USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1286 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 154 CYS SG : rot 130:sc= -2.32 USER MOD Set 1.2: A 162 CYS SG : rot 180:sc= -0.651 USER MOD Set 2.1: A 58 THR OG1 : rot -156:sc= 0.265 USER MOD Set 2.2: A 85 SER OG : rot 109:sc= 0.286 USER MOD Set 3.1: A 60 HIS :FLIP no HD1:sc= -0.192 F(o=-3.4,f=-2.8) USER MOD Set 3.2: A 80 HIS : no HE2:sc= -0.189 K(o=-2.8,f=-14!) USER MOD Set 3.3: A 83 THR OG1 : rot -97:sc= 0.875 USER MOD Set 3.4: A 96 HIS : no HE2:sc= -3.26! C(o=-2.8!,f=-14!) USER MOD Set 4.1: A 75 THR OG1 : rot 137:sc= -1.22 USER MOD Set 4.2: A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 35:sc= 0.461 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.026 K(o=-0.026,f=-0.97) USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= 0.516 (180deg=-0.806!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -2.58! C(o=-2.6!,f=-5.7!) USER MOD Single : A 28 GLN : amide:sc= -1.08 K(o=-1.1,f=-3.1!) USER MOD Single : A 29 SER OG : rot -23:sc= 0.0767 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot -146:sc= -0.172 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 44:sc= 0.299 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 41:sc= 0.0974 USER MOD Single : A 71 SER OG : rot -95:sc= 0.935 USER MOD Single : A 78 TYR OH : rot 41:sc= 0.322 USER MOD Single : A 92 SER OG : rot 17:sc= 0.478 USER MOD Single : A 100 GLN :FLIP amide:sc= -0.0549 F(o=-1.2,f=-0.055) USER MOD Single : A 105 SER OG : rot -43:sc= 0.407 USER MOD Single : A 107 THR OG1 : rot -52:sc= 0.0954 USER MOD Single : A 115 LYS NZ :NH3+ -114:sc= -1.51 (180deg=-4.68!) USER MOD Single : A 116 THR OG1 : rot 43:sc= 1.11 USER MOD Single : A 117 THR OG1 : rot 44:sc= 1.26 USER MOD Single : A 119 GLN : amide:sc= 0.133 X(o=0.13,f=-0.013) USER MOD Single : A 120 GLN :FLIP amide:sc= -0.0825 F(o=-0.66,f=-0.083) USER MOD Single : A 121 SER OG : rot 170:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0.137 USER MOD Single : A 128 MET CE :methyl -166:sc=-0.00448 (180deg=-0.253) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -1.52 K(o=-1.5,f=-2.3!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 88:sc= 1.21 USER MOD Single : A 159 THR OG1 : rot -32:sc= 0.62 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -1.58 K(o=-1.6,f=-7.1!) USER MOD Single : A 173 THR OG1 : rot 103:sc= 0.26 USER MOD Single : A 176 THR OG1 : rot 45:sc= 0.487 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.788 3.060 -15.962 1.00 64.31 N ATOM 60 CA THR A 5 -13.289 2.306 -14.813 1.00 42.32 C ATOM 61 C THR A 5 -12.327 1.164 -15.246 1.00 63.54 C ATOM 62 O THR A 5 -11.806 0.427 -14.399 1.00 30.44 O ATOM 63 CB THR A 5 -14.513 1.763 -13.992 1.00 35.01 C ATOM 64 OG1 THR A 5 -15.564 2.753 -13.981 1.00 75.54 O ATOM 65 CG2 THR A 5 -14.141 1.440 -12.547 1.00 72.24 C ATOM 0 HA THR A 5 -12.701 2.968 -14.178 1.00 42.32 H new ATOM 0 HB THR A 5 -14.844 0.844 -14.476 1.00 35.01 H new ATOM 0 HG1 THR A 5 -15.577 3.226 -14.839 1.00 75.54 H new ATOM 0 HG21 THR A 5 -15.019 1.068 -12.020 1.00 72.24 H new ATOM 0 HG22 THR A 5 -13.361 0.679 -12.534 1.00 72.24 H new ATOM 0 HG23 THR A 5 -13.777 2.342 -12.055 1.00 72.24 H new ATOM 73 N GLU A 6 -12.091 1.011 -16.570 1.00 33.13 N ATOM 74 CA GLU A 6 -11.119 0.011 -17.086 1.00 72.22 C ATOM 75 C GLU A 6 -9.677 0.573 -17.030 1.00 13.21 C ATOM 76 O GLU A 6 -8.707 -0.192 -16.947 1.00 64.11 O ATOM 77 CB GLU A 6 -11.490 -0.438 -18.531 1.00 71.52 C ATOM 78 CG GLU A 6 -11.001 0.494 -19.666 1.00 54.01 C ATOM 79 CD GLU A 6 -11.407 0.031 -21.072 1.00 51.31 C ATOM 80 OE1 GLU A 6 -11.035 -1.098 -21.467 1.00 44.31 O ATOM 81 OE2 GLU A 6 -12.062 0.806 -21.805 1.00 23.00 O ATOM 0 H GLU A 6 -12.553 1.559 -17.295 1.00 33.13 H new ATOM 0 HA GLU A 6 -11.165 -0.869 -16.445 1.00 72.22 H new ATOM 0 HB2 GLU A 6 -11.079 -1.433 -18.700 1.00 71.52 H new ATOM 0 HB3 GLU A 6 -12.574 -0.525 -18.598 1.00 71.52 H new ATOM 0 HG2 GLU A 6 -11.397 1.495 -19.496 1.00 54.01 H new ATOM 0 HG3 GLU A 6 -9.915 0.568 -19.619 1.00 54.01 H new ATOM 88 N ASP A 7 -9.577 1.926 -17.097 1.00 40.34 N ATOM 89 CA ASP A 7 -8.295 2.669 -16.994 1.00 41.53 C ATOM 90 C ASP A 7 -7.570 2.345 -15.670 1.00 62.22 C ATOM 91 O ASP A 7 -6.336 2.326 -15.612 1.00 21.31 O ATOM 92 CB ASP A 7 -8.531 4.196 -17.101 1.00 21.34 C ATOM 93 CG ASP A 7 -9.149 4.617 -18.442 1.00 33.22 C ATOM 94 OD1 ASP A 7 -8.398 4.879 -19.408 1.00 61.03 O ATOM 95 OD2 ASP A 7 -10.389 4.675 -18.546 1.00 4.35 O ATOM 0 H ASP A 7 -10.386 2.534 -17.224 1.00 40.34 H new ATOM 0 HA ASP A 7 -7.665 2.351 -17.824 1.00 41.53 H new ATOM 0 HB2 ASP A 7 -9.186 4.514 -16.290 1.00 21.34 H new ATOM 0 HB3 ASP A 7 -7.582 4.715 -16.966 1.00 21.34 H new ATOM 100 N TRP A 8 -8.379 2.113 -14.618 1.00 42.12 N ATOM 101 CA TRP A 8 -7.945 1.603 -13.300 1.00 61.02 C ATOM 102 C TRP A 8 -6.981 0.397 -13.436 1.00 43.44 C ATOM 103 O TRP A 8 -5.911 0.388 -12.825 1.00 64.30 O ATOM 104 CB TRP A 8 -9.227 1.247 -12.472 1.00 12.21 C ATOM 105 CG TRP A 8 -9.036 0.294 -11.320 1.00 1.12 C ATOM 106 CD1 TRP A 8 -8.524 0.563 -10.084 1.00 5.10 C ATOM 107 CD2 TRP A 8 -9.385 -1.091 -11.316 1.00 10.32 C ATOM 108 NE1 TRP A 8 -8.541 -0.572 -9.316 1.00 2.52 N ATOM 109 CE2 TRP A 8 -9.062 -1.600 -10.055 1.00 11.32 C ATOM 110 CE3 TRP A 8 -9.948 -1.946 -12.267 1.00 44.34 C ATOM 111 CZ2 TRP A 8 -9.284 -2.926 -9.718 1.00 11.12 C ATOM 112 CZ3 TRP A 8 -10.158 -3.260 -11.930 1.00 63.23 C ATOM 113 CH2 TRP A 8 -9.829 -3.737 -10.664 1.00 42.34 C ATOM 0 H TRP A 8 -9.384 2.280 -14.662 1.00 42.12 H new ATOM 0 HA TRP A 8 -7.376 2.371 -12.776 1.00 61.02 H new ATOM 0 HB2 TRP A 8 -9.651 2.173 -12.083 1.00 12.21 H new ATOM 0 HB3 TRP A 8 -9.965 0.819 -13.151 1.00 12.21 H new ATOM 0 HD1 TRP A 8 -8.160 1.527 -9.759 1.00 5.10 H new ATOM 0 HE1 TRP A 8 -8.218 -0.640 -8.351 1.00 2.52 H new ATOM 0 HE3 TRP A 8 -10.213 -1.580 -13.248 1.00 44.34 H new ATOM 0 HZ2 TRP A 8 -9.033 -3.302 -8.737 1.00 11.12 H new ATOM 0 HZ3 TRP A 8 -10.585 -3.934 -12.658 1.00 63.23 H new ATOM 0 HH2 TRP A 8 -10.011 -4.775 -10.428 1.00 42.34 H new ATOM 124 N GLU A 9 -7.361 -0.588 -14.280 1.00 2.13 N ATOM 125 CA GLU A 9 -6.550 -1.800 -14.514 1.00 64.44 C ATOM 126 C GLU A 9 -5.311 -1.475 -15.382 1.00 64.13 C ATOM 127 O GLU A 9 -4.279 -2.132 -15.253 1.00 24.20 O ATOM 128 CB GLU A 9 -7.397 -2.918 -15.179 1.00 15.32 C ATOM 129 CG GLU A 9 -6.681 -4.289 -15.233 1.00 74.33 C ATOM 130 CD GLU A 9 -7.407 -5.331 -16.092 1.00 62.53 C ATOM 131 OE1 GLU A 9 -8.460 -5.840 -15.668 1.00 5.32 O ATOM 132 OE2 GLU A 9 -6.929 -5.650 -17.200 1.00 41.40 O ATOM 0 H GLU A 9 -8.230 -0.565 -14.813 1.00 2.13 H new ATOM 0 HA GLU A 9 -6.207 -2.162 -13.545 1.00 64.44 H new ATOM 0 HB2 GLU A 9 -8.333 -3.028 -14.631 1.00 15.32 H new ATOM 0 HB3 GLU A 9 -7.655 -2.612 -16.193 1.00 15.32 H new ATOM 0 HG2 GLU A 9 -5.673 -4.147 -15.624 1.00 74.33 H new ATOM 0 HG3 GLU A 9 -6.578 -4.675 -14.219 1.00 74.33 H new ATOM 139 N THR A 10 -5.425 -0.442 -16.243 1.00 12.54 N ATOM 140 CA THR A 10 -4.347 -0.028 -17.161 1.00 40.03 C ATOM 141 C THR A 10 -3.141 0.542 -16.384 1.00 71.32 C ATOM 142 O THR A 10 -2.003 0.097 -16.583 1.00 41.45 O ATOM 143 CB THR A 10 -4.869 1.029 -18.184 1.00 30.25 C ATOM 144 OG1 THR A 10 -6.057 0.529 -18.817 1.00 2.41 O ATOM 145 CG2 THR A 10 -3.821 1.376 -19.260 1.00 32.20 C ATOM 0 H THR A 10 -6.268 0.128 -16.320 1.00 12.54 H new ATOM 0 HA THR A 10 -4.019 -0.914 -17.705 1.00 40.03 H new ATOM 0 HB THR A 10 -5.083 1.944 -17.631 1.00 30.25 H new ATOM 0 HG1 THR A 10 -6.389 1.191 -19.459 1.00 2.41 H new ATOM 0 HG21 THR A 10 -4.235 2.115 -19.946 1.00 32.20 H new ATOM 0 HG22 THR A 10 -2.930 1.783 -18.782 1.00 32.20 H new ATOM 0 HG23 THR A 10 -3.556 0.475 -19.814 1.00 32.20 H new ATOM 153 N GLN A 11 -3.403 1.531 -15.502 1.00 73.54 N ATOM 154 CA GLN A 11 -2.362 2.098 -14.632 1.00 1.24 C ATOM 155 C GLN A 11 -1.830 1.022 -13.663 1.00 2.01 C ATOM 156 O GLN A 11 -0.632 0.949 -13.437 1.00 3.53 O ATOM 157 CB GLN A 11 -2.884 3.344 -13.860 1.00 2.24 C ATOM 158 CG GLN A 11 -3.935 3.051 -12.766 1.00 23.41 C ATOM 159 CD GLN A 11 -4.409 4.309 -12.030 1.00 30.24 C ATOM 160 OE1 GLN A 11 -3.817 4.721 -11.035 1.00 44.01 O ATOM 161 NE2 GLN A 11 -5.491 4.910 -12.502 1.00 72.13 N ATOM 0 H GLN A 11 -4.325 1.949 -15.377 1.00 73.54 H new ATOM 0 HA GLN A 11 -1.537 2.431 -15.261 1.00 1.24 H new ATOM 0 HB2 GLN A 11 -2.034 3.847 -13.399 1.00 2.24 H new ATOM 0 HB3 GLN A 11 -3.316 4.041 -14.578 1.00 2.24 H new ATOM 0 HG2 GLN A 11 -4.795 2.558 -13.220 1.00 23.41 H new ATOM 0 HG3 GLN A 11 -3.513 2.353 -12.043 1.00 23.41 H new ATOM 0 HE21 GLN A 11 -5.959 4.542 -13.330 1.00 72.13 H new ATOM 0 HE22 GLN A 11 -5.857 5.741 -12.037 1.00 72.13 H new ATOM 170 N LEU A 12 -2.746 0.155 -13.173 1.00 64.11 N ATOM 171 CA LEU A 12 -2.431 -0.905 -12.196 1.00 44.11 C ATOM 172 C LEU A 12 -1.426 -1.919 -12.751 1.00 10.21 C ATOM 173 O LEU A 12 -0.435 -2.231 -12.081 1.00 65.23 O ATOM 174 CB LEU A 12 -3.720 -1.650 -11.786 1.00 63.33 C ATOM 175 CG LEU A 12 -3.518 -2.961 -10.959 1.00 52.11 C ATOM 176 CD1 LEU A 12 -2.896 -2.669 -9.573 1.00 45.40 C ATOM 177 CD2 LEU A 12 -4.831 -3.754 -10.864 1.00 15.21 C ATOM 0 H LEU A 12 -3.728 0.174 -13.448 1.00 64.11 H new ATOM 0 HA LEU A 12 -1.983 -0.418 -11.329 1.00 44.11 H new ATOM 0 HB2 LEU A 12 -4.341 -0.969 -11.204 1.00 63.33 H new ATOM 0 HB3 LEU A 12 -4.277 -1.896 -12.690 1.00 63.33 H new ATOM 0 HG LEU A 12 -2.802 -3.591 -11.487 1.00 52.11 H new ATOM 0 HD11 LEU A 12 -2.770 -3.604 -9.026 1.00 45.40 H new ATOM 0 HD12 LEU A 12 -1.925 -2.191 -9.703 1.00 45.40 H new ATOM 0 HD13 LEU A 12 -3.554 -2.006 -9.011 1.00 45.40 H new ATOM 0 HD21 LEU A 12 -4.666 -4.662 -10.284 1.00 15.21 H new ATOM 0 HD22 LEU A 12 -5.590 -3.144 -10.375 1.00 15.21 H new ATOM 0 HD23 LEU A 12 -5.169 -4.019 -11.866 1.00 15.21 H new ATOM 189 N GLN A 13 -1.707 -2.435 -13.961 1.00 52.14 N ATOM 190 CA GLN A 13 -0.922 -3.521 -14.567 1.00 52.30 C ATOM 191 C GLN A 13 0.526 -3.068 -14.806 1.00 33.35 C ATOM 192 O GLN A 13 1.445 -3.873 -14.725 1.00 25.41 O ATOM 193 CB GLN A 13 -1.591 -4.019 -15.874 1.00 53.55 C ATOM 194 CG GLN A 13 -1.563 -3.023 -17.047 1.00 33.03 C ATOM 195 CD GLN A 13 -2.318 -3.479 -18.295 1.00 20.01 C ATOM 196 OE1 GLN A 13 -3.430 -4.184 -18.121 1.00 53.32 O flip ATOM 197 NE2 GLN A 13 -1.924 -3.156 -19.414 1.00 44.44 N flip ATOM 0 H GLN A 13 -2.481 -2.112 -14.542 1.00 52.14 H new ATOM 0 HA GLN A 13 -0.895 -4.362 -13.874 1.00 52.30 H new ATOM 0 HB2 GLN A 13 -1.098 -4.939 -16.188 1.00 53.55 H new ATOM 0 HB3 GLN A 13 -2.629 -4.272 -15.658 1.00 53.55 H new ATOM 0 HG2 GLN A 13 -1.985 -2.076 -16.711 1.00 33.03 H new ATOM 0 HG3 GLN A 13 -0.525 -2.832 -17.318 1.00 33.03 H new ATOM 0 HE21 GLN A 13 -1.066 -2.614 -19.516 1.00 44.44 H new ATOM 0 HE22 GLN A 13 -2.455 -3.430 -20.240 1.00 44.44 H new ATOM 206 N ALA A 14 0.696 -1.751 -15.055 1.00 60.41 N ATOM 207 CA ALA A 14 2.007 -1.112 -15.191 1.00 52.25 C ATOM 208 C ALA A 14 2.660 -0.914 -13.805 1.00 72.42 C ATOM 209 O ALA A 14 3.846 -1.198 -13.643 1.00 23.51 O ATOM 210 CB ALA A 14 1.855 0.219 -15.936 1.00 1.33 C ATOM 0 H ALA A 14 -0.084 -1.103 -15.167 1.00 60.41 H new ATOM 0 HA ALA A 14 2.666 -1.758 -15.772 1.00 52.25 H new ATOM 0 HB1 ALA A 14 2.831 0.693 -16.036 1.00 1.33 H new ATOM 0 HB2 ALA A 14 1.437 0.036 -16.926 1.00 1.33 H new ATOM 0 HB3 ALA A 14 1.189 0.875 -15.376 1.00 1.33 H new ATOM 216 N ASN A 15 1.848 -0.458 -12.815 1.00 73.11 N ATOM 217 CA ASN A 15 2.269 -0.243 -11.396 1.00 0.21 C ATOM 218 C ASN A 15 2.846 -1.525 -10.765 1.00 34.33 C ATOM 219 O ASN A 15 3.707 -1.456 -9.878 1.00 25.12 O ATOM 220 CB ASN A 15 1.058 0.266 -10.532 1.00 55.24 C ATOM 221 CG ASN A 15 0.695 1.739 -10.752 1.00 65.34 C ATOM 222 OD1 ASN A 15 1.045 2.340 -11.758 1.00 51.13 O ATOM 223 ND2 ASN A 15 -0.062 2.319 -9.832 1.00 54.34 N ATOM 0 H ASN A 15 0.868 -0.225 -12.978 1.00 73.11 H new ATOM 0 HA ASN A 15 3.054 0.513 -11.408 1.00 0.21 H new ATOM 0 HB2 ASN A 15 0.185 -0.347 -10.756 1.00 55.24 H new ATOM 0 HB3 ASN A 15 1.292 0.116 -9.478 1.00 55.24 H new ATOM 0 HD21 ASN A 15 -0.364 3.285 -9.955 1.00 54.34 H new ATOM 0 HD22 ASN A 15 -0.342 1.799 -9.000 1.00 54.34 H new ATOM 230 N ARG A 16 2.345 -2.694 -11.209 1.00 44.43 N ATOM 231 CA ARG A 16 2.816 -4.002 -10.714 1.00 70.34 C ATOM 232 C ARG A 16 3.790 -4.672 -11.701 1.00 75.43 C ATOM 233 O ARG A 16 4.485 -5.607 -11.307 1.00 24.41 O ATOM 234 CB ARG A 16 1.635 -4.942 -10.365 1.00 1.33 C ATOM 235 CG ARG A 16 0.662 -5.229 -11.525 1.00 55.14 C ATOM 236 CD ARG A 16 -0.495 -6.141 -11.100 1.00 30.30 C ATOM 237 NE ARG A 16 -1.182 -5.648 -9.882 1.00 60.44 N ATOM 238 CZ ARG A 16 -2.001 -6.381 -9.114 1.00 52.22 C ATOM 239 NH1 ARG A 16 -2.268 -7.649 -9.418 1.00 73.01 N ATOM 240 NH2 ARG A 16 -2.552 -5.842 -8.031 1.00 34.52 N ATOM 0 H ARG A 16 1.610 -2.759 -11.913 1.00 44.43 H new ATOM 0 HA ARG A 16 3.367 -3.811 -9.793 1.00 70.34 H new ATOM 0 HB2 ARG A 16 2.039 -5.889 -10.007 1.00 1.33 H new ATOM 0 HB3 ARG A 16 1.073 -4.503 -9.540 1.00 1.33 H new ATOM 0 HG2 ARG A 16 0.261 -4.288 -11.901 1.00 55.14 H new ATOM 0 HG3 ARG A 16 1.206 -5.695 -12.346 1.00 55.14 H new ATOM 0 HD2 ARG A 16 -1.215 -6.215 -11.915 1.00 30.30 H new ATOM 0 HD3 ARG A 16 -0.114 -7.146 -10.918 1.00 30.30 H new ATOM 0 HE ARG A 16 -1.019 -4.679 -9.608 1.00 60.44 H new ATOM 0 HH11 ARG A 16 -1.848 -8.075 -10.244 1.00 73.01 H new ATOM 0 HH12 ARG A 16 -2.893 -8.195 -8.825 1.00 73.01 H new ATOM 0 HH21 ARG A 16 -2.352 -4.872 -7.786 1.00 34.52 H new ATOM 0 HH22 ARG A 16 -3.175 -6.398 -7.445 1.00 34.52 H new ATOM 254 N ASP A 17 3.825 -4.213 -12.980 1.00 61.35 N ATOM 255 CA ASP A 17 4.818 -4.689 -13.989 1.00 72.11 C ATOM 256 C ASP A 17 6.224 -4.231 -13.599 1.00 12.24 C ATOM 257 O ASP A 17 7.160 -5.039 -13.501 1.00 61.31 O ATOM 258 CB ASP A 17 4.467 -4.159 -15.411 1.00 62.43 C ATOM 259 CG ASP A 17 5.503 -4.544 -16.488 1.00 73.11 C ATOM 260 OD1 ASP A 17 5.409 -5.653 -17.042 1.00 23.51 O ATOM 261 OD2 ASP A 17 6.407 -3.728 -16.787 1.00 34.40 O ATOM 0 H ASP A 17 3.177 -3.513 -13.340 1.00 61.35 H new ATOM 0 HA ASP A 17 4.785 -5.778 -14.009 1.00 72.11 H new ATOM 0 HB2 ASP A 17 3.491 -4.546 -15.703 1.00 62.43 H new ATOM 0 HB3 ASP A 17 4.381 -3.073 -15.374 1.00 62.43 H new ATOM 266 N GLU A 18 6.344 -2.918 -13.377 1.00 32.55 N ATOM 267 CA GLU A 18 7.583 -2.295 -12.911 1.00 42.20 C ATOM 268 C GLU A 18 7.955 -2.820 -11.512 1.00 75.41 C ATOM 269 O GLU A 18 9.126 -2.873 -11.162 1.00 20.50 O ATOM 270 CB GLU A 18 7.433 -0.751 -12.935 1.00 2.54 C ATOM 271 CG GLU A 18 6.306 -0.164 -12.028 1.00 30.21 C ATOM 272 CD GLU A 18 6.779 0.348 -10.652 1.00 13.01 C ATOM 273 OE1 GLU A 18 7.180 1.519 -10.566 1.00 25.31 O ATOM 274 OE2 GLU A 18 6.760 -0.415 -9.668 1.00 3.33 O ATOM 0 H GLU A 18 5.580 -2.257 -13.517 1.00 32.55 H new ATOM 0 HA GLU A 18 8.401 -2.561 -13.580 1.00 42.20 H new ATOM 0 HB2 GLU A 18 8.383 -0.308 -12.635 1.00 2.54 H new ATOM 0 HB3 GLU A 18 7.246 -0.439 -13.962 1.00 2.54 H new ATOM 0 HG2 GLU A 18 5.824 0.657 -12.559 1.00 30.21 H new ATOM 0 HG3 GLU A 18 5.548 -0.932 -11.873 1.00 30.21 H new ATOM 281 N LYS A 19 6.924 -3.224 -10.736 1.00 62.41 N ATOM 282 CA LYS A 19 7.089 -3.812 -9.398 1.00 31.21 C ATOM 283 C LYS A 19 7.585 -5.278 -9.507 1.00 33.03 C ATOM 284 O LYS A 19 8.311 -5.766 -8.632 1.00 75.22 O ATOM 285 CB LYS A 19 5.751 -3.736 -8.613 1.00 72.14 C ATOM 286 CG LYS A 19 5.872 -3.950 -7.090 1.00 62.43 C ATOM 287 CD LYS A 19 6.578 -2.778 -6.348 1.00 3.22 C ATOM 288 CE LYS A 19 5.664 -1.556 -6.102 1.00 65.33 C ATOM 289 NZ LYS A 19 5.271 -0.830 -7.343 1.00 75.52 N ATOM 0 H LYS A 19 5.949 -3.148 -11.028 1.00 62.41 H new ATOM 0 HA LYS A 19 7.841 -3.242 -8.852 1.00 31.21 H new ATOM 0 HB2 LYS A 19 5.298 -2.761 -8.792 1.00 72.14 H new ATOM 0 HB3 LYS A 19 5.068 -4.484 -9.016 1.00 72.14 H new ATOM 0 HG2 LYS A 19 4.875 -4.086 -6.671 1.00 62.43 H new ATOM 0 HG3 LYS A 19 6.424 -4.871 -6.904 1.00 62.43 H new ATOM 0 HD2 LYS A 19 6.952 -3.139 -5.390 1.00 3.22 H new ATOM 0 HD3 LYS A 19 7.444 -2.461 -6.929 1.00 3.22 H new ATOM 0 HE2 LYS A 19 4.762 -1.888 -5.587 1.00 65.33 H new ATOM 0 HE3 LYS A 19 6.175 -0.862 -5.434 1.00 65.33 H new ATOM 0 HZ1 LYS A 19 4.994 0.143 -7.103 1.00 75.52 H new ATOM 0 HZ2 LYS A 19 6.075 -0.808 -8.002 1.00 75.52 H new ATOM 0 HZ3 LYS A 19 4.469 -1.318 -7.791 1.00 75.52 H new ATOM 303 N ASP A 20 7.195 -5.947 -10.610 1.00 22.12 N ATOM 304 CA ASP A 20 7.559 -7.355 -10.905 1.00 31.43 C ATOM 305 C ASP A 20 9.050 -7.480 -11.291 1.00 42.05 C ATOM 306 O ASP A 20 9.657 -8.544 -11.138 1.00 20.00 O ATOM 307 CB ASP A 20 6.630 -7.916 -12.023 1.00 60.42 C ATOM 308 CG ASP A 20 6.959 -9.360 -12.451 1.00 65.41 C ATOM 309 OD1 ASP A 20 6.711 -10.289 -11.658 1.00 14.00 O ATOM 310 OD2 ASP A 20 7.451 -9.568 -13.583 1.00 60.52 O ATOM 0 H ASP A 20 6.612 -5.524 -11.332 1.00 22.12 H new ATOM 0 HA ASP A 20 7.414 -7.951 -10.004 1.00 31.43 H new ATOM 0 HB2 ASP A 20 5.598 -7.878 -11.675 1.00 60.42 H new ATOM 0 HB3 ASP A 20 6.697 -7.266 -12.895 1.00 60.42 H new ATOM 315 N ARG A 21 9.639 -6.389 -11.789 1.00 20.43 N ATOM 316 CA ARG A 21 11.097 -6.312 -12.022 1.00 25.33 C ATOM 317 C ARG A 21 11.798 -5.573 -10.868 1.00 13.20 C ATOM 318 O ARG A 21 12.998 -5.729 -10.692 1.00 52.22 O ATOM 319 CB ARG A 21 11.418 -5.643 -13.380 1.00 12.44 C ATOM 320 CG ARG A 21 10.773 -4.258 -13.607 1.00 70.52 C ATOM 321 CD ARG A 21 11.319 -3.535 -14.849 1.00 51.53 C ATOM 322 NE ARG A 21 11.180 -4.319 -16.094 1.00 74.55 N ATOM 323 CZ ARG A 21 11.115 -3.805 -17.336 1.00 63.34 C ATOM 324 NH1 ARG A 21 11.157 -2.486 -17.537 1.00 11.11 N ATOM 325 NH2 ARG A 21 11.021 -4.627 -18.372 1.00 51.11 N ATOM 0 H ARG A 21 9.132 -5.540 -12.042 1.00 20.43 H new ATOM 0 HA ARG A 21 11.480 -7.332 -12.057 1.00 25.33 H new ATOM 0 HB2 ARG A 21 12.500 -5.540 -13.468 1.00 12.44 H new ATOM 0 HB3 ARG A 21 11.096 -6.310 -14.179 1.00 12.44 H new ATOM 0 HG2 ARG A 21 9.694 -4.378 -13.709 1.00 70.52 H new ATOM 0 HG3 ARG A 21 10.943 -3.636 -12.728 1.00 70.52 H new ATOM 0 HD2 ARG A 21 10.797 -2.586 -14.966 1.00 51.53 H new ATOM 0 HD3 ARG A 21 12.372 -3.302 -14.691 1.00 51.53 H new ATOM 0 HE ARG A 21 11.129 -5.334 -16.005 1.00 74.55 H new ATOM 0 HH11 ARG A 21 11.240 -1.851 -16.743 1.00 11.11 H new ATOM 0 HH12 ARG A 21 11.107 -2.113 -18.485 1.00 11.11 H new ATOM 0 HH21 ARG A 21 10.999 -5.636 -18.222 1.00 51.11 H new ATOM 0 HH22 ARG A 21 10.971 -4.251 -19.319 1.00 51.11 H new ATOM 339 N PHE A 22 11.038 -4.770 -10.097 1.00 4.14 N ATOM 340 CA PHE A 22 11.563 -3.951 -8.976 1.00 75.11 C ATOM 341 C PHE A 22 12.348 -4.793 -7.947 1.00 13.32 C ATOM 342 O PHE A 22 13.487 -4.465 -7.613 1.00 10.42 O ATOM 343 CB PHE A 22 10.379 -3.230 -8.291 1.00 62.43 C ATOM 344 CG PHE A 22 10.740 -2.139 -7.293 1.00 15.14 C ATOM 345 CD1 PHE A 22 10.963 -0.831 -7.718 1.00 33.31 C ATOM 346 CD2 PHE A 22 10.824 -2.412 -5.933 1.00 31.34 C ATOM 347 CE1 PHE A 22 11.255 0.166 -6.810 1.00 51.11 C ATOM 348 CE2 PHE A 22 11.121 -1.419 -5.036 1.00 5.01 C ATOM 349 CZ PHE A 22 11.335 -0.128 -5.468 1.00 72.23 C ATOM 0 H PHE A 22 10.032 -4.668 -10.233 1.00 4.14 H new ATOM 0 HA PHE A 22 12.266 -3.225 -9.384 1.00 75.11 H new ATOM 0 HB2 PHE A 22 9.751 -2.790 -9.066 1.00 62.43 H new ATOM 0 HB3 PHE A 22 9.774 -3.977 -7.777 1.00 62.43 H new ATOM 0 HD1 PHE A 22 10.907 -0.595 -8.770 1.00 33.31 H new ATOM 0 HD2 PHE A 22 10.653 -3.418 -5.579 1.00 31.34 H new ATOM 0 HE1 PHE A 22 11.421 1.177 -7.152 1.00 51.11 H new ATOM 0 HE2 PHE A 22 11.188 -1.650 -3.983 1.00 5.01 H new ATOM 0 HZ PHE A 22 11.565 0.651 -4.756 1.00 72.23 H new ATOM 359 N PHE A 23 11.730 -5.893 -7.477 1.00 44.23 N ATOM 360 CA PHE A 23 12.326 -6.768 -6.440 1.00 61.34 C ATOM 361 C PHE A 23 13.509 -7.593 -6.997 1.00 0.43 C ATOM 362 O PHE A 23 14.309 -8.108 -6.229 1.00 63.01 O ATOM 