USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 789 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 110 GLN : amide:sc= 0.867 K(o=1.9,f=-1.3!) USER MOD Set 1.2: A 113 SER OG : rot 106:sc= 0.991 USER MOD Set 2.1: A 100 THR OG1 : rot -179:sc= -0.982 USER MOD Set 2.2: A 102 GLN : amide:sc= -0.462 K(o=-1.4,f=-2.5) USER MOD Set 2.3: A 103 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 79 LYS NZ :NH3+ 144:sc= -0.547 (180deg=-2.05!) USER MOD Set 3.2: A 82 GLN : amide:sc= 0.904 K(o=0.36,f=-4.2) USER MOD Set 4.1: A 67 SER OG : rot -76:sc= 1.09 USER MOD Set 4.2: A 69 LYS NZ :NH3+ -132:sc= 1.06 (180deg=-0.0562) USER MOD Set 5.1: A 47 GLN : amide:sc= 0.636 X(o=1.6,f=1.4) USER MOD Set 5.2: A 98 THR OG1 : rot 180:sc= 0.919 USER MOD Single : A 27 SER OG : rot 180:sc=-0.000157 USER MOD Single : A 29 TYR OH : rot 165:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.161 K(o=-0.16,f=-4.9!) USER MOD Single : A 38 THR OG1 : rot -170:sc= 0.028 USER MOD Single : A 40 SER OG : rot 90:sc= -0.765 USER MOD Single : A 41 ASN : amide:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0.181 USER MOD Single : A 43 LYS NZ :NH3+ -165:sc= -0.0601 (180deg=-0.354) USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -0.0244 X(o=-0.024,f=-0.32) USER MOD Single : A 58 MET CE :methyl 164:sc= -0.701 (180deg=-1.42) USER MOD Single : A 61 SER OG : rot 138:sc= 1.29 USER MOD Single : A 62 GLN : amide:sc= -2.94! C(o=-2.9!,f=-3!) USER MOD Single : A 63 SER OG : rot -25:sc= 0.103 USER MOD Single : A 68 SER OG : rot 52:sc= 0.0582 USER MOD Single : A 70 GLN : amide:sc= -1.27! K(o=-1.3!,f=-0.028) USER MOD Single : A 75 SER OG : rot -160:sc= -0.18 USER MOD Single : A 76 GLN : amide:sc= -0.972 K(o=-0.97,f=-0.04) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0154 USER MOD Single : A 85 ASN : amide:sc= -0.932 X(o=-0.93,f=-0.52) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0675) USER MOD Single : A 99 TYR OH : rot 81:sc= 1.17 USER MOD Single : A 104 SER OG : rot 34:sc= 1.06 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.0374 X(o=-0.037,f=-0.037) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -0.0543 X(o=-0.054,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 126 HIS : no HD1:sc= -0.0121 X(o=-0.012,f=0) USER MOD Single : A 127 SER OG : rot 142:sc= 1.29 USER MOD Single : A 131 THR OG1 : rot 27:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -100.960 -8.370 -24.860 1.00 0.00 N ATOM 26 CA LEU A 26 -99.671 -7.934 -25.372 1.00 0.00 C ATOM 27 C LEU A 26 -99.475 -8.490 -26.779 1.00 0.00 C ATOM 28 O LEU A 26 -99.032 -9.622 -26.956 1.00 0.00 O ATOM 29 CB LEU A 26 -98.519 -8.387 -24.460 1.00 0.00 C ATOM 30 CG LEU A 26 -98.451 -7.735 -23.070 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.447 -6.221 -23.181 1.00 0.00 C ATOM 32 CD2 LEU A 26 -99.593 -8.199 -22.182 1.00 0.00 C ATOM 0 HA LEU A 26 -99.661 -6.844 -25.398 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.592 -9.466 -24.328 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -97.578 -8.192 -24.975 1.00 0.00 H new ATOM 0 HG LEU A 26 -97.516 -8.050 -22.607 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.398 -5.783 -22.184 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -97.581 -5.901 -23.760 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -99.359 -5.890 -23.678 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -99.514 -7.718 -21.207 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -100.544 -7.931 -22.643 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.542 -9.281 -22.059 1.00 0.00 H new ATOM 44 N SER A 27 -99.881 -7.719 -27.773 1.00 0.00 N ATOM 45 CA SER A 27 -99.775 -8.133 -29.161 1.00 0.00 C ATOM 46 C SER A 27 -99.471 -6.931 -30.038 1.00 0.00 C ATOM 47 O SER A 27 -99.962 -5.838 -29.773 1.00 0.00 O ATOM 48 CB SER A 27 -101.082 -8.797 -29.598 1.00 0.00 