289 1.00 0.00 H new ATOM 0 HA GLN A 64 -3.162 12.951 -7.398 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.091 12.344 -7.796 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.560 13.285 -6.417 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -5.766 15.047 -7.878 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.154 14.565 -8.368 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.957 14.701 -10.460 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -5.109 14.131 -11.673 1.00 0.00 H new ATOM 989 N ASN A 65 -4.703 10.327 -6.114 1.00 0.00 N ATOM 990 CA ASN A 65 -4.710 9.415 -4.983 1.00 0.00 C ATOM 991 C ASN A 65 -3.310 8.826 -4.799 1.00 0.00 C ATOM 992 O ASN A 65 -2.857 8.632 -3.672 1.00 0.00 O ATOM 993 CB ASN A 65 -5.683 8.257 -5.215 1.00 0.00 C ATOM 994 CG ASN A 65 -7.061 8.574 -4.630 1.00 0.00 C ATOM 995 OD1 ASN A 65 -7.529 7.638 -3.809 1.00 0.00 O flip ATOM 996 ND2 ASN A 65 -7.660 9.600 -4.907 1.00 0.00 N flip ATOM 0 H ASN A 65 -5.386 10.111 -6.840 1.00 0.00 H new ATOM 0 HA ASN A 65 -5.019 9.975 -4.101 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.774 8.062 -6.284 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -5.290 7.349 -4.757 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -7.243 10.278 -5.545 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -8.578 9.780 -4.500 1.00 0.00 H new ATOM 1003 N LEU A 66 -2.662 8.560 -5.924 1.00 0.00 N ATOM 1004 CA LEU A 66 -1.323 7.997 -5.902 1.00 0.00 C ATOM 1005 C LEU A 66 -0.361 9.008 -5.274 1.00 0.00 C ATOM 1006 O LEU A 66 0.217 8.748 -4.219 1.00 0.00 O ATOM 1007 CB LEU A 66 -0.909 7.542 -7.302 1.00 0.00 C ATOM 1008 CG LEU A 66 -1.744 6.416 -7.915 1.00 0.00 C ATOM 1009 CD1 LEU A 66 -1.410 6.230 -9.397 1.00 0.00 C ATOM 1010 CD2 LEU A 66 -1.578 5.117 -7.123 1.00 0.00 C ATOM 0 H LEU A 66 -3.040 8.724 -6.857 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.296 7.101 -5.281 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.950 8.403 -7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.131 7.217 -7.264 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.795 6.698 -7.855 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.017 5.424 -9.808 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.620 7.154 -9.936 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.354 5.980 -9.503 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.182 4.333 -7.580 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.530 4.818 -7.130 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.904 5.274 -6.095 1.00 0.00 H new ATOM 1022 N GLU A 67 -0.218 10.139 -5.949 1.00 0.00 N ATOM 1023 CA GLU A 67 0.665 11.189 -5.471 1.00 0.00 C ATOM 1024 C GLU A 67 0.600 11.284 -3.946 1.00 0.00 C ATOM 1025 O GLU A 67 1.589 11.624 -3.298 1.00 0.00 O ATOM 1026 CB GLU A 67 0.320 12.532 -6.119 1.00 0.00 C ATOM 1027 CG GLU A 67 1.361 12.915 -7.173 1.00 0.00 C ATOM 1028 CD GLU A 67 1.719 14.400 -7.076 1.00 0.00 C ATOM 1029 OE1 GLU A 67 2.151 14.808 -5.976 1.00 0.00 O ATOM 1030 OE2 GLU A 67 1.551 15.092 -8.103 1.00 0.00 O ATOM 0 H GLU A 67 -0.699 10.351 -6.823 1.00 0.00 H new ATOM 0 HA GLU A 67 1.686 10.936 -5.756 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.666 12.475 -6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.270 13.307 -5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.259 12.311 -7.039 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.974 12.695 -8.168 1.00 0.00 H new ATOM 1037 N ARG A 68 -0.575 10.976 -3.415 1.00 0.00 N ATOM 1038 CA ARG A 68 -0.782 11.022 -1.978 1.00 0.00 C ATOM 1039 C ARG A 68 -0.098 9.831 -1.305 1.00 0.00 C ATOM 1040 O ARG A 68 0.682 10.006 -0.369 1.00 0.00 O ATOM 1041 CB ARG A 68 -2.273 11.006 -1.635 1.00 0.00 C ATOM 1042 CG ARG A 68 -2.977 12.247 -2.187 1.00 0.00 C ATOM 1043 CD ARG A 68 -4.493 12.144 -2.009 1.00 0.00 C ATOM 1044 NE ARG A 68 -5.109 13.484 -2.124 1.00 0.00 N ATOM 1045 CZ ARG A 68 -6.430 13.706 -2.130 1.00 0.00 C ATOM 1046 NH1 ARG A 68 -7.282 12.677 -2.027 1.00 0.00 N ATOM 1047 NH2 ARG A 68 -6.900 14.956 -2.238 1.00 0.00 N ATOM 0 H ARG A 68 -1.393 10.694 -3.955 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.347 11.951 -1.610 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -2.735 10.109 -2.047 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.400 10.962 -0.553 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -2.607 13.136 -1.676 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.739 12.364 -3.244 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -4.911 11.477 -2.763 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.724 11.711 -1.036 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.489 14.290 -2.204 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.925 11.725 -1.944 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.288 12.845 -2.031 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.252 15.740 -2.316 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.906 15.124 -2.242 1.00 0.00 H new ATOM 1061 N ILE A 69 -0.415 8.646 -1.806 1.00 0.00 N ATOM 1062 CA ILE A 69 0.160 7.427 -1.265 1.00 0.00 C ATOM 1063 C ILE A 69 1.675 7.595 -1.137 1.00 0.00 C ATOM 1064 O ILE A 69 2.215 7.563 -0.032 1.00 0.00 O ATOM 1065 CB ILE A 69 -0.256 6.219 -2.108 1.00 0.00 C ATOM 1066 CG1 ILE A 69 -1.704 5.820 -1.817 1.00 0.00 C ATOM 1067 CG2 ILE A 69 0.713 5.051 -1.907 1.00 0.00 C ATOM 1068 CD1 ILE A 69 -2.335 5.129 -3.027 1.00 0.00 C ATOM 0 H ILE A 69 -1.063 8.505 -2.581 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.225 7.236 -0.263 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.206 6.502 -3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -1.735 5.153 -0.955 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.284 6.705 -1.556 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.395 4.205 -2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.717 5.356 -2.204 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.718 4.759 -0.857 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -3.364 4.855 -2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -2.324 5.807 -3.880 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.767 4.231 -3.270 1.00 0.00 H new ATOM 1080 N LEU A 70 2.318 7.770 -2.282 1.00 0.00 N ATOM 1081 CA LEU A 70 3.760 7.943 -2.311 1.00 0.00 C ATOM 1082 C LEU A 70 4.162 9.015 -1.296 1.00 0.00 C ATOM 1083 O LEU A 70 5.294 9.027 -0.815 1.00 0.00 O ATOM 1084 CB LEU A 70 4.236 8.236 -3.736 1.00 0.00 C ATOM 1085 CG LEU A 70 3.888 7.183 -4.789 1.00 0.00 C ATOM 1086 CD1 LEU A 70 4.185 7.698 -6.199 1.00 0.00 C ATOM 1087 CD2 LEU A 70 4.602 5.861 -4.499 1.00 0.00 C ATOM 0 H LEU A 70 1.867 7.796 -3.196 1.00 0.00 H new ATOM 0 HA LEU A 70 4.260 7.021 -2.016 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.812 9.190 -4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.319 8.359 -3.718 1.00 0.00 H new ATOM 0 HG LEU A 70 2.817 6.989 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.929 6.930 -6.928 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.594 8.593 -6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.245 7.939 -6.283 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.337 5.129 -5.262 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.680 6.020 -4.507 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.298 5.490 -3.520 1.00 0.00 H new ATOM 1099 N ALA A 71 3.212 9.890 -1.001 1.00 0.00 N ATOM 1100 CA ALA A 71 3.452 10.964 -0.052 1.00 0.00 C ATOM 1101 C ALA A 71 3.582 10.376 1.355 1.00 0.00 C ATOM 1102 O ALA A 71 4.588 10.587 2.030 1.00 0.00 O ATOM 1103 CB ALA A 71 2.327 11.995 -0.151 1.00 0.00 C ATOM 0 H ALA A 71 2.274 9.877 -1.402 1.00 0.00 H new ATOM 0 HA ALA A 71 4.385 11.478 -0.283 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.508 12.800 0.561 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.296 12.404 -1.161 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.374 11.517 0.076 1.00 0.00 H new ATOM 1109 N VAL A 72 2.549 9.649 1.755 1.00 0.00 N ATOM 1110 CA VAL A 72 2.534 9.029 3.069 1.00 0.00 C ATOM 1111 C VAL A 72 