363 CB PHE A 23 11.277 -7.758 -5.854 1.00 74.13 C ATOM 364 CG PHE A 23 10.078 -7.182 -5.075 1.00 1.52 C ATOM 365 CD1 PHE A 23 9.566 -5.906 -5.312 1.00 2.15 C ATOM 366 CD2 PHE A 23 9.464 -7.953 -4.082 1.00 70.34 C ATOM 367 CE1 PHE A 23 8.492 -5.427 -4.583 1.00 23.55 C ATOM 368 CE2 PHE A 23 8.398 -7.469 -3.353 1.00 61.31 C ATOM 369 CZ PHE A 23 7.913 -6.210 -3.602 1.00 40.14 C ATOM 0 H PHE A 23 10.813 -6.201 -7.799 1.00 44.23 H new ATOM 0 HA PHE A 23 12.683 -6.102 -5.654 1.00 61.34 H new ATOM 0 HB2 PHE A 23 10.882 -8.350 -6.680 1.00 74.13 H new ATOM 0 HB3 PHE A 23 11.803 -8.445 -5.192 1.00 74.13 H new ATOM 0 HD1 PHE A 23 10.013 -5.285 -6.074 1.00 2.15 H new ATOM 0 HD2 PHE A 23 9.833 -8.948 -3.882 1.00 70.34 H new ATOM 0 HE1 PHE A 23 8.105 -4.438 -4.781 1.00 23.55 H new ATOM 0 HE2 PHE A 23 7.945 -8.081 -2.587 1.00 61.31 H new ATOM 0 HZ PHE A 23 7.078 -5.830 -3.031 1.00 40.14 H new ATOM 379 N SER A 24 13.600 -7.730 -8.330 1.00 25.24 N ATOM 380 CA SER A 24 14.581 -8.633 -8.973 1.00 61.21 C ATOM 381 C SER A 24 15.743 -7.873 -9.636 1.00 63.45 C ATOM 382 O SER A 24 16.854 -8.407 -9.733 1.00 12.23 O ATOM 383 CB SER A 24 13.853 -9.517 -10.008 1.00 2.01 C ATOM 384 OG SER A 24 12.826 -10.279 -9.388 1.00 21.20 O ATOM 0 H SER A 24 13.006 -7.227 -8.989 1.00 25.24 H new ATOM 0 HA SER A 24 15.024 -9.254 -8.194 1.00 61.21 H new ATOM 0 HB2 SER A 24 13.425 -8.891 -10.791 1.00 2.01 H new ATOM 0 HB3 SER A 24 14.568 -10.185 -10.489 1.00 2.01 H new ATOM 0 HG SER A 24 12.376 -10.831 -10.061 1.00 21.20 H new ATOM 390 N GLU A 25 15.500 -6.623 -10.074 1.00 52.10 N ATOM 391 CA GLU A 25 16.436 -5.880 -10.947 1.00 21.13 C ATOM 392 C GLU A 25 16.840 -4.558 -10.281 1.00 52.45 C ATOM 393 O GLU A 25 18.032 -4.277 -10.112 1.00 22.44 O ATOM 394 CB GLU A 25 15.781 -5.589 -12.331 1.00 13.33 C ATOM 395 CG GLU A 25 15.275 -6.826 -13.100 1.00 21.33 C ATOM 396 CD GLU A 25 16.381 -7.841 -13.410 1.00 22.54 C ATOM 397 OE1 GLU A 25 17.327 -7.497 -14.152 1.00 71.12 O ATOM 398 OE2 GLU A 25 16.325 -8.976 -12.907 1.00 32.53 O ATOM 0 H GLU A 25 14.657 -6.101 -9.836 1.00 52.10 H new ATOM 0 HA GLU A 25 17.323 -6.494 -11.100 1.00 21.13 H new ATOM 0 HB2 GLU A 25 14.943 -4.909 -12.181 1.00 13.33 H new ATOM 0 HB3 GLU A 25 16.507 -5.067 -12.954 1.00 13.33 H new ATOM 0 HG2 GLU A 25 14.496 -7.315 -12.515 1.00 21.33 H new ATOM 0 HG3 GLU A 25 14.816 -6.502 -14.034 1.00 21.33 H new ATOM 405 N HIS A 26 15.819 -3.758 -9.900 1.00 4.11 N ATOM 406 CA HIS A 26 16.019 -2.419 -9.294 1.00 21.14 C ATOM 407 C HIS A 26 16.685 -2.557 -7.914 1.00 31.11 C ATOM 408 O HIS A 26 17.625 -1.827 -7.574 1.00 10.35 O ATOM 409 CB HIS A 26 14.653 -1.679 -9.179 1.00 55.22 C ATOM 410 CG HIS A 26 14.709 -0.327 -8.495 1.00 61.01 C ATOM 411 ND1 HIS A 26 14.568 -0.215 -7.138 1.00 72.12 N ATOM 412 CD2 HIS A 26 14.888 0.917 -9.014 1.00 52.40 C ATOM 413 CE1 HIS A 26 14.664 1.065 -6.855 1.00 34.21 C ATOM 414 NE2 HIS A 26 14.855 1.800 -7.960 1.00 20.41 N ATOM 0 H HIS A 26 14.838 -4.019 -10.002 1.00 4.11 H new ATOM 0 HA HIS A 26 16.677 -1.831 -9.933 1.00 21.14 H new ATOM 0 HB2 HIS A 26 14.244 -1.545 -10.181 1.00 55.22 H new ATOM 0 HB3 HIS A 26 13.957 -2.316 -8.633 1.00 55.22 H new ATOM 0 HD2 HIS A 26 15.029 1.165 -10.056 1.00 52.40 H new ATOM 0 HE1 HIS A 26 14.597 1.473 -5.857 1.00 34.21 H new ATOM 0 HE2 HIS A 26 14.956 2.814 -8.009 1.00 20.41 H new ATOM 422 N ARG A 27 16.181 -3.522 -7.148 1.00 43.02 N ATOM 423 CA ARG A 27 16.640 -3.845 -5.796 1.00 21.34 C ATOM 424 C ARG A 27 16.858 -5.354 -5.674 1.00 23.13 C ATOM 425 O ARG A 27 16.293 -6.138 -6.450 1.00 54.45 O ATOM 426 CB ARG A 27 15.621 -3.345 -4.729 1.00 3.12 C ATOM 427 CG ARG A 27 15.626 -1.816 -4.515 1.00 60.34 C ATOM 428 CD ARG A 27 17.009 -1.288 -4.113 1.00 22.32 C ATOM 429 NE ARG A 27 17.030 0.163 -3.869 1.00 63.11 N ATOM 430 CZ ARG A 27 18.024 0.987 -4.248 1.00 62.32 C ATOM 431 NH1 ARG A 27 19.084 0.519 -4.900 1.00 11.31 N ATOM 432 NH2 ARG A 27 17.972 2.265 -3.936 1.00 14.24 N ATOM 0 H ARG A 27 15.417 -4.121 -7.460 1.00 43.02 H new ATOM 0 HA ARG A 27 17.586 -3.335 -5.614 1.00 21.34 H new ATOM 0 HB2 ARG A 27 14.619 -3.655 -5.026 1.00 3.12 H new ATOM 0 HB3 ARG A 27 15.838 -3.834 -3.779 1.00 3.12 H new ATOM 0 HG2 ARG A 27 15.304 -1.322 -5.432 1.00 60.34 H new ATOM 0 HG3 ARG A 27 14.902 -1.557 -3.742 1.00 60.34 H new ATOM 0 HD2 ARG A 27 17.340 -1.806 -3.213 1.00 22.32 H new ATOM 0 HD3 ARG A 27 17.724 -1.527 -4.900 1.00 22.32 H new ATOM 0 HE ARG A 27 16.235 0.573 -3.378 1.00 63.11 H new ATOM 0 HH11 ARG A 27 19.150 -0.475 -5.118 1.00 11.31 H new ATOM 0 HH12 ARG A 27 19.831 1.154 -5.182 1.00 11.31 H new ATOM 0 HH21 ARG A 27 17.179 2.629 -3.408 1.00 14.24 H new ATOM 0 HH22 ARG A 27 18.725 2.891 -4.223 1.00 14.24 H new ATOM 446 N GLN A 28 17.755 -5.726 -4.747 1.00 52.32 N ATOM 447 CA GLN A 28 17.962 -7.122 -4.320 1.00 22.13 C ATOM 448 C GLN A 28 16.632 -7.727 -3.806 1.00 23.25 C ATOM 449 O GLN A 28 15.825 -7.015 -3.178 1.00 43.41 O ATOM 450 CB GLN A 28 19.065 -7.223 -3.213 1.00 63.51 C ATOM 451 CG GLN A 28 18.745 -6.525 -1.859 1.00 73.41 C ATOM 452 CD GLN A 28 18.721 -4.988 -1.919 1.00 4.50 C ATOM 453 OE1 GLN A 28 19.421 -4.371 -2.725 1.00 55.11 O ATOM 454 NE2 GLN A 28 17.905 -4.357 -1.088 1.00 73.11 N ATOM 0 H GLN A 28 18.363 -5.062 -4.268 1.00 52.32 H new ATOM 0 HA GLN A 28 18.303 -7.690 -5.186 1.00 22.13 H new ATOM 0 HB2 GLN A 28 19.259 -8.278 -3.017 1.00 63.51 H new ATOM 0 HB3 GLN A 28 19.987 -6.797 -3.608 1.00 63.51 H new ATOM 0 HG2 GLN A 28 17.776 -6.877 -1.504 1.00 73.41 H new ATOM 0 HG3 GLN A 28 19.486 -6.835 -1.122 1.00 73.41 H new ATOM 0 HE21 GLN A 28 17.336 -4.889 -0.430 1.00 73.11 H new ATOM 0 HE22 GLN A 28 17.846 -3.339 -1.106 1.00 73.11 H new ATOM 463 N SER A 29 16.417 -9.022 -4.110 1.00 23.24 N ATOM 464 CA SER A 29 15.181 -9.732 -3.748 1.00 12.50 C ATOM 465 C SER A 29 14.991 -9.781 -2.214 1.00 61.41 C ATOM 466 O SER A 29 15.865 -10.298 -1.497 1.00 21.54 O ATOM 467 CB SER A 29 15.181 -11.157 -4.353 1.00 22.33 C ATOM 468 OG SER A 29 15.339 -11.103 -5.767 1.00 55.33 O ATOM 0 H SER A 29 17.093 -9.600 -4.610 1.00 23.24 H new ATOM 0 HA SER A 29 14.338 -9.181 -4.165 1.00 12.50 H new ATOM 0 HB2 SER A 29 15.988 -11.744 -3.914 1.00 22.33 H new ATOM 0 HB3 SER A 29 14.248 -11.663 -4.105 1.00 22.33 H new ATOM 0 HG SER A 29 15.044 -10.228 -6.096 1.00 55.33 H new ATOM 474 N PRO A 30 13.843 -9.232 -1.699 1.00 40.31 N ATOM 475 CA PRO A 30 13.473 -9.347 -0.273 1.00 22.11 C ATOM 476 C PRO A 30 12.951 -10.755 0.047 1.00 22.15 C ATOM 477 O PRO A 30 12.943 -11.170 1.196 1.00 52.32 O ATOM 478 CB PRO A 30 12.364 -8.290 -0.127 1.00 74.34 C ATOM 479 CG PRO A 30 11.704 -8.261 -1.465 1.00 63.21 C ATOM 480 CD PRO A 30 12.832 -8.431 -2.460 1.00 1.45 C ATOM 0 HA PRO A 30 14.308 -9.190 0.409 1.00 22.11 H new ATOM 0 HB2 PRO A 30 11.658 -8.560 0.659 1.00 74.34 H new ATOM 0 HB3 PRO A 30 12.775 -7.315 0.135 1.00 74.34 H new ATOM 0 HG2 PRO A 30 10.969 -9.061 -1.560 1.00 63.21 H new ATOM 0 HG3 PRO A 30 11.175 -7.321 -1.624 1.00 63.21 H new ATOM 0 HD2 PRO A 30 12.501 -8.951 -3.359 1.00 1.45 H new ATOM 0 HD3 PRO A 30 13.236 -7.470 -2.778 1.00 1.45 H new ATOM 488 N ILE A 31 12.444 -11.434 -0.995 1.00 61.13 N ATOM 489 CA ILE A 31 12.129 -12.858 -0.967 1.00 1.03 C ATOM 490 C ILE A 31 13.469 -13.621 -1.127 1.00 2.54 C ATOM 491 O ILE A 31 13.977 -13.731 -2.252 1.00 10.34 O ATOM 492 CB ILE A 31 11.122 -13.243 -2.130 1.00 22.45 C ATOM 493 CG1 ILE A 31 9.944 -12.209 -2.240 1.00 62.23 C ATOM 494 CG2 ILE A 31 10.569 -14.677 -1.946 1.00 1.24 C ATOM 495 CD1 ILE A 31 9.021 -12.130 -1.034 1.00 50.13 C ATOM 0 H ILE A 31 12.241 -10.994 -1.893 1.00 61.13 H new ATOM 0 HA ILE A 31 11.641 -13.122 -0.029 1.00 1.03 H new ATOM 0 HB ILE A 31 11.685 -13.212 -3.063 1.00 22.45 H new ATOM 0 HG12 ILE A 31 10.368 -11.220 -2.415 1.00 62.23 H new ATOM 0 HG13 ILE A 31 9.346 -12.459 -3.116 1.00 62.23 H new ATOM 0 HG21 ILE A 31 9.882 -14.909 -2.760 1.00 1.24 H new ATOM 0 HG22 ILE A 31 11.394 -15.389 -1.953 1.00 1.24 H new ATOM 0 HG23 ILE A 31 10.041 -14.744 -0.995 1.00 1.24 H new ATOM 0 HD11 ILE A 31 8.245 -11.386 -1.217 1.00 50.13 H new ATOM 0 HD12 ILE A 31 8.559 -13.103 -0.865 1.00 50.13 H new ATOM 0 HD13 ILE A 31 9.596 -11.844 -0.153 1.00 50.13 H new ATOM 507 N PRO A 32 14.087 -14.122 -0.003 1.00 21.12 N ATOM 508 CA PRO A 32 15.463 -14.687 -0.024 1.00 50.41 C ATOM 509 C PRO A 32 15.519 -16.003 -0.833 1.00 21.41 C ATOM 510 O PRO A 32 14.460 -16.576 -1.106 1.00 54.54 O ATOM 511 CB PRO A 32 15.761 -14.923 1.488 1.00 33.32 C ATOM 512 CG PRO A 32 14.419 -15.155 2.099 1.00 13.12 C ATOM 513 CD PRO A 32 13.483 -14.230 1.353 1.00 24.03 C ATOM 0 HA PRO A 32 16.192 -14.036 -0.506 1.00 50.41 H new ATOM 0 HB2 PRO A 32 16.418 -15.780 1.634 1.00 33.32 H new ATOM 0 HB3 PRO A 32 16.257 -14.061 1.934 1.00 33.32 H new ATOM 0 HG2 PRO A 32 14.112 -16.196 1.994 1.00 13.12 H new ATOM 0 HG3 PRO A 32 14.427 -14.932 3.166 1.00 13.12 H new ATOM 0 HD2 PRO A 32 12.472 -14.636 1.308 1.00 24.03 H new ATOM 0 HD3 PRO A 32 13.414 -13.256 1.838 1.00 24.03 H new ATOM 521 N PRO A 33 16.752 -16.504 -1.220 1.00 40.32 N ATOM 522 CA PRO A 33 16.922 -17.773 -1.985 1.00 14.43 C ATOM 523 C PRO A 33 16.078 -18.933 -1.440 1.00 44.14 C ATOM 524 O PRO A 33 15.573 -19.768 -2.201 1.00 23.12 O ATOM 525 CB PRO A 33 18.426 -18.085 -1.833 1.00 51.34 C ATOM 526 CG PRO A 33 19.083 -16.749 -1.658 1.00 11.01 C ATOM 527 CD PRO A 33 18.071 -15.852 -0.961 1.00 1.40 C ATOM 0 HA PRO A 33 16.591 -17.659 -3.017 1.00 14.43 H new ATOM 0 HB2 PRO A 33 18.610 -18.731 -0.975 1.00 51.34 H new ATOM 0 HB3 PRO A 33 18.812 -18.603 -2.711 1.00 51.34 H new ATOM 0 HG2 PRO A 33 19.993 -16.840 -1.065 1.00 11.01 H new ATOM 0 HG3 PRO A 33 19.372 -16.330 -2.622 1.00 11.01 H new ATOM 0 HD2 PRO A 33 18.275 -15.779 0.107 1.00 1.40 H new ATOM 0 HD3 PRO A 33 18.098 -14.838 -1.360 1.00 1.40 H new ATOM 535 N GLU A 34 15.901 -18.928 -0.110 1.00 54.40 N ATOM 536 CA GLU A 34 15.193 -19.987 0.616 1.00 40.22 C ATOM 537 C GLU A 34 13.695 -19.965 0.262 1.00 31.20 C ATOM 538 O GLU A 34 13.133 -20.979 -0.164 1.00 61.43 O ATOM 539 CB GLU A 34 15.388 -19.791 2.147 1.00 55.32 C ATOM 540 CG GLU A 34 16.823 -19.397 2.579 1.00 22.24 C ATOM 541 CD GLU A 34 17.914 -20.338 2.037 1.00 55.13 C ATOM 542 OE1 GLU A 34 18.016 -21.479 2.521 1.00 21.10 O ATOM 543 OE2 GLU A 34 18.664 -19.939 1.118 1.00 4.50 O ATOM 0 H GLU A 34 16.248 -18.183 0.494 1.00 54.40 H new ATOM 0 HA GLU A 34 15.602 -20.955 0.325 1.00 40.22 H new ATOM 0 HB2 GLU A 34 14.697 -19.021 2.490 1.00 55.32 H new ATOM 0 HB3 GLU A 34 15.113 -20.716 2.654 1.00 55.32 H new ATOM 0 HG2 GLU A 34 17.029 -18.382 2.239 1.00 22.24 H new ATOM 0 HG3 GLU A 34 16.874 -19.385 3.668 1.00 22.24 H new ATOM 550 N GLU A 35 13.069 -18.781 0.415 1.00 23.11 N ATOM 551 CA GLU A 35 11.652 -18.580 0.084 1.00 20.24 C ATOM 552 C GLU A 35 11.390 -18.735 -1.415 1.00 54.33 C ATOM 553 O GLU A 35 10.577 -19.569 -1.807 1.00 44.40 O ATOM 554 CB GLU A 35 11.182 -17.189 0.582 1.00 42.13 C ATOM 555 CG GLU A 35 11.179 -17.028 2.113 1.00 70.13 C ATOM 556 CD GLU A 35 10.182 -17.965 2.811 1.00 73.41 C ATOM 557 OE1 GLU A 35 9.001 -17.590 2.951 1.00 1.32 O ATOM 558 OE2 GLU A 35 10.571 -19.078 3.225 1.00 11.12 O ATOM 0 H GLU A 35 13.532 -17.944 0.770 1.00 23.11 H new ATOM 0 HA GLU A 35 11.077 -19.353 0.593 1.00 20.24 H new ATOM 0 HB2 GLU A 35 11.828 -16.425 0.150 1.00 42.13 H new ATOM 0 HB3 GLU A 35 10.175 -17.004 0.208 1.00 42.13 H new ATOM 0 HG2 GLU A 35 12.181 -17.222 2.496 1.00 70.13 H new ATOM 0 HG3 GLU A 35 10.936 -15.995 2.364 1.00 70.13 H new ATOM 565 N ARG A 36 12.137 -17.984 -2.259 1.00 62.11 N ATOM 566 CA ARG A 36 11.861 -17.898 -3.716 1.00 72.14 C ATOM 567 C ARG A 36 12.162 -19.225 -4.460 1.00 14.22 C ATOM 568 O ARG A 36 11.949 -19.322 -5.674 1.00 1.22 O ATOM 569 CB ARG A 36 12.637 -16.716 -4.353 1.00 3.13 C ATOM 570 CG ARG A 36 14.173 -16.868 -4.386 1.00 30.31 C ATOM 571 CD ARG A 36 14.847 -15.750 -5.200 1.00 11.03 C ATOM 572 NE ARG A 36 14.298 -15.688 -6.571 1.00 23.20 N ATOM 573 CZ ARG A 36 14.850 -15.067 -7.617 1.00 1.34 C ATOM 574 NH1 ARG A 36 16.008 -14.424 -7.510 1.00 42.42 N ATOM 575 NH2 ARG A 36 14.234 -15.115 -8.790 1.00 73.10 N ATOM 0 H ARG A 36 12.937 -17.428 -1.957 1.00 62.11 H new ATOM 0 HA ARG A 36 10.792 -17.714 -3.826 1.00 72.14 H new ATOM 0 HB2 ARG A 36 12.281 -16.579 -5.374 1.00 3.13 H new ATOM 0 HB3 ARG A 36 12.391 -15.806 -3.805 1.00 3.13 H new ATOM 0 HG2 ARG A 36 14.560 -16.858 -3.367 1.00 30.31 H new ATOM 0 HG3 ARG A 36 14.432 -17.836 -4.816 1.00 30.31 H new ATOM 0 HD2 ARG A 36 14.698 -14.792 -4.701 1.00 11.03 H new ATOM 0 HD3 ARG A 36 15.922 -15.924 -5.243 1.00 11.03 H new ATOM 0 HE ARG A 36 13.412 -16.166 -6.734 1.00 23.20 H new ATOM 0 HH11 ARG A 36 16.496 -14.397 -6.614 1.00 42.42 H new ATOM 0 HH12 ARG A 36 16.409 -13.957 -8.323 1.00 42.42 H new ATOM 0 HH21 ARG A 36 13.353 -15.620 -8.883 1.00 73.10 H new ATOM 0 HH22 ARG A 36 14.641 -14.646 -9.599 1.00 73.10 H new ATOM 589 N ASP A 37 12.669 -20.229 -3.720 1.00 40.12 N ATOM 590 CA ASP A 37 12.812 -21.602 -4.215 1.00 42.54 C ATOM 591 C ASP A 37 11.416 -22.258 -4.327 1.00 71.04 C ATOM 592 O ASP A 37 11.077 -22.837 -5.364 1.00 32.13 O ATOM 593 CB ASP A 37 13.743 -22.406 -3.270 1.00 35.44 C ATOM 594 CG ASP A 37 14.023 -23.833 -3.764 1.00 62.32 C ATOM 595 OD1 ASP A 37 14.575 -23.986 -4.873 1.00 62.14 O ATOM 596 OD2 ASP A 37 13.699 -24.806 -3.061 1.00 45.42 O ATOM 0 H ASP A 37 12.990 -20.105 -2.760 1.00 40.12 H new ATOM 0 HA ASP A 37 13.265 -21.595 -5.206 1.00 42.54 H new ATOM 0 HB2 ASP A 37 14.688 -21.874 -3.163 1.00 35.44 H new ATOM 0 HB3 ASP A 37 13.290 -22.454 -2.280 1.00 35.44 H new ATOM 601 N ASP A 38 10.613 -22.141 -3.250 1.00 63.30 N ATOM 602 CA ASP A 38 9.211 -22.634 -3.226 1.00 11.31 C ATOM 603 C ASP A 38 8.263 -21.652 -3.933 1.00 13.33 C ATOM 604 O ASP A 38 7.291 -22.069 -4.577 1.00 15.42 O ATOM 605 CB ASP A 38 8.722 -22.836 -1.770 1.00 45.22 C ATOM 606 CG ASP A 38 9.501 -23.911 -1.014 1.00 3.05 C ATOM 607 OD1 ASP A 38 9.115 -25.100 -1.073 1.00 41.41 O ATOM 608 OD2 ASP A 38 10.514 -23.584 -0.369 1.00 45.24 O ATOM 0 H ASP A 38 10.910 -21.706 -2.376 1.00 63.30 H new ATOM 0 HA ASP A 38 9.199 -23.588 -3.753 1.00 11.31 H new ATOM 0 HB2 ASP A 38 8.805 -21.892 -1.232 1.00 45.22 H new ATOM 0 HB3 ASP A 38 7.666 -23.104 -1.783 1.00 45.22 H new ATOM 613 N PHE A 39 8.554 -20.348 -3.793 1.00 33.01 N ATOM 614 CA PHE A 39 7.739 -19.272 -4.376 1.00 41.50 C ATOM 615 C PHE A 39 8.024 -19.139 -5.878 1.00 72.04 C ATOM 616 O PHE A 39 9.168 -19.272 -6.331 1.00 23.20 O ATOM 617 CB PHE A 39 7.984 -17.912 -3.648 1.00 71.23 C ATOM 618 CG PHE A 39 7.262 -17.761 -2.302 1.00 75.03 C ATOM 619 CD1 PHE A 39 7.796 -18.285 -1.123 1.00 45.10 C ATOM 620 CD2 PHE A 39 6.046 -17.079 -2.221 1.00 54.21 C ATOM 621 CE1 PHE A 39 7.146 -18.131 0.085 1.00 24.13 C ATOM 622 CE2 PHE A 39 5.397 -16.929 -1.011 1.00 2.22 C ATOM 623 CZ PHE A 39 5.947 -17.452 0.140 1.00 34.54 C ATOM 0 H PHE A 39 9.363 -20.011 -3.271 1.00 33.01 H new ATOM 0 HA PHE A 39 6.690 -19.536 -4.240 1.00 41.50 H new ATOM 0 HB2 PHE A 39 9.055 -17.791 -3.485 1.00 71.23 H new ATOM 0 HB3 PHE A 39 7.669 -17.102 -4.306 1.00 71.23 H new ATOM 0 HD1 PHE A 39 8.734 -18.820 -1.157 1.00 45.10 H new ATOM 0 HD2 PHE A 39 5.607 -16.663 -3.116 1.00 54.21 H new ATOM 0 HE1 PHE A 39 7.576 -18.542 0.986 1.00 24.13 H new ATOM 0 HE2 PHE A 39 4.456 -16.401 -0.966 1.00 2.22 H new ATOM 0 HZ PHE A 39 5.439 -17.330 1.085 1.00 34.54 H new ATOM 633 N ASP A 40 6.958 -18.878 -6.628 1.00 61.52 N ATOM 634 CA ASP A 40 7.006 -18.599 -8.067 1.00 22.23 C ATOM 635 C ASP A 40 7.348 -17.108 -8.266 1.00 22.03 C ATOM 636 O ASP A 40 7.331 -16.337 -7.285 1.00 34.44 O ATOM 637 CB ASP A 40 5.637 -18.974 -8.715 1.00 42.31 C ATOM 638 CG ASP A 40 5.616 -18.853 -10.249 1.00 43.33 C ATOM 639 OD1 ASP A 40 6.129 -19.760 -10.939 1.00 64.13 O ATOM 640 OD2 ASP A 40 5.106 -17.840 -10.773 1.00 32.04 O ATOM 0 H ASP A 40 6.012 -18.853 -6.247 1.00 61.52 H new ATOM 0 HA ASP A 40 7.775 -19.198 -8.555 1.00 22.23 H new ATOM 0 HB2 ASP A 40 5.384 -19.997 -8.438 1.00 42.31 H new ATOM 0 HB3 ASP A 40 4.862 -18.330 -8.299 1.00 42.31 H new ATOM 645 N GLY A 41 7.713 -16.723 -9.513 1.00 34.12 N ATOM 646 CA GLY A 41 7.949 -15.311 -9.877 1.00 70.53 C ATOM 647 C GLY A 41 6.860 -14.366 -9.347 1.00 4.43 C ATOM 648 O GLY A 41 5.681 -14.738 -9.345 1.00 11.32 O ATOM 0 H GLY A 41 7.850 -17.376 -10.284 1.00 34.12 H new ATOM 0 HA2 GLY A 41 8.917 -14.997 -9.486 1.00 70.53 H new ATOM 0 HA3 GLY A 41 8.001 -15.225 -10.962 1.00 70.53 H new ATOM 652 N LEU A 42 7.281 -13.142 -8.970 1.00 4.11 N ATOM 653 CA LEU A 42 6.532 -12.229 -8.068 1.00 54.55 C ATOM 654 C LEU A 42 5.008 -12.168 -8.325 1.00 71.23 C ATOM 655 O LEU A 42 4.521 -11.482 -9.232 1.00 10.43 O ATOM 656 CB LEU A 42 7.123 -10.806 -8.166 1.00 41.43 C ATOM 657 CG LEU A 42 8.617 -10.654 -7.769 1.00 41.24 C ATOM 658 CD1 LEU A 42 9.103 -9.238 -8.082 1.00 71.34 C ATOM 659 CD2 LEU A 42 8.850 -11.015 -6.277 1.00 4.11 C ATOM 0 H LEU A 42 8.167 -12.748 -9.287 1.00 4.11 H new ATOM 0 HA LEU A 42 6.650 -12.644 -7.067 1.00 54.55 H new ATOM 0 HB2 LEU A 42 7.004 -10.456 -9.191 1.00 41.43 H new ATOM 0 HB3 LEU A 42 6.531 -10.145 -7.532 1.00 41.43 H new ATOM 0 HG LEU A 42 9.201 -11.358 -8.361 1.00 41.24 H new ATOM 0 HD11 LEU A 42 10.151 -9.142 -7.800 1.00 71.34 H new ATOM 0 HD12 LEU A 42 8.995 -9.044 -9.149 1.00 71.34 H new ATOM 0 HD13 LEU A 42 8.509 -8.517 -7.520 1.00 71.34 H new ATOM 0 HD21 LEU A 42 9.906 -10.897 -6.035 1.00 4.11 H new ATOM 0 HD22 LEU A 42 8.257 -10.353 -5.646 1.00 4.11 H new ATOM 0 HD23 LEU A 42 8.551 -12.048 -6.102 1.00 4.11 H new ATOM 671 N SER A 43 4.286 -12.956 -7.514 1.00 3.01 N ATOM 672 CA SER A 43 2.828 -12.983 -7.489 1.00 73.41 C ATOM 673 C SER A 43 2.301 -11.779 -6.691 1.00 1.21 C ATOM 674 O SER A 43 2.784 -11.498 -5.586 1.00 63.44 O ATOM 675 CB SER A 43 2.350 -14.307 -6.859 1.00 64.41 C ATOM 676 OG SER A 43 2.876 -15.423 -7.563 1.00 43.21 O ATOM 0 H SER A 43 4.713 -13.601 -6.849 1.00 3.01 H new ATOM 0 HA SER A 43 2.440 -12.919 -8.506 1.00 73.41 H new ATOM 0 HB2 SER A 43 2.661 -14.351 -5.815 1.00 64.41 H new ATOM 0 HB3 SER A 43 1.261 -14.346 -6.869 1.00 64.41 H new ATOM 0 HG SER A 43 2.561 -16.252 -7.145 1.00 43.21 H new ATOM 682 N TYR A 44 1.342 -11.063 -7.279 1.00 44.31 N ATOM 683 CA TYR A 44 0.702 -9.894 -6.655 1.00 53.20 C ATOM 684 C TYR A 44 -0.809 -10.098 -6.609 1.00 62.43 C ATOM 685 O TYR A 44 -1.377 -10.779 -7.472 1.00 70.35 O ATOM 686 CB TYR A 44 1.087 -8.586 -7.398 1.00 31.45 C ATOM 687 CG TYR A 44 2.580 -8.233 -7.253 1.00 61.25 C ATOM 688 CD1 TYR A 44 3.119 -7.944 -5.994 1.00 44.34 C ATOM 689 CD2 TYR A 44 3.449 -8.218 -8.350 1.00 14.21 C ATOM 690 CE1 TYR A 44 4.457 -7.648 -5.838 1.00 45.24 C ATOM 691 CE2 TYR A 44 4.791 -7.927 -8.194 1.00 34.13 C ATOM 692 CZ TYR A 44 5.289 -7.643 -6.937 1.00 44.53 C ATOM 693 OH TYR A 44 6.623 -7.359 -6.775 1.00 74.44 O ATOM 0 H TYR A 44 0.981 -11.276 -8.209 1.00 44.31 H new ATOM 0 HA TYR A 44 1.063 -9.793 -5.631 1.00 53.20 H new ATOM 0 HB2 TYR A 44 0.844 -8.690 -8.456 1.00 31.45 H new ATOM 0 HB3 TYR A 44 0.485 -7.764 -7.012 1.00 31.45 H new ATOM 0 HD1 TYR A 44 2.474 -7.953 -5.128 1.00 44.34 H new ATOM 0 HD2 TYR A 44 3.064 -8.438 -9.335 1.00 14.21 H new ATOM 0 HE1 TYR A 44 4.851 -7.421 -4.859 1.00 45.24 H new ATOM 0 HE2 TYR A 44 5.448 -7.922 -9.051 1.00 34.13 H new ATOM 0 HH TYR A 44 6.953 -6.877 -7.562 1.00 74.44 H new ATOM 703 N PHE A 45 -1.439 -9.486 -5.597 1.00 25.51 N ATOM 704 CA PHE A 45 -2.858 -9.697 -5.262 1.00 53.15 C ATOM 705 C PHE A 45 -3.761 -9.355 -6.458 1.00 4.42 C ATOM 706 O PHE A 45 -3.565 -8.324 -7.100 1.00 24.40 O ATOM 707 CB PHE A 45 -3.235 -8.848 -4.016 1.00 64.32 C ATOM 708 CG PHE A 45 -2.628 -9.325 -2.690 1.00 31.01 C ATOM 709 CD1 PHE A 45 -1.394 -9.992 -2.630 1.00 61.42 C ATOM 710 CD2 PHE A 45 -3.296 -9.089 -1.494 1.00 60.21 C ATOM 711 CE1 PHE A 45 -0.862 -10.403 -1.430 1.00 41.22 C ATOM 712 CE2 PHE A 45 -2.763 -9.502 -0.294 1.00 14.43 C ATOM 713 CZ PHE A 45 -1.545 -10.159 -0.262 1.00 5.52 C ATOM 0 H PHE A 45 -0.973 -8.822 -4.979 1.00 25.51 H new ATOM 0 HA PHE A 45 -3.012 -10.750 -5.027 1.00 53.15 H new ATOM 0 HB2 PHE A 45 -2.922 -7.818 -4.190 1.00 64.32 H new ATOM 0 HB3 PHE A 45 -4.321 -8.839 -3.918 1.00 64.32 H new ATOM 0 HD1 PHE A 45 -0.852 -10.186 -3.544 1.00 61.42 H new ATOM 0 HD2 PHE A 45 -4.246 -8.575 -1.506 1.00 60.21 H new ATOM 0 HE1 PHE A 45 0.088 -10.915 -1.405 1.00 41.22 H new ATOM 0 HE2 PHE A 45 -3.297 -9.313 0.626 1.00 14.43 H new ATOM 0 HZ PHE A 45 -1.131 -10.480 0.682 1.00 5.52 H new ATOM 723 N ASP A 46 -4.760 -10.208 -6.730 1.00 61.31 N ATOM 724 CA ASP A 46 -5.560 -10.138 -7.965 1.00 54.22 C ATOM 725 C ASP A 46 -6.622 -9.022 -7.840 1.00 52.11 C ATOM 726 O ASP A 46 -7.297 -8.947 -6.810 1.00 44.55 O ATOM 727 CB ASP A 46 -6.243 -11.512 -8.228 1.00 61.24 C ATOM 728 CG ASP A 46 -7.152 -11.515 -9.475 1.00 50.11 C ATOM 729 OD1 ASP A 46 -6.638 -11.699 -10.595 1.00 72.51 O ATOM 730 OD2 ASP A 46 -8.379 -11.324 -9.333 1.00 43.43 O ATOM 0 H ASP A 46 -5.036 -10.964 -6.103 1.00 61.31 H new ATOM 0 HA ASP A 46 -4.907 -9.905 -8.806 1.00 54.22 H new ATOM 0 HB2 ASP A 46 -5.474 -12.275 -8.346 1.00 61.24 H new ATOM 0 HB3 ASP A 46 -6.835 -11.788 -7.355 1.00 61.24 H new ATOM 735 N PRO A 47 -6.770 -8.135 -8.873 1.00 30.44 N ATOM 736 CA PRO A 47 -7.788 -7.059 -8.859 1.00 33.12 C ATOM 737 C PRO A 47 -9.249 -7.591 -8.934 1.00 33.03 C ATOM 738 O PRO A 47 -9.703 -8.067 -9.984 1.00 32.21 O ATOM 739 CB PRO A 47 -7.423 -6.219 -10.112 1.00 53.54 C ATOM 740 CG PRO A 47 -6.710 -7.172 -11.026 1.00 22.23 C ATOM 741 CD PRO A 47 -5.937 -8.088 -10.114 1.00 3.23 C ATOM 0 HA PRO A 47 -7.771 -6.492 -7.928 1.00 33.12 H new ATOM 0 HB2 PRO A 47 -8.315 -5.810 -10.586 1.00 53.54 H new ATOM 0 HB3 PRO A 47 -6.787 -5.374 -9.849 1.00 53.54 H new ATOM 0 HG2 PRO A 47 -7.416 -7.731 -11.640 1.00 22.23 H new ATOM 0 HG3 PRO A 47 -6.045 -6.641 -11.707 1.00 22.23 H new ATOM 0 HD2 PRO A 47 -5.814 -9.079 -10.552 1.00 3.23 H new ATOM 0 HD3 PRO A 47 -4.938 -7.702 -9.912 1.00 3.23 H new ATOM 749 N ASP A 48 -9.959 -7.516 -7.798 1.00 3.42 N ATOM 750 CA ASP A 48 -11.427 -7.687 -7.733 1.00 21.01 C ATOM 751 C ASP A 48 -12.059 -6.322 -7.371 1.00 1.44 C ATOM 752 O ASP A 48 -12.046 -5.920 -6.205 1.00 64.43 O ATOM 753 CB ASP A 48 -11.863 -8.802 -6.722 1.00 12.51 C ATOM 754 CG ASP A 48 -12.007 -10.190 -7.383 1.00 25.24 C ATOM 755 OD1 ASP A 48 -12.959 -10.386 -8.161 1.00 2.43 O ATOM 756 OD2 ASP A 48 -11.178 -11.078 -7.156 1.00 60.04 O ATOM 0 H ASP A 48 -9.532 -7.334 -6.890 1.00 3.42 H new ATOM 0 HA ASP A 48 -11.784 -8.021 -8.707 1.00 21.01 H new ATOM 0 HB2 ASP A 48 -11.130 -8.863 -5.918 1.00 12.51 H new ATOM 0 HB3 ASP A 48 -12.813 -8.522 -6.267 1.00 12.51 H new ATOM 761 N PRO A 49 -12.611 -5.575 -8.391 1.00 32.33 N ATOM 762 CA PRO A 49 -13.251 -4.243 -8.185 1.00 33.24 C ATOM 763 C PRO A 49 -14.527 -4.293 -7.307 1.00 25.24 C ATOM 764 O PRO A 49 -15.088 -3.244 -6.963 1.00 65.03 O ATOM 765 CB PRO A 49 -13.564 -3.778 -9.629 1.00 24.54 C ATOM 766 CG PRO A 49 -13.646 -5.035 -10.436 1.00 31.54 C ATOM 767 CD PRO A 49 -12.634 -5.969 -9.830 1.00 74.24 C ATOM 0 HA PRO A 49 -12.601 -3.562 -7.636 1.00 33.24 H new ATOM 0 HB2 PRO A 49 -14.501 -3.222 -9.669 1.00 24.54 H new ATOM 0 HB3 PRO A 49 -12.784 -3.117 -10.008 1.00 24.54 H new ATOM 0 HG2 PRO A 49 -14.648 -5.462 -10.396 1.00 31.54 H new ATOM 0 HG3 PRO A 49 -13.423 -4.843 -11.486 1.00 31.54 H new ATOM 0 HD2 PRO A 49 -12.925 -7.012 -9.956 1.00 74.24 H new ATOM 0 HD3 PRO A 49 -11.654 -5.854 -10.293 1.00 74.24 H new ATOM 775 N ASP A 50 -15.000 -5.516 -7.007 1.00 14.34 N ATOM 776 CA ASP A 50 -16.113 -5.765 -6.070 1.00 41.45 C ATOM 777 C ASP A 50 -15.858 -5.115 -4.693 1.00 75.02 C ATOM 778 O ASP A 50 -16.737 -4.437 -4.150 1.00 51.35 O ATOM 779 CB ASP A 50 -16.336 -7.293 -5.910 1.00 12.02 C ATOM 780 CG ASP A 50 -17.558 -7.640 -5.042 1.00 25.42 C ATOM 781 OD1 ASP A 50 -18.692 -7.605 -5.569 1.00 71.14 O ATOM 782 OD2 ASP A 50 -17.390 -7.927 -3.835 1.00 44.23 O ATOM 0 H ASP A 50 -14.616 -6.370 -7.412 1.00 14.34 H new ATOM 0 HA ASP A 50 -17.011 -5.308 -6.487 1.00 41.45 H new ATOM 0 HB2 ASP A 50 -16.460 -7.741 -6.896 1.00 12.02 H new ATOM 0 HB3 ASP A 50 -15.446 -7.739 -5.467 1.00 12.02 H new ATOM 787 N TYR A 51 -14.623 -5.272 -4.171 1.00 44.31 N ATOM 788 CA TYR A 51 -14.255 -4.831 -2.799 1.00 14.14 C ATOM 789 C TYR A 51 -13.680 -3.384 -2.831 1.00 71.42 C ATOM 790 O TYR A 51 -13.022 -2.933 -1.892 1.00 70.34 O ATOM 791 CB TYR A 51 -13.228 -5.845 -2.177 1.00 34.45 C ATOM 792 CG TYR A 51 -13.300 -5.973 -0.631 1.00 41.43 C ATOM 793 CD1 TYR A 51 -12.730 -5.025 0.221 1.00 43.41 C ATOM 794 CD2 TYR A 51 -13.970 -7.040 -0.031 1.00 3.42 C ATOM 795 CE1 TYR A 51 -12.819 -5.137 1.597 1.00 30.03 C ATOM 796 CE2 TYR A 51 -14.062 -7.151 1.342 1.00 73.11 C ATOM 797 CZ TYR A 51 -13.484 -6.198 2.153 1.00 32.31 C ATOM 798 OH TYR A 51 -13.573 -6.304 3.527 1.00 14.12 O ATOM 0 H TYR A 51 -13.853 -5.705 -4.681 1.00 44.31 H new ATOM 0 HA TYR A 51 -15.145 -4.817 -2.171 1.00 14.14 H new ATOM 0 HB2 TYR A 51 -13.396 -6.828 -2.618 1.00 34.45 H new ATOM 0 HB3 TYR A 51 -12.220 -5.538 -2.456 1.00 34.45 H new ATOM 0 HD1 TYR A 51 -12.206 -4.182 -0.205 1.00 43.41 H new ATOM 0 HD2 TYR A 51 -14.426 -7.795 -0.654 1.00 3.42 H new ATOM 0 HE1 TYR A 51 -12.365 -4.390 2.231 1.00 30.03 H new ATOM 0 HE2 TYR A 51 -14.588 -7.986 1.781 1.00 73.11 H new ATOM 0 HH TYR A 51 -14.077 -7.111 3.761 1.00 14.12 H new ATOM 808 N ARG A 52 -13.958 -2.653 -3.917 1.00 22.11 N ATOM 809 CA ARG A 52 -13.420 -1.306 -4.142 1.00 1.04 C ATOM 810 C ARG A 52 -14.342 -0.244 -3.531 1.00 23.13 C ATOM 811 O ARG A 52 -15.555 -0.251 -3.773 1.00 12.43 O ATOM 812 CB ARG A 52 -13.239 -1.086 -5.655 1.00 42.52 C ATOM 813 CG ARG A 52 -12.567 0.242 -6.061 1.00 64.12 C ATOM 814 CD ARG A 52 -12.254 0.276 -7.562 1.00 62.24 C ATOM 815 NE ARG A 52 -13.460 0.037 -8.355 1.00 43.52 N ATOM 816 CZ ARG A 52 -13.489 -0.325 -9.624 1.00 71.13 C ATOM 817 NH1 ARG A 52 -12.364 -0.492 -10.327 1.00 53.31 N ATOM 818 NH2 ARG A 52 -14.658 -0.562 -10.189 1.00 5.33 N ATOM 0 H ARG A 52 -14.565 -2.981 -4.668 1.00 22.11 H new ATOM 0 HA ARG A 52 -12.451 -1.212 -3.651 1.00 1.04 H new ATOM 0 HB2 ARG A 52 -12.647 -1.909 -6.055 1.00 42.52 H new ATOM 0 HB3 ARG A 52 -14.218 -1.137 -6.131 1.00 42.52 H new ATOM 0 HG2 ARG A 52 -13.221 1.075 -5.805 1.00 64.12 H new ATOM 0 HG3 ARG A 52 -11.646 0.374 -5.493 1.00 64.12 H new ATOM 0 HD2 ARG A 52 -11.827 1.243 -7.826 1.00 62.24 H new ATOM 0 HD3 ARG A 52 -11.504 -0.479 -7.798 1.00 62.24 H new ATOM 0 HE ARG A 52 -14.357 0.161 -7.886 1.00 43.52 H new ATOM 0 HH11 ARG A 52 -11.458 -0.339 -9.884 1.00 53.31 H new ATOM 0 HH12 ARG A 52 -12.412 -0.772 -11.307 1.00 53.31 H new ATOM 0 HH21 ARG A 52 -15.516 -0.464 -9.646 1.00 5.33 H new ATOM 0 HH22 ARG A 52 -14.703 -0.843 -11.169 1.00 5.33 H new ATOM 832 N VAL A 53 -13.751 0.667 -2.746 1.00 64.12 N ATOM 833 CA VAL A 53 -14.464 1.776 -2.083 1.00 31.21 C ATOM 834 C VAL A 53 -13.895 3.117 -2.582 1.00 11.14 C ATOM 835 O VAL A 53 -12.905 3.147 -3.333 1.00 23.00 O ATOM 836 CB VAL A 53 -14.348 1.690 -0.502 1.00 24.42 C ATOM 837 CG1 VAL A 53 -14.797 0.308 0.024 1.00 54.44 C ATOM 838 CG2 VAL A 53 -12.923 2.031 0.004 1.00 44.34 C ATOM 0 H VAL A 53 -12.750 0.657 -2.549 1.00 64.12 H new ATOM 0 HA VAL A 53 -15.521 1.702 -2.337 1.00 31.21 H new ATOM 0 HB VAL A 53 -15.024 2.445 -0.101 1.00 24.42 H new ATOM 0 HG11 VAL A 53 -14.705 0.284 1.110 1.00 54.44 H new ATOM 0 HG12 VAL A 53 -15.836 0.132 -0.256 1.00 54.44 H new ATOM 0 HG13 VAL A 53 -14.168 -0.469 -0.411 1.00 54.44 H new ATOM 0 HG21 VAL A 53 -12.896 1.958 1.091 1.00 44.34 H new ATOM 0 HG22 VAL A 53 -12.207 1.330 -0.425 1.00 44.34 H new ATOM 0 HG23 VAL A 53 -12.663 3.045 -0.298 1.00 44.34 H new ATOM 848 N GLU A 54 -14.526 4.219 -2.163 1.00 43.00 N ATOM 849 CA GLU A 54 -14.007 5.586 -2.370 1.00 32.44 C ATOM 850 C GLU A 54 -13.737 6.215 -0.993 1.00 43.34 C ATOM 851 O GLU A 54 -14.365 5.829 -0.002 1.00 75.20 O ATOM 852 CB GLU A 54 -15.003 6.451 -3.194 1.00 51.22 C ATOM 853 CG GLU A 54 -16.354 6.738 -2.506 1.00 51.12 C ATOM 854 CD GLU A 54 -17.225 7.745 -3.274 1.00 21.41 C ATOM 855 OE1 GLU A 54 -18.008 7.332 -4.151 1.00 42.52 O ATOM 856 OE2 GLU A 54 -17.119 8.961 -3.017 1.00 51.32 O ATOM 0 H GLU A 54 -15.417 4.193 -1.667 1.00 43.00 H new ATOM 0 HA GLU A 54 -13.081 5.541 -2.944 1.00 32.44 H new ATOM 0 HB2 GLU A 54 -14.525 7.402 -3.429 1.00 51.22 H new ATOM 0 HB3 GLU A 54 -15.196 5.949 -4.142 1.00 51.22 H new ATOM 0 HG2 GLU A 54 -16.903 5.803 -2.395 1.00 51.12 H new ATOM 0 HG3 GLU A 54 -16.169 7.120 -1.502 1.00 51.12 H new ATOM 863 N ALA A 55 -12.801 7.174 -0.936 1.00 0.10 N ATOM 864 CA ALA A 55 -12.392 7.833 0.322 1.00 61.33 C ATOM 865 C ALA A 55 -12.055 9.307 0.084 1.00 3.31 C ATOM 866 O ALA A 55 -11.646 9.682 -1.013 1.00 72.11 O ATOM 867 CB ALA A 55 -11.187 7.101 0.928 1.00 21.40 C ATOM 0 H ALA A 55 -12.304 7.517 -1.758 1.00 0.10 H new ATOM 0 HA ALA A 55 -13.226 7.787 1.022 1.00 61.33 H new ATOM 0 HB1 ALA A 55 -10.891 7.592 1.855 1.00 21.40 H new ATOM 0 HB2 ALA A 55 -11.457 6.066 1.136 1.00 21.40 H new ATOM 0 HB3 ALA A 55 -10.355 7.124 0.224 1.00 21.40 H new ATOM 873 N THR A 56 -12.242 10.133 1.127 1.00 24.31 N ATOM 874 CA THR A 56 -11.890 11.556 1.103 1.00 20.22 C ATOM 875 C THR A 56 -10.565 11.772 1.872 1.00 3.24 C ATOM 876 O THR A 56 -10.387 11.261 2.982 1.00 52.22 O ATOM 877 CB THR A 56 -13.038 12.423 1.720 1.00 72.22 C ATOM 878 OG1 THR A 56 -14.294 12.038 1.142 1.00 11.55 O ATOM 879 CG2 THR A 56 -12.817 13.931 1.485 1.00 71.23 C ATOM 0 H THR A 56 -12.644 9.827 2.013 1.00 24.31 H new ATOM 0 HA THR A 56 -11.757 11.872 0.068 1.00 20.22 H new ATOM 0 HB THR A 56 -13.040 12.247 2.796 1.00 72.22 H new ATOM 0 HG1 THR A 56 -15.012 12.580 1.530 1.00 11.55 H new ATOM 0 HG21 THR A 56 -13.638 14.493 1.930 1.00 71.23 H new ATOM 0 HG22 THR A 56 -11.877 14.237 1.944 1.00 71.23 H new ATOM 0 HG23 THR A 56 -12.780 14.131 0.414 1.00 71.23 H new ATOM 887 N VAL A 57 -9.655 12.529 1.253 1.00 34.25 N ATOM 888 CA VAL A 57 -8.290 12.770 1.735 1.00 31.13 C ATOM 889 C VAL A 57 -8.290 13.787 2.897 1.00 34.12 C ATOM 890 O VAL A 57 -8.718 14.933 2.725 1.00 44.01 O ATOM 891 CB VAL A 57 -7.391 13.295 0.553 1.00 34.43 C ATOM 892 CG1 VAL A 57 -5.918 13.455 0.979 1.00 31.34 C ATOM 893 CG2 VAL A 57 -7.509 12.377 -0.686 1.00 13.21 C ATOM 0 H VAL A 57 -9.853 13.007 0.374 1.00 34.25 H new ATOM 0 HA VAL A 57 -7.882 11.830 2.106 1.00 31.13 H new ATOM 0 HB VAL A 57 -7.761 14.284 0.282 1.00 34.43 H new ATOM 0 HG11 VAL A 57 -5.333 13.819 0.135 1.00 31.34 H new ATOM 0 HG12 VAL A 57 -5.852 14.168 1.801 1.00 31.34 H new ATOM 0 HG13 VAL A 57 -5.526 12.491 1.303 1.00 31.34 H new ATOM 0 HG21 VAL A 57 -6.878 12.763 -1.486 1.00 13.21 H new ATOM 0 HG22 VAL A 57 -7.187 11.369 -0.424 1.00 13.21 H new ATOM 0 HG23 VAL A 57 -8.546 12.351 -1.022 1.00 13.21 H new ATOM 903 N THR A 58 -7.797 13.348 4.067 1.00 20.54 N ATOM 904 CA THR A 58 -7.703 14.170 5.283 1.00 74.13 C ATOM 905 C THR A 58 -6.220 14.507 5.520 1.00 11.10 C ATOM 906 O THR A 58 -5.479 13.703 6.106 1.00 25.45 O ATOM 907 CB THR A 58 -8.286 13.411 6.530 1.00 43.04 C ATOM 908 OG1 THR A 58 -9.565 12.842 6.212 1.00 1.42 O ATOM 909 CG2 THR A 58 -8.418 14.320 7.762 1.00 24.03 C ATOM 0 H THR A 58 -7.448 12.398 4.196 1.00 20.54 H new ATOM 0 HA THR A 58 -8.288 15.080 5.150 1.00 74.13 H new ATOM 0 HB THR A 58 -7.579 12.620 6.779 1.00 43.04 H new ATOM 0 HG1 THR A 58 -10.081 12.716 7.036 1.00 1.42 H new ATOM 0 HG21 THR A 58 -8.825 13.747 8.595 1.00 24.03 H new ATOM 0 HG22 THR A 58 -7.437 14.709 8.034 1.00 24.03 H new ATOM 0 HG23 THR A 58 -9.086 15.150 7.532 1.00 24.03 H new ATOM 917 N VAL A 59 -5.778 15.680 5.048 1.00 11.54 N ATOM 918 CA VAL A 59 -4.354 16.057 5.092 1.00 34.41 C ATOM 919 C VAL A 59 -4.042 16.743 6.421 1.00 3.52 C ATOM 920 O VAL A 59 -4.733 17.683 6.829 1.00 51.33 O ATOM 921 CB VAL A 59 -3.928 16.953 3.867 1.00 35.04 C ATOM 922 CG1 VAL A 59 -2.550 17.641 4.073 1.00 65.11 C ATOM 923 CG2 VAL A 59 -3.917 16.096 2.582 1.00 52.12 C ATOM 0 H VAL A 59 -6.384 16.386 4.631 1.00 11.54 H new ATOM 0 HA VAL A 59 -3.764 15.144 5.017 1.00 34.41 H new ATOM 0 HB VAL A 59 -4.662 17.754 3.776 1.00 35.04 H new ATOM 0 HG11 VAL A 59 -2.310 18.244 3.197 1.00 65.11 H new ATOM 0 HG12 VAL A 59 -2.591 18.281 4.954 1.00 65.11 H new ATOM 0 HG13 VAL A 59 -1.781 16.881 4.212 1.00 65.11 H new ATOM 0 HG21 VAL A 59 -3.623 16.715 1.734 1.00 52.12 H new ATOM 0 HG22 VAL A 59 -3.207 15.277 2.697 1.00 52.12 H new ATOM 0 HG23 VAL A 59 -4.913 15.691 2.406 1.00 52.12 H new ATOM 933 N HIS A 60 -2.999 16.235 7.087 1.00 31.25 N ATOM 934 CA HIS A 60 -2.560 16.725 8.387 1.00 42.30 C ATOM 935 C HIS A 60 -1.601 17.903 8.210 1.00 24.30 C ATOM 936 O HIS A 60 -0.529 17.754 7.607 1.00 11.25 O ATOM 937 CB HIS A 60 -1.926 15.570 9.196 1.00 42.04 C ATOM 938 CG HIS A 60 -2.953 14.573 9.658 1.00 23.14 C ATOM 939 ND1 HIS A 60 -3.493 14.352 10.878 1.00 24.42 N flip ATOM 940 CD2 HIS A 60 -3.626 13.738 8.791 1.00 63.13 C flip ATOM 941 CE1 HIS A 60 -4.467 13.409 10.720 1.00 70.43 C flip ATOM 942 NE2 HIS A 60 -4.530 13.062 9.460 1.00 35.31 N flip ATOM 0 H HIS A 60 -2.434 15.464 6.730 1.00 31.25 H new ATOM 0 HA HIS A 60 -3.418 17.090 8.952 1.00 42.30 H new ATOM 0 HB2 HIS A 60 -1.181 15.064 8.582 1.00 42.04 H new ATOM 0 HB3 HIS A 60 -1.403 15.978 10.061 1.00 42.04 H new ATOM 0 HD2 HIS A 60 -3.439 13.654 7.731 1.00 63.13 H new ATOM 0 HE1 HIS A 60 -5.087 13.012 11.510 1.00 70.43 H new ATOM 0 HE2 HIS A 60 -5.175 12.379 9.063 1.00 35.31 H new ATOM 951 N GLU A 61 -2.036 19.075 8.724 1.00 72.41 N ATOM 952 CA GLU A 61 -1.267 20.335 8.721 1.00 40.12 C ATOM 953 C GLU A 61 0.123 20.157 9.376 1.00 11.30 C ATOM 954 O GLU A 61 1.082 20.849 9.022 1.00 64.22 O ATOM 955 CB GLU A 61 -2.087 21.423 9.465 1.00 34.54 C ATOM 956 CG GLU A 61 -2.439 21.058 10.923 1.00 40.44 C ATOM 957 CD GLU A 61 -3.330 22.099 11.611 1.00 61.35 C ATOM 958 OE1 GLU A 61 -2.799 23.102 12.125 1.00 71.42 O ATOM 959 OE2 GLU A 61 -4.568 21.937 11.614 1.00 74.54 O ATOM 0 H GLU A 61 -2.952 19.171 9.162 1.00 72.41 H new ATOM 0 HA GLU A 61 -1.095 20.640 7.689 1.00 40.12 H new ATOM 0 HB2 GLU A 61 -1.522 22.355 9.461 1.00 34.54 H new ATOM 0 HB3 GLU A 61 -3.010 21.607 8.915 1.00 34.54 H new ATOM 0 HG2 GLU A 61 -2.944 20.092 10.937 1.00 40.44 H new ATOM 0 HG3 GLU A 61 -1.518 20.944 11.494 1.00 40.44 H new ATOM 966 N THR A 62 0.204 19.219 10.339 1.00 20.33 N ATOM 967 CA THR A 62 1.444 18.847 11.025 1.00 11.32 C ATOM 968 C THR A 62 1.742 17.344 10.782 1.00 25.35 C ATOM 969 O THR A 62 1.298 16.491 11.563 1.00 3.44 O ATOM 970 CB THR A 62 1.336 19.176 12.560 1.00 34.04 C ATOM 971 OG1 THR A 62 0.151 18.579 13.118 1.00 44.34 O ATOM 972 CG2 THR A 62 1.291 20.694 12.818 1.00 3.14 C ATOM 0 H THR A 62 -0.607 18.693 10.663 1.00 20.33 H new ATOM 0 HA THR A 62 2.274 19.428 10.622 1.00 11.32 H new ATOM 0 HB THR A 62 2.226 18.765 13.037 1.00 34.04 H new ATOM 0 HG1 THR A 62 0.060 17.661 12.786 1.00 44.34 H new ATOM 0 HG21 THR A 62 1.216 20.879 13.890 1.00 3.14 H new ATOM 0 HG22 THR A 62 2.200 21.156 12.433 1.00 3.14 H new ATOM 0 HG23 THR A 62 0.425 21.123 12.315 1.00 3.14 H new ATOM 980 N PRO A 63 2.449 16.991 9.650 1.00 25.34 N ATOM 981 CA PRO A 63 2.788 15.584 9.327 1.00 71.10 C ATOM 982 C PRO A 63 3.800 14.983 10.327 1.00 31.34 C ATOM 983 O PRO A 63 4.897 15.525 10.518 1.00 13.11 O ATOM 984 CB PRO A 63 3.391 15.673 7.893 1.00 64.14 C ATOM 985 CG PRO A 63 3.904 17.079 7.778 1.00 60.11 C ATOM 986 CD PRO A 63 2.948 17.927 8.598 1.00 25.43 C ATOM 0 HA PRO A 63 1.921 14.926 9.386 1.00 71.10 H new ATOM 0 HB2 PRO A 63 4.193 14.947 7.755 1.00 64.14 H new ATOM 0 HB3 PRO A 63 2.638 15.464 7.134 1.00 64.14 H new ATOM 0 HG2 PRO A 63 4.923 17.157 8.158 1.00 60.11 H new ATOM 0 HG3 PRO A 63 3.925 17.405 6.738 1.00 60.11 H new ATOM 0 HD2 PRO A 63 3.453 18.788 9.036 1.00 25.43 H new ATOM 0 HD3 PRO A 63 2.132 18.313 7.987 1.00 25.43 H new ATOM 994 N GLU A 64 3.424 13.858 10.959 1.00 44.22 N ATOM 995 CA GLU A 64 4.290 13.165 11.929 1.00 23.11 C ATOM 996 C GLU A 64 5.279 12.234 11.205 1.00 61.23 C ATOM 997 O GLU A 64 5.075 11.856 10.045 1.00 53.23 O ATOM 998 CB GLU A 64 3.449 12.370 12.966 1.00 33.25 C ATOM 999 CG GLU A 64 2.571 11.255 12.361 1.00 10.00 C ATOM 1000 CD GLU A 64 1.897 10.360 13.410 1.00 64.23 C ATOM 1001 OE1 GLU A 64 0.972 10.833 14.103 1.00 10.01 O ATOM 1002 OE2 GLU A 64 2.288 9.180 13.557 1.00 22.03 O ATOM 0 H GLU A 64 2.521 13.407 10.814 1.00 44.22 H new ATOM 0 HA GLU A 64 4.859 13.921 12.469 1.00 23.11 H new ATOM 0 HB2 GLU A 64 4.124 11.926 13.698 1.00 33.25 H new ATOM 0 HB3 GLU A 64 2.808 13.067 13.505 1.00 33.25 H new ATOM 0 HG2 GLU A 64 1.802 11.710 11.737 1.00 10.00 H new ATOM 0 HG3 GLU A 64 3.186 10.635 11.709 1.00 10.00 H new ATOM 1009 N SER A 65 6.345 11.867 11.919 1.00 4.41 N ATOM 1010 CA SER A 65 7.400 10.989 11.413 1.00 3.32 C ATOM 1011 C SER A 65 7.064 9.523 11.751 1.00 73.42 C ATOM 1012 O SER A 65 7.084 9.124 12.921 1.00 13.53 O ATOM 1013 CB SER A 65 8.736 11.424 12.039 1.00 55.33 C ATOM 1014 OG SER A 65 9.024 12.773 11.708 1.00 54.24 O ATOM 0 H SER A 65 6.501 12.176 12.878 1.00 4.41 H new ATOM 0 HA SER A 65 7.479 11.065 10.328 1.00 3.32 H new ATOM 0 HB2 SER A 65 8.691 11.311 13.122 1.00 55.33 H new ATOM 0 HB3 SER A 65 9.538 10.777 11.684 1.00 55.33 H new ATOM 0 HG SER A 65 9.876 13.035 12.115 1.00 54.24 H new ATOM 1020 N VAL A 66 6.728 8.747 10.705 1.00 44.22 N ATOM 1021 CA VAL A 66 6.315 7.334 10.814 1.00 54.24 C ATOM 1022 C VAL A 66 7.381 6.431 10.167 1.00 1.45 C ATOM 1023 O VAL A 66 7.644 6.549 8.965 1.00 75.11 O ATOM 1024 CB VAL A 66 4.919 7.099 10.118 1.00 2.25 C ATOM 1025 CG1 VAL A 66 4.398 5.655 10.343 1.00 15.31 C ATOM 1026 CG2 VAL A 66 3.886 8.148 10.598 1.00 54.14 C ATOM 0 H VAL A 66 6.736 9.089 9.744 1.00 44.22 H new ATOM 0 HA VAL A 66 6.217 7.084 11.870 1.00 54.24 H new ATOM 0 HB VAL A 66 5.060 7.224 9.044 1.00 2.25 H new ATOM 0 HG11 VAL A 66 3.435 5.535 9.848 1.00 15.31 H new ATOM 0 HG12 VAL A 66 5.111 4.942 9.928 1.00 15.31 H new ATOM 0 HG13 VAL A 66 4.282 5.472 11.411 1.00 15.31 H new ATOM 0 HG21 VAL A 66 2.930 7.969 10.106 1.00 54.14 H new ATOM 0 HG22 VAL A 66 3.760 8.067 11.678 1.00 54.14 H new ATOM 0 HG23 VAL A 66 4.240 9.148 10.348 1.00 54.14 H new ATOM 1036 N ASP A 67 7.976 5.534 10.967 1.00 15.14 N ATOM 1037 CA ASP A 67 9.022 4.606 10.501 1.00 10.25 C ATOM 1038 C ASP A 67 8.385 3.452 9.721 1.00 13.14 C ATOM 1039 O ASP A 67 7.684 2.610 10.303 1.00 74.22 O ATOM 1040 CB ASP A 67 9.844 4.055 11.696 1.00 33.13 C ATOM 1041 CG ASP A 67 10.621 5.152 12.435 1.00 12.22 C ATOM 1042 OD1 ASP A 67 10.062 5.767 13.368 1.00 63.11 O ATOM 1043 OD2 ASP A 67 11.786 5.419 12.080 1.00 62.24 O ATOM 0 H ASP A 67 7.747 5.430 11.956 1.00 15.14 H new ATOM 0 HA ASP A 67 9.700 5.151 9.844 1.00 10.25 H new ATOM 0 HB2 ASP A 67 9.172 3.557 12.395 1.00 33.13 H new ATOM 0 HB3 ASP A 67 10.543 3.301 11.334 1.00 33.13 H new ATOM 1048 N LEU A 68 8.603 3.437 8.397 1.00 22.32 N ATOM 1049 CA LEU A 68 8.119 2.365 7.513 1.00 33.22 C ATOM 1050 C LEU A 68 9.306 1.766 6.747 1.00 2.31 C ATOM 1051 O LEU A 68 10.399 2.357 6.703 1.00 62.34 O ATOM 1052 CB LEU A 68 7.041 2.876 6.517 1.00 63.12 C ATOM 1053 CG LEU A 68 5.790 3.588 7.125 1.00 63.10 C ATOM 1054 CD1 LEU A 68 4.847 4.070 6.013 1.00 4.14 C ATOM 1055 CD2 LEU A 68 5.037 2.685 8.124 1.00 53.12 C ATOM 0 H LEU A 68 9.120 4.168 7.909 1.00 22.32 H new ATOM 0 HA