3.144 7.629 2.974 1.00 0.00 C ATOM 1112 O VAL A 72 2.945 6.800 3.861 1.00 0.00 O ATOM 1113 CB VAL A 72 1.111 9.024 3.630 1.00 0.00 C ATOM 1114 CG1 VAL A 72 0.624 10.449 3.902 1.00 0.00 C ATOM 1115 CG2 VAL A 72 0.154 8.287 2.690 1.00 0.00 C ATOM 0 H VAL A 72 1.716 9.475 1.192 1.00 0.00 H new ATOM 0 HA VAL A 72 3.142 9.602 3.769 1.00 0.00 H new ATOM 0 HB VAL A 72 1.127 8.489 4.579 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -0.390 10.417 4.300 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.283 10.927 4.626 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.631 11.020 2.973 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.851 8.298 3.112 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.145 8.782 1.719 1.00 0.00 H new ATOM 0 HG23 VAL A 72 0.485 7.256 2.569 1.00 0.00 H new ATOM 1125 N ALA A 73 3.875 7.409 1.892 1.00 0.00 N ATOM 1126 CA ALA A 73 4.516 6.124 1.670 1.00 0.00 C ATOM 1127 C ALA A 73 5.195 5.667 2.962 1.00 0.00 C ATOM 1128 O ALA A 73 5.355 4.470 3.194 1.00 0.00 O ATOM 1129 CB ALA A 73 5.500 6.238 0.503 1.00 0.00 C ATOM 0 H ALA A 73 4.038 8.099 1.159 1.00 0.00 H new ATOM 0 HA ALA A 73 3.777 5.369 1.401 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.981 5.274 0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.963 6.536 -0.398 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.258 6.985 0.738 1.00 0.00 H new ATOM 1135 N ASP A 74 5.575 6.646 3.771 1.00 0.00 N ATOM 1136 CA ASP A 74 6.233 6.359 5.034 1.00 0.00 C ATOM 1137 C ASP A 74 5.217 5.759 6.009 1.00 0.00 C ATOM 1138 O ASP A 74 5.502 4.764 6.674 1.00 0.00 O ATOM 1139 CB ASP A 74 6.796 7.635 5.664 1.00 0.00 C ATOM 1140 CG ASP A 74 8.270 7.562 6.065 1.00 0.00 C ATOM 1141 OD1 ASP A 74 9.047 6.991 5.270 1.00 0.00 O ATOM 1142 OD2 ASP A 74 8.587 8.079 7.158 1.00 0.00 O ATOM 0 H ASP A 74 5.440 7.638 3.576 1.00 0.00 H new ATOM 0 HA ASP A 74 7.049 5.663 4.839 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.667 8.457 4.960 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.206 7.877 6.548 1.00 0.00 H new ATOM 1147 N LYS A 75 4.053 6.389 6.062 1.00 0.00 N ATOM 1148 CA LYS A 75 2.993 5.930 6.944 1.00 0.00 C ATOM 1149 C LYS A 75 2.577 4.514 6.539 1.00 0.00 C ATOM 1150 O LYS A 75 2.515 3.618 7.379 1.00 0.00 O ATOM 1151 CB LYS A 75 1.836 6.931 6.958 1.00 0.00 C ATOM 1152 CG LYS A 75 2.270 8.262 7.574 1.00 0.00 C ATOM 1153 CD LYS A 75 3.115 9.072 6.589 1.00 0.00 C ATOM 1154 CE LYS A 75 2.966 10.573 6.844 1.00 0.00 C ATOM 1155 NZ LYS A 75 3.981 11.333 6.081 1.00 0.00 N ATOM 0 H LYS A 75 3.820 7.214 5.509 1.00 0.00 H new ATOM 0 HA LYS A 75 3.349 5.877 7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.481 7.096 5.941 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.001 6.519 7.525 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.390 8.837 7.863 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.842 8.077 8.483 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.163 8.786 6.682 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.811 8.841 5.568 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.967 10.899 6.556 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.074 10.779 7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.898 12.345 6.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.931 10.998 6.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.828 11.191 5.062 1.00 0.00 H new ATOM 1169 N ILE A 76 2.302 4.357 5.253 1.00 0.00 N ATOM 1170 CA ILE A 76 1.894 3.066 4.727 1.00 0.00 C ATOM 1171 C ILE A 76 2.717 1.964 5.396 1.00 0.00 C ATOM 1172 O ILE A 76 3.936 1.911 5.236 1.00 0.00 O ATOM 1173 CB ILE A 76 1.980 3.057 3.199 1.00 0.00 C ATOM 1174 CG1 ILE A 76 0.871 3.912 2.582 1.00 0.00 C ATOM 1175 CG2 ILE A 76 1.971 1.627 2.657 1.00 0.00 C ATOM 1176 CD1 ILE A 76 1.210 4.293 1.140 1.00 0.00 C ATOM 0 H ILE A 76 2.354 5.103 4.559 1.00 0.00 H new ATOM 0 HA ILE A 76 0.848 2.872 4.965 1.00 0.00 H new ATOM 0 HB ILE A 76 2.930 3.504 2.908 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -0.071 3.364 2.605 1.00 0.00 H new ATOM 0 HG13 ILE A 76 0.729 4.815 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.033 1.650 1.569 1.00 0.00 H new ATOM 0 HG22 ILE A 76 2.825 1.081 3.058 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.049 1.130 2.957 1.00 0.00 H new ATOM 0 HD11 ILE A 76 0.405 4.900 0.725 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.140 4.862 1.123 1.00 0.00 H new ATOM 0 HD13 ILE A 76 1.327 3.389 0.543 1.00 0.00 H new ATOM 1188 N LYS A 77 2.019 1.110 6.130 1.00 0.00 N ATOM 1189 CA LYS A 77 2.671 0.012 6.823 1.00 0.00 C ATOM 1190 C LYS A 77 1.947 -1.295 6.493 1.00 0.00 C ATOM 1191 O LYS A 77 0.728 -1.386 6.632 1.00 0.00 O ATOM 1192 CB LYS A 77 2.761 0.303 8.323 1.00 0.00 C ATOM 1193 CG LYS A 77 3.476 -0.831 9.060 1.00 0.00 C ATOM 1194 CD LYS A 77 3.686 -0.480 10.534 1.00 0.00 C ATOM 1195 CE LYS A 77 5.024 -1.022 11.041 1.00 0.00 C ATOM 1196 NZ LYS A 77 4.868 -2.407 11.537 1.00 0.00 N ATOM 0 H LYS A 77 1.008 1.156 6.260 1.00 0.00 H new ATOM 0 HA LYS A 77 3.700 -0.097 6.480 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.295 1.240 8.484 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.759 0.433 8.733 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.891 -1.747 8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.439 -1.026 8.588 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.656 0.602 10.662 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.873 -0.894 11.130 1.00 0.00 H new ATOM 0 HE2 LYS A 77 5.761 -0.998 10.238 1.00 0.00 H new ATOM 0 HE3 LYS A 77 5.402 -0.384 11.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.785 -2.759 11.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 4.181 -2.421 12.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.528 -3.016 10.765 1.00 0.00 H new ATOM 1210 N PHE A 78 2.729 -2.275 6.063 1.00 0.00 N ATOM 1211 CA PHE A 78 2.178 -3.573 5.713 1.00 0.00 C ATOM 1212 C PHE A 78 2.335 -4.565 6.866 1.00 0.00 C ATOM 1213 O PHE A 78 3.275 -4.463 7.654 1.00 0.00 O ATOM 1214 CB PHE A 78 2.967 -4.083 4.506 1.00 0.00 C ATOM 1215 CG PHE A 78 2.501 -3.505 3.168 1.00 0.00 C ATOM 1216 CD1 PHE A 78 2.337 -2.162 3.027 1.00 0.00 C ATOM 1217 CD2 PHE A 78 2.250 -4.334 2.119 1.00 0.00 C ATOM 1218 CE1 PHE A 78 1.904 -1.625 1.786 1.00 0.00 C ATOM 1219 CE2 PHE A 78 1.818 -3.797 0.878 1.00 0.00 C ATOM 1220 CZ PHE A 78 1.654 -2.454 0.737 1.00 0.00 C ATOM 0 H PHE A 78 3.740 -2.196 5.949 1.00 0.00 H new ATOM 0 HA PHE A 78 1.115 -3.478 5.494 1.00 0.00 H new ATOM 0 HB2 PHE A 78 4.021 -3.843 4.646 1.00 0.00 H new ATOM 0 HB3 PHE A 78 2.890 -5.170 4.467 1.00 0.00 H new ATOM 0 HD1 PHE A 78 2.536 -1.504 3.860 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.379 -5.400 2.230 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.773 -0.559 1.675 1.00 0.00 H new ATOM 0 HE2 PHE A 78 1.619 -4.455 0.045 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.325 -2.046 -0.207 1.00 0.00 H new ATOM 1230 N THR A 79 1.402 -5.503 6.930 1.00 0.00 N ATOM 1231 CA THR A 79 1.425 -6.513 7.974 1.00 0.00 C ATOM 1232 C THR A 79 1.464 -7.914 7.360 1.00 0.00 C ATOM 1233 O THR A 79 0.714 -8.210 6.431 1.00 0.00 O ATOM 1234 CB THR A 79 0.217 -6.282 8.883 1.00 0.00 C ATOM 1235 OG1 THR A 79 0.427 -4.976 9.414 1.00 0.00 O ATOM 1236 CG2 THR A 79 0.227 -7.191 10.114 1.00 0.00 C ATOM 0 H THR A 79 0.624 -5.585 6.275 1.00 0.00 H new ATOM 0 HA THR A 79 2.327 -6.433 8.581 1.00 0.00 H new ATOM 0 HB THR A 79 -0.700 -6.448 8.317 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.312 -4.744 10.014 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.652 -6.986 10.725 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.213 -8.234 9.797 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.127 -7.002 10.699 1.00 0.00 H new ATOM 1244 N VAL A 80 2.346 -8.740 7.904 1.00 0.00 N ATOM 1245 CA VAL A 80 2.492 -10.103 7.422 1.00 0.00 C ATOM 1246 C VAL A 80 2.315 -11.074 8.590 1.00 0.00 C ATOM 1247 O VAL A 80 3.237 -11.277 9.379 1.00 0.00 O ATOM 1248 CB VAL A 80 3.836 -10.264 6.708 1.00 0.00 C ATOM 