LEU A 68 7.650 1.600 8.132 1.00 33.22 H new ATOM 0 HB2 LEU A 68 7.521 3.568 5.825 1.00 63.12 H new ATOM 0 HB3 LEU A 68 6.694 2.026 5.929 1.00 63.12 H new ATOM 0 HG LEU A 68 6.149 4.455 7.680 1.00 63.10 H new ATOM 0 HD11 LEU A 68 3.982 4.563 6.457 1.00 4.14 H new ATOM 0 HD12 LEU A 68 5.374 4.773 5.368 1.00 4.14 H new ATOM 0 HD13 LEU A 68 4.514 3.216 5.423 1.00 4.14 H new ATOM 0 HD21 LEU A 68 4.175 3.221 8.521 1.00 53.12 H new ATOM 0 HD22 LEU A 68 4.700 1.782 7.615 1.00 53.12 H new ATOM 0 HD23 LEU A 68 5.704 2.413 8.942 1.00 53.12 H new ATOM 1067 N GLU A 69 9.067 0.602 6.130 1.00 52.25 N ATOM 1068 CA GLU A 69 10.073 -0.124 5.348 1.00 12.31 C ATOM 1069 C GLU A 69 10.332 0.581 3.995 1.00 30.34 C ATOM 1070 O GLU A 69 9.434 1.226 3.430 1.00 41.24 O ATOM 1071 CB GLU A 69 9.597 -1.587 5.107 1.00 73.42 C ATOM 1072 CG GLU A 69 8.297 -1.704 4.272 1.00 43.54 C ATOM 1073 CD GLU A 69 7.771 -3.142 4.127 1.00 63.21 C ATOM 1074 OE1 GLU A 69 8.547 -4.023 3.727 1.00 25.34 O ATOM 1075 OE2 GLU A 69 6.578 -3.398 4.414 1.00 14.30 O ATOM 0 H GLU A 69 8.161 0.134 6.160 1.00 52.25 H new ATOM 0 HA GLU A 69 11.007 -0.137 5.910 1.00 12.31 H new ATOM 0 HB2 GLU A 69 10.391 -2.136 4.601 1.00 73.42 H new ATOM 0 HB3 GLU A 69 9.440 -2.069 6.072 1.00 73.42 H new ATOM 0 HG2 GLU A 69 7.524 -1.091 4.735 1.00 43.54 H new ATOM 0 HG3 GLU A 69 8.478 -1.293 3.279 1.00 43.54 H new ATOM 1082 N THR A 70 11.575 0.483 3.519 1.00 3.22 N ATOM 1083 CA THR A 70 11.946 0.831 2.140 1.00 2.01 C ATOM 1084 C THR A 70 12.551 -0.408 1.466 1.00 73.14 C ATOM 1085 O THR A 70 12.664 -1.471 2.083 1.00 73.34 O ATOM 1086 CB THR A 70 12.934 2.053 2.100 1.00 34.04 C ATOM 1087 OG1 THR A 70 13.201 2.461 0.743 1.00 14.24 O ATOM 1088 CG2 THR A 70 14.264 1.762 2.816 1.00 4.22 C ATOM 0 H THR A 70 12.361 0.158 4.082 1.00 3.22 H new ATOM 0 HA THR A 70 11.055 1.139 1.592 1.00 2.01 H new ATOM 0 HB THR A 70 12.435 2.862 2.633 1.00 34.04 H new ATOM 0 HG1 THR A 70 12.371 2.428 0.222 1.00 14.24 H new ATOM 0 HG21 THR A 70 14.908 2.639 2.758 1.00 4.22 H new ATOM 0 HG22 THR A 70 14.070 1.523 3.862 1.00 4.22 H new ATOM 0 HG23 THR A 70 14.758 0.917 2.337 1.00 4.22 H new ATOM 1096 N SER A 71 12.931 -0.267 0.201 1.00 44.45 N ATOM 1097 CA SER A 71 13.481 -1.354 -0.619 1.00 33.31 C ATOM 1098 C SER A 71 15.020 -1.316 -0.638 1.00 3.02 C ATOM 1099 O SER A 71 15.666 -2.137 -1.292 1.00 1.54 O ATOM 1100 CB SER A 71 12.915 -1.185 -2.033 1.00 51.54 C ATOM 1101 OG SER A 71 11.521 -0.926 -1.981 1.00 2.11 O ATOM 0 H SER A 71 12.866 0.620 -0.298 1.00 44.45 H new ATOM 0 HA SER A 71 13.198 -2.321 -0.203 1.00 33.31 H new ATOM 0 HB2 SER A 71 13.425 -0.366 -2.540 1.00 51.54 H new ATOM 0 HB3 SER A 71 13.102 -2.086 -2.616 1.00 51.54 H new ATOM 0 HG SER A 71 11.028 -1.767 -2.084 1.00 2.11 H new ATOM 1107 N ASP A 72 15.590 -0.429 0.184 1.00 43.34 N ATOM 1108 CA ASP A 72 17.002 -0.009 0.090 1.00 55.23 C ATOM 1109 C ASP A 72 17.824 -0.685 1.199 1.00 24.01 C ATOM 1110 O ASP A 72 18.790 -0.104 1.704 1.00 63.33 O ATOM 1111 CB ASP A 72 17.085 1.551 0.173 1.00 43.43 C ATOM 1112 CG ASP A 72 16.494 2.294 -1.044 1.00 53.11 C ATOM 1113 OD1 ASP A 72 15.529 1.801 -1.665 1.00 3.22 O ATOM 1114 OD2 ASP A 72 16.999 3.387 -1.391 1.00 14.31 O ATOM 0 H ASP A 72 15.083 0.026 0.943 1.00 43.34 H new ATOM 0 HA ASP A 72 17.423 -0.320 -0.866 1.00 55.23 H new ATOM 0 HB2 ASP A 72 16.564 1.882 1.071 1.00 43.43 H new ATOM 0 HB3 ASP A 72 18.130 1.840 0.286 1.00 43.43 H new ATOM 1119 N ASP A 73 17.426 -1.945 1.538 1.00 71.31 N ATOM 1120 CA ASP A 73 18.004 -2.783 2.643 1.00 24.32 C ATOM 1121 C ASP A 73 18.145 -1.984 3.957 1.00 31.14 C ATOM 1122 O ASP A 73 19.028 -2.236 4.780 1.00 55.03 O ATOM 1123 CB ASP A 73 19.329 -3.522 2.221 1.00 43.01 C ATOM 1124 CG ASP A 73 20.566 -2.626 1.980 1.00 12.42 C ATOM 1125 OD1 ASP A 73 20.760 -2.144 0.838 1.00 50.10 O ATOM 1126 OD2 ASP A 73 21.352 -2.403 2.926 1.00 53.41 O ATOM 0 H ASP A 73 16.675 -2.423 1.040 1.00 71.31 H new ATOM 0 HA ASP A 73 17.285 -3.578 2.843 1.00 24.32 H new ATOM 0 HB2 ASP A 73 19.578 -4.247 2.996 1.00 43.01 H new ATOM 0 HB3 ASP A 73 19.131 -4.085 1.309 1.00 43.01 H new ATOM 1131 N ARG A 74 17.186 -1.070 4.165 1.00 23.22 N ATOM 1132 CA ARG A 74 17.247 -0.041 5.211 1.00 22.25 C ATOM 1133 C ARG A 74 15.809 0.247 5.715 1.00 44.45 C ATOM 1134 O ARG A 74 14.849 -0.440 5.333 1.00 2.14 O ATOM 1135 CB ARG A 74 17.952 1.220 4.591 1.00 20.04 C ATOM 1136 CG ARG A 74 18.544 2.247 5.592 1.00 23.42 C ATOM 1137 CD ARG A 74 19.355 3.350 4.895 1.00 53.42 C ATOM 1138 NE ARG A 74 20.504 2.794 4.151 1.00 63.11 N ATOM 1139 CZ ARG A 74 20.773 2.993 2.849 1.00 32.41 C ATOM 1140 NH1 ARG A 74 19.979 3.753 2.094 1.00 62.33 N ATOM 1141 NH2 ARG A 74 21.836 2.417 2.308 1.00 53.52 N ATOM 0 H ARG A 74 16.336 -1.025 3.604 1.00 23.22 H new ATOM 0 HA ARG A 74 17.825 -0.360 6.079 1.00 22.25 H new ATOM 0 HB2 ARG A 74 18.756 0.875 3.941 1.00 20.04 H new ATOM 0 HB3 ARG A 74 17.230 1.737 3.959 1.00 20.04 H new ATOM 0 HG2 ARG A 74 17.734 2.702 6.162 1.00 23.42 H new ATOM 0 HG3 ARG A 74 19.183 1.727 6.305 1.00 23.42 H new ATOM 0 HD2 ARG A 74 18.709 3.899 4.210 1.00 53.42 H new ATOM 0 HD3 ARG A 74 19.713 4.063 5.637 1.00 53.42 H new ATOM 0 HE ARG A 74 21.153 2.205 4.673 1.00 63.11 H new ATOM 0 HH11 ARG A 74 19.154 4.193 2.503 1.00 62.33 H new ATOM 0 HH12 ARG A 74 20.196 3.895 1.108 1.00 62.33 H new ATOM 0 HH21 ARG A 74 22.443 1.828 2.878 1.00 53.52 H new ATOM 0 HH22 ARG A 74 22.048 2.562 1.321 1.00 53.52 H new ATOM 1155 N THR A 75 15.690 1.263 6.565 1.00 63.32 N ATOM 1156 CA THR A 75 14.432 1.767 7.110 1.00 12.13 C ATOM 1157 C THR A 75 14.488 3.292 6.957 1.00 42.43 C ATOM 1158 O THR A 75 15.563 3.886 7.135 1.00 4.42 O ATOM 1159 CB THR A 75 14.281 1.374 8.615 1.00 14.43 C ATOM 1160 OG1 THR A 75 14.504 -0.035 8.741 1.00 61.15 O ATOM 1161 CG2 THR A 75 12.893 1.736 9.187 1.00 51.15 C ATOM 0 H THR A 75 16.500 1.779 6.907 1.00 63.32 H new ATOM 0 HA THR A 75 13.576 1.342 6.586 1.00 12.13 H new ATOM 0 HB THR A 75 15.015 1.940 9.188 1.00 14.43 H new ATOM 0 HG1 THR A 75 15.067 -0.208 9.524 1.00 61.15 H new ATOM 0 HG21 THR A 75 12.843 1.441 10.235 1.00 51.15 H new ATOM 0 HG22 THR A 75 12.735 2.811 9.105 1.00 51.15 H new ATOM 0 HG23 THR A 75 12.120 1.212 8.625 1.00 51.15 H new ATOM 1169 N VAL A 76 13.359 3.925 6.628 1.00 65.14 N ATOM 1170 CA VAL A 76 13.317 5.373 6.338 1.00 52.22 C ATOM 1171 C VAL A 76 12.078 5.998 6.967 1.00 44.02 C ATOM 1172 O VAL A 76 11.036 5.343 7.138 1.00 70.52 O ATOM 1173 CB VAL A 76 13.358 5.718 4.795 1.00 71.41 C ATOM 1174 CG1 VAL A 76 14.744 5.415 4.174 1.00 1.24 C ATOM 1175 CG2 VAL A 76 12.238 4.991 4.034 1.00 2.23 C ATOM 0 H VAL A 76 12.454 3.460 6.554 1.00 65.14 H new ATOM 0 HA VAL A 76 14.223 5.793 6.775 1.00 52.22 H new ATOM 0 HB VAL A 76 13.188 6.790 4.699 1.00 71.41 H new ATOM 0 HG11 VAL A 76 14.730 5.666 3.113 1.00 1.24 H new ATOM 0 HG12 VAL A 76 15.506 6.010 4.678 1.00 1.24 H new ATOM 0 HG13 VAL A 76 14.973 4.356 4.294 1.00 1.24 H new ATOM 0 HG21 VAL A 76 12.291 5.247 2.976 1.00 2.23 H new ATOM 0 HG22 VAL A 76 12.357 3.914 4.153 1.00 2.23 H new ATOM 0 HG23 VAL A 76 11.270 5.295 4.433 1.00 2.23 H new ATOM 1185 N ARG A 77 12.226 7.271 7.327 1.00 44.54 N ATOM 1186 CA ARG A 77 11.158 8.084 7.873 1.00 45.14 C ATOM 1187 C ARG A 77 10.211 8.499 6.730 1.00 0.50 C ATOM 1188 O ARG A 77 10.658 9.022 5.703 1.00 43.10 O ATOM 1189 CB ARG A 77 11.777 9.313 8.611 1.00 15.23 C ATOM 1190 CG ARG A 77 10.761 10.319 9.232 1.00 25.14 C ATOM 1191 CD ARG A 77 10.328 11.442 8.265 1.00 43.14 C ATOM 1192 NE ARG A 77 11.473 12.288 7.886 1.00 33.43 N ATOM 1193 CZ ARG A 77 12.010 12.399 6.658 1.00 22.43 C ATOM 1194 NH1 ARG A 77 11.529 11.715 5.633 1.00 61.10 N ATOM 1195 NH2 ARG A 77 13.049 13.189 6.479 1.00 14.13 N ATOM 0 H ARG A 77 13.112 7.770 7.243 1.00 44.54 H new ATOM 0 HA ARG A 77 10.572 7.525 8.602 1.00 45.14 H new ATOM 0 HB2 ARG A 77 12.426 8.945 9.406 1.00 15.23 H new ATOM 0 HB3 ARG A 77 12.410 9.854 7.907 1.00 15.23 H new ATOM 0 HG2 ARG A 77 9.876 9.773 9.559 1.00 25.14 H new ATOM 0 HG3 ARG A 77 11.205 10.768 10.120 1.00 25.14 H new ATOM 0 HD2 ARG A 77 9.884 11.005 7.371 1.00 43.14 H new ATOM 0 HD3 ARG A 77 9.559 12.055 8.736 1.00 43.14 H new ATOM 0 HE ARG A 77 11.900 12.844 8.627 1.00 33.43 H new ATOM 0 HH11 ARG A 77 10.735 11.088 5.766 1.00 61.10 H new ATOM 0 HH12 ARG A 77 11.952 11.814 4.710 1.00 61.10 H new ATOM 0 HH21 ARG A 77 13.437 13.708 7.267 1.00 14.13 H new ATOM 0 HH22 ARG A 77 13.465 13.282 5.553 1.00 14.13 H new ATOM 1209 N TYR A 78 8.923 8.221 6.919 1.00 62.41 N ATOM 1210 CA TYR A 78 7.836 8.735 6.075 1.00 33.10 C ATOM 1211 C TYR A 78 7.134 9.876 6.815 1.00 54.54 C ATOM 1212 O TYR A 78 7.148 9.929 8.048 1.00 14.43 O ATOM 1213 CB TYR A 78 6.812 7.615 5.736 1.00 73.11 C ATOM 1214 CG TYR A 78 7.281 6.577 4.699 1.00 32.33 C ATOM 1215 CD1 TYR A 78 8.416 5.797 4.912 1.00 13.11 C ATOM 1216 CD2 TYR A 78 6.566 6.366 3.513 1.00 51.20 C ATOM 1217 CE1 TYR A 78 8.819 4.857 3.987 1.00 43.53 C ATOM 1218 CE2 TYR A 78 6.965 5.423 2.589 1.00 72.22 C ATOM 1219 CZ TYR A 78 8.093 4.669 2.831 1.00 52.53 C ATOM 1220 OH TYR A 78 8.501 3.726 1.913 1.00 52.11 O ATOM 0 H TYR A 78 8.595 7.621 7.676 1.00 62.41 H new ATOM 0 HA TYR A 78 8.257 9.097 5.137 1.00 33.10 H new ATOM 0 HB2 TYR A 78 6.555 7.092 6.657 1.00 73.11 H new ATOM 0 HB3 TYR A 78 5.898 8.082 5.369 1.00 73.11 H new ATOM 0 HD1 TYR A 78 8.990 5.931 5.817 1.00 13.11 H new ATOM 0 HD2 TYR A 78 5.682 6.955 3.318 1.00 51.20 H new ATOM 0 HE1 TYR A 78 9.705 4.267 4.169 1.00 43.53 H new ATOM 0 HE2 TYR A 78 6.397 5.276 1.682 1.00 72.22 H new ATOM 0 HH TYR A 78 8.803 2.921 2.383 1.00 52.11 H new ATOM 1230 N LEU A 79 6.545 10.795 6.054 1.00 33.12 N ATOM 1231 CA LEU A 79 5.716 11.869 6.603 1.00 42.34 C ATOM 1232 C LEU A 79 4.252 11.482 6.434 1.00 1.33 C ATOM 1233 O LEU A 79 3.831 11.121 5.321 1.00 42.33 O ATOM 1234 CB LEU A 79 6.009 13.218 5.894 1.00 42.21 C ATOM 1235 CG LEU A 79 7.427 13.818 6.143 1.00 12.34 C ATOM 1236 CD1 LEU A 79 7.629 15.108 5.327 1.00 62.14 C ATOM 1237 CD2 LEU A 79 7.668 14.062 7.657 1.00 13.32 C ATOM 0 H LEU A 79 6.628 10.818 5.038 1.00 33.12 H new ATOM 0 HA LEU A 79 5.947 12.002 7.660 1.00 42.34 H new ATOM 0 HB2 LEU A 79 5.876 13.080 4.821 1.00 42.21 H new ATOM 0 HB3 LEU A 79 5.265 13.946 6.216 1.00 42.21 H new ATOM 0 HG LEU A 79 8.167 13.093 5.804 1.00 12.34 H new ATOM 0 HD11 LEU A 79 8.625 15.507 5.518 1.00 62.14 H new ATOM 0 HD12 LEU A 79 7.524 14.887 4.265 1.00 62.14 H new ATOM 0 HD13 LEU A 79 6.881 15.845 5.620 1.00 62.14 H new ATOM 0 HD21 LEU A 79 8.664 14.481 7.804 1.00 13.32 H new ATOM 0 HD22 LEU A 79 6.921 14.760 8.036 1.00 13.32 H new ATOM 0 HD23 LEU A 79 7.588 13.117 8.195 1.00 13.32 H new ATOM 1249 N HIS A 80 3.493 11.524 7.542 1.00 63.43 N ATOM 1250 CA HIS A 80 2.058 11.269 7.515 1.00 74.23 C ATOM 1251 C HIS A 80 1.373 12.514 6.945 1.00 54.33 C ATOM 1252 O HIS A 80 1.080 13.471 7.657 1.00 44.52 O ATOM 1253 CB HIS A 80 1.564 10.924 8.948 1.00 31.54 C ATOM 1254 CG HIS A 80 0.072 10.749 9.095 1.00 24.34 C ATOM 1255 ND1 HIS A 80 -0.569 11.087 10.260 1.00 44.24 N ATOM 1256 CD2 HIS A 80 -0.845 10.300 8.205 1.00 70.43 C ATOM 1257 CE1 HIS A 80 -1.841 10.849 10.052 1.00 21.43 C ATOM 1258 NE2 HIS A 80 -2.056 10.373 8.822 1.00 4.25 N ATOM 0 H HIS A 80 3.861 11.734 8.470 1.00 63.43 H new ATOM 0 HA HIS A 80 1.814 10.416 6.882 1.00 74.23 H new ATOM 0 HB2 HIS A 80 2.054 10.006 9.271 1.00 31.54 H new ATOM 0 HB3 HIS A 80 1.888 11.714 9.626 1.00 31.54 H new ATOM 0 HD1 HIS A 80 -0.143 11.449 11.113 1.00 44.24 H new ATOM 0 HD2 HIS A 80 -0.653 9.952 7.201 1.00 70.43 H new ATOM 0 HE1 HIS A 80 -2.618 11.017 10.783 1.00 21.43 H new ATOM 1266 N VAL A 81 1.113 12.466 5.642 1.00 13.52 N ATOM 1267 CA VAL A 81 0.612 13.623 4.887 1.00 65.12 C ATOM 1268 C VAL A 81 -0.911 13.606 4.805 1.00 13.05 C ATOM 1269 O VAL A 81 -1.538 14.654 4.883 1.00 55.44 O ATOM 1270 CB VAL A 81 1.248 13.686 3.448 1.00 34.40 C ATOM 1271 CG1 VAL A 81 2.767 13.979 3.530 1.00 40.45 C ATOM 1272 CG2 VAL A 81 0.970 12.386 2.647 1.00 15.11 C ATOM 0 H VAL A 81 1.242 11.628 5.075 1.00 13.52 H new ATOM 0 HA VAL A 81 0.913 14.522 5.425 1.00 65.12 H new ATOM 0 HB VAL A 81 0.774 14.507 2.910 1.00 34.40 H new ATOM 0 HG11 VAL A 81 3.185 14.018 2.524 1.00 40.45 H new ATOM 0 HG12 VAL A 81 2.927 14.936 4.027 1.00 40.45 H new ATOM 0 HG13 VAL A 81 3.260 13.189 4.097 1.00 40.45 H new ATOM 0 HG21 VAL A 81 1.423 12.464 1.659 1.00 15.11 H new ATOM 0 HG22 VAL A 81 1.397 11.534 3.176 1.00 15.11 H new ATOM 0 HG23 VAL A 81 -0.106 12.246 2.543 1.00 15.11 H new ATOM 1282 N ALA A 82 -1.504 12.411 4.684 1.00 60.40 N ATOM 1283 CA ALA A 82 -2.944 12.269 4.419 1.00 64.13 C ATOM 1284 C ALA A 82 -3.547 11.115 5.208 1.00 14.11 C ATOM 1285 O ALA A 82 -2.828 10.274 5.748 1.00 2.05 O ATOM 1286 CB ALA A 82 -3.181 12.080 2.914 1.00 13.04 C ATOM 0 H ALA A 82 -1.007 11.524 4.766 1.00 60.40 H new ATOM 0 HA ALA A 82 -3.442 13.181 4.747 1.00 64.13 H new ATOM 0 HB1 ALA A 82 -4.249 11.975 2.724 1.00 13.04 H new ATOM 0 HB2 ALA A 82 -2.800 12.947 2.374 1.00 13.04 H new ATOM 0 HB3 ALA A 82 -2.663 11.184 2.574 1.00 13.04 H new ATOM 1292 N THR A 83 -4.886 11.109 5.282 1.00 61.54 N ATOM 1293 CA THR A 83 -5.675 10.013 5.850 1.00 52.13 C ATOM 1294 C THR A 83 -6.938 9.834 5.001 1.00 62.21 C ATOM 1295 O THR A 83 -7.876 10.627 5.069 1.00 31.11 O ATOM 1296 CB THR A 83 -6.036 10.271 7.348 1.00 53.31 C ATOM 1297 OG1 THR A 83 -4.834 10.389 8.106 1.00 45.34 O ATOM 1298 CG2 THR A 83 -6.901 9.153 7.950 1.00 62.14 C ATOM 0 H THR A 83 -5.459 11.881 4.942 1.00 61.54 H new ATOM 0 HA THR A 83 -5.082 9.099 5.830 1.00 52.13 H new ATOM 0 HB THR A 83 -6.617 11.192 7.388 1.00 53.31 H new ATOM 0 HG1 THR A 83 -4.624 9.527 8.523 1.00 45.34 H new ATOM 0 HG21 THR A 83 -7.121 9.385 8.992 1.00 62.14 H new ATOM 0 HG22 THR A 83 -7.833 9.073 7.391 1.00 62.14 H new ATOM 0 HG23 THR A 83 -6.363 8.207 7.895 1.00 62.14 H new ATOM 1306 N LEU A 84 -6.928 8.806 4.170 1.00 15.31 N ATOM 1307 CA LEU A 84 -8.008 8.501 3.240 1.00 4.53 C ATOM 1308 C LEU A 84 -9.169 7.854 4.031 1.00 10.31 C ATOM 1309 O LEU A 84 -9.126 6.667 4.357 1.00 50.32 O ATOM 1310 CB LEU A 84 -7.459 7.568 2.116 1.00 1.35 C ATOM 1311 CG LEU A 84 -6.009 7.900 1.596 1.00 52.00 C ATOM 1312 CD1 LEU A 84 -5.579 6.952 0.464 1.00 24.31 C ATOM 1313 CD2 LEU A 84 -5.863 9.385 1.176 1.00 72.33 C ATOM 0 H LEU A 84 -6.153 8.144 4.120 1.00 15.31 H new ATOM 0 HA LEU A 84 -8.390 9.402 2.761 1.00 4.53 H new ATOM 0 HB2 LEU A 84 -7.466 6.543 2.486 1.00 1.35 H new ATOM 0 HB3 LEU A 84 -8.146 7.607 1.270 1.00 1.35 H new ATOM 0 HG LEU A 84 -5.332 7.738 2.435 1.00 52.00 H new ATOM 0 HD11 LEU A 84 -4.574 7.213 0.133 1.00 24.31 H new ATOM 0 HD12 LEU A 84 -5.586 5.924 0.828 1.00 24.31 H new ATOM 0 HD13 LEU A 84 -6.272 7.045 -0.372 1.00 24.31 H new ATOM 0 HD21 LEU A 84 -4.847 9.566 0.825 1.00 72.33 H new ATOM 0 HD22 LEU A 84 -6.569 9.608 0.376 1.00 72.33 H new ATOM 0 HD23 LEU A 84 -6.071 10.027 2.032 1.00 72.33 H new ATOM 1325 N SER A 85 -10.177 8.674 4.362 1.00 74.40 N ATOM 1326 CA SER A 85 -11.283 8.309 5.266 1.00 55.53 C ATOM 1327 C SER A 85 -12.517 7.842 4.469 1.00 43.13 C ATOM 1328 O SER A 85 -12.957 8.526 3.540 1.00 74.42 O ATOM 1329 CB SER A 85 -11.626 9.529 6.149 1.00 51.53 C ATOM 1330 OG SER A 85 -10.476 9.983 6.847 1.00 42.31 O ATOM 0 H SER A 85 -10.250 9.626 4.004 1.00 74.40 H new ATOM 0 HA SER A 85 -10.974 7.477 5.899 1.00 55.53 H new ATOM 0 HB2 SER A 85 -12.022 10.333 5.529 1.00 51.53 H new ATOM 0 HB3 SER A 85 -12.407 9.261 6.860 1.00 51.53 H new ATOM 0 HG SER A 85 -10.183 10.840 6.473 1.00 42.31 H new ATOM 1336 N PHE A 86 -13.083 6.695 4.868 1.00 61.34 N ATOM 1337 CA PHE A 86 -14.190 6.016 4.158 1.00 41.11 C ATOM 1338 C PHE A 86 -15.029 5.202 5.155 1.00 35.22 C ATOM 1339 O PHE A 86 -14.880 5.353 6.366 1.00 60.42 O ATOM 1340 CB PHE A 86 -13.636 5.118 3.009 1.00 12.21 C ATOM 1341 CG PHE A 86 -12.598 4.071 3.429 1.00 11.12 C ATOM 1342 CD1 PHE A 86 -11.241 4.395 3.486 1.00 40.20 C ATOM 1343 CD2 PHE A 86 -12.973 2.768 3.755 1.00 33.11 C ATOM 1344 CE1 PHE A 86 -10.305 3.457 3.854 1.00 1.23 C ATOM 1345 CE2 PHE A 86 -12.032 1.831 4.125 1.00 2.11 C ATOM 1346 CZ PHE A 86 -10.700 2.175 4.174 1.00 30.44 C ATOM 0 H PHE A 86 -12.783 6.199 5.708 1.00 61.34 H new ATOM 0 HA PHE A 86 -14.836 6.766 3.703 1.00 41.11 H new ATOM 0 HB2 PHE A 86 -14.474 4.604 2.537 1.00 12.21 H new ATOM 0 HB3 PHE A 86 -13.190 5.762 2.251 1.00 12.21 H new ATOM 0 HD1 PHE A 86 -10.922 5.396 3.238 1.00 40.20 H new ATOM 0 HD2 PHE A 86 -14.016 2.489 3.717 1.00 33.11 H new ATOM 0 HE1 PHE A 86 -9.259 3.725 3.892 1.00 1.23 H new ATOM 0 HE2 PHE A 86 -12.340 0.827 4.376 1.00 2.11 H new ATOM 0 HZ PHE A 86 -9.963 1.440 4.463 1.00 30.44 H new ATOM 1356 N ASP A 87 -15.951 4.383 4.628 1.00 73.01 N ATOM 1357 CA ASP A 87 -16.741 3.420 5.420 1.00 25.44 C ATOM 1358 C ASP A 87 -16.482 2.007 4.884 1.00 72.44 C ATOM 1359 O ASP A 87 -16.255 1.823 3.681 1.00 31.01 O ATOM 1360 CB ASP A 87 -18.252 3.753 5.347 1.00 61.11 C ATOM 1361 CG ASP A 87 -18.596 5.146 5.898 1.00 23.42 C ATOM 1362 OD1 ASP A 87 -18.590 6.134 5.120 1.00 53.45 O ATOM 1363 OD2 ASP A 87 -18.877 5.269 7.110 1.00 63.32 O ATOM 0 H ASP A 87 -16.173 4.368 3.633 1.00 73.01 H new ATOM 0 HA ASP A 87 -16.437 3.481 6.465 1.00 25.44 H new ATOM 0 HB2 ASP A 87 -18.581 3.689 4.310 1.00 61.11 H new ATOM 0 HB3 ASP A 87 -18.810 3.001 5.905 1.00 61.11 H new ATOM 1368 N LEU A 88 -16.526 1.013 5.782 1.00 12.10 N ATOM 1369 CA LEU A 88 -16.190 -0.383 5.466 1.00 73.31 C ATOM 1370 C LEU A 88 -16.803 -1.317 6.531 1.00 61.30 C ATOM 1371 O LEU A 88 -16.714 -1.021 7.734 1.00 51.34 O ATOM 1372 CB LEU A 88 -14.644 -0.550 5.416 1.00 11.41 C ATOM 1373 CG LEU A 88 -14.102 -1.902 4.853 1.00 65.34 C ATOM 1374 CD1 LEU A 88 -14.430 -2.055 3.351 1.00 74.43 C ATOM 1375 CD2 LEU A 88 -12.589 -2.042 5.117 1.00 42.00 C ATOM 0 H LEU A 88 -16.798 1.156 6.755 1.00 12.10 H new ATOM 0 HA LEU A 88 -16.601 -0.648 4.492 1.00 73.31 H new ATOM 0 HB2 LEU A 88 -14.234 0.259 4.812 1.00 11.41 H new ATOM 0 HB3 LEU A 88 -14.255 -0.422 6.426 1.00 11.41 H new ATOM 0 HG LEU A 88 -14.607 -2.711 5.380 1.00 65.34 H new ATOM 0 HD11 LEU A 88 -14.040 -3.006 2.988 1.00 74.43 H new ATOM 0 HD12 LEU A 88 -15.511 -2.029 3.210 1.00 74.43 H new ATOM 0 HD13 LEU A 88 -13.971 -1.238 2.793 1.00 74.43 H new ATOM 0 HD21 LEU A 88 -12.236 -2.992 4.715 1.00 42.00 H new ATOM 0 HD22 LEU A 88 -12.058 -1.223 4.632 1.00 42.00 H new ATOM 0 HD23 LEU A 88 -12.402 -2.010 6.190 1.00 42.00 H new ATOM 1387 N ASP A 89 -17.405 -2.436 6.057 1.00 61.23 N ATOM 1388 CA ASP A 89 -18.053 -3.476 6.892 1.00 1.11 C ATOM 1389 C ASP A 89 -19.312 -2.926 7.610 1.00 64.25 C ATOM 1390 O ASP A 89 -20.443 -3.117 7.145 1.00 20.21 O ATOM 1391 CB ASP A 89 -17.059 -4.101 7.911 1.00 21.51 C ATOM 1392 CG ASP A 89 -17.664 -5.274 8.715 1.00 3.53 C ATOM 1393 OD1 ASP A 89 -18.258 -5.051 9.791 1.00 30.24 O ATOM 1394 OD2 ASP A 89 -17.554 -6.431 8.264 1.00 73.41 O ATOM 0 H ASP A 89 -17.454 -2.644 5.060 1.00 61.23 H new ATOM 0 HA ASP A 89 -18.374 -4.270 6.218 1.00 1.11 H new ATOM 0 HB2 ASP A 89 -16.176 -4.453 7.378 1.00 21.51 H new ATOM 0 HB3 ASP A 89 -16.726 -3.328 8.604 1.00 21.51 H new ATOM 1399 N GLY A 90 -19.083 -2.202 8.723 1.00 31.41 N ATOM 1400 CA GLY A 90 -20.160 -1.675 9.564 1.00 34.03 C ATOM 1401 C GLY A 90 -19.710 -0.484 10.393 1.00 24.30 C ATOM 1402 O GLY A 90 -20.366 -0.130 11.382 1.00 20.11 O ATOM 0 H GLY A 90 -18.148 -1.970 9.058 1.00 31.41 H new ATOM 0 HA2 GLY A 90 -21.000 -1.381 8.934 1.00 34.03 H new ATOM 0 HA3 GLY A 90 -20.519 -2.462 10.227 1.00 34.03 H new ATOM 1406 N GLU A 91 -18.579 0.128 9.991 1.00 2.00 N ATOM 1407 CA GLU A 91 -18.000 1.301 10.665 1.00 4.44 C ATOM 1408 C GLU A 91 -17.191 2.153 9.676 1.00 32.33 C ATOM 1409 O GLU A 91 -16.733 1.667 8.637 1.00 70.05 O ATOM 1410 CB GLU A 91 -17.111 0.839 11.849 1.00 22.14 C ATOM 1411 CG GLU A 91 -15.999 -0.165 11.474 1.00 33.31 C ATOM 1412 CD GLU A 91 -15.203 -0.660 12.696 1.00 43.12 C ATOM 1413 OE1 GLU A 91 -15.714 -1.520 13.438 1.00 51.23 O ATOM 1414 OE2 GLU A 91 -14.083 -0.175 12.931 1.00 5.31 O ATOM 0 H GLU A 91 -18.039 -0.182 9.183 1.00 2.00 H new ATOM 0 HA GLU A 91 -18.809 1.920 11.053 1.00 4.44 H new ATOM 0 HB2 GLU A 91 -16.650 1.717 12.302 1.00 22.14 H new ATOM 0 HB3 GLU A 91 -17.749 0.386 12.608 1.00 22.14 H new ATOM 0 HG2 GLU A 91 -16.445 -1.020 10.966 1.00 33.31 H new ATOM 0 HG3 GLU A 91 -15.315 0.305 10.767 1.00 33.31 H new ATOM 1421 N SER A 92 -17.023 3.432 10.028 1.00 60.44 N ATOM 1422 CA SER A 92 -16.187 4.368 9.273 1.00 43.31 C ATOM 1423 C SER A 92 -14.709 4.012 9.521 1.00 71.43 C ATOM 1424 O SER A 92 -14.251 4.010 10.671 1.00 2.45 O ATOM 1425 CB SER A 92 -16.492 5.830 9.678 1.00 62.34 C ATOM 1426 OG SER A 92 -15.804 6.752 8.851 1.00 75.14 O ATOM 0 H SER A 92 -17.465 3.848 10.848 1.00 60.44 H new ATOM 0 HA SER A 92 -16.404 4.283 8.208 1.00 43.31 H new ATOM 0 HB2 SER A 92 -17.565 6.011 9.612 1.00 62.34 H new ATOM 0 HB3 SER A 92 -16.205 5.988 10.718 1.00 62.34 H new ATOM 0 HG SER A 92 -15.499 6.298 8.038 1.00 75.14 H new ATOM 1432 N ARG A 93 -13.986 3.667 8.438 1.00 42.14 N ATOM 1433 CA ARG A 93 -12.574 3.245 8.487 1.00 55.53 C ATOM 1434 C ARG A 93 -11.703 4.236 7.726 1.00 4.03 C ATOM 1435 O ARG A 93 -12.084 4.706 6.664 1.00 10.41 O ATOM 1436 CB ARG A 93 -12.402 1.820 7.890 1.00 52.11 C ATOM 1437 CG ARG A 93 -13.017 0.666 8.724 1.00 63.45 C ATOM 1438 CD ARG A 93 -12.332 0.482 10.100 1.00 4.54 C ATOM 1439 NE ARG A 93 -12.690 1.547 11.053 1.00 13.23 N ATOM 1440 CZ ARG A 93 -11.858 2.142 11.926 1.00 50.12 C ATOM 1441 NH1 ARG A 93 -10.580 1.793 12.008 1.00 52.40 N ATOM 1442 NH2 ARG A 93 -12.321 3.109 12.695 1.00 72.33 N ATOM 0 H ARG A 93 -14.371 3.674 7.494 1.00 42.14 H new ATOM 0 HA ARG A 93 -12.261 3.222 9.531 1.00 55.53 H new ATOM 0 HB2 ARG A 93 -12.850 1.805 6.896 1.00 52.11 H new ATOM 0 HB3 ARG A 93 -11.337 1.625 7.762 1.00 52.11 H new ATOM 0 HG2 ARG A 93 -14.079 0.861 8.876 1.00 63.45 H new ATOM 0 HG3 ARG A 93 -12.941 -0.263 8.159 1.00 63.45 H new ATOM 0 HD2 ARG A 93 -12.614 -0.485 10.517 1.00 4.54 H new ATOM 0 HD3 ARG A 93 -11.250 0.467 9.965 1.00 4.54 H new ATOM 0 HE ARG A 93 -13.660 1.863 11.050 1.00 13.23 H new ATOM 0 HH11 ARG A 93 -10.211 1.060 11.402 1.00 52.40 H new ATOM 0 HH12 ARG A 93 -9.966 2.258 12.677 1.00 52.40 H new ATOM 0 HH21 ARG A 93 -13.297 3.395 12.622 1.00 72.33 H new ATOM 0 HH22 ARG A 93 -11.703 3.570 13.362 1.00 72.33 H new ATOM 1456 N ASP A 94 -10.519 4.514 8.268 1.00 13.24 N ATOM 1457 CA ASP A 94 -9.573 5.483 7.695 1.00 60.20 C ATOM 1458 C ASP A 94 -8.189 4.836 7.520 1.00 20.20 C ATOM 1459 O ASP A 94 -7.726 4.103 8.391 1.00 63.54 O ATOM 1460 CB ASP A 94 -9.499 6.745 8.602 1.00 51.21 C ATOM 1461 CG ASP A 94 -8.977 6.463 10.029 1.00 71.44 C ATOM 1462 OD1 ASP A 94 -9.753 5.962 10.866 1.00 0.22 O ATOM 1463 OD2 ASP A 94 -7.788 6.738 10.313 1.00 64.22 O ATOM 0 H ASP A 94 -10.182 4.073 9.124 1.00 13.24 H new ATOM 0 HA ASP A 94 -9.922 5.791 6.709 1.00 60.20 H new ATOM 0 HB2 ASP A 94 -8.851 7.483 8.128 1.00 51.21 H new ATOM 0 HB3 ASP A 94 -10.492 7.189 8.670 1.00 51.21 H new ATOM 1468 N LEU A 95 -7.552 5.090 6.363 1.00 0.13 N ATOM 1469 CA LEU A 95 -6.193 4.598 6.052 1.00 13.42 C ATOM 1470 C LEU A 95 -5.267 5.778 5.842 1.00 51.35 C ATOM 1471 O LEU A 95 -5.581 6.675 5.081 1.00 0.22 O ATOM 1472 CB LEU A 95 -6.187 3.695 4.793 1.00 21.25 C ATOM 1473 CG LEU A 95 -6.992 2.371 4.908 1.00 23.33 C ATOM 1474 CD1 LEU A 95 -6.757 1.484 3.677 1.00 72.14 C ATOM 1475 CD2 LEU A 95 -6.673 1.625 6.218 1.00 55.41 C ATOM 0 H LEU A 95 -7.965 5.644 5.613 1.00 0.13 H new ATOM 0 HA LEU A 95 -5.848 3.997 6.893 1.00 13.42 H new ATOM 0 HB2 LEU A 95 -6.584 4.268 3.956 1.00 21.25 H new ATOM 0 HB3 LEU A 95 -5.153 3.450 4.549 1.00 21.25 H new ATOM 0 HG LEU A 95 -8.052 2.624 4.939 1.00 23.33 H new ATOM 0 HD11 LEU A 95 -7.330 0.562 3.778 1.00 72.14 H new ATOM 0 HD12 LEU A 95 -7.078 2.014 2.780 1.00 72.14 H new ATOM 0 HD13 LEU A 95 -5.696 1.245 3.598 1.00 72.14 H new ATOM 0 HD21 LEU A 95 -7.254 0.704 6.263 1.00 55.41 H new ATOM 0 HD22 LEU A 95 -5.610 1.385 6.251 1.00 55.41 H new ATOM 0 HD23 LEU A 95 -6.928 2.257 7.068 1.00 55.41 H new ATOM 1487 N HIS A 96 -4.106 5.749 6.481 1.00 23.14 N ATOM 1488 CA HIS A 96 -3.177 6.880 6.489 1.00 0.34 C ATOM 1489 C HIS A 96 -2.204 6.737 5.315 1.00 15.04 C ATOM 1490 O HIS A 96 -1.607 5.673 5.126 1.00 24.13 O ATOM 1491 CB HIS A 96 -2.443 6.935 7.848 1.00 41.52 C ATOM 1492 CG HIS A 96 -3.383 7.024 9.020 1.00 73.33 C ATOM 1493 ND1 HIS A 96 -3.602 8.198 9.678 1.00 43.43 N ATOM 1494 CD2 HIS A 96 -4.171 6.071 9.562 1.00 53.31 C ATOM 1495 CE1 HIS A 96 -4.509 7.941 10.589 1.00 54.31 C ATOM 1496 NE2 HIS A 96 -4.889 6.663 10.553 1.00 14.34 N ATOM 0 H HIS A 96 -3.777 4.941 7.010 1.00 23.14 H new ATOM 0 HA HIS A 96 -3.715 7.820 6.368 1.00 0.34 H new ATOM 0 HB2 HIS A 96 -1.821 6.047 7.955 1.00 41.52 H new ATOM 0 HB3 HIS A 96 -1.774 7.796 7.859 1.00 41.52 H new ATOM 0 HD1 HIS A 96 -3.151 9.095 9.498 1.00 43.43 H new ATOM 0 HD2 HIS A 96 -4.221 5.034 9.264 1.00 53.31 H new ATOM 0 HE1 HIS A 96 -4.899 8.672 11.281 1.00 54.31 H new ATOM 1504 N ALA A 97 -2.080 7.810 4.519 1.00 61.24 N ATOM 1505 CA ALA A 97 -1.222 7.855 3.327 1.00 54.51 C ATOM 1506 C ALA A 97 0.059 8.591 3.676 1.00 31.33 C ATOM 1507 O ALA A 97 0.018 9.704 4.225 1.00 32.34 O ATOM 1508 CB ALA A 97 -1.948 8.552 2.159 1.00 52.51 C ATOM 0 H ALA A 97 -2.580 8.683 4.688 1.00 61.24 H new ATOM 0 HA ALA A 97 -0.986 6.839 3.009 1.00 54.51 H new ATOM 0 HB1 ALA A 97 -1.295 8.575 1.286 1.00 52.51 H new ATOM 0 HB2 ALA A 97 -2.858 8.003 1.917 1.00 52.51 H new ATOM 0 HB3 ALA A 97 -2.205 9.572 2.447 1.00 52.51 H new ATOM 1514 N PHE A 98 1.194 7.949 3.387 1.00 52.13 N ATOM 1515 CA PHE A 98 2.516 8.485 3.687 1.00 14.32 C ATOM 1516 C PHE A 98 3.350 8.537 2.403 1.00 3.50 C ATOM 1517 O PHE A 98 2.990 7.942 1.382 1.00 44.44 O ATOM 1518 CB PHE A 98 3.254 7.599 4.740 1.00 11.24 C ATOM 1519 CG PHE A 98 2.400 7.033 5.879 1.00 41.34 C ATOM 1520 CD1 PHE A 98 2.223 7.731 7.064 1.00 51.25 C ATOM 1521 CD2 PHE A 98 1.800 5.779 5.765 1.00 44.12 C ATOM 1522 CE1 PHE A 98 1.479 7.199 8.097 1.00 50.43 C ATOM 1523 CE2 PHE A 98 1.055 5.250 6.799 1.00 35.45 C ATOM 1524 CZ PHE A 98 0.900 5.960 7.963 1.00 41.31 C ATOM 0 H PHE A 98 1.217 7.035 2.934 1.00 52.13 H new ATOM 0 HA PHE A 98 2.394 9.487 4.098 1.00 14.32 H new ATOM 0 HB2 PHE A 98 3.720 6.764 4.216 1.00 11.24 H new ATOM 0 HB3 PHE A 98 4.059 8.190 5.178 1.00 11.24 H new ATOM 0 HD1 PHE A 98 2.674 8.705 7.180 1.00 51.25 H new ATOM 0 HD2 PHE A 98 1.920 5.213 4.853 1.00 44.12 H new ATOM 0 HE1 PHE A 98 1.351 7.757 9.013 1.00 50.43 H new ATOM 0 HE2 PHE A 98 0.595 4.279 6.692 1.00 35.45 H new ATOM 0 HZ PHE A 98 0.322 5.544 8.775 1.00 41.31 H new ATOM 1534 N ARG A 99 4.464 9.251 2.496 1.00 25.14 N ATOM 1535 CA ARG A 99 5.489 9.342 1.448 1.00 15.30 C ATOM 1536 C ARG A 99 6.771 9.836 2.116 1.00 61.13 C ATOM 1537 O ARG A 99 6.685 10.666 3.033 1.00 24.30 O ATOM 1538 CB ARG A 99 5.011 10.267 0.302 1.00 0.54 C ATOM 1539 CG ARG A 99 4.593 11.701 0.728 1.00 11.11 C ATOM 1540 CD ARG A 99 3.431 12.252 -0.111 1.00 43.15 C ATOM 1541 NE ARG A 99 3.672 12.158 -1.565 1.00 74.41 N ATOM 1542 CZ ARG A 99 2.941 12.760 -2.514 1.00 14.51 C ATOM 1543 NH1 ARG A 99 1.904 13.528 -2.207 1.00 45.24 N ATOM 1544 NH2 ARG A 99 3.245 12.556 -3.785 1.00 65.22 N ATOM 0 H ARG A 99 4.692 9.801 3.324 1.00 25.14 H new ATOM 0 HA ARG A 99 5.678 8.374 0.985 1.00 15.30 H new ATOM 0 HB2 ARG A 99 5.810 10.345 -0.436 1.00 0.54 H new ATOM 0 HB3 ARG A 99 4.164 9.793 -0.194 1.00 0.54 H new ATOM 0 HG2 ARG A 99 4.306 11.694 1.779 1.00 11.11 H new ATOM 0 HG3 ARG A 99 5.450 12.368 0.636 1.00 11.11 H new ATOM 0 HD2 ARG A 99 2.521 11.706 0.137 1.00 43.15 H new ATOM 0 HD3 ARG A 99 3.260 13.295 0.156 1.00 43.15 H new ATOM 0 HE ARG A 99 4.460 11.588 -1.873 1.00 74.41 H new ATOM 0 HH11 ARG A 99 1.647 13.671 -1.230 1.00 45.24 H new ATOM 0 HH12 ARG A 99 1.364 13.975 -2.948 1.00 45.24 H new ATOM 0 HH21 ARG A 99 4.026 11.948 -4.031 1.00 65.22 H new ATOM 0 HH22 ARG A 99 2.698 13.007 -4.519 1.00 65.22 H new ATOM 1558 N GLN A 100 7.932 9.312 1.666 1.00 74.22 N ATOM 1559 CA GLN A 100 9.197 9.353 2.433 1.00 0.42 C ATOM 1560 C GLN A 100 9.549 10.757 2.987 1.00 70.34 C ATOM 1561 O GLN A 100 9.312 11.019 4.172 1.00 33.52 O ATOM 1562 CB GLN A 100 10.361 8.774 1.587 1.00 32.40 C ATOM 1563 CG GLN A 100 10.205 7.285 1.215 1.00 2.25 C ATOM 1564 CD GLN A 100 11.480 6.639 0.653 1.00 52.51 C ATOM 1565 OE1 GLN A 100 12.643 7.020 1.176 1.00 3.11 O flip ATOM 1566 NE2 GLN A 100 11.416 5.757 -0.203 1.00 62.45 N flip ATOM 0 H GLN A 100 8.019 8.849 0.761 1.00 74.22 H new ATOM 0 HA GLN A 100 9.044 8.725 3.311 1.00 0.42 H new ATOM 0 HB2 GLN A 100 10.451 9.357 0.670 1.00 32.40 H new ATOM 0 HB3 GLN A 100 11.292 8.902 2.139 1.00 32.40 H new ATOM 0 HG2 GLN A 100 9.891 6.732 2.100 1.00 2.25 H new ATOM 0 HG3 GLN A 100 9.407 7.188 0.479 1.00 2.25 H new ATOM 0 HE21 GLN A 100 10.511 5.484 -0.587 1.00 62.45 H new ATOM 0 HE22 GLN A 100 12.267 5.299 -0.528 1.00 62.45 H new ATOM 1575 N ALA A 101 10.064 11.669 2.146 1.00 30.34 N ATOM 1576 CA ALA A 101 10.349 13.053 2.570 1.00 13.44 C ATOM 1577 C ALA A 101 9.535 14.063 1.745 1.00 43.23 C ATOM 1578 O ALA A 101 8.495 14.550 2.193 1.00 2.11 O ATOM 1579 CB ALA A 101 11.866 13.327 2.490 1.00 54.21 C ATOM 0 H ALA A 101 10.292 11.475 1.171 1.00 30.34 H new ATOM 0 HA ALA A 101 10.041 13.176 3.608 1.00 13.44 H new ATOM 0 HB1 ALA A 101 12.068 14.351 2.805 1.00 54.21 H new ATOM 0 HB2 ALA A 101 12.396 12.635 3.145 1.00 54.21 H new ATOM 0 HB3 ALA A 101 12.207 13.189 1.464 1.00 54.21 H new ATOM 1585 N ALA A 102 9.986 14.318 0.508 1.00 5.11 N ATOM 1586 CA ALA A 102 9.433 15.372 -0.365 1.00 65.54 C ATOM 1587 C ALA A 102 8.909 14.783 -1.678 1.00 5.34 C ATOM 1588 O ALA A 102 9.048 15.399 -2.747 1.00 1.31 O ATOM 1589 CB ALA A 102 10.532 16.422 -0.620 1.00 61.41 C ATOM 0 H ALA A 102 10.750 13.796 0.079 1.00 5.11 H new ATOM 0 HA ALA A 102 8.584 15.847 0.126 1.00 65.54 H new ATOM 0 HB1 ALA A 102 10.141 17.209 -1.264 1.00 61.41 H new ATOM 0 HB2 ALA A 102 10.850 16.854 0.329 1.00 61.41 H new ATOM 0 HB3 ALA A 102 11.384 15.946 -1.105 1.00 61.41 H new ATOM 1595 N ASP A 103 8.292 13.591 -1.587 1.00 40.33 N ATOM 1596 CA ASP A 103 7.773 12.878 -2.767 1.00 40.03 C ATOM 1597 C ASP A 103 6.623 13.666 -3.410 1.00 54.20 C ATOM 1598 O ASP A 103 5.713 14.132 -2.722 1.00 21.15 O ATOM 1599 CB ASP A 103 7.299 11.444 -2.410 1.00 25.24 C ATOM 1600 CG ASP A 103 6.629 10.715 -3.598 1.00 54.54 C ATOM 1601 OD1 ASP A 103 7.352 10.282 -4.512 1.00 63.41 O ATOM 1602 OD2 ASP A 103 5.380 10.615 -3.640 1.00 34.21 O ATOM 0 H ASP A 103 8.141 13.101 -0.706 1.00 40.33 H new ATOM 0 HA ASP A 103 8.592 12.793 -3.481 1.00 40.03 H new ATOM 0 HB2 ASP A 103 8.153 10.860 -2.068 1.00 25.24 H new ATOM 0 HB3 ASP A 103 6.595 11.496 -1.579 1.00 25.24 H new ATOM 1607 N GLU A 104 6.709 13.814 -4.735 1.00 44.10 N ATOM 1608 CA GLU A 104 5.689 14.473 -5.573 1.00 23.35 C ATOM 1609 C GLU A 104 5.386 13.578 -6.792 1.00 42.32 C ATOM 1610 O GLU A 104 4.694 13.992 -7.728 1.00 40.04 O ATOM 1611 CB GLU A 104 6.187 15.886 -6.004 1.00 32.13 C ATOM 1612 CG GLU A 104 6.483 16.831 -4.818 1.00 44.12 C ATOM 1613 CD GLU A 104 6.977 18.219 -5.248 1.00 11.20 C ATOM 1614 OE1 GLU A 104 6.140 19.104 -5.518 1.00 33.44 O ATOM 1615 OE2 GLU A 104 8.205 18.433 -5.319 1.00 23.22 O ATOM 0 H GLU A 104 7.506 13.473 -5.272 1.00 44.10 H new ATOM 0 HA GLU A 104 4.767 14.610 -5.008 1.00 23.35 H new ATOM 0 HB2 GLU A 104 7.091 15.775 -6.603 1.00 32.13 H new ATOM 0 HB3 GLU A 104 5.435 16.346 -6.644 1.00 32.13 H new ATOM 0 HG2 GLU A 104 5.578 16.945 -4.221 1.00 44.12 H new ATOM 0 HG3 GLU A 104 7.233 16.370 -4.175 1.00 44.12 H new ATOM 1622 N SER A 105 5.875 12.321 -6.733 1.00 1.31 N ATOM 1623 CA SER A 105 5.674 11.303 -7.779 1.00 50.22 C ATOM 1624 C SER A 105 4.338 10.543 -7.559 1.00 70.00 C ATOM 1625 O SER A 105 4.149 9.435 -8.080 1.00 42.11 O ATOM 1626 CB SER A 105 6.882 10.336 -7.780 1.00 55.21 C ATOM 1627 OG SER A 105 6.857 9.456 -8.887 1.00 33.04 O ATOM 0 H SER A 105 6.428 11.983 -5.945 1.00 1.31 H new ATOM 0 HA SER A 105 5.609 11.788 -8.753 1.00 50.22 H new ATOM 0 HB2 SER A 105 7.807 10.912 -7.796 1.00 55.21 H new ATOM 0 HB3 SER A 105 6.883 9.757 -6.857 1.00 55.21 H new ATOM 0 HG SER A 105 5.944 9.126 -9.022 1.00 33.04 H new ATOM 1633 N ARG A 106 3.431 11.153 -6.746 1.00 4.04 N ATOM 1634 CA ARG A 106 2.049 10.670 -6.499 1.00 1.32 C ATOM 1635 C ARG A 106 2.043 9.393 -5.635 1.00 32.44 C ATOM 1636 O ARG A 106 0.977 8.844 -5.363 1.00 33.03 O ATOM 1637 CB ARG A 106 1.277 10.416 -7.844 1.00 75.11 C ATOM 1638 CG ARG A 106 1.321 11.583 -8.854 1.00 4.22 C ATOM 1639 CD ARG A 106 0.592 12.838 -8.359 1.00 70.51 C ATOM 1640 NE ARG A 106 0.872 14.021 -9.199 1.00 32.41 N ATOM 1641 CZ ARG A 106 0.425 14.219 -10.448 1.00 4.34 C ATOM 1642 NH1 ARG A 106 -0.352 13.331 -11.060 1.00 71.43 N ATOM 1643 NH2 ARG A 106 0.755 15.330 -11.092 1.00 23.12 N ATOM 0 H ARG A 106 3.647 12.010 -6.236 1.00 4.04 H new ATOM 0 HA ARG A 106 1.532 11.458 -5.951 1.00 1.32 H new ATOM 0 HB2 ARG A 106 1.691 9.528 -8.321 1.00 75.11 H new ATOM 0 HB3 ARG A 106 0.235 10.196 -7.611 1.00 75.11 H new ATOM 0 HG2 ARG A 106 2.361 11.834 -9.064 1.00 4.22 H new ATOM 0 HG3 ARG A 106 0.875 11.258 -9.794 1.00 4.22 H new ATOM 0 HD2 ARG A 106 -0.482 12.650 -8.347 1.00 70.51 H new ATOM 0 HD3 ARG A 106 0.890 13.047 -7.332 1.00 70.51 H new ATOM 0 HE ARG A 106 1.457 14.752 -8.793 1.00 32.41 H new ATOM 0 HH11 ARG A 106 -0.623 12.473 -10.579 1.00 71.43 H new ATOM 0 HH12 ARG A 106 -0.678 13.507 -12.010 1.00 71.43 H new ATOM 0 HH21 ARG A 106 1.345 16.027 -10.637 1.00 23.12 H new ATOM 0 HH22 ARG A 106 0.419 15.488 -12.042 1.00 23.12 H new ATOM 1657 N THR A 107 3.226 8.961 -5.167 1.00 25.20 N ATOM 1658 CA THR A 107 3.409 7.642 -4.561 1.00 73.21 C ATOM 1659 C THR A 107 2.967 7.674 -3.086 1.00 12.23 C ATOM 1660 O THR A 107 3.765 7.936 -2.173 1.00 21.33 O ATOM 1661 CB THR A 107 4.894 7.177 -4.710 1.00 63.12 C ATOM 1662 OG1 THR A 107 5.303 7.343 -6.077 1.00 72.42 O ATOM 1663 CG2 THR A 107 5.100 5.705 -4.295 1.00 10.32 C ATOM 0 H THR A 107 4.079 9.520 -5.201 1.00 25.20 H new ATOM 0 HA THR A 107 2.784 6.916 -5.082 1.00 73.21 H new ATOM 0 HB THR A 107 5.498 7.792 -4.043 1.00 63.12 H new ATOM 0 HG1 THR A 107 4.657 6.903 -6.668 1.00 72.42 H new ATOM 0 HG21 THR A 107 6.149 5.436 -4.419 1.00 10.32 H new ATOM 0 HG22 THR A 107 4.813 5.578 -3.251 1.00 10.32 H new ATOM 0 HG23 THR A 107 4.484 5.061 -4.922 1.00 10.32 H new ATOM 1671 N LEU A 108 1.658 7.488 -2.888 1.00 12.01 N ATOM 1672 CA LEU A 108 1.038 7.411 -1.570 1.00 5.03 C ATOM 1673 C LEU A 108 1.023 5.949 -1.123 1.00 62.31 C ATOM 1674 O LEU A 108 0.318 5.121 -1.706 1.00 11.45 O ATOM 1675 CB LEU A 108 -0.402 7.992 -1.619 1.00 43.34 C ATOM 1676 CG LEU A 108 -0.514 9.486 -2.058 1.00 43.00 C ATOM 1677 CD1 LEU A 108 -1.984 9.945 -2.105 1.00 44.40 C ATOM 1678 CD2 LEU A 108 0.330 10.403 -1.145 1.00 11.52 C ATOM 0 H LEU A 108 0.993 7.386 -3.654 1.00 12.01 H new ATOM 0 HA LEU A 108 1.609 8.001 -0.853 1.00 5.03 H new ATOM 0 HB2 LEU A 108 -0.996 7.386 -2.303 1.00 43.34 H new ATOM 0 HB3 LEU A 108 -0.850 7.888 -0.631 1.00 43.34 H new ATOM 0 HG LEU A 108 -0.111 9.565 -3.068 1.00 43.00 H new ATOM 0 HD11 LEU A 108 -2.029 10.989 -2.414 1.00 44.40 H new ATOM 0 HD12 LEU A 108 -2.534 9.331 -2.818 1.00 44.40 H new ATOM 0 HD13 LEU A 108 -2.430 9.839 -1.116 1.00 44.40 H new ATOM 0 HD21 LEU A 108 0.231 11.437 -1.476 1.00 11.52 H new ATOM 0 HD22 LEU A 108 -0.022 10.316 -0.117 1.00 11.52 H new ATOM 0 HD23 LEU A 108 1.377 10.104 -1.197 1.00 11.52 H new ATOM 1690 N PHE A 109 1.820 5.639 -0.104 1.00 24.13 N ATOM 1691 CA PHE A 109 1.943 4.287 0.429 1.00 72.43 C ATOM 1692 C PHE A 109 0.982 4.175 1.620 1.00 73.02 C ATOM 1693 O PHE A 109 1.165 4.878 2.621 1.00 25.32 O ATOM 1694 CB PHE A 109 3.419 4.018 0.844 1.00 65.22 C ATOM 1695 CG PHE A 109 3.699 2.596 1.349 1.00 14.31 C ATOM 1696 CD1 PHE A 109 3.497 1.489 0.518 1.00 51.45 C ATOM 1697 CD2 PHE A 109 4.173 2.366 2.646 1.00 63.43 C ATOM 1698 CE1 PHE A 109 3.755 0.203 0.970 1.00 2.54 C ATOM 1699 CE2 PHE A 109 4.428 1.080 3.094 1.00 35.10 C ATOM 1700 CZ PHE A 109 4.220 0.000 2.257 1.00 52.32 C ATOM 0 H PHE A 109 2.402 6.324 0.378 1.00 24.13 H new ATOM 0 HA PHE A 109 1.681 3.537 -0.317 1.00 72.43 H new ATOM 0 HB2 PHE A 109 4.064 4.218 -0.012 1.00 65.22 H new ATOM 0 HB3 PHE A 109 3.697 4.726 1.624 1.00 65.22 H new ATOM 0 HD1 PHE A 109 3.135 1.637 -0.489 1.00 51.45 H new ATOM 0 HD2 PHE A 109 4.342 3.203 3.307 1.00 63.43 H new ATOM 0 HE1 PHE A 109 3.593 -0.641 0.316 1.00 2.54 H new ATOM 0 HE2 PHE A 109 4.790 0.921 4.099 1.00 35.10 H new ATOM 0 HZ PHE A 109 4.420 -1.002 2.607 1.00 52.32 H new ATOM 1710 N VAL A 110 -0.065 3.334 1.487 1.00 5.35 N ATOM 1711 CA VAL A 110 -1.035 3.074 2.573 1.00 41.32 C ATOM 1712 C VAL A 110 -0.916 1.594 3.034 1.00 3.22 C ATOM 1713 O VAL A 110 -1.558 0.692 2.478 1.00 40.33 O ATOM 1714 CB VAL A 110 -2.543 3.444 2.198 1.00 51.30 C ATOM 1715 CG1 VAL A 110 -2.714 4.955 1.994 1.00 13.41 C ATOM 1716 CG2 VAL A 110 -3.058 2.690 0.960 1.00 11.24 C ATOM 0 H VAL A 110 -0.262 2.818 0.629 1.00 5.35 H new ATOM 0 HA VAL A 110 -0.776 3.740 3.396 1.00 41.32 H new ATOM 0 HB VAL A 110 -3.145 3.126 3.049 1.00 51.30 H new ATOM 0 HG11 VAL A 110 -3.751 5.173 1.740 1.00 13.41 H new ATOM 0 HG12 VAL A 110 -2.448 5.479 2.912 1.00 13.41 H new ATOM 0 HG13 VAL A 110 -2.065 5.289 1.185 1.00 13.41 H new ATOM 0 HG21 VAL A 110 -4.088 2.985 0.757 1.00 11.24 H new ATOM 0 HG22 VAL A 110 -2.434 2.934 0.100 1.00 11.24 H new ATOM 0 HG23 VAL A 110 -3.017 1.617 1.145 1.00 11.24 H new ATOM 1726 N PRO A 111 -0.040 1.293 4.027 1.00 32.43 N ATOM 1727 CA PRO A 111 -0.082 -0.005 4.696 1.00 43.23 C ATOM 1728 C PRO A 111 -1.318 -0.025 5.605 1.00 14.25 C ATOM 1729 O PRO A 111 -1.527 0.922 6.363 1.00 42.45 O ATOM 1730 CB PRO A 111 1.248 -0.051 5.493 1.00 60.24 C ATOM 1731 CG PRO A 111 1.587 1.394 5.761 1.00 11.23 C ATOM 1732 CD PRO A 111 1.024 2.178 4.583 1.00 4.05 C ATOM 0 HA PRO A 111 -0.164 -0.868 4.035 1.00 43.23 H new ATOM 0 HB2 PRO A 111 1.133 -0.609 6.422 1.00 60.24 H new ATOM 0 HB3 PRO A 111 2.035 -0.542 4.921 1.00 60.24 H new ATOM 0 HG2 PRO A 111 1.148 1.731 6.700 1.00 11.23 H new ATOM 0 HG3 PRO A 111 2.665 1.534 5.844 1.00 11.23 H new ATOM 0 HD2 PRO A 111 0.617 3.138 4.902 1.00 4.05 H new ATOM 0 HD3 PRO A 111 1.794 2.389 3.841 1.00 4.05 H new ATOM 1740 N PHE A 112 -2.170 -1.045 5.481 1.00 42.11 N ATOM 1741 CA PHE A 112 -3.360 -1.184 6.335 1.00 40.13 C ATOM 1742 C PHE A 112 -3.232 -2.463 7.146 1.00 61.05 C ATOM 1743 O PHE A 112 -2.630 -3.424 6.676 1.00 31.50 O ATOM 1744 CB PHE A 112 -4.687 -1.149 5.512 1.00 75.24 C ATOM 1745 CG PHE A 112 -4.960 -2.307 4.544 1.00 71.12 C ATOM 1746 CD1 PHE A 112 -5.532 -3.506 4.996 1.00 22.11 C ATOM 1747 CD2 PHE A 112 -4.677 -2.189 3.184 1.00 20.20 C ATOM 1748 CE1 PHE A 112 -5.798 -4.538 4.124 1.00 33.23 C ATOM 1749 CE2 PHE A 112 -4.949 -3.227 2.315 1.00 32.52 C ATOM 1750 CZ PHE A 112 -5.509 -4.398 2.785 1.00 21.23 C ATOM 0 H PHE A 112 -2.060 -1.792 4.795 1.00 42.11 H new ATOM 0 HA PHE A 112 -3.411 -0.330 7.011 1.00 40.13 H new ATOM 0 HB2 PHE A 112 -5.517 -1.099 6.217 1.00 75.24 H new ATOM 0 HB3 PHE A 112 -4.701 -0.223 4.938 1.00 75.24 H new ATOM 0 HD1 PHE A 112 -5.767 -3.621 6.044 1.00 22.11 H new ATOM 0 HD2 PHE A 112 -4.240 -1.276 2.806 1.00 20.20 H new ATOM 0 HE1 PHE A 