1249 CG1 VAL A 80 4.095 -11.729 6.351 1.00 0.00 C ATOM 1250 CG2 VAL A 80 3.906 -9.375 5.465 1.00 0.00 C ATOM 0 H VAL A 80 2.967 -8.491 8.674 1.00 0.00 H new ATOM 0 HA VAL A 80 1.720 -10.334 6.688 1.00 0.00 H new ATOM 0 HB VAL A 80 4.621 -9.943 7.393 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.056 -11.816 5.845 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.109 -12.328 7.261 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.304 -12.088 5.692 1.00 0.00 H new ATOM 0 HG21 VAL A 80 4.871 -9.508 4.976 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.109 -9.651 4.775 1.00 0.00 H new ATOM 0 HG23 VAL A 80 3.788 -8.331 5.757 1.00 0.00 H new ATOM 1260 N THR A 81 1.123 -11.650 8.664 1.00 0.00 N ATOM 1261 CA THR A 81 0.814 -12.595 9.723 1.00 0.00 C ATOM 1262 C THR A 81 2.020 -13.494 10.005 1.00 0.00 C ATOM 1263 O THR A 81 2.436 -13.638 11.153 1.00 0.00 O ATOM 1264 CB THR A 81 -0.439 -13.371 9.313 1.00 0.00 C ATOM 1265 OG1 THR A 81 -0.115 -13.900 8.030 1.00 0.00 O ATOM 1266 CG2 THR A 81 -1.635 -12.454 9.046 1.00 0.00 C ATOM 0 H THR A 81 0.361 -11.480 8.008 1.00 0.00 H new ATOM 0 HA THR A 81 0.604 -12.082 10.662 1.00 0.00 H new ATOM 0 HB THR A 81 -0.696 -14.084 10.096 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.873 -14.420 7.690 1.00 0.00 H new ATOM 0 HG21 THR A 81 -2.498 -13.055 8.759 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.870 -11.890 9.949 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.390 -11.762 8.240 1.00 0.00 H new ATOM 1274 N ARG A 82 2.547 -14.075 8.937 1.00 0.00 N ATOM 1275 CA ARG A 82 3.696 -14.956 9.055 1.00 0.00 C ATOM 1276 C ARG A 82 4.798 -14.283 9.875 1.00 0.00 C ATOM 1277 O ARG A 82 4.812 -13.061 10.019 1.00 0.00 O ATOM 1278 CB ARG A 82 4.249 -15.327 7.678 1.00 0.00 C ATOM 1279 CG ARG A 82 3.529 -16.551 7.109 1.00 0.00 C ATOM 1280 CD ARG A 82 4.514 -17.493 6.413 1.00 0.00 C ATOM 1281 NE ARG A 82 5.267 -18.272 7.421 1.00 0.00 N ATOM 1282 CZ ARG A 82 6.413 -18.919 7.167 1.00 0.00 C ATOM 1283 NH1 ARG A 82 6.944 -18.884 5.938 1.00 0.00 N ATOM 1284 NH2 ARG A 82 7.028 -19.601 8.143 1.00 0.00 N ATOM 0 H ARG A 82 2.199 -13.953 7.986 1.00 0.00 H new ATOM 0 HA ARG A 82 3.367 -15.865 9.559 1.00 0.00 H new ATOM 0 HB2 ARG A 82 4.134 -14.484 6.997 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.317 -15.532 7.754 1.00 0.00 H new ATOM 0 HG2 ARG A 82 3.018 -17.082 7.912 1.00 0.00 H new ATOM 0 HG3 ARG A 82 2.764 -16.231 6.401 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.976 -18.168 5.747 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.204 -16.919 5.795 1.00 0.00 H new ATOM 0 HE ARG A 82 4.891 -18.320 8.368 1.00 0.00 H new ATOM 0 HH11 ARG A 82 6.476 -18.365 5.195 1.00 0.00 H new ATOM 0 HH12 ARG A 82 7.816 -19.376 5.745 1.00 0.00 H new ATOM 0 HH21 ARG A 82 6.624 -19.628 9.079 1.00 0.00 H new ATOM 0 HH22 ARG A 82 7.900 -20.093 7.950 1.00 0.00 H new ATOM 1298 N PRO A 83 5.720 -15.131 10.406 1.00 0.00 N ATOM 1299 CA PRO A 83 6.823 -14.631 11.208 1.00 0.00 C ATOM 1300 C PRO A 83 7.887 -13.972 10.327 1.00 0.00 C ATOM 1301 O PRO A 83 8.297 -14.537 9.315 1.00 0.00 O ATOM 1302 CB PRO A 83 7.344 -15.845 11.960 1.00 0.00 C ATOM 1303 CG PRO A 83 6.822 -17.057 11.208 1.00 0.00 C ATOM 1304 CD PRO A 83 5.735 -16.583 10.256 1.00 0.00 C ATOM 0 HA PRO A 83 6.517 -13.849 11.903 1.00 0.00 H new ATOM 0 HB2 PRO A 83 8.433 -15.846 11.993 1.00 0.00 H new ATOM 0 HB3 PRO A 83 6.993 -15.845 12.992 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.628 -17.540 10.656 1.00 0.00 H new ATOM 0 HG3 PRO A 83 6.424 -17.796 11.904 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.954 -16.873 9.228 1.00 0.00 H new ATOM 0 HD3 PRO A 83 4.768 -17.018 10.510 1.00 0.00 H new ATOM 1312 N PHE A 84 8.302 -12.784 10.744 1.00 0.00 N ATOM 1313 CA PHE A 84 9.309 -12.042 10.006 1.00 0.00 C ATOM 1314 C PHE A 84 10.319 -11.395 10.956 1.00 0.00 C ATOM 1315 O PHE A 84 9.974 -11.028 12.078 1.00 0.00 O ATOM 1316 CB PHE A 84 8.578 -10.943 9.232 1.00 0.00 C ATOM 1317 CG PHE A 84 8.079 -9.792 10.109 