112 -6.233 -5.456 4.490 1.00 33.23 H new ATOM 0 HE2 PHE A 112 -4.723 -3.122 1.264 1.00 32.52 H new ATOM 0 HZ PHE A 112 -5.721 -5.206 2.101 1.00 21.23 H new ATOM 1760 N ARG A 113 -3.765 -2.474 8.368 1.00 51.14 N ATOM 1761 CA ARG A 113 -3.854 -3.705 9.165 1.00 23.41 C ATOM 1762 C ARG A 113 -5.309 -4.147 9.228 1.00 3.01 C ATOM 1763 O ARG A 113 -6.174 -3.351 9.542 1.00 74.04 O ATOM 1764 CB ARG A 113 -3.250 -3.517 10.576 1.00 22.54 C ATOM 1765 CG ARG A 113 -3.294 -4.801 11.436 1.00 51.23 C ATOM 1766 CD ARG A 113 -2.547 -4.677 12.772 1.00 61.33 C ATOM 1767 NE ARG A 113 -2.693 -5.907 13.573 1.00 42.54 N ATOM 1768 CZ ARG A 113 -1.770 -6.873 13.705 1.00 73.12 C ATOM 1769 NH1 ARG A 113 -0.591 -6.788 13.105 1.00 45.44 N ATOM 1770 NH2 ARG A 113 -2.036 -7.932 14.442 1.00 34.35 N ATOM 0 H ARG A 113 -4.142 -1.647 8.830 1.00 51.14 H new ATOM 0 HA ARG A 113 -3.265 -4.486 8.685 1.00 23.41 H new ATOM 0 HB2 ARG A 113 -2.215 -3.188 10.480 1.00 22.54 H new ATOM 0 HB3 ARG A 113 -3.790 -2.724 11.092 1.00 22.54 H new ATOM 0 HG2 ARG A 113 -4.334 -5.059 11.634 1.00 51.23 H new ATOM 0 HG3 ARG A 113 -2.865 -5.624 10.865 1.00 51.23 H new ATOM 0 HD2 ARG A 113 -1.491 -4.483 12.586 1.00 61.33 H new ATOM 0 HD3 ARG A 113 -2.934 -3.826 13.332 1.00 61.33 H new ATOM 0 HE ARG A 113 -3.574 -6.035 14.071 1.00 42.54 H new ATOM 0 HH11 ARG A 113 -0.369 -5.976 12.529 1.00 45.44 H new ATOM 0 HH12 ARG A 113 0.095 -7.534 13.220 1.00 45.44 H new ATOM 0 HH21 ARG A 113 -2.939 -8.015 14.909 1.00 34.35 H new ATOM 0 HH22 ARG A 113 -1.339 -8.669 14.546 1.00 34.35 H new ATOM 1784 N ASP A 114 -5.566 -5.414 8.925 1.00 33.03 N ATOM 1785 CA ASP A 114 -6.919 -5.994 8.836 1.00 61.10 C ATOM 1786 C ASP A 114 -7.081 -7.075 9.926 1.00 2.40 C ATOM 1787 O ASP A 114 -6.336 -7.074 10.916 1.00 73.11 O ATOM 1788 CB ASP A 114 -7.123 -6.554 7.401 1.00 15.12 C ATOM 1789 CG ASP A 114 -5.986 -7.492 6.950 1.00 35.35 C ATOM 1790 OD1 ASP A 114 -4.886 -7.002 6.584 1.00 70.30 O ATOM 1791 OD2 ASP A 114 -6.171 -8.719 6.994 1.00 21.53 O ATOM 0 H ASP A 114 -4.828 -6.090 8.728 1.00 33.03 H new ATOM 0 HA ASP A 114 -7.687 -5.241 9.013 1.00 61.10 H new ATOM 0 HB2 ASP A 114 -8.069 -7.094 7.359 1.00 15.12 H new ATOM 0 HB3 ASP A 114 -7.199 -5.722 6.700 1.00 15.12 H new ATOM 1796 N LYS A 115 -8.086 -7.962 9.788 1.00 13.22 N ATOM 1797 CA LYS A 115 -8.315 -9.063 10.758 1.00 33.50 C ATOM 1798 C LYS A 115 -7.787 -10.415 10.229 1.00 14.30 C ATOM 1799 O LYS A 115 -7.469 -11.310 11.016 1.00 23.01 O ATOM 1800 CB LYS A 115 -9.819 -9.165 11.130 1.00 21.11 C ATOM 1801 CG LYS A 115 -10.474 -7.862 11.668 1.00 63.02 C ATOM 1802 CD LYS A 115 -10.176 -7.479 13.152 1.00 24.20 C ATOM 1803 CE LYS A 115 -8.805 -6.803 13.404 1.00 53.52 C ATOM 1804 NZ LYS A 115 -7.738 -7.788 13.725 1.00 33.24 N ATOM 0 H LYS A 115 -8.754 -7.942 9.017 1.00 13.22 H new ATOM 0 HA LYS A 115 -7.751 -8.825 11.660 1.00 33.50 H new ATOM 0 HB2 LYS A 115 -10.371 -9.489 10.247 1.00 21.11 H new ATOM 0 HB3 LYS A 115 -9.935 -9.945 11.882 1.00 21.11 H new ATOM 0 HG2 LYS A 115 -10.154 -7.035 11.034 1.00 63.02 H new ATOM 0 HG3 LYS A 115 -11.554 -7.953 11.552 1.00 63.02 H new ATOM 0 HD2 LYS A 115 -10.962 -6.809 13.501 1.00 24.20 H new ATOM 0 HD3 LYS A 115 -10.234 -8.381 13.761 1.00 24.20 H new ATOM 0 HE2 LYS A 115 -8.516 -6.233 12.521 1.00 53.52 H new ATOM 0 HE3 LYS A 115 -8.899 -6.092 14.225 1.00 53.52 H new ATOM 0 HZ1 LYS A 115 -7.421 -7.649 14.706 1.00 33.24 H new ATOM 0 HZ2 LYS A 115 -8.111 -8.752 13.615 1.00 33.24 H new ATOM 0 HZ3 LYS A 115 -6.935 -7.652 13.079 1.00 33.24 H new ATOM 1818 N THR A 116 -7.703 -10.550 8.898 1.00 54.33 N ATOM 1819 CA THR A 116 -7.237 -11.788 8.237 1.00 43.50 C ATOM 1820 C THR A 116 -5.688 -11.891 8.218 1.00 25.24 C ATOM 1821 O THR A 116 -5.129 -12.949 7.886 1.00 10.10 O ATOM 1822 CB THR A 116 -7.852 -11.898 6.792 1.00 42.40 C ATOM 1823 OG1 THR A 116 -8.120 -10.590 6.258 1.00 63.33 O ATOM 1824 CG2 THR A 116 -9.155 -12.712 6.778 1.00 32.41 C ATOM 0 H THR A 116 -7.955 -9.808 8.245 1.00 54.33 H new ATOM 0 HA THR A 116 -7.591 -12.637 8.822 1.00 43.50 H new ATOM 0 HB THR A 116 -7.115 -12.413 6.176 1.00 42.40 H new ATOM 0 HG1 THR A 116 -7.369 -9.994 6.460 1.00 63.33 H new ATOM 0 HG21 THR A 116 -9.543 -12.761 5.760 1.00 32.41 H new ATOM 0 HG22 THR A 116 -8.958 -13.721 7.140 1.00 32.41 H new ATOM 0 HG23 THR A 116 -9.891 -12.232 7.424 1.00 32.41 H new ATOM 1832 N THR A 117 -5.010 -10.786 8.583 1.00 22.40 N ATOM 1833 CA THR A 117 -3.558 -10.765 8.815 1.00 33.14 C ATOM 1834 C THR A 117 -3.232 -11.551 10.097 1.00 44.20 C ATOM 1835 O THR A 117 -4.009 -11.520 11.063 1.00 2.31 O ATOM 1836 CB THR A 117 -3.010 -9.306 8.924 1.00 72.44 C ATOM 1837 OG1 THR A 117 -1.590 -9.334 9.079 1.00 1.50 O ATOM 1838 CG2 THR A 117 -3.624 -8.507 10.093 1.00 34.13 C ATOM 0 H THR A 117 -5.458 -9.881 8.725 1.00 22.40 H new ATOM 0 HA THR A 117 -3.071 -11.234 7.960 1.00 33.14 H new ATOM 0 HB THR A 117 -3.294 -8.801 8.001 1.00 72.44 H new ATOM 0 HG1 THR A 117 -1.206 -9.986 8.456 1.00 1.50 H new ATOM 0 HG21 THR A 117 -3.199 -7.503 10.110 1.00 34.13 H new ATOM 0 HG22 THR A 117 -4.704 -8.442 9.962 1.00 34.13 H new ATOM 0 HG23 THR A 117 -3.403 -9.011 11.034 1.00 34.13 H new ATOM 1846 N GLY A 118 -2.114 -12.298 10.080 1.00 63.11 N ATOM 1847 CA GLY A 118 -1.746 -13.173 11.199 1.00 21.32 C ATOM 1848 C GLY A 118 -2.520 -14.492 11.192 1.00 64.33 C ATOM 1849 O GLY A 118 -2.310 -15.339 12.060 1.00 15.14 O ATOM 0 H GLY A 118 -1.453 -12.311 9.303 1.00 63.11 H new ATOM 0 HA2 GLY A 118 -0.677 -13.383 11.155 1.00 21.32 H new ATOM 0 HA3 GLY A 118 -1.931 -12.652 12.139 1.00 21.32 H new ATOM 1853 N GLN A 119 -3.443 -14.650 10.213 1.00 53.40 N ATOM 1854 CA GLN A 119 -4.277 -15.852 10.053 1.00 63.13 C ATOM 1855 C GLN A 119 -3.955 -16.520 8.700 1.00 12.33 C ATOM 1856 O GLN A 119 -3.172 -17.475 8.637 1.00 71.40 O ATOM 1857 CB GLN A 119 -5.790 -15.480 10.144 1.00 24.32 C ATOM 1858 CG GLN A 119 -6.243 -14.871 11.489 1.00 61.33 C ATOM 1859 CD GLN A 119 -6.114 -15.848 12.663 1.00 11.41 C ATOM 1860 OE1 GLN A 119 -7.035 -16.605 12.965 1.00 63.12 O ATOM 1861 NE2 GLN A 119 -4.978 -15.837 13.331 1.00 12.42 N ATOM 0 H GLN A 119 -3.627 -13.936 9.508 1.00 53.40 H new ATOM 0 HA GLN A 119 -4.058 -16.556 10.856 1.00 63.13 H new ATOM 0 HB2 GLN A 119 -6.021 -14.772 9.348 1.00 24.32 H new ATOM 0 HB3 GLN A 119 -6.379 -16.377 9.954 1.00 24.32 H new ATOM 0 HG2 GLN A 119 -5.649 -13.981 11.697 1.00 61.33 H new ATOM 0 HG3 GLN A 119 -7.281 -14.549 11.404 1.00 61.33 H new ATOM 0 HE21 GLN A 119 -4.232 -15.198 13.057 1.00 12.42 H new ATOM 0 HE22 GLN A 119 -4.845 -16.468 14.122 1.00 12.42 H new ATOM 1870 N GLN A 120 -4.539 -15.972 7.613 1.00 41.00 N ATOM 1871 CA GLN A 120 -4.315 -16.460 6.235 1.00 53.32 C ATOM 1872 C GLN A 120 -3.114 -15.738 5.597 1.00 40.11 C ATOM 1873 O GLN A 120 -2.736 -16.032 4.468 1.00 23.00 O ATOM 1874 CB GLN A 120 -5.588 -16.222 5.374 1.00 42.10 C ATOM 1875 CG GLN A 120 -5.877 -14.730 5.057 1.00 14.35 C ATOM 1876 CD GLN A 120 -7.188 -14.475 4.314 1.00 53.11 C ATOM 1877 OE1 GLN A 120 -8.226 -15.225 4.635 1.00 61.52 O flip ATOM 1878 NE2 GLN A 120 -7.285 -13.561 3.497 1.00 55.31 N flip ATOM 0 H GLN A 120 -5.179 -15.179 7.666 1.00 41.00 H new ATOM 0 HA GLN A 120 -4.102 -17.528 6.276 1.00 53.32 H new ATOM 0 HB2 GLN A 120 -5.484 -16.767 4.436 1.00 42.10 H new ATOM 0 HB3 GLN A 120 -6.448 -16.644 5.894 1.00 42.10 H new ATOM 0 HG2 GLN A 120 -5.891 -14.171 5.992 1.00 14.35 H new ATOM 0 HG3 GLN A 120 -5.055 -14.334 4.461 1.00 14.35 H new ATOM 0 HE21 GLN A 120 -6.469 -12.995 3.265 1.00 55.31 H new ATOM 0 HE22 GLN A 120 -8.182 -13.369 3.051 1.00 55.31 H new ATOM 1887 N SER A 121 -2.551 -14.778 6.333 1.00 71.32 N ATOM 1888 CA SER A 121 -1.437 -13.944 5.882 1.00 24.43 C ATOM 1889 C SER A 121 -0.483 -13.701 7.052 1.00 64.23 C ATOM 1890 O SER A 121 -0.802 -14.048 8.196 1.00 14.14 O ATOM 1891 CB SER A 121 -1.972 -12.606 5.308 1.00 25.21 C ATOM 1892 OG SER A 121 -2.804 -12.826 4.178 1.00 50.11 O ATOM 0 H SER A 121 -2.863 -14.555 7.278 1.00 71.32 H new ATOM 0 HA SER A 121 -0.892 -14.454 5.088 1.00 24.43 H new ATOM 0 HB2 SER A 121 -2.533 -12.076 6.078 1.00 25.21 H new ATOM 0 HB3 SER A 121 -1.135 -11.967 5.027 1.00 25.21 H new ATOM 0 HG SER A 121 -3.254 -11.990 3.935 1.00 50.11 H new ATOM 1898 N TYR A 122 0.691 -13.124 6.756 1.00 34.23 N ATOM 1899 CA TYR A 122 1.673 -12.754 7.787 1.00 11.41 C ATOM 1900 C TYR A 122 1.179 -11.525 8.586 1.00 3.13 C ATOM 1901 O TYR A 122 0.509 -10.651 8.033 1.00 74.13 O ATOM 1902 CB TYR A 122 3.060 -12.479 7.145 1.00 42.04 C ATOM 1903 CG TYR A 122 4.166 -12.154 8.171 1.00 10.52 C ATOM 1904 CD1 TYR A 122 4.728 -13.160 8.964 1.00 20.44 C ATOM 1905 CD2 TYR A 122 4.621 -10.847 8.362 1.00 52.41 C ATOM 1906 CE1 TYR A 122 5.702 -12.867 9.900 1.00 54.51 C ATOM 1907 CE2 TYR A 122 5.594 -10.557 9.300 1.00 52.04 C ATOM 1908 CZ TYR A 122 6.132 -11.570 10.063 1.00 73.05 C ATOM 1909 OH TYR A 122 7.105 -11.280 10.993 1.00 4.24 O ATOM 0 H TYR A 122 0.985 -12.902 5.805 1.00 34.23 H new ATOM 0 HA TYR A 122 1.782 -13.589 8.480 1.00 11.41 H new ATOM 0 HB2 TYR A 122 3.361 -13.351 6.564 1.00 42.04 H new ATOM 0 HB3 TYR A 122 2.969 -11.647 6.447 1.00 42.04 H new ATOM 0 HD1 TYR A 122 4.396 -14.181 8.843 1.00 20.44 H new ATOM 0 HD2 TYR A 122 4.205 -10.048 7.766 1.00 52.41 H new ATOM 0 HE1 TYR A 122 6.126 -13.656 10.504 1.00 54.51 H new ATOM 0 HE2 TYR A 122 5.931 -9.540 9.434 1.00 52.04 H new ATOM 0 HH TYR A 122 7.294 -10.318 10.980 1.00 4.24 H new ATOM 1919 N ASP A 123 1.569 -11.489 9.872 1.00 45.40 N ATOM 1920 CA ASP A 123 1.156 -10.461 10.850 1.00 20.54 C ATOM 1921 C ASP A 123 1.683 -9.057 10.463 1.00 43.15 C ATOM 1922 O ASP A 123 2.820 -8.923 10.015 1.00 2.13 O ATOM 1923 CB ASP A 123 1.680 -10.852 12.261 1.00 54.42 C ATOM 1924 CG ASP A 123 1.336 -9.829 13.356 1.00 21.31 C ATOM 1925 OD1 ASP A 123 0.148 -9.707 13.713 1.00 41.51 O ATOM 1926 OD2 ASP A 123 2.244 -9.130 13.850 1.00 64.30 O ATOM 0 H ASP A 123 2.194 -12.189 10.272 1.00 45.40 H new ATOM 0 HA ASP A 123 0.067 -10.415 10.855 1.00 20.54 H new ATOM 0 HB2 ASP A 123 1.263 -11.820 12.538 1.00 54.42 H new ATOM 0 HB3 ASP A 123 2.762 -10.972 12.216 1.00 54.42 H new ATOM 1931 N GLY A 124 0.843 -8.027 10.660 1.00 61.35 N ATOM 1932 CA GLY A 124 1.221 -6.629 10.393 1.00 63.44 C ATOM 1933 C GLY A 124 0.172 -5.913 9.566 1.00 3.11 C ATOM 1934 O GLY A 124 0.002 -4.690 9.680 1.00 34.31 O ATOM 0 H GLY A 124 -0.110 -8.138 11.006 1.00 61.35 H new ATOM 0 HA2 GLY A 124 1.361 -6.103 11.337 1.00 63.44 H new ATOM 0 HA3 GLY A 124 2.177 -6.604 9.869 1.00 63.44 H new ATOM 1938 N GLY A 125 -0.538 -6.684 8.734 1.00 71.23 N ATOM 1939 CA GLY A 125 -1.542 -6.153 7.817 1.00 62.20 C ATOM 1940 C GLY A 125 -1.263 -6.559 6.386 1.00 54.23 C ATOM 1941 O GLY A 125 -0.449 -7.462 6.145 1.00 24.21 O ATOM 0 H GLY A 125 -0.429 -7.697 8.681 1.00 71.23 H new ATOM 0 HA2 GLY A 125 -2.529 -6.511 8.111 1.00 62.20 H new ATOM 0 HA3 GLY A 125 -1.562 -5.066 7.889 1.00 62.20 H new ATOM 1945 N ARG A 126 -1.957 -5.907 5.438 1.00 71.23 N ATOM 1946 CA ARG A 126 -1.668 -5.972 3.990 1.00 30.44 C ATOM 1947 C ARG A 126 -1.463 -4.538 3.492 1.00 32.53 C ATOM 1948 O ARG A 126 -2.106 -3.619 3.977 1.00 61.13 O ATOM 1949 CB ARG A 126 -2.800 -6.702 3.223 1.00 74.10 C ATOM 1950 CG ARG A 126 -3.012 -8.182 3.630 1.00 42.12 C ATOM 1951 CD ARG A 126 -1.884 -9.138 3.165 1.00 53.32 C ATOM 1952 NE ARG A 126 -0.576 -8.938 3.843 1.00 4.23 N ATOM 1953 CZ ARG A 126 0.425 -9.838 3.864 1.00 24.31 C ATOM 1954 NH1 ARG A 126 0.307 -11.008 3.234 1.00 32.41 N ATOM 1955 NH2 ARG A 126 1.522 -9.582 4.566 1.00 64.04 N ATOM 0 H ARG A 126 -2.752 -5.307 5.659 1.00 71.23 H new ATOM 0 HA ARG A 126 -0.764 -6.553 3.808 1.00 30.44 H new ATOM 0 HB2 ARG A 126 -3.733 -6.160 3.378 1.00 74.10 H new ATOM 0 HB3 ARG A 126 -2.582 -6.661 2.156 1.00 74.10 H new ATOM 0 HG2 ARG A 126 -3.097 -8.240 4.715 1.00 42.12 H new ATOM 0 HG3 ARG A 126 -3.959 -8.528 3.217 1.00 42.12 H new ATOM 0 HD2 ARG A 126 -2.208 -10.166 3.328 1.00 53.32 H new ATOM 0 HD3 ARG A 126 -1.743 -9.015 2.091 1.00 53.32 H new ATOM 0 HE ARG A 126 -0.426 -8.053 4.328 1.00 4.23 H new ATOM 0 HH11 ARG A 126 -0.550 -11.230 2.728 1.00 32.41 H new ATOM 0 HH12 ARG A 126 1.074 -11.680 3.259 1.00 32.41 H new ATOM 0 HH21 ARG A 126 1.603 -8.708 5.085 1.00 64.04 H new ATOM 0 HH22 ARG A 126 2.284 -10.260 4.586 1.00 64.04 H new ATOM 1969 N TYR A 127 -0.550 -4.338 2.538 1.00 55.00 N ATOM 1970 CA TYR A 127 0.068 -3.008 2.305 1.00 23.15 C ATOM 1971 C TYR A 127 -0.122 -2.593 0.848 1.00 71.02 C ATOM 1972 O TYR A 127 0.195 -3.342 -0.064 1.00 21.10 O ATOM 1973 CB TYR A 127 1.590 -3.046 2.692 1.00 1.42 C ATOM 1974 CG TYR A 127 1.909 -4.146 3.724 1.00 12.32 C ATOM 1975 CD1 TYR A 127 2.187 -5.431 3.286 1.00 42.21 C ATOM 1976 CD2 TYR A 127 1.852 -3.933 5.103 1.00 34.33 C ATOM 1977 CE1 TYR A 127 2.414 -6.455 4.172 1.00 20.03 C ATOM 1978 CE2 TYR A 127 2.088 -4.960 6.000 1.00 22.51 C ATOM 1979 CZ TYR A 127 2.370 -6.221 5.523 1.00 53.34 C ATOM 1980 OH TYR A 127 2.599 -7.263 6.400 1.00 21.02 O ATOM 0 H TYR A 127 -0.216 -5.070 1.911 1.00 55.00 H new ATOM 0 HA TYR A 127 -0.422 -2.266 2.936 1.00 23.15 H new ATOM 0 HB2 TYR A 127 2.186 -3.211 1.794 1.00 1.42 H new ATOM 0 HB3 TYR A 127 1.883 -2.077 3.096 1.00 1.42 H new ATOM 0 HD1 TYR A 127 2.226 -5.631 2.225 1.00 42.21 H new ATOM 0 HD2 TYR A 127 1.619 -2.947 5.477 1.00 34.33 H new ATOM 0 HE1 TYR A 127 2.628 -7.448 3.804 1.00 20.03 H new ATOM 0 HE2 TYR A 127 2.051 -4.775 7.063 1.00 22.51 H new ATOM 0 HH TYR A 127 2.534 -6.935 7.321 1.00 21.02 H new ATOM 1990 N MET A 128 -0.610 -1.373 0.661 1.00 74.51 N ATOM 1991 CA MET A 128 -1.038 -0.846 -0.649 1.00 44.13 C ATOM 1992 C MET A 128 -0.225 0.387 -1.051 1.00 32.43 C ATOM 1993 O MET A 128 0.387 1.051 -0.213 1.00 1.11 O ATOM 1994 CB MET A 128 -2.547 -0.489 -0.619 1.00 31.42 C ATOM 1995 CG MET A 128 -3.509 -1.678 -0.711 1.00 1.14 C ATOM 1996 SD MET A 128 -5.095 -1.199 -1.416 1.00 20.02 S ATOM 1997 CE MET A 128 -5.560 0.182 -0.377 1.00 73.32 C ATOM 0 H MET A 128 -0.725 -0.703 1.422 1.00 74.51 H new ATOM 0 HA MET A 128 -0.864 -1.626 -1.390 1.00 44.13 H new ATOM 0 HB2 MET A 128 -2.756 0.054 0.303 1.00 31.42 H new ATOM 0 HB3 MET A 128 -2.758 0.191 -1.444 1.00 31.42 H new ATOM 0 HG2 MET A 128 -3.061 -2.462 -1.322 1.00 1.14 H new ATOM 0 HG3 MET A 128 -3.665 -2.098 0.283 1.00 1.14 H new ATOM 0 HE1 MET A 128 -6.613 0.415 -0.532 1.00 73.32 H new ATOM 0 HE2 MET A 128 -5.396 -0.078 0.669 1.00 73.32 H new ATOM 0 HE3 MET A 128 -4.954 1.051 -0.634 1.00 73.32 H new ATOM 2007 N GLU A 129 -0.250 0.666 -2.360 1.00 5.23 N ATOM 2008 CA GLU A 129 0.377 1.839 -2.977 1.00 51.42 C ATOM 2009 C GLU A 129 -0.556 2.389 -4.072 1.00 5.32 C ATOM 2010 O GLU A 129 -1.004 1.632 -4.945 1.00 33.22 O ATOM 2011 CB GLU A 129 1.738 1.418 -3.583 1.00 61.00 C ATOM 2012 CG GLU A 129 2.455 2.502 -4.417 1.00 34.01 C ATOM 2013 CD GLU A 129 3.648 1.934 -5.193 1.00 31.15 C ATOM 2014 OE1 GLU A 129 3.419 1.183 -6.172 1.00 44.14 O ATOM 2015 OE2 GLU A 129 4.811 2.206 -4.828 1.00 0.31 O ATOM 0 H GLU A 129 -0.720 0.065 -3.037 1.00 5.23 H new ATOM 0 HA GLU A 129 0.545 2.618 -2.234 1.00 51.42 H new ATOM 0 HB2 GLU A 129 2.399 1.112 -2.772 1.00 61.00 H new ATOM 0 HB3 GLU A 129 1.581 0.543 -4.214 1.00 61.00 H new ATOM 0 HG2 GLU A 129 1.748 2.949 -5.116 1.00 34.01 H new ATOM 0 HG3 GLU A 129 2.798 3.299 -3.757 1.00 34.01 H new ATOM 2022 N LEU A 130 -0.861 3.698 -4.012 1.00 22.10 N ATOM 2023 CA LEU A 130 -1.682 4.390 -5.025 1.00 44.32 C ATOM 2024 C LEU A 130 -0.859 5.521 -5.643 1.00 13.24 C ATOM 2025 O LEU A 130 -0.003 6.116 -4.971 1.00 20.40 O ATOM 2026 CB LEU A 130 -3.011 4.994 -4.435 1.00 63.33 C ATOM 2027 CG LEU A 130 -3.648 4.264 -3.205 1.00 41.12 C ATOM 2028 CD1 LEU A 130 -2.974 4.706 -1.891 1.00 23.31 C ATOM 2029 CD2 LEU A 130 -5.167 4.489 -3.141 1.00 42.01 C ATOM 0 H LEU A 130 -0.545 4.308 -3.258 1.00 22.10 H new ATOM 0 HA LEU A 130 -1.966 3.647 -5.770 1.00 44.32 H new ATOM 0 HB2 LEU A 130 -2.814 6.027 -4.149 1.00 63.33 H new ATOM 0 HB3 LEU A 130 -3.753 5.020 -5.233 1.00 63.33 H new ATOM 0 HG LEU A 130 -3.477 3.195 -3.334 1.00 41.12 H new ATOM 0 HD11 LEU A 130 -3.435 4.184 -1.052 1.00 23.31 H new ATOM 0 HD12 LEU A 130 -1.912 4.466 -1.928 1.00 23.31 H new ATOM 0 HD13 LEU A 130 -3.098 5.781 -1.762 1.00 23.31 H new ATOM 0 HD21 LEU A 130 -5.576 3.968 -2.275 1.00 42.01 H new ATOM 0 HD22 LEU A 130 -5.373 5.556 -3.054 1.00 42.01 H new ATOM 0 HD23 LEU A 130 -5.631 4.103 -4.049 1.00 42.01 H new ATOM 2041 N GLU A 131 -1.140 5.812 -6.916 1.00 12.43 N ATOM 2042 CA GLU A 131 -0.614 6.984 -7.626 1.00 12.41 C ATOM 2043 C GLU A 131 -1.803 7.679 -8.329 1.00 4.02 C ATOM 2044 O GLU A 131 -2.180 7.291 -9.439 1.00 50.41 O ATOM 2045 CB GLU A 131 0.526 6.595 -8.609 1.00 50.54 C ATOM 2046 CG GLU A 131 1.765 5.995 -7.904 1.00 33.35 C ATOM 2047 CD GLU A 131 2.933 5.708 -8.846 1.00 1.43 C ATOM 2048 OE1 GLU A 131 2.787 4.831 -9.724 1.00 21.30 O ATOM 2049 OE2 GLU A 131 3.996 6.363 -8.729 1.00 54.42 O ATOM 0 H GLU A 131 -1.749 5.231 -7.493 1.00 12.43 H new ATOM 0 HA GLU A 131 -0.156 7.681 -6.924 1.00 12.41 H new ATOM 0 HB2 GLU A 131 0.143 5.874 -9.331 1.00 50.54 H new ATOM 0 HB3 GLU A 131 0.829 7.479 -9.171 1.00 50.54 H new ATOM 0 HG2 GLU A 131 2.098 6.683 -7.127 1.00 33.35 H new ATOM 0 HG3 GLU A 131 1.476 5.069 -7.407 1.00 33.35 H new ATOM 2056 N PRO A 132 -2.453 8.678 -7.637 1.00 2.33 N ATOM 2057 CA PRO A 132 -3.651 9.403 -8.155 1.00 42.52 C ATOM 2058 C PRO A 132 -3.395 10.192 -9.463 1.00 42.32 C ATOM 2059 O PRO A 132 -2.241 10.360 -9.897 1.00 62.24 O ATOM 2060 CB PRO A 132 -4.021 10.358 -6.980 1.00 43.13 C ATOM 2061 CG PRO A 132 -2.753 10.508 -6.193 1.00 11.21 C ATOM 2062 CD PRO A 132 -2.089 9.162 -6.270 1.00 25.34 C ATOM 0 HA PRO A 132 -4.445 8.711 -8.434 1.00 42.52 H new ATOM 0 HB2 PRO A 132 -4.373 11.321 -7.349 1.00 43.13 H new ATOM 0 HB3 PRO A 132 -4.820 9.940 -6.367 1.00 43.13 H new ATOM 0 HG2 PRO A 132 -2.117 11.287 -6.613 1.00 11.21 H new ATOM 0 HG3 PRO A 132 -2.960 10.788 -5.160 1.00 11.21 H new ATOM 0 HD2 PRO A 132 -1.009 9.238 -6.144 1.00 25.34 H new ATOM 0 HD3 PRO A 132 -2.453 8.488 -5.494 1.00 25.34 H new ATOM 2070 N ASP A 133 -4.503 10.697 -10.047 1.00 3.50 N ATOM 2071 CA ASP A 133 -4.511 11.407 -11.336 1.00 71.42 C ATOM 2072 C ASP A 133 -3.723 12.714 -11.218 1.00 13.04 C ATOM 2073 O ASP A 133 -2.900 13.038 -12.082 1.00 61.13 O ATOM 2074 CB ASP A 133 -5.980 11.665 -11.789 1.00 12.13 C ATOM 2075 CG ASP A 133 -6.098 12.520 -13.069 1.00 72.44 C ATOM 2076 OD1 ASP A 133 -5.703 12.040 -14.154 1.00 71.45 O ATOM 2077 OD2 ASP A 133 -6.568 13.677 -12.992 1.00 70.11 O ATOM 0 H ASP A 133 -5.429 10.620 -9.626 1.00 3.50 H new ATOM 0 HA ASP A 133 -4.027 10.792 -12.095 1.00 71.42 H new ATOM 0 HB2 ASP A 133 -6.472 10.707 -11.957 1.00 12.13 H new ATOM 0 HB3 ASP A 133 -6.517 12.162 -10.981 1.00 12.13 H new ATOM 2082 N ARG A 134 -3.990 13.457 -10.137 1.00 51.51 N ATOM 2083 CA ARG A 134 -3.168 14.599 -9.703 1.00 63.02 C ATOM 2084 C ARG A 134 -2.768 14.395 -8.231 1.00 13.23 C ATOM 2085 O ARG A 134 -3.192 13.422 -7.610 1.00 60.23 O ATOM 2086 CB ARG A 134 -3.943 15.925 -9.955 1.00 10.25 C ATOM 2087 CG ARG A 134 -5.322 16.062 -9.237 1.00 12.51 C ATOM 2088 CD ARG A 134 -5.237 16.747 -7.855 1.00 64.34 C ATOM 2089 NE ARG A 134 -6.518 17.329 -7.425 1.00 20.25 N ATOM 2090 CZ ARG A 134 -6.799 18.648 -7.405 1.00 75.41 C ATOM 2091 NH1 ARG A 134 -5.898 19.548 -7.793 1.00 62.25 N ATOM 2092 NH2 ARG A 134 -7.976 19.062 -6.964 1.00 21.12 N ATOM 0 H ARG A 134 -4.791 13.282 -9.531 1.00 51.51 H new ATOM 0 HA ARG A 134 -2.246 14.664 -10.281 1.00 63.02 H new ATOM 0 HB2 ARG A 134 -3.310 16.756 -9.644 1.00 10.25 H new ATOM 0 HB3 ARG A 134 -4.103 16.030 -11.028 1.00 10.25 H new ATOM 0 HG2 ARG A 134 -5.998 16.632 -9.874 1.00 12.51 H new ATOM 0 HG3 ARG A 134 -5.758 15.071 -9.115 1.00 12.51 H new ATOM 0 HD2 ARG A 134 -4.907 16.019 -7.114 1.00 64.34 H new ATOM 0 HD3 ARG A 134 -4.481 17.531 -7.890 1.00 64.34 H new ATOM 0 HE ARG A 134 -7.249 16.687 -7.119 1.00 20.25 H new ATOM 0 HH11 ARG A 134 -4.978 19.244 -8.112 1.00 62.25 H new ATOM 0 HH12 ARG A 134 -6.128 20.542 -7.771 1.00 62.25 H new ATOM 0 HH21 ARG A 134 -8.667 18.384 -6.641 1.00 21.12 H new ATOM 0 HH22 ARG A 134 -8.193 20.059 -6.947 1.00 21.12 H new ATOM 2106 N ASP A 135 -1.969 15.318 -7.668 1.00 64.54 N ATOM 2107 CA ASP A 135 -1.431 15.154 -6.300 1.00 41.52 C ATOM 2108 C ASP A 135 -2.482 15.669 -5.304 1.00 21.34 C ATOM 2109 O ASP A 135 -3.048 16.746 -5.509 1.00 12.15 O ATOM 2110 CB ASP A 135 -0.069 15.892 -6.133 1.00 63.13 C ATOM 2111 CG ASP A 135 0.780 15.305 -4.986 1.00 21.42 C ATOM 2112 OD1 ASP A 135 0.577 15.685 -3.815 1.00 32.30 O ATOM 2113 OD2 ASP A 135 1.630 14.425 -5.263 1.00 34.23 O ATOM 0 H ASP A 135 -1.681 16.180 -8.132 1.00 64.54 H new ATOM 0 HA ASP A 135 -1.232 14.100 -6.106 1.00 41.52 H new ATOM 0 HB2 ASP A 135 0.492 15.830 -7.066 1.00 63.13 H new ATOM 0 HB3 ASP A 135 -0.253 16.949 -5.942 1.00 63.13 H new ATOM 2118 N LEU A 136 -2.730 14.912 -4.225 1.00 64.24 N ATOM 2119 CA LEU A 136 -3.934 15.089 -3.388 1.00 55.40 C ATOM 2120 C LEU A 136 -3.700 16.070 -2.232 1.00 4.53 C ATOM 2121 O LEU A 136 -2.573 16.247 -1.761 1.00 70.52 O ATOM 2122 CB LEU A 136 -4.407 13.717 -2.845 1.00 23.03 C ATOM 2123 CG LEU A 136 -4.761 12.655 -3.928 1.00 22.01 C ATOM 2124 CD1 LEU A 136 -5.180 11.323 -3.286 1.00 13.31 C ATOM 2125 CD2 LEU A 136 -5.845 13.173 -4.900 1.00 42.51 C ATOM 0 H LEU A 136 -2.111 14.166 -3.907 1.00 64.24 H new ATOM 0 HA LEU A 136 -4.712 15.519 -4.019 1.00 55.40 H new ATOM 0 HB2 LEU A 136 -3.625 13.310 -2.204 1.00 23.03 H new ATOM 0 HB3 LEU A 136 -5.283 13.877 -2.217 1.00 23.03 H new ATOM 0 HG LEU A 136 -3.859 12.473 -4.513 1.00 22.01 H new ATOM 0 HD11 LEU A 136 -5.421 10.602 -4.067 1.00 13.31 H new ATOM 0 HD12 LEU A 136 -4.361 10.939 -2.678 1.00 13.31 H new ATOM 0 HD13 LEU A 136 -6.056 11.482 -2.657 1.00 13.31 H new ATOM 0 HD21 LEU A 136 -6.066 12.405 -5.641 1.00 42.51 H new ATOM 0 HD22 LEU A 136 -6.751 13.410 -4.342 1.00 42.51 H new ATOM 0 HD23 LEU A 136 -5.484 14.070 -5.403 1.00 42.51 H new ATOM 2137 N SER A 137 -4.805 16.678 -1.787 1.00 60.42 N ATOM 2138 CA SER A 137 -4.859 17.633 -0.674 1.00 62.32 C ATOM 2139 C SER A 137 -6.151 17.406 0.132 1.00 64.22 C ATOM 2140 O SER A 137 -7.005 16.596 -0.258 1.00 61.50 O ATOM 2141 CB SER A 137 -4.786 19.086 -1.205 1.00 61.14 C ATOM 2142 OG SER A 137 -3.562 19.322 -1.883 1.00 43.03 O ATOM 0 H SER A 137 -5.720 16.513 -2.207 1.00 60.42 H new ATOM 0 HA SER A 137 -4.003 17.474 -0.019 1.00 62.32 H new ATOM 0 HB2 SER A 137 -5.621 19.272 -1.881 1.00 61.14 H new ATOM 0 HB3 SER A 137 -4.886 19.785 -0.375 1.00 61.14 H new ATOM 0 HG SER A 137 -3.542 20.246 -2.210 1.00 43.03 H new ATOM 2148 N ASP A 138 -6.260 18.108 1.277 1.00 55.43 N ATOM 2149 CA ASP A 138 -7.430 18.052 2.167 1.00 61.04 C ATOM 2150 C ASP A 138 -8.686 18.569 1.433 1.00 23.41 C ATOM 2151 O ASP A 138 -8.863 19.770 1.241 1.00 51.03 O ATOM 2152 CB ASP A 138 -7.160 18.835 3.492 1.00 2.02 C ATOM 2153 CG ASP A 138 -6.606 20.261 3.297 1.00 71.51 C ATOM 2154 OD1 ASP A 138 -5.413 20.408 2.947 1.00 64.12 O ATOM 2155 OD2 ASP A 138 -7.359 21.242 3.479 1.00 40.33 O ATOM 0 H ASP A 138 -5.529 18.736 1.611 1.00 55.43 H new ATOM 0 HA ASP A 138 -7.614 17.014 2.443 1.00 61.04 H new ATOM 0 HB2 ASP A 138 -8.090 18.895 4.058 1.00 2.02 H new ATOM 0 HB3 ASP A 138 -6.455 18.266 4.097 1.00 2.02 H new ATOM 2160 N GLY A 139 -9.512 17.619 0.961 1.00 12.12 N ATOM 2161 CA GLY A 139 -10.740 17.931 0.225 1.00 11.32 C ATOM 2162 C GLY A 139 -10.879 17.091 -1.037 1.00 0.42 C ATOM 2163 O GLY A 139 -11.990 16.920 -1.549 1.00 64.32 O ATOM 0 H GLY A 139 -9.345 16.620 1.080 1.00 12.12 H new ATOM 0 HA2 GLY A 139 -11.602 17.761 0.870 1.00 11.32 H new ATOM 0 HA3 GLY A 139 -10.744 18.988 -0.041 1.00 11.32 H new ATOM 2167 N ASP A 140 -9.740 16.584 -1.552 1.00 22.30 N ATOM 2168 CA ASP A 140 -9.717 15.653 -2.702 1.00 23.54 C ATOM 2169 C ASP A 140 -10.286 14.290 -2.305 1.00 73.44 C ATOM 2170 O ASP A 140 -10.392 13.977 -1.126 1.00 3.41 O ATOM 2171 CB ASP A 140 -8.274 15.477 -3.258 1.00 54.35 C ATOM 2172 CG ASP A 140 -7.812 16.673 -4.094 1.00 41.23 C ATOM 2173 OD1 ASP A 140 -8.413 16.907 -5.152 1.00 13.13 O ATOM 2174 OD2 ASP A 140 -6.877 17.389 -3.695 1.00 24.23 O ATOM 0 H ASP A 140 -8.814 16.806 -1.186 1.00 22.30 H new ATOM 0 HA ASP A 140 -10.339 16.086 -3.486 1.00 23.54 H new ATOM 0 HB2 ASP A 140 -7.584 15.332 -2.427 1.00 54.35 H new ATOM 0 HB3 ASP A 140 -8.232 14.575 -3.868 1.00 54.35 H new ATOM 2179 N GLU A 141 -10.678 13.500 -3.309 1.00 10.04 N ATOM 2180 CA GLU A 141 -11.112 12.103 -3.125 1.00 72.40 C ATOM 2181 C GLU A 141 -10.072 11.149 -3.749 1.00 4.10 C ATOM 2182 O GLU A 141 -9.151 11.602 -4.447 1.00 50.25 O ATOM 2183 CB GLU A 141 -12.506 11.920 -3.768 1.00 65.02 C ATOM 2184 CG GLU A 141 -13.576 12.882 -3.213 1.00 54.44 C ATOM 2185 CD GLU A 141 -14.871 12.868 -4.030 1.00 43.42 C ATOM 2186 OE1 GLU A 141 -14.987 13.663 -4.988 1.00 14.41 O ATOM 2187 OE2 GLU A 141 -15.774 12.053 -3.732 1.00 14.12 O ATOM 0 H GLU A 141 -10.705 13.810 -4.281 1.00 10.04 H new ATOM 0 HA GLU A 141 -11.187 11.866 -2.064 1.00 72.40 H new ATOM 0 HB2 GLU A 141 -12.422 12.067 -4.845 1.00 65.02 H new ATOM 0 HB3 GLU A 141 -12.837 10.893 -3.611 1.00 65.02 H new ATOM 0 HG2 GLU A 141 -13.800 12.612 -2.181 1.00 54.44 H new ATOM 0 HG3 GLU A 141 -13.173 13.895 -3.197 1.00 54.44 H new ATOM 2194 N ILE A 142 -10.228 9.836 -3.492 1.00 33.51 N ATOM 2195 CA ILE A 142 -9.269 8.797 -3.914 1.00 55.24 C ATOM 2196 C ILE A 142 -9.926 7.398 -3.809 1.00 3.43 C ATOM 2197 O ILE A 142 -10.691 7.125 -2.877 1.00 1.31 O ATOM 2198 CB ILE A 142 -7.954 8.869 -3.040 1.00 23.00 C ATOM 2199 CG1 ILE A 142 -6.891 7.793 -3.456 1.00 60.22 C ATOM 2200 CG2 ILE A 142 -8.284 8.788 -1.529 1.00 21.42 C ATOM 2201 CD1 ILE A 142 -6.334 7.944 -4.870 1.00 0.13 C ATOM 0 H ILE A 142 -11.029 9.464 -2.982 1.00 33.51 H new ATOM 0 HA ILE A 142 -8.992 8.973 -4.953 1.00 55.24 H new ATOM 0 HB ILE A 142 -7.499 9.840 -3.235 1.00 23.00 H new ATOM 0 HG12 ILE A 142 -6.062 7.832 -2.750 1.00 60.22 H new ATOM 0 HG13 ILE A 142 -7.342 6.805 -3.364 1.00 60.22 H new ATOM 0 HG21 ILE A 142 -7.361 8.840 -0.952 1.00 21.42 H new ATOM 0 HG22 ILE A 142 -8.932 9.620 -1.253 1.00 21.42 H new ATOM 0 HG23 ILE A 142 -8.792 7.847 -1.317 1.00 21.42 H new ATOM 0 HD11 ILE A 142 -5.608 7.154 -5.061 1.00 0.13 H new ATOM 0 HD12 ILE A 142 -7.148 7.871 -5.591 1.00 0.13 H new ATOM 0 HD13 ILE A 142 -5.848 8.915 -4.968 1.00 0.13 H new ATOM 2213 N THR A 143 -9.625 6.529 -4.777 1.00 44.32 N ATOM 2214 CA THR A 143 -10.181 5.173 -4.871 1.00 52.53 C ATOM 2215 C THR A 143 -9.293 4.177 -4.082 1.00 14.11 C ATOM 2216 O THR A 143 -8.080 4.149 -4.290 1.00 11.12 O ATOM 2217 CB THR A 143 -10.257 4.767 -6.375 1.00 42.34 C ATOM 2218 OG1 THR A 143 -11.014 5.750 -7.104 1.00 63.24 O ATOM 2219 CG2 THR A 143 -10.893 3.394 -6.571 1.00 70.15 C ATOM 0 H THR A 143 -8.976 6.750 -5.532 1.00 44.32 H new ATOM 0 HA THR A 143 -11.181 5.150 -4.438 1.00 52.53 H new ATOM 0 HB THR A 143 -9.235 4.717 -6.751 1.00 42.34 H new ATOM 0 HG1 THR A 143 -11.059 5.494 -8.049 1.00 63.24 H new ATOM 0 HG21 THR A 143 -10.924 3.156 -7.634 1.00 70.15 H new ATOM 0 HG22 THR A 143 -10.303 2.642 -6.047 1.00 70.15 H new ATOM 0 HG23 THR A 143 -11.907 3.402 -6.172 1.00 70.15 H new ATOM 2227 N LEU A 144 -9.904 3.368 -3.181 1.00 51.34 N ATOM 2228 CA LEU A 144 -9.185 2.420 -2.287 1.00 15.45 C ATOM 2229 C LEU A 144 -9.716 1.000 -2.545 1.00 50.42 C ATOM 2230 O LEU A 144 -10.828 0.676 -2.126 1.00 31.11 O ATOM 2231 CB LEU A 144 -9.407 2.773 -0.765 1.00 45.34 C ATOM 2232 CG LEU A 144 -8.510 3.873 -0.110 1.00 63.14 C ATOM 2233 CD1 LEU A 144 -7.038 3.427 -0.024 1.00 25.32 C ATOM 2234 CD2 LEU A 144 -8.643 5.222 -0.833 1.00 60.52 C ATOM 0 H LEU A 144 -10.916 3.353 -3.052 1.00 51.34 H new ATOM 0 HA LEU A 144 -8.119 2.489 -2.503 1.00 15.45 H new ATOM 0 HB2 LEU A 144 -10.446 3.080 -0.645 1.00 45.34 H new ATOM 0 HB3 LEU A 144 -9.277 1.856 -0.191 1.00 45.34 H new ATOM 0 HG LEU A 144 -8.871 4.014 0.909 1.00 63.14 H new ATOM 0 HD11 LEU A 144 -6.445 4.217 0.437 1.00 25.32 H new ATOM 0 HD12 LEU A 144 -6.967 2.521 0.579 1.00 25.32 H new ATOM 0 HD13 LEU A 144 -6.659 3.227 -1.026 1.00 25.32 H new ATOM 0 HD21 LEU A 144 -8.004 5.960 -0.347 1.00 60.52 H new ATOM 0 HD22 LEU A 144 -8.340 5.108 -1.874 1.00 60.52 H new ATOM 0 HD23 LEU A 144 -9.680 5.556 -0.791 1.00 60.52 H new ATOM 2246 N ASP A 145 -8.954 0.162 -3.261 1.00 45.20 N ATOM 2247 CA ASP A 145 -9.258 -1.283 -3.361 1.00 13.45 C ATOM 2248 C ASP A 145 -8.065 -2.122 -2.913 1.00 5.11 C ATOM 2249 O ASP A 145 -6.992 -2.124 -3.518 1.00 25.40 O ATOM 2250 CB ASP A 145 -9.791 -1.704 -4.749 1.00 23.00 C ATOM 2251 CG ASP A 145 -8.970 -1.275 -5.957 1.00 55.32 C ATOM 2252 OD1 ASP A 145 -8.725 -0.061 -6.129 1.00 41.22 O ATOM 2253 OD2 ASP A 145 -8.632 -2.145 -6.769 1.00 42.14 O ATOM 0 H ASP A 145 -8.125 0.452 -3.779 1.00 45.20 H new ATOM 0 HA ASP A 145 -10.080 -1.480 -2.673 1.00 13.45 H new ATOM 0 HB2 ASP A 145 -9.877 -2.790 -4.765 1.00 23.00 H new ATOM 0 HB3 ASP A 145 -10.798 -1.303 -4.863 1.00 23.00 H new ATOM 2258 N PHE A 146 -8.314 -2.837 -1.811 1.00 15.24 N ATOM 2259 CA PHE A 146 -7.335 -3.651 -1.063 1.00 60.13 C ATOM 2260 C PHE A 146 -6.786 -4.856 -1.860 1.00 23.02 C ATOM 2261 O PHE A 146 -5.877 -5.557 -1.396 1.00 13.34 O ATOM 2262 CB PHE A 146 -8.006 -4.104 0.258 1.00 11.43 C ATOM 2263 CG PHE A 146 -8.721 -2.953 0.982 1.00 23.31 C ATOM 2264 CD1 PHE A 146 -8.066 -1.750 1.223 1.00 24.23 C ATOM 2265 CD2 PHE A 146 -10.049 -3.051 1.360 1.00 20.42 C ATOM 2266 CE1 PHE A 146 -8.712 -0.699 1.822 1.00 12.11 C ATOM 2267 CE2 PHE A 146 -10.702 -1.992 1.959 1.00 74.11 C ATOM 2268 CZ PHE A 146 -10.033 -0.817 2.190 1.00 74.14 C ATOM 0 H PHE A 146 -9.244 -2.869 -1.393 1.00 15.24 H new ATOM 0 HA PHE A 146 -6.459 -3.035 -0.862 1.00 60.13 H new ATOM 0 HB2 PHE A 146 -8.724 -4.895 0.044 1.00 11.43 H new ATOM 0 HB3 PHE A 146 -7.250 -4.530 0.918 1.00 11.43 H new ATOM 0 HD1 PHE A 146 -7.031 -1.642 0.934 1.00 24.23 H new ATOM 0 HD2 PHE A 146 -10.584 -3.972 1.183 1.00 20.42 H new ATOM 0 HE1 PHE A 146 -8.182 0.224 2.006 1.00 12.11 H new ATOM 0 HE2 PHE A 146 -11.739 -2.089 2.245 1.00 74.11 H new ATOM 0 HZ PHE A 146 -10.541 0.013 2.659 1.00 74.14 H new ATOM 2278 N ASN A 147 -7.330 -5.055 -3.066 1.00 72.42 N ATOM 2279 CA ASN A 147 -6.926 -6.111 -4.003 1.00 65.34 C ATOM 2280 C ASN A 147 -5.614 -5.763 -4.737 1.00 74.24 C ATOM 2281 O ASN A 147 -5.127 -6.556 -5.542 1.00 22.12 O ATOM 2282 CB ASN A 147 -8.069 -6.311 -5.026 1.00 63.31 C ATOM 2283 CG ASN A 147 -9.383 -6.737 -4.365 1.00 50.24 C ATOM 2284 OD1 ASN A 147 -10.162 -5.905 -3.904 1.00 13.41 O ATOM 2285 ND2 ASN A 147 -9.640 -8.035 -4.319 1.00 3.21 N ATOM 0 H ASN A 147 -8.084 -4.471 -3.427 1.00 72.42 H new ATOM 0 HA ASN A 147 -6.742 -7.027 -3.442 1.00 65.34 H new ATOM 0 HB2 ASN A 147 -8.227 -5.383 -5.575 1.00 63.31 H new ATOM 0 HB3 ASN A 147 -7.772 -7.065 -5.754 1.00 63.31 H new ATOM 0 HD21 ASN A 147 -10.504 -8.369 -3.892 1.00 3.21 H new ATOM 0 HD22 ASN A 147 -8.974 -8.701 -4.710 1.00 3.21 H new ATOM 2292 N LEU A 148 -5.059 -4.562 -4.478 1.00 55.14 N ATOM 2293 CA LEU A 148 -3.827 -4.074 -5.143 1.00 4.35 C ATOM 2294 C LEU A 148 -2.624 -4.135 -4.191 1.00 54.44 C ATOM 2295 O LEU A 148 -1.576 -3.538 -4.470 1.00 50.43 O ATOM 2296 CB LEU A 148 -4.045 -2.619 -5.648 1.00 20.23 C ATOM 2297 CG LEU A 148 -5.410 -2.342 -6.341 1.00 44.35 C ATOM 2298 CD1 LEU A 148 -5.514 -0.895 -6.861 1.00 13.25 C ATOM 2299 CD2 LEU A 148 -5.720 -3.371 -7.453 1.00 14.01 C ATOM 0 H LEU A 148 -5.448 -3.902 -3.804 1.00 55.14 H new ATOM 0 HA LEU A 148 -3.613 -4.721 -5.993 1.00 4.35 H new ATOM 0 HB2 LEU A 148 -3.945 -1.941 -4.800 1.00 20.23 H new ATOM 0 HB3 LEU A 148 -3.247 -2.374 -6.348 1.00 20.23 H new ATOM 0 HG LEU A 148 -6.175 -2.462 -5.574 1.00 44.35 H new ATOM 0 HD11 LEU A 148 -6.484 -0.748 -7.337 1.00 13.25 H new ATOM 0 HD12 LEU A 148 -5.410 -0.200 -6.027 1.00 13.25 H new ATOM 0 HD13 LEU A 148 -4.722 -0.711 -7.587 1.00 13.25 H new ATOM 0 HD21 LEU A 148 -6.683 -3.137 -7.908 1.00 14.01 H new ATOM 0 HD22 LEU A 148 -4.940 -3.331 -8.214 1.00 14.01 H new ATOM 0 HD23 LEU A 148 -5.756 -4.372 -7.023 1.00 14.01 H new ATOM 2311 N ALA A 149 -2.782 -4.874 -3.073 1.00 24.31 N ATOM 2312 CA ALA A 149 -1.748 -4.982 -2.033 1.00 12.12 C ATOM 2313 C ALA A 149 -0.549 -5.826 -2.515 1.00 24.22 C ATOM 2314 O ALA A 149 -0.707 -6.758 -3.313 1.00 72.33 O ATOM 2315 CB ALA A 149 -2.347 -5.550 -0.731 1.00 30.14 C ATOM 0 H ALA A 149 -3.627 -5.408 -2.870 1.00 24.31 H new ATOM 0 HA ALA A 149 -1.373 -3.980 -1.825 1.00 12.12 H new ATOM 0 HB1 ALA A 149 -1.567 -5.623 0.027 1.00 30.14 H new ATOM 0 HB2 ALA A 149 -3.138 -4.889 -0.376 1.00 30.14 H new ATOM 0 HB3 ALA A 149 -2.760 -6.540 -0.922 1.00 30.14 H new ATOM 2321 N TYR A 150 0.654 -5.464 -2.039 1.00 55.34 N ATOM 2322 CA TYR A 150 1.921 -6.118 -2.409 1.00 15.11 C ATOM 2323 C TYR A 150 2.553 -6.756 -1.158 1.00 64.30 C ATOM 2324 O TYR A 150 2.302 -6.300 -0.029 1.00 40.22 O ATOM 2325 CB TYR A 150 2.898 -5.080 -3.038 1.00 13.31 C ATOM 2326 CG TYR A 150 2.293 -4.230 -4.183 1.00 43.33 C ATOM 2327 CD1 TYR A 150 1.680 -4.834 -5.287 1.00 53.43 C ATOM 2328 CD2 TYR A 150 2.344 -2.829 -4.159 1.00 62.23 C ATOM 2329 CE1 TYR A 150 1.149 -4.078 -6.317 1.00 52.04 C ATOM 2330 CE2 TYR A 150 1.810 -2.071 -5.186 1.00 64.44 C ATOM 2331 CZ TYR A 150 1.216 -2.699 -6.264 1.00 72.40 C ATOM 2332 OH TYR A 150 0.692 -1.943 -7.296 1.00 71.21 O ATOM 0 H TYR A 150 0.776 -4.698 -1.377 1.00 55.34 H new ATOM 0 HA TYR A 150 1.723 -6.896 -3.146 1.00 15.11 H new ATOM 0 HB2 TYR A 150 3.249 -4.410 -2.253 1.00 13.31 H new ATOM 0 HB3 TYR A 150 3.772 -5.609 -3.419 1.00 13.31 H new ATOM 0 HD1 TYR A 150 1.620 -5.911 -5.336 1.00 53.43 H new ATOM 0 HD2 TYR A 150 2.810 -2.331 -3.321 1.00 62.23 H new ATOM 0 HE1 TYR A 150 0.683 -4.565 -7.161 1.00 52.04 H new ATOM 0 HE2 TYR A 150 1.857 -0.993 -5.145 1.00 64.44 H new ATOM 0 HH TYR A 150 0.820 -0.991 -7.102 1.00 71.21 H new ATOM 2342 N SER A 151 3.338 -7.827 -1.366 1.00 60.22 N ATOM 2343 CA SER A 151 4.100 -8.501 -0.298 1.00 75.34 C ATOM 2344 C SER A 151 5.196 -7.574 0.313 1.00 22.33 C ATOM 2345 O SER A 151 5.833 -6.801 -0.419 1.00 61.14 O ATOM 2346 CB SER A 151 4.730 -9.794 -0.872 1.00 35.34 C ATOM 2347 OG SER A 151 3.730 -10.634 -1.432 1.00 3.51 O ATOM 0 H SER A 151 3.463 -8.253 -2.285 1.00 60.22 H new ATOM 0 HA SER A 151 3.416 -8.750 0.513 1.00 75.34 H new ATOM 0 HB2 SER A 151 5.466 -9.538 -1.634 1.00 35.34 H new ATOM 0 HB3 SER A 151 5.260 -10.327 -0.083 1.00 35.34 H new ATOM 0 HG SER A 151 4.147 -11.445 -1.791 1.00 3.51 H new ATOM 2353 N PRO A 152 5.430 -7.652 1.668 1.00 31.54 N ATOM 2354 CA PRO A 152 6.387 -6.768 2.377 1.00 72.21 C ATOM 2355 C PRO A 152 7.846 -7.272 2.290 1.00 61.05 C ATOM 2356 O PRO A 152 8.118 -8.467 2.499 1.00 73.33 O ATOM 2357 CB PRO A 152 5.877 -6.831 3.834 1.00 24.14 C ATOM 2358 CG PRO A 152 5.344 -8.234 3.976 1.00 31.23 C ATOM 2359 CD PRO A 152 4.785 -8.618 2.611 1.00 63.31 C ATOM 0 HA PRO A 152 6.420 -5.765 1.951 1.00 72.21 H new ATOM 0 HB2 PRO A 152 6.679 -6.635 4.546 1.00 24.14 H new ATOM 0 HB3 PRO A 152 5.100 -6.089 4.017 1.00 24.14 H new ATOM 0 HG2 PRO A 152 6.133 -8.921 4.280 1.00 31.23 H new ATOM 0 HG3 PRO A 152 4.569 -8.280 4.741 1.00 31.23 H new ATOM 0 HD2 PRO A 152 5.030 -9.649 2.355 1.00 63.31 H new ATOM 0 HD3 PRO A 152 3.699 -8.534 2.587 1.00 63.31 H new ATOM 2367 N PHE A 153 8.760 -6.357 1.952 1.00 24.02 N ATOM 2368 CA PHE A 153 10.218 -6.578 1.996 1.00 71.10 C ATOM 2369 C PHE A 153 10.694 -7.125 3.363 1.00 32.32 C ATOM 2370 O PHE A 153 11.473 -8.090 3.431 1.00 32.45 O ATOM 2371 CB PHE A 153 10.962 -5.238 1.675 1.00 23.43 C ATOM 2372 CG PHE A 153 10.462 -4.520 0.412 1.00 14.15 C ATOM 2373 CD1 PHE A 153 10.979 -4.830 -0.843 1.00 71.01 C ATOM 2374 CD2 PHE A 153 9.457 -3.549 0.484 1.00 61.33 C ATOM 2375 CE1 PHE A 153 10.514 -4.200 -1.977 1.00 22.45 C ATOM 2376 CE2 PHE A 153 8.989 -2.921 -0.654 1.00 13.42 C ATOM 2377 CZ PHE A 153 9.518 -3.249 -1.883 1.00 73.31 C ATOM 0 H PHE A 153 8.507 -5.422 1.633 1.00 24.02 H new ATOM 0 HA PHE A 153 10.456 -7.332 1.246 1.00 71.10 H new ATOM 0 HB2 PHE A 153 10.856 -4.565 2.526 1.00 23.43 H new ATOM 0 HB3 PHE A 153 12.026 -5.446 1.563 1.00 23.43 H new ATOM 0 HD1 PHE A 153 11.756 -5.575 -0.929 1.00 71.01 H new ATOM 0 HD2 PHE A 153 9.040 -3.286 1.445 1.00 61.33 H new ATOM 0 HE1 PHE A 153 10.930 -4.451 -2.942 1.00 22.45 H new ATOM 0 HE2 PHE A 153 8.211 -2.175 -0.580 1.00 13.42 H new ATOM 0 HZ PHE A 153 9.153 -2.761 -2.775 1.00 73.31 H new ATOM 2387 N CYS A 154 10.181 -6.497 4.429 1.00 1.03 N ATOM 2388 CA CYS A 154 10.591 -6.742 5.819 1.00 31.54 C ATOM 2389 C CYS A 154 10.318 -8.175 6.301 1.00 33.45 C ATOM 2390 O CYS A 154 11.197 -8.804 6.893 1.00 21.11 O ATOM 2391 CB CYS A 154 9.858 -5.739 6.711 1.00 2.35 C ATOM 2392 SG CYS A 154 8.058 -5.858 6.620 1.00 15.45 S ATOM 0 H CYS A 154 9.452 -5.788 4.348 1.00 1.03 H new ATOM 0 HA CYS A 154 11.672 -6.615 5.875 1.00 31.54 H new ATOM 0 HB2 CYS A 154 10.171 -5.890 7.744 1.00 2.35 H new ATOM 0 HB3 CYS A 154 10.160 -4.730 6.431 1.00 2.35 H new ATOM 0 HG CYS A 154 7.566 -5.922 7.822 1.00 15.45 H new ATOM 2398 N ALA A 155 9.093 -8.678 6.059 1.00 50.20 N ATOM 2399 CA ALA A 155 8.650 -9.997 6.561 1.00 71.54 C ATOM 2400 C ALA A 155 9.561 -11.146 6.114 1.00 11.42 C ATOM 2401 O ALA A 155 9.791 -12.093 6.864 1.00 5.32 O ATOM 2402 CB ALA A 155 7.225 -10.279 6.099 1.00 73.41 C ATOM 0 H ALA A 155 8.385 -8.187 5.514 1.00 50.20 H new ATOM 0 HA ALA A 155 8.698 -9.947 7.649 1.00 71.54 H new ATOM 0 HB1 ALA A 155 6.907 -11.252 6.473 1.00 73.41 H new ATOM 0 HB2 ALA A 155 6.558 -9.507 6.483 1.00 73.41 H new ATOM 0 HB3 ALA A 155 7.189 -10.280 5.010 1.00 73.41 H new ATOM 2408 N TYR A 156 10.060 -11.053 4.879 1.00 24.31 N ATOM 2409 CA TYR A 156 10.852 -12.128 4.262 1.00 74.24 C ATOM 2410 C TYR A 156 12.367 -11.896 4.420 1.00 24.34 C ATOM 2411 O TYR A 156 13.152 -12.813 4.186 1.00 13.43 O ATOM 2412 CB TYR A 156 10.433 -12.284 2.782 1.00 34.23 C ATOM 2413 CG TYR A 156 8.961 -12.704 2.610 1.00 40.33 C ATOM 2414 CD1 TYR A 156 7.937 -11.749 2.527 1.00 65.12 C ATOM 2415 CD2 TYR A 156 8.593 -14.054 2.558 1.00 25.03 C ATOM 2416 CE1 TYR A 156 6.615 -12.125 2.398 1.00 14.43 C ATOM 2417 CE2 TYR A 156 7.269 -14.431 2.424 1.00 73.13 C ATOM 2418 CZ TYR A 156 6.286 -13.464 2.347 1.00 73.01 C ATOM 2419 OH TYR A 156 4.969 -13.839 2.229 1.00 30.31 O ATOM 0 H TYR A 156 9.930 -10.238 4.280 1.00 24.31 H new ATOM 0 HA TYR A 156 10.644 -13.062 4.783 1.00 74.24 H new ATOM 0 HB2 TYR A 156 10.598 -11.340 2.263 1.00 34.23 H new ATOM 0 HB3 TYR A 156 11.074 -13.026 2.306 1.00 34.23 H new ATOM 0 HD1 TYR A 156 8.188 -10.699 2.565 1.00 65.12 H new ATOM 0 HD2 TYR A 156 9.357 -14.815 2.624 1.00 25.03 H new ATOM 0 HE1 TYR A 156 5.841 -11.374 2.337 1.00 14.43 H new ATOM 0 HE2 TYR A 156 7.005 -15.477 2.380 1.00 73.13 H new ATOM 0 HH TYR A 156 4.908 -14.817 2.206 1.00 30.31 H new ATOM 2429 N SER A 157 12.779 -10.683 4.829 1.00 61.03 N ATOM 2430 CA SER A 157 14.198 -10.374 5.110 1.00 63.24 C ATOM 2431 C SER A 157 14.323 -9.480 6.358 1.00 24.25 C ATOM 2432 O SER A 157 13.868 -8.330 6.357 1.00 3.45 O ATOM 2433 CB SER A 157 14.864 -9.696 3.890 1.00 55.34 C ATOM 2434 OG SER A 157 15.040 -10.597 2.816 1.00 2.41 O ATOM 0 H SER A 157 12.148 -9.895 4.974 1.00 61.03 H new ATOM 0 HA SER A 157 14.717 -11.313 5.305 1.00 63.24 H new ATOM 0 HB2 