1.00 0.00 C ATOM 1318 CD1 PHE A 84 8.897 -8.740 10.380 1.00 0.00 C ATOM 1319 CD2 PHE A 84 6.817 -9.821 10.616 1.00 0.00 C ATOM 1320 CE1 PHE A 84 8.434 -7.672 11.193 1.00 0.00 C ATOM 1321 CE2 PHE A 84 6.354 -8.753 11.429 1.00 0.00 C ATOM 1322 CZ PHE A 84 7.172 -7.701 11.700 1.00 0.00 C ATOM 0 H PHE A 84 7.959 -12.318 11.584 1.00 0.00 H new ATOM 0 HA PHE A 84 9.853 -12.713 9.342 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.247 -10.542 8.470 1.00 0.00 H new ATOM 0 HB3 PHE A 84 7.728 -11.384 8.710 1.00 0.00 H new ATOM 0 HD1 PHE A 84 9.899 -8.717 9.977 1.00 0.00 H new ATOM 0 HD2 PHE A 84 6.167 -10.656 10.400 1.00 0.00 H new ATOM 0 HE1 PHE A 84 9.084 -6.837 11.409 1.00 0.00 H new ATOM 0 HE2 PHE A 84 5.352 -8.776 11.832 1.00 0.00 H new ATOM 0 HZ PHE A 84 6.820 -6.888 12.318 1.00 0.00 H new ATOM 1332 N GLN A 85 11.546 -11.275 10.471 1.00 0.00 N ATOM 1333 CA GLN A 85 12.609 -10.679 11.263 1.00 0.00 C ATOM 1334 C GLN A 85 12.347 -9.184 11.462 1.00 0.00 C ATOM 1335 O GLN A 85 11.918 -8.764 12.536 1.00 0.00 O ATOM 1336 CB GLN A 85 13.974 -10.914 10.614 1.00 0.00 C ATOM 1337 CG GLN A 85 14.665 -12.137 11.220 1.00 0.00 C ATOM 1338 CD GLN A 85 14.794 -13.261 10.190 1.00 0.00 C ATOM 1339 OE1 GLN A 85 13.893 -14.059 9.989 1.00 0.00 O ATOM 1340 NE2 GLN A 85 15.960 -13.280 9.552 1.00 0.00 N ATOM 0 H GLN A 85 11.828 -11.580 9.540 1.00 0.00 H new ATOM 0 HA GLN A 85 12.621 -11.160 12.241 1.00 0.00 H new ATOM 0 HB2 GLN A 85 13.851 -11.056 9.540 1.00 0.00 H new ATOM 0 HB3 GLN A 85 14.602 -10.033 10.749 1.00 0.00 H new ATOM 0 HG2 GLN A 85 15.654 -11.857 11.584 1.00 0.00 H new ATOM 0 HG3 GLN A 85 14.097 -12.491 12.080 1.00 0.00 H new ATOM 0 HE21 GLN A 85 16.671 -12.582 9.769 1.00 0.00 H new ATOM 0 HE22 GLN A 85 16.143 -13.993 8.846 1.00 0.00 H new ATOM 1349 N GLY A 86 12.616 -8.423 10.411 1.00 0.00 N ATOM 1350 CA GLY A 86 12.415 -6.985 10.458 1.00 0.00 C ATOM 1351 C GLY A 86 13.521 -6.252 9.696 1.00 0.00 C ATOM 1352 O GLY A 86 14.449 -6.879 9.186 1.00 0.00 O ATOM 0 H GLY A 86 12.971 -8.775 9.522 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.445 -6.735 10.028 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.399 -6.650 11.495 1.00 0.00 H new ATOM 1356 N LEU A 87 13.387 -4.935 9.644 1.00 0.00 N ATOM 1357 CA LEU A 87 14.364 -4.110 8.953 1.00 0.00 C ATOM 1358 C LEU A 87 15.040 -3.178 9.960 1.00 0.00 C ATOM 1359 O LEU A 87 14.454 -2.181 10.380 1.00 0.00 O ATOM 1360 CB LEU A 87 13.712 -3.378 7.779 1.00 0.00 C ATOM 1361 CG LEU A 87 14.504 -3.370 6.470 1.00 0.00 C ATOM 1362 CD1 LEU A 87 15.684 -2.400 6.549 1.00 0.00 C ATOM 1363 CD2 LEU A 87 14.949 -4.784 6.090 1.00 0.00 C ATOM 0 H LEU A 87 12.617 -4.419 10.069 1.00 0.00 H new ATOM 0 HA LEU A 87 15.147 -4.730 8.516 1.00 0.00 H new ATOM 0 HB2 LEU A 87 12.739 -3.831 7.589 1.00 0.00 H new ATOM 0 HB3 LEU A 87 13.530 -2.345 8.077 1.00 0.00 H new ATOM 0 HG LEU A 87 13.848 -3.014 5.676 1.00 0.00 H new ATOM 0 HD11 LEU A 87 16.230 -2.414 5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 87 15.315 -1.392 6.740 1.00 0.00 H new ATOM 0 HD13 LEU A 87 16.349 -2.702 7.358 1.00 0.00 H new ATOM 0 HD21 LEU A 87 15.510 -4.750 5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 87 15.582 -5.191 6.879 1.00 0.00 H new ATOM 0 HD23 LEU A 87 14.073 -5.420 5.964 1.00 0.00 H new ATOM 1375 N ILE A 88 16.265 -3.535 10.319 1.00 0.00 N ATOM 1376 CA ILE A 88 17.027 -2.742 11.268 1.00 0.00 C ATOM 1377 C ILE A 88 17.444 -1.426 10.609 1.00 0.00 C ATOM 1378 O ILE A 88 17.804 -1.403 9.434 1.00 0.00 O ATOM 1379 CB ILE A 88 18.202 -3.552 11.821 1.00 0.00 C ATOM 1380 CG1 ILE A 88 17.726 -4.889 12.392 1.00 0.00 C ATOM 1381 CG2 ILE A 88 18.994 -2.740 12.847 1.00 0.00 C ATOM 1382 CD1 ILE A 88 17.921 -6.019 11.379 1.00 0.00 C ATOM 0 H ILE A 88 16.748 -4.363 9.970 1.00 0.00 H new ATOM 0 HA ILE A 88 16.412 -2.486 12.130 1.00 0.00 H new ATOM 0 HB ILE A 88 18.879 -3.777 10.997 1.00 0.00 H new ATOM 0 HG12 ILE A 88 18.277 -5.115 13.305 1.00 0.00 H new ATOM 0 HG13 ILE A 88 16.673 -4.818 12.664 1.00 0.00 H new ATOM 0 HG21 ILE A 88 19.823 -3.339 13.224 1.00 0.00 H new ATOM 0 HG22 ILE A 88 19.383 -1.838 12.375 1.00 0.00 H new ATOM 0 HG23 ILE A 88 18.341 -2.463 13.675 1.00 0.00 H new ATOM 0 HD11 ILE A 88 17.575 -6.958 11.810 1.00 0.00 H new ATOM 0 HD12 ILE A 88 17.349 -5.801 10.477 1.00 0.00 H new ATOM 0 HD13 ILE A 88 18.978 -6.104 11.127 1.00 0.00 H new ATOM 1394 N PRO A 89 17.378 -0.333 11.416 1.00 0.00 N ATOM 1395 CA PRO A 89 17.744 0.984 10.924 1.00 0.00 C ATOM 1396 C PRO A 89 19.263 1.121 10.803 1.00 0.00 C ATOM 1397 O PRO A 89 19.999 0.169 11.058 1.00 0.00 O ATOM 1398 CB PRO A 89 17.137 1.959 11.920 1.00 0.00 C ATOM 1399 CG PRO A 89 16.854 1.150 13.175 1.00 0.00 C ATOM 1400 CD PRO A 89 16.956 -0.323 12.814 1.00 0.00 C ATOM 0 HA PRO A 89 17.369 1.177 9.919 1.00 0.00 H new ATOM 0 HB2 PRO A 89 17.823 2.780 12.131 1.00 0.00 H new ATOM 0 HB3 PRO A 89 16.222 2.401 11.526 1.00 0.00 H new ATOM 0 HG2 PRO A 89 17.568 1.401 13.960 1.00 0.00 H new ATOM 0 HG3 PRO A 89 15.861 1.380 13.562 1.00 0.00 H new ATOM 0 HD2 PRO A 89 17.677 -0.837 13.449 1.00 0.00 H new ATOM 0 HD3 PRO A 89 15.999 -0.830 12.943 1.00 0.00 H new ATOM 1408 N LYS A 90 19.688 2.315 10.414 1.00 0.00 N ATOM 1409 CA LYS A 90 21.106 2.589 10.256 1.00 0.00 C ATOM 1410 C LYS A 90 21.292 4.028 9.771 1.00 0.00 C ATOM 1411 O LYS A 90 21.961 4.826 10.426 1.00 0.00 O ATOM 1412 CB LYS A 90 21.756 1.545 9.345 1.00 0.00 C ATOM 1413 CG LYS A 90 22.897 0.824 10.065 1.00 0.00 C ATOM 1414 CD LYS A 90 23.484 -0.285 9.189 1.00 0.00 C ATOM 1415 CE LYS A 90 24.817 0.149 8.576 1.00 0.00 C ATOM 1416 NZ LYS A 90 25.125 -0.663 7.377 1.00 0.00 N ATOM 0 H LYS A 90 19.075 3.103 10.204 1.00 0.00 H new ATOM 0 HA LYS A 90 21.619 2.506 11.214 1.00 0.00 H new ATOM 0 HB2 LYS A 90 21.008 0.820 9.025 1.00 0.00 H new ATOM 0 HB3 LYS A 90 22.137 2.029 8.445 1.00 0.00 H new ATOM 0 HG2 LYS A 90 23.678 1.539 10.324 1.00 0.00 H new ATOM 0 HG3 LYS A 90 22.531 0.399 11.000 1.00 0.00 H new ATOM 0 HD2 LYS A 90 23.630 -1.186 9.785 1.00 0.00 H new ATOM 0 HD3 LYS A 90 22.780 -0.538 8.396 1.00 0.00 H new ATOM 0 HE2 LYS A 90 24.774 1.204 8.307 1.00 0.00 H new ATOM 0 HE3 LYS A 90 25.615 0.040 9.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 26.033 -0.356 6.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 25.187 -1.666 7.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 24.372 -0.538 6.671 1.00 0.00 H new ATOM 1430 N PRO A 91 20.671 4.324 8.598 1.00 0.00 N ATOM 1431 CA PRO A 91 20.761 5.653 8.018 1.00 0.00 C ATOM 1432 C PRO A 91 19.875 6.644 8.776 1.00 0.00 C ATOM 1433 O PRO A 91 19.024 7.302 8.181 1.00 0.00 O ATOM 1434 CB PRO A 91 20.348 5.478 6.566 1.00 0.00 C ATOM 1435 CG PRO A 91 19.599 4.157 6.502 1.00 0.00 C ATOM 1436 CD PRO A 91 19.870 3.405 7.795 1.00 0.00 C ATOM 0 HA PRO A 91 21.764 6.073 8.085 1.00 0.00 H new ATOM 0 HB2 PRO A 91 19.715 6.302 6.238 1.00 0.00 H new ATOM 0 HB3 PRO A 91 21.219 5.465 5.911 1.00 0.00 H new ATOM 0 HG2 PRO A 91 18.530 4.330 6.378 1.00 0.00 H new ATOM 0 HG3 PRO A 91 19.929 3.572 5.644 1.00 0.00 H new ATOM 0 HD2 PRO A 91 18.942 3.142 8.302 1.00 0.00 H new ATOM 0 HD3 PRO A 91 20.405 2.474 7.607 1.00 0.00 H new ATOM 1444 N ASP A 92 20.106 6.718 10.079 1.00 0.00 N ATOM 1445 CA ASP A 92 19.340 7.617 10.925 1.00 0.00 C ATOM 1446 C ASP A 92 17.871 7.188 10.919 1.00 0.00 C ATOM 1447 O ASP A 92 17.312 6.892 9.864 1.00 0.00 O ATOM 1448 CB ASP A 92 19.414 9.055 10.410 1.00 0.00 C ATOM 1449 CG ASP A 92 19.623 10.119 11.489 1.00 0.00 C ATOM 1450 OD1 ASP A 92 19.749 9.716 12.666 1.00 0.00 O ATOM 1451 OD2 ASP A 92 19.652 11.311 11.114 1.00 0.00 O ATOM 0 H ASP A 92 20.813 6.170 10.569 1.00 0.00 H new ATOM 0 HA ASP A 92 19.759 7.572 11.930 1.00 0.00 H new ATOM 0 HB2 ASP A 92 20.229 9.125 9.689 1.00 0.00 H new ATOM 0 HB3 ASP A 92 18.493 9.280 9.873 1.00 0.00 H new ATOM 1456 N GLU A 93 17.289 7.168 12.109 1.00 0.00 N ATOM 1457 CA GLU A 93 15.896 6.780 12.254 1.00 0.00 C ATOM 1458 C GLU A 93 15.421 7.033 13.686 1.00 0.00 C ATOM 1459 O GLU A 93 16.048 6.579 14.642 1.00 0.00 O ATOM 1460 CB GLU