SER A 157 14.251 -8.856 3.562 1.00 55.34 H new ATOM 0 HB3 SER A 157 15.831 -9.289 4.184 1.00 55.34 H new ATOM 0 HG SER A 157 14.235 -10.601 2.257 1.00 2.41 H new ATOM 2440 N ASP A 158 14.984 -10.024 7.401 1.00 61.40 N ATOM 2441 CA ASP A 158 15.235 -9.333 8.692 1.00 41.41 C ATOM 2442 C ASP A 158 16.189 -8.138 8.516 1.00 12.05 C ATOM 2443 O ASP A 158 16.243 -7.253 9.371 1.00 33.11 O ATOM 2444 CB ASP A 158 15.828 -10.318 9.740 1.00 52.12 C ATOM 2445 CG ASP A 158 14.972 -11.577 9.947 1.00 24.32 C ATOM 2446 OD1 ASP A 158 15.076 -12.512 9.123 1.00 1.34 O ATOM 2447 OD2 ASP A 158 14.207 -11.645 10.933 1.00 60.53 O ATOM 0 H ASP A 158 15.366 -10.969 7.374 1.00 61.40 H new ATOM 0 HA ASP A 158 14.275 -8.961 9.049 1.00 41.41 H new ATOM 0 HB2 ASP A 158 16.828 -10.615 9.423 1.00 52.12 H new ATOM 0 HB3 ASP A 158 15.936 -9.801 10.693 1.00 52.12 H new ATOM 2452 N THR A 159 16.934 -8.128 7.385 1.00 45.23 N ATOM 2453 CA THR A 159 17.829 -7.014 6.998 1.00 72.24 C ATOM 2454 C THR A 159 17.022 -5.765 6.527 1.00 50.31 C ATOM 2455 O THR A 159 17.600 -4.756 6.110 1.00 61.24 O ATOM 2456 CB THR A 159 18.870 -7.468 5.905 1.00 43.54 C ATOM 2457 OG1 THR A 159 19.801 -6.408 5.612 1.00 12.33 O ATOM 2458 CG2 THR A 159 18.197 -7.925 4.600 1.00 4.23 C ATOM 0 H THR A 159 16.930 -8.896 6.714 1.00 45.23 H new ATOM 0 HA THR A 159 18.388 -6.723 7.887 1.00 72.24 H new ATOM 0 HB THR A 159 19.401 -8.322 6.326 1.00 43.54 H new ATOM 0 HG1 THR A 159 19.355 -5.542 5.720 1.00 12.33 H new ATOM 0 HG21 THR A 159 18.961 -8.226 3.883 1.00 4.23 H new ATOM 0 HG22 THR A 159 17.539 -8.769 4.806 1.00 4.23 H new ATOM 0 HG23 THR A 159 17.613 -7.104 4.185 1.00 4.23 H new ATOM 2466 N PHE A 160 15.680 -5.866 6.577 1.00 22.11 N ATOM 2467 CA PHE A 160 14.746 -4.736 6.461 1.00 24.41 C ATOM 2468 C PHE A 160 13.917 -4.726 7.763 1.00 43.32 C ATOM 2469 O PHE A 160 13.291 -5.748 8.090 1.00 34.42 O ATOM 2470 CB PHE A 160 13.775 -4.918 5.252 1.00 55.01 C ATOM 2471 CG PHE A 160 14.409 -5.019 3.862 1.00 31.32 C ATOM 2472 CD1 PHE A 160 15.103 -6.161 3.466 1.00 64.25 C ATOM 2473 CD2 PHE A 160 14.273 -3.991 2.938 1.00 2.21 C ATOM 2474 CE1 PHE A 160 15.645 -6.267 2.196 1.00 23.02 C ATOM 2475 CE2 PHE A 160 14.804 -4.102 1.670 1.00 13.20 C ATOM 2476 CZ PHE A 160 15.491 -5.237 1.298 1.00 63.03 C ATOM 0 H PHE A 160 15.206 -6.760 6.703 1.00 22.11 H new ATOM 0 HA PHE A 160 15.299 -3.809 6.305 1.00 24.41 H new ATOM 0 HB2 PHE A 160 13.187 -5.820 5.423 1.00 55.01 H new ATOM 0 HB3 PHE A 160 13.079 -4.079 5.247 1.00 55.01 H new ATOM 0 HD1 PHE A 160 15.220 -6.978 4.162 1.00 64.25 H new ATOM 0 HD2 PHE A 160 13.744 -3.092 3.216 1.00 2.21 H new ATOM 0 HE1 PHE A 160 16.187 -7.157 1.912 1.00 23.02 H new ATOM 0 HE2 PHE A 160 14.681 -3.294 0.964 1.00 13.20 H new ATOM 0 HZ PHE A 160 15.907 -5.317 0.305 1.00 63.03 H new ATOM 2486 N SER A 161 13.929 -3.608 8.514 1.00 54.32 N ATOM 2487 CA SER A 161 13.091 -3.469 9.724 1.00 34.34 C ATOM 2488 C SER A 161 11.626 -3.251 9.307 1.00 62.43 C ATOM 2489 O SER A 161 11.361 -2.538 8.326 1.00 52.32 O ATOM 2490 CB SER A 161 13.581 -2.305 10.607 1.00 24.14 C ATOM 2491 OG SER A 161 14.960 -2.429 10.908 1.00 54.53 O ATOM 0 H SER A 161 14.505 -2.792 8.307 1.00 54.32 H new ATOM 0 HA SER A 161 13.168 -4.383 10.312 1.00 34.34 H new ATOM 0 HB2 SER A 161 13.402 -1.359 10.096 1.00 24.14 H new ATOM 0 HB3 SER A 161 13.006 -2.281 11.533 1.00 24.14 H new ATOM 0 HG SER A 161 15.242 -1.675 11.468 1.00 54.53 H new ATOM 2497 N CYS A 162 10.688 -3.876 10.048 1.00 41.14 N ATOM 2498 CA CYS A 162 9.256 -3.877 9.701 1.00 1.53 C ATOM 2499 C CYS A 162 8.601 -2.501 9.945 1.00 51.13 C ATOM 2500 O CYS A 162 9.003 -1.782 10.872 1.00 41.23 O ATOM 2501 CB CYS A 162 8.530 -4.984 10.498 1.00 71.15 C ATOM 2502 SG CYS A 162 9.161 -6.641 10.148 1.00 11.31 S ATOM 0 H CYS A 162 10.903 -4.392 10.901 1.00 41.14 H new ATOM 0 HA CYS A 162 9.165 -4.083 8.635 1.00 1.53 H new ATOM 0 HB2 CYS A 162 8.631 -4.781 11.564 1.00 71.15 H new ATOM 0 HB3 CYS A 162 7.465 -4.951 10.267 1.00 71.15 H new ATOM 0 HG CYS A 162 8.505 -7.513 10.854 1.00 11.31 H new ATOM 2508 N PRO A 163 7.586 -2.112 9.103 1.00 61.53 N ATOM 2509 CA PRO A 163 6.827 -0.856 9.284 1.00 73.13 C ATOM 2510 C PRO A 163 5.828 -0.967 10.447 1.00 42.34 C ATOM 2511 O PRO A 163 5.347 -2.066 10.749 1.00 2.41 O ATOM 2512 CB PRO A 163 6.091 -0.709 7.923 1.00 3.22 C ATOM 2513 CG PRO A 163 5.861 -2.112 7.464 1.00 60.10 C ATOM 2514 CD PRO A 163 7.093 -2.878 7.912 1.00 72.00 C ATOM 0 HA PRO A 163 7.457 -0.002 9.533 1.00 73.13 H new ATOM 0 HB2 PRO A 163 5.150 -0.170 8.037 1.00 3.22 H new ATOM 0 HB3 PRO A 163 6.693 -0.151 7.205 1.00 3.22 H new ATOM 0 HG2 PRO A 163 4.955 -2.528 7.905 1.00 60.10 H new ATOM 0 HG3 PRO A 163 5.739 -2.158 6.382 1.00 60.10 H new ATOM 0 HD2 PRO A 163 6.849 -3.908 8.173 1.00 72.00 H new ATOM 0 HD3 PRO A 163 7.846 -2.919 7.125 1.00 72.00 H new ATOM 2522 N LEU A 164 5.518 0.159 11.106 1.00 51.32 N ATOM 2523 CA LEU A 164 4.490 0.202 12.154 1.00 32.35 C ATOM 2524 C LEU A 164 3.186 0.763 11.537 1.00 74.44 C ATOM 2525 O LEU A 164 3.209 1.846 10.930 1.00 71.53 O ATOM 2526 CB LEU A 164 4.994 1.033 13.382 1.00 24.32 C ATOM 2527 CG LEU A 164 5.388 2.548 13.148 1.00 73.02 C ATOM 2528 CD1 LEU A 164 4.208 3.511 13.439 1.00 11.12 C ATOM 2529 CD2 LEU A 164 6.634 2.947 13.963 1.00 71.34 C ATOM 0 H LEU A 164 5.968 1.057 10.929 1.00 51.32 H new ATOM 0 HA LEU A 164 4.282 -0.798 12.534 1.00 32.35 H new ATOM 0 HB2 LEU A 164 4.216 1.005 14.145 1.00 24.32 H new ATOM 0 HB3 LEU A 164 5.864 0.523 13.795 1.00 24.32 H new ATOM 0 HG LEU A 164 5.635 2.643 12.090 1.00 73.02 H new ATOM 0 HD11 LEU A 164 4.526 4.539 13.265 1.00 11.12 H new ATOM 0 HD12 LEU A 164 3.373 3.273 12.780 1.00 11.12 H new ATOM 0 HD13 LEU A 164 3.895 3.399 14.477 1.00 11.12 H new ATOM 0 HD21 LEU A 164 6.872 3.994 13.775 1.00 71.34 H new ATOM 0 HD22 LEU A 164 6.435 2.805 15.025 1.00 71.34 H new ATOM 0 HD23 LEU A 164 7.478 2.324 13.666 1.00 71.34 H new ATOM 2541 N PRO A 165 2.048 0.004 11.586 1.00 53.41 N ATOM 2542 CA PRO A 165 0.745 0.539 11.165 1.00 23.15 C ATOM 2543 C PRO A 165 0.102 1.367 12.313 1.00 63.14 C ATOM 2544 O PRO A 165 -0.086 0.838 13.416 1.00 72.34 O ATOM 2545 CB PRO A 165 -0.064 -0.743 10.834 1.00 75.05 C ATOM 2546 CG PRO A 165 0.494 -1.803 11.749 1.00 43.21 C ATOM 2547 CD PRO A 165 1.949 -1.425 12.016 1.00 4.04 C ATOM 0 HA PRO A 165 0.796 1.224 10.319 1.00 23.15 H new ATOM 0 HB2 PRO A 165 -1.130 -0.593 11.007 1.00 75.05 H new ATOM 0 HB3 PRO A 165 0.052 -1.024 9.787 1.00 75.05 H new ATOM 0 HG2 PRO A 165 -0.072 -1.849 12.680 1.00 43.21 H new ATOM 0 HG3 PRO A 165 0.428 -2.788 11.287 1.00 43.21 H new ATOM 0 HD2 PRO A 165 2.203 -1.541 13.070 1.00 4.04 H new ATOM 0 HD3 PRO A 165 2.634 -2.058 11.452 1.00 4.04 H new ATOM 2555 N PRO A 166 -0.237 2.681 12.078 1.00 71.22 N ATOM 2556 CA PRO A 166 -0.928 3.517 13.094 1.00 53.53 C ATOM 2557 C PRO A 166 -2.279 2.888 13.459 1.00 10.41 C ATOM 2558 O PRO A 166 -3.022 2.532 12.572 1.00 75.34 O ATOM 2559 CB PRO A 166 -1.095 4.894 12.387 1.00 71.54 C ATOM 2560 CG PRO A 166 -0.955 4.595 10.918 1.00 62.41 C ATOM 2561 CD PRO A 166 0.026 3.447 10.828 1.00 64.53 C ATOM 0 HA PRO A 166 -0.382 3.609 14.033 1.00 53.53 H new ATOM 0 HB2 PRO A 166 -2.066 5.337 12.609 1.00 71.54 H new ATOM 0 HB3 PRO A 166 -0.337 5.603 12.720 1.00 71.54 H new ATOM 0 HG2 PRO A 166 -1.916 4.325 10.480 1.00 62.41 H new ATOM 0 HG3 PRO A 166 -0.590 5.466 10.374 1.00 62.41 H new ATOM 0 HD2 PRO A 166 -0.145 2.839 9.939 1.00 64.53 H new ATOM 0 HD3 PRO A 166 1.056 3.800 10.780 1.00 64.53 H new ATOM 2569 N GLU A 167 -2.581 2.772 14.759 1.00 42.54 N ATOM 2570 CA GLU A 167 -3.725 1.974 15.272 1.00 1.42 C ATOM 2571 C GLU A 167 -5.096 2.397 14.688 1.00 51.34 C ATOM 2572 O GLU A 167 -6.056 1.627 14.753 1.00 1.22 O ATOM 2573 CB GLU A 167 -3.746 2.004 16.824 1.00 34.41 C ATOM 2574 CG GLU A 167 -2.456 1.455 17.471 1.00 54.31 C ATOM 2575 CD GLU A 167 -2.524 1.390 19.006 1.00 74.52 C ATOM 2576 OE1 GLU A 167 -3.064 0.403 19.549 1.00 33.21 O ATOM 2577 OE2 GLU A 167 -2.057 2.334 19.678 1.00 31.12 O ATOM 0 H GLU A 167 -2.042 3.228 15.495 1.00 42.54 H new ATOM 0 HA GLU A 167 -3.566 0.951 14.930 1.00 1.42 H new ATOM 0 HB2 GLU A 167 -3.901 3.030 17.157 1.00 34.41 H new ATOM 0 HB3 GLU A 167 -4.596 1.422 17.179 1.00 34.41 H new ATOM 0 HG2 GLU A 167 -2.259 0.457 17.081 1.00 54.31 H new ATOM 0 HG3 GLU A 167 -1.615 2.084 17.178 1.00 54.31 H new ATOM 2584 N SER A 168 -5.165 3.604 14.101 1.00 34.34 N ATOM 2585 CA SER A 168 -6.382 4.128 13.452 1.00 54.33 C ATOM 2586 C SER A 168 -6.676 3.454 12.081 1.00 74.24 C ATOM 2587 O SER A 168 -7.819 3.481 11.610 1.00 33.22 O ATOM 2588 CB SER A 168 -6.248 5.650 13.277 1.00 73.51 C ATOM 2589 OG SER A 168 -5.878 6.274 14.491 1.00 34.33 O ATOM 0 H SER A 168 -4.375 4.248 14.063 1.00 34.34 H new ATOM 0 HA SER A 168 -7.226 3.893 14.100 1.00 54.33 H new ATOM 0 HB2 SER A 168 -5.502 5.866 12.512 1.00 73.51 H new ATOM 0 HB3 SER A 168 -7.194 6.063 12.926 1.00 73.51 H new ATOM 0 HG SER A 168 -5.798 7.241 14.351 1.00 34.33 H new ATOM 2595 N ASN A 169 -5.657 2.808 11.472 1.00 25.32 N ATOM 2596 CA ASN A 169 -5.758 2.215 10.111 1.00 61.32 C ATOM 2597 C ASN A 169 -6.216 0.748 10.175 1.00 40.14 C ATOM 2598 O ASN A 169 -6.230 0.047 9.155 1.00 3.30 O ATOM 2599 CB ASN A 169 -4.397 2.350 9.343 1.00 54.13 C ATOM 2600 CG ASN A 169 -3.300 1.321 9.704 1.00 31.23 C ATOM 2601 OD1 ASN A 169 -3.299 0.682 10.742 1.00 3.13 O ATOM 2602 ND2 ASN A 169 -2.325 1.190 8.844 1.00 74.14 N ATOM 0 H ASN A 169 -4.742 2.681 11.905 1.00 25.32 H new ATOM 0 HA ASN A 169 -6.514 2.771 9.558 1.00 61.32 H new ATOM 0 HB2 ASN A 169 -4.598 2.274 8.274 1.00 54.13 H new ATOM 0 HB3 ASN A 169 -4.001 3.349 9.523 1.00 54.13 H new ATOM 0 HD21 ASN A 169 -1.556 0.549 9.039 1.00 74.14 H new ATOM 0 HD22 ASN A 169 -2.333 1.728 7.978 1.00 74.14 H new ATOM 2609 N TRP A 170 -6.580 0.303 11.388 1.00 11.05 N ATOM 2610 CA TRP A 170 -7.007 -1.073 11.641 1.00 52.03 C ATOM 2611 C TRP A 170 -8.453 -1.249 11.151 1.00 70.32 C ATOM 2612 O TRP A 170 -9.386 -0.664 11.707 1.00 14.51 O ATOM 2613 CB TRP A 170 -6.859 -1.434 13.149 1.00 34.11 C ATOM 2614 CG TRP A 170 -5.423 -1.462 13.666 1.00 4.44 C ATOM 2615 CD1 TRP A 170 -4.299 -1.032 13.018 1.00 51.44 C ATOM 2616 CD2 TRP A 170 -4.970 -1.938 14.944 1.00 61.10 C ATOM 2617 NE1 TRP A 170 -3.190 -1.209 13.799 1.00 33.05 N ATOM 2618 CE2 TRP A 170 -3.570 -1.763 14.984 1.00 71.55 C ATOM 2619 CE3 TRP A 170 -5.607 -2.495 16.053 1.00 24.35 C ATOM 2620 CZ2 TRP A 170 -2.803 -2.124 16.085 1.00 63.45 C ATOM 2621 CZ3 TRP A 170 -4.845 -2.853 17.148 1.00 50.34 C ATOM 2622 CH2 TRP A 170 -3.456 -2.663 17.158 1.00 60.12 C ATOM 0 H TRP A 170 -6.585 0.893 12.220 1.00 11.05 H new ATOM 0 HA TRP A 170 -6.366 -1.761 11.090 1.00 52.03 H new ATOM 0 HB2 TRP A 170 -7.427 -0.714 13.737 1.00 34.11 H new ATOM 0 HB3 TRP A 170 -7.310 -2.412 13.319 1.00 34.11 H new ATOM 0 HD1 TRP A 170 -4.288 -0.610 12.024 1.00 51.44 H new ATOM 0 HE1 TRP A 170 -2.235 -0.966 13.537 1.00 33.05 H new ATOM 0 HE3 TRP A 170 -6.677 -2.644 16.055 1.00 24.35 H new ATOM 0 HZ2 TRP A 170 -1.732 -1.984 16.093 1.00 63.45 H new ATOM 0 HZ3 TRP A 170 -5.328 -3.287 18.011 1.00 50.34 H new ATOM 0 HH2 TRP A 170 -2.890 -2.949 18.032 1.00 60.12 H new ATOM 2633 N LEU A 171 -8.610 -2.022 10.075 1.00 73.31 N ATOM 2634 CA LEU A 171 -9.901 -2.373 9.502 1.00 52.04 C ATOM 2635 C LEU A 171 -10.445 -3.542 10.321 1.00 3.51 C ATOM 2636 O LEU A 171 -9.861 -4.637 10.282 1.00 3.32 O ATOM 2637 CB LEU A 171 -9.729 -2.779 8.003 1.00 61.31 C ATOM 2638 CG LEU A 171 -8.966 -1.756 7.096 1.00 63.24 C ATOM 2639 CD1 LEU A 171 -8.839 -2.259 5.644 1.00 62.31 C ATOM 2640 CD2 LEU A 171 -9.625 -0.364 7.141 1.00 41.12 C ATOM 0 H LEU A 171 -7.822 -2.428 9.570 1.00 73.31 H new ATOM 0 HA LEU A 171 -10.591 -1.530 9.534 1.00 52.04 H new ATOM 0 HB2 LEU A 171 -9.202 -3.732 7.964 1.00 61.31 H new ATOM 0 HB3 LEU A 171 -10.718 -2.944 7.577 1.00 61.31 H new ATOM 0 HG LEU A 171 -7.958 -1.664 7.499 1.00 63.24 H new ATOM 0 HD11 LEU A 171 -8.303 -1.520 5.048 1.00 62.31 H new ATOM 0 HD12 LEU A 171 -8.291 -3.201 5.632 1.00 62.31 H new ATOM 0 HD13 LEU A 171 -9.833 -2.412 5.224 1.00 62.31 H new ATOM 0 HD21 LEU A 171 -9.071 0.322 6.501 1.00 41.12 H new ATOM 0 HD22 LEU A 171 -10.654 -0.437 6.789 1.00 41.12 H new ATOM 0 HD23 LEU A 171 -9.617 0.009 8.165 1.00 41.12 H new ATOM 2652 N GLU A 172 -11.519 -3.320 11.103 1.00 73.10 N ATOM 2653 CA GLU A 172 -12.109 -4.379 11.952 1.00 74.25 C ATOM 2654 C GLU A 172 -13.056 -5.269 11.103 1.00 15.14 C ATOM 2655 O GLU A 172 -14.242 -5.420 11.390 1.00 21.13 O ATOM 2656 CB GLU A 172 -12.824 -3.768 13.198 1.00 70.52 C ATOM 2657 CG GLU A 172 -13.194 -4.810 14.282 1.00 60.03 C ATOM 2658 CD GLU A 172 -13.935 -4.221 15.489 1.00 2.53 C ATOM 2659 OE1 GLU A 172 -13.273 -3.712 16.421 1.00 0.12 O ATOM 2660 OE2 GLU A 172 -15.182 -4.266 15.519 1.00 11.22 O ATOM 0 H GLU A 172 -11.996 -2.421 11.166 1.00 73.10 H new ATOM 0 HA GLU A 172 -11.311 -5.015 12.336 1.00 74.25 H new ATOM 0 HB2 GLU A 172 -12.177 -3.011 13.641 1.00 70.52 H new ATOM 0 HB3 GLU A 172 -13.731 -3.260 12.871 1.00 70.52 H new ATOM 0 HG2 GLU A 172 -13.815 -5.584 13.830 1.00 60.03 H new ATOM 0 HG3 GLU A 172 -12.282 -5.296 14.630 1.00 60.03 H new ATOM 2667 N THR A 173 -12.487 -5.850 10.036 1.00 4.32 N ATOM 2668 CA THR A 173 -13.182 -6.747 9.121 1.00 21.31 C ATOM 2669 C THR A 173 -12.163 -7.696 8.475 1.00 43.43 C ATOM 2670 O THR A 173 -10.969 -7.356 8.334 1.00 22.52 O ATOM 2671 CB THR A 173 -13.958 -5.952 8.022 1.00 31.04 C ATOM 2672 OG1 THR A 173 -14.693 -6.853 7.182 1.00 24.53 O ATOM 2673 CG2 THR A 173 -13.034 -5.074 7.159 1.00 40.03 C ATOM 0 H THR A 173 -11.509 -5.701 9.786 1.00 4.32 H new ATOM 0 HA THR A 173 -13.915 -7.323 9.686 1.00 21.31 H new ATOM 0 HB THR A 173 -14.645 -5.286 8.543 1.00 31.04 H new ATOM 0 HG1 THR A 173 -15.640 -6.835 7.433 1.00 24.53 H new ATOM 0 HG21 THR A 173 -13.627 -4.545 6.413 1.00 40.03 H new ATOM 0 HG22 THR A 173 -12.522 -4.351 7.794 1.00 40.03 H new ATOM 0 HG23 THR A 173 -12.298 -5.703 6.658 1.00 40.03 H new ATOM 2681 N ALA A 174 -12.629 -8.892 8.115 1.00 1.31 N ATOM 2682 CA ALA A 174 -11.803 -9.895 7.450 1.00 14.44 C ATOM 2683 C ALA A 174 -11.655 -9.518 5.969 1.00 74.21 C ATOM 2684 O ALA A 174 -12.515 -9.852 5.149 1.00 4.10 O ATOM 2685 CB ALA A 174 -12.434 -11.285 7.620 1.00 30.21 C ATOM 0 H ALA A 174 -13.591 -9.191 8.277 1.00 1.31 H new ATOM 0 HA ALA A 174 -10.810 -9.926 7.899 1.00 14.44 H new ATOM 0 HB1 ALA A 174 -11.813 -12.030 7.122 1.00 30.21 H new ATOM 0 HB2 ALA A 174 -12.507 -11.524 8.681 1.00 30.21 H new ATOM 0 HB3 ALA A 174 -13.430 -11.289 7.178 1.00 30.21 H new ATOM 2691 N VAL A 175 -10.575 -8.776 5.651 1.00 31.35 N ATOM 2692 CA VAL A 175 -10.327 -8.284 4.289 1.00 21.03 C ATOM 2693 C VAL A 175 -9.757 -9.425 3.428 1.00 53.10 C ATOM 2694 O VAL A 175 -8.545 -9.677 3.409 1.00 40.02 O ATOM 2695 CB VAL A 175 -9.374 -7.027 4.269 1.00 55.45 C ATOM 2696 CG1 VAL A 175 -9.126 -6.530 2.819 1.00 60.44 C ATOM 2697 CG2 VAL A 175 -9.949 -5.893 5.151 1.00 43.14 C ATOM 0 H VAL A 175 -9.860 -8.506 6.326 1.00 31.35 H new ATOM 0 HA VAL A 175 -11.278 -7.954 3.870 1.00 21.03 H new ATOM 0 HB VAL A 175 -8.412 -7.329 4.683 1.00 55.45 H new ATOM 0 HG11 VAL A 175 -8.466 -5.663 2.839 1.00 60.44 H new ATOM 0 HG12 VAL A 175 -8.662 -7.326 2.236 1.00 60.44 H new ATOM 0 HG13 VAL A 175 -10.076 -6.252 2.362 1.00 60.44 H new ATOM 0 HG21 VAL A 175 -9.277 -5.035 5.124 1.00 43.14 H new ATOM 0 HG22 VAL A 175 -10.928 -5.599 4.773 1.00 43.14 H new ATOM 0 HG23 VAL A 175 -10.047 -6.245 6.178 1.00 43.14 H new ATOM 2707 N THR A 176 -10.667 -10.135 2.758 1.00 2.42 N ATOM 2708 CA THR A 176 -10.331 -11.214 1.837 1.00 42.31 C ATOM 2709 C THR A 176 -10.215 -10.616 0.424 1.00 74.22 C ATOM 2710 O THR A 176 -11.215 -10.447 -0.286 1.00 23.41 O ATOM 2711 CB THR A 176 -11.403 -12.354 1.910 1.00 42.04 C ATOM 2712 OG1 THR A 176 -12.713 -11.814 1.648 1.00 74.10 O ATOM 2713 CG2 THR A 176 -11.402 -13.047 3.290 1.00 74.24 C ATOM 0 H THR A 176 -11.670 -9.972 2.843 1.00 2.42 H new ATOM 0 HA THR A 176 -9.379 -11.669 2.109 1.00 42.31 H new ATOM 0 HB THR A 176 -11.148 -13.097 1.154 1.00 42.04 H new ATOM 0 HG1 THR A 176 -12.669 -11.206 0.881 1.00 74.10 H new ATOM 0 HG21 THR A 176 -12.158 -13.832 3.304 1.00 74.24 H new ATOM 0 HG22 THR A 176 -10.421 -13.485 3.477 1.00 74.24 H new ATOM 0 HG23 THR A 176 -11.626 -12.314 4.065 1.00 74.24 H new ATOM 2721 N ALA A 177 -8.988 -10.222 0.066 1.00 23.31 N ATOM 2722 CA ALA A 177 -8.697 -9.500 -1.178 1.00 11.22 C ATOM 2723 C ALA A 177 -7.373 -10.000 -1.760 1.00 33.43 C ATOM 2724 O ALA A 177 -6.383 -10.144 -1.030 1.00 32.22 O ATOM 2725 CB ALA A 177 -8.666 -7.986 -0.903 1.00 4.42 C ATOM 0 H ALA A 177 -8.161 -10.397 0.637 1.00 23.31 H new ATOM 0 HA ALA A 177 -9.479 -9.688 -1.914 1.00 11.22 H new ATOM 0 HB1 ALA A 177 -8.450 -7.452 -1.829 1.00 4.42 H new ATOM 0 HB2 ALA A 177 -9.634 -7.666 -0.518 1.00 4.42 H new ATOM 0 HB3 ALA A 177 -7.892 -7.766 -0.168 1.00 4.42 H new ATOM 2731 N GLY A 178 -7.380 -10.255 -3.079 1.00 34.24 N ATOM 2732 CA GLY A 178 -6.235 -10.819 -3.781 1.00 62.30 C ATOM 2733 C GLY A 178 -5.875 -12.233 -3.342 1.00 13.32 C ATOM 2734 O GLY A 178 -6.740 -13.002 -2.910 1.00 4.53 O ATOM 0 H GLY A 178 -8.183 -10.073 -3.681 1.00 34.24 H new ATOM 0 HA2 GLY A 178 -6.444 -10.824 -4.851 1.00 62.30 H new ATOM 0 HA3 GLY A 178 -5.372 -10.171 -3.627 1.00 62.30 H new ATOM 2738 N GLU A 179 -4.586 -12.568 -3.472 1.00 22.55 N ATOM 2739 CA GLU A 179 -4.029 -13.843 -2.993 1.00 53.14 C ATOM 2740 C GLU A 179 -3.695 -13.716 -1.500 1.00 14.01 C ATOM 2741 O GLU A 179 -3.365 -12.625 -1.031 1.00 45.25 O ATOM 2742 CB GLU A 179 -2.750 -14.202 -3.804 1.00 70.44 C ATOM 2743 CG GLU A 179 -2.981 -14.323 -5.325 1.00 30.23 C ATOM 2744 CD GLU A 179 -1.687 -14.586 -6.117 1.00 51.42 C ATOM 2745 OE1 GLU A 179 -1.011 -13.611 -6.509 1.00 42.42 O ATOM 2746 OE2 GLU A 179 -1.343 -15.769 -6.353 1.00 44.12 O ATOM 0 H GLU A 179 -3.895 -11.961 -3.914 1.00 22.55 H new ATOM 0 HA GLU A 179 -4.761 -14.639 -3.132 1.00 53.14 H new ATOM 0 HB2 GLU A 179 -1.992 -13.440 -3.622 1.00 70.44 H new ATOM 0 HB3 GLU A 179 -2.350 -15.145 -3.432 1.00 70.44 H new ATOM 0 HG2 GLU A 179 -3.686 -15.132 -5.515 1.00 30.23 H new ATOM 0 HG3 GLU A 179 -3.442 -13.405 -5.690 1.00 30.23 H new ATOM 2753 N ARG A 180 -3.778 -14.830 -0.763 1.00 2.02 N ATOM 2754 CA ARG A 180 -3.399 -14.881 0.664 1.00 12.41 C ATOM 2755 C ARG A 180 -1.872 -15.137 0.760 1.00 30.13 C ATOM 2756 O ARG A 180 -1.141 -14.964 -0.225 1.00 54.31 O ATOM 2757 CB ARG A 180 -4.225 -15.996 1.385 1.00 21.13 C ATOM 2758 CG ARG A 180 -3.827 -17.442 1.012 1.00 24.44 C ATOM 2759 CD ARG A 180 -4.800 -18.511 1.538 1.00 44.32 C ATOM 2760 NE ARG A 180 -6.037 -18.586 0.734 1.00 42.33 N ATOM 2761 CZ ARG A 180 -6.296 -19.526 -0.198 1.00 43.14 C ATOM 2762 NH1 ARG A 180 -5.407 -20.487 -0.468 1.00 35.12 N ATOM 2763 NH2 ARG A 180 -7.441 -19.495 -0.860 1.00 33.41 N ATOM 0 H ARG A 180 -4.108 -15.722 -1.133 1.00 2.02 H new ATOM 0 HA ARG A 180 -3.622 -13.936 1.160 1.00 12.41 H new ATOM 0 HB2 ARG A 180 -4.115 -15.870 2.462 1.00 21.13 H new ATOM 0 HB3 ARG A 180 -5.281 -15.854 1.153 1.00 21.13 H new ATOM 0 HG2 ARG A 180 -3.765 -17.523 -0.073 1.00 24.44 H new ATOM 0 HG3 ARG A 180 -2.831 -17.647 1.404 1.00 24.44 H new ATOM 0 HD2 ARG A 180 -4.306 -19.483 1.533 1.00 44.32 H new ATOM 0 HD3 ARG A 180 -5.055 -18.289 2.574 1.00 44.32 H new ATOM 0 HE ARG A 180 -6.749 -17.873 0.896 1.00 42.33 H new ATOM 0 HH11 ARG A 180 -4.519 -20.516 0.033 1.00 35.12 H new ATOM 0 HH12 ARG A 180 -5.616 -21.191 -1.175 1.00 35.12 H new ATOM 0 HH21 ARG A 180 -8.123 -18.762 -0.665 1.00 33.41 H new ATOM 0 HH22 ARG A 180 -7.641 -20.204 -1.566 1.00 33.41 H new