A 93 15.691 5.316 11.860 1.00 0.00 C ATOM 1461 CG GLU A 93 14.469 5.158 10.952 1.00 0.00 C ATOM 1462 CD GLU A 93 14.820 4.362 9.694 1.00 0.00 C ATOM 1463 OE1 GLU A 93 15.524 4.937 8.836 1.00 0.00 O ATOM 1464 OE2 GLU A 93 14.375 3.196 9.617 1.00 0.00 O ATOM 0 H GLU A 93 17.756 7.414 12.982 1.00 0.00 H new ATOM 0 HA GLU A 93 15.297 7.391 11.579 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.579 4.946 11.348 1.00 0.00 H new ATOM 0 HB3 GLU A 93 15.563 4.709 12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.671 4.653 11.495 1.00 0.00 H new ATOM 0 HG3 GLU A 93 14.091 6.141 10.671 1.00 0.00 H new ATOM 1471 N SER A 94 14.317 7.759 13.789 1.00 0.00 N ATOM 1472 CA SER A 94 13.750 8.078 15.089 1.00 0.00 C ATOM 1473 C SER A 94 12.223 8.024 15.021 1.00 0.00 C ATOM 1474 O SER A 94 11.585 8.964 14.551 1.00 0.00 O ATOM 1475 CB SER A 94 14.212 9.457 15.566 1.00 0.00 C ATOM 1476 OG SER A 94 13.839 10.489 14.658 1.00 0.00 O ATOM 0 H SER A 94 13.800 8.135 12.994 1.00 0.00 H new ATOM 0 HA SER A 94 14.101 7.337 15.808 1.00 0.00 H new ATOM 0 HB2 SER A 94 13.783 9.664 16.546 1.00 0.00 H new ATOM 0 HB3 SER A 94 15.295 9.455 15.687 1.00 0.00 H new ATOM 0 HG SER A 94 12.939 10.312 14.314 1.00 0.00 H new ATOM 1482 N GLY A 95 11.681 6.913 15.498 1.00 0.00 N ATOM 1483 CA GLY A 95 10.240 6.723 15.497 1.00 0.00 C ATOM 1484 C GLY A 95 9.636 7.106 16.850 1.00 0.00 C ATOM 1485 O GLY A 95 10.139 8.002 17.527 1.00 0.00 O ATOM 0 H GLY A 95 12.214 6.135 15.888 1.00 0.00 H new ATOM 0 HA2 GLY A 95 9.790 7.328 14.710 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.007 5.682 15.272 1.00 0.00 H new ATOM 1489 N PRO A 96 8.539 6.390 17.213 1.00 0.00 N ATOM 1490 CA PRO A 96 7.861 6.646 18.473 1.00 0.00 C ATOM 1491 C PRO A 96 8.661 6.083 19.650 1.00 0.00 C ATOM 1492 O PRO A 96 8.454 4.940 20.055 1.00 0.00 O ATOM 1493 CB PRO A 96 6.493 6.002 18.322 1.00 0.00 C ATOM 1494 CG PRO A 96 6.622 5.015 17.173 1.00 0.00 C ATOM 1495 CD PRO A 96 7.916 5.322 16.437 1.00 0.00 C ATOM 0 HA PRO A 96 7.763 7.710 18.690 1.00 0.00 H new ATOM 0 HB2 PRO A 96 6.196 5.496 19.240 1.00 0.00 H new ATOM 0 HB3 PRO A 96 5.730 6.751 18.110 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.630 3.992 17.548 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.770 5.101 16.499 1.00 0.00 H new ATOM 0 HD2 PRO A 96 8.559 4.444 16.384 1.00 0.00 H new ATOM 0 HD3 PRO A 96 7.723 5.638 15.412 1.00 0.00 H new ATOM 1503 N SER A 97 9.557 6.912 20.165 1.00 0.00 N ATOM 1504 CA SER A 97 10.388 6.511 21.288 1.00 0.00 C ATOM 1505 C SER A 97 11.270 5.326 20.888 1.00 0.00 C ATOM 1506 O SER A 97 10.985 4.186 21.250 1.00 0.00 O ATOM 1507 CB SER A 97 9.534 6.149 22.505 1.00 0.00 C ATOM 1508 OG SER A 97 10.203 6.434 23.730 1.00 0.00 O ATOM 0 H SER A 97 9.726 7.859 19.826 1.00 0.00 H new ATOM 0 HA SER A 97 11.023 7.354 21.562 1.00 0.00 H new ATOM 0 HB2 SER A 97 8.596 6.702 22.467 1.00 0.00 H new ATOM 0 HB3 SER A 97 9.281 5.089 22.468 1.00 0.00 H new ATOM 0 HG SER A 97 9.625 6.191 24.483 1.00 0.00 H new ATOM 1514 N SER A 98 12.324 5.638 20.148 1.00 0.00 N ATOM 1515 CA SER A 98 13.250 4.613 19.696 1.00 0.00 C ATOM 1516 C SER A 98 14.675 5.170 19.669 1.00 0.00 C ATOM 1517 O SER A 98 15.066 5.838 18.713 1.00 0.00 O ATOM 1518 CB SER A 98 12.859 4.089 18.313 1.00 0.00 C ATOM 1519 OG SER A 98 12.011 2.947 18.395 1.00 0.00 O ATOM 0 H SER A 98 12.557 6.585 19.850 1.00 0.00 H new ATOM 0 HA SER A 98 13.206 3.779 20.397 1.00 0.00 H new ATOM 0 HB2 SER A 98 12.352 4.878 17.756 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.759 3.833 17.755 1.00 0.00 H new ATOM 0 HG SER A 98 11.782 2.644 17.492 1.00 0.00 H new ATOM 1525 N GLY A 99 15.411 4.876 20.730 1.00 0.00 N ATOM 1526 CA GLY A 99 16.784 5.339 20.840 1.00 0.00 C ATOM 1527 C GLY A 99 17.768 4.237 20.445 1.00 0.00 C ATOM 1528 O GLY A 99 18.593 4.427 19.552 1.00 0.00 O ATOM 0 H GLY A 99 15.083 4.323 21.522 1.00 0.00 H new ATOM 0 HA2 GLY A 99 16.931 6.209 20.200 1.00 0.00 H new ATOM 0 HA3 GLY A 99 16.983 5.659 21.863 1.00 0.00 H new TER 1532 GLY A 99