C ATOM 49 OG SER A 27 -101.372 -9.911 -28.774 1.00 0.00 O ATOM 0 H SER A 27 -100.291 -6.794 -27.642 1.00 0.00 H new ATOM 0 HA SER A 27 -98.962 -8.851 -29.265 1.00 0.00 H new ATOM 0 HB2 SER A 27 -101.898 -8.076 -29.546 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.005 -9.116 -30.637 1.00 0.00 H new ATOM 0 HG SER A 27 -102.212 -10.324 -29.066 1.00 0.00 H new ATOM 55 N TRP A 28 -98.679 -7.120 -31.087 1.00 0.00 N ATOM 56 CA TRP A 28 -98.326 -5.997 -31.949 1.00 0.00 C ATOM 57 C TRP A 28 -99.433 -5.691 -32.960 1.00 0.00 C ATOM 58 O TRP A 28 -99.223 -4.968 -33.932 1.00 0.00 O ATOM 59 CB TRP A 28 -96.968 -6.201 -32.637 1.00 0.00 C ATOM 60 CG TRP A 28 -96.815 -7.454 -33.454 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.779 -8.348 -33.825 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.590 -7.931 -34.013 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.220 -9.357 -34.575 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.876 -9.119 -34.705 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.273 -7.463 -33.990 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -94.892 -9.843 -35.371 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.300 -8.181 -34.651 1.00 0.00 C ATOM 68 CH2 TRP A 28 -93.611 -9.359 -35.330 1.00 0.00 C ATOM 0 H TRP A 28 -98.277 -8.017 -31.358 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.225 -5.123 -31.305 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.781 -5.345 -33.286 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.192 -6.196 -31.871 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.825 -8.274 -33.568 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.723 -10.152 -34.970 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.022 -6.554 -33.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.129 -10.754 -35.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.280 -7.826 -34.643 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -92.825 -9.901 -35.834 1.00 0.00 H new ATOM 79 N TYR A 29 -100.611 -6.248 -32.718 1.00 0.00 N ATOM 80 CA TYR A 29 -101.814 -5.834 -33.420 1.00 0.00 C ATOM 81 C TYR A 29 -102.852 -5.357 -32.414 1.00 0.00 C ATOM 82 O TYR A 29 -104.033 -5.213 -32.730 1.00 0.00 O ATOM 83 CB TYR A 29 -102.377 -6.949 -34.313 1.00 0.00 C ATOM 84 CG TYR A 29 -102.195 -8.354 -33.789 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.043 -8.886 -32.824 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.182 -9.158 -34.286 1.00 0.00 C ATOM 87 CE1 TYR A 29 -102.878 -10.180 -32.367 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.012 -10.451 -33.838 1.00 0.00 C ATOM 89 CZ TYR A 29 -101.861 -10.959 -32.881 1.00 0.00 C ATOM 90 OH TYR A 29 -101.690 -12.253 -32.441 1.00 0.00 O ATOM 0 H TYR A 29 -100.758 -6.992 -32.036 1.00 0.00 H new ATOM 0 HA TYR A 29 -101.553 -5.010 -34.084 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -103.442 -6.770 -34.461 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.903 -6.881 -35.292 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -103.843 -8.279 -32.426 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.514 -8.765 -35.038 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -103.540 -10.579 -31.613 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -100.216 -11.063 -34.236 1.00 0.00 H new ATOM 0 HH TYR A 29 -101.101 -12.734 -33.059 1.00 0.00 H new ATOM 100 N ASP A 30 -102.389 -5.102 -31.197 1.00 0.00 N ATOM 101 CA ASP A 30 -103.229 -4.534 -30.154 1.00 0.00 C ATOM 102 C ASP A 30 -102.851 -3.076 -29.930 1.00 0.00 C ATOM 103 O ASP A 30 -101.675 -2.752 -29.772 1.00 0.00 O ATOM 104 CB ASP A 30 -103.095 -5.316 -28.844 1.00 0.00 C ATOM 105 CG ASP A 30 -104.244 -6.278 -28.618 1.00 0.00 C ATOM 106 OD1 ASP A 30 -105.410 -5.825 -28.595 1.00 0.00 O ATOM 107 OD2 ASP A 30 -103.996 -7.489 -28.449 1.00 0.00 O ATOM 0 H ASP A 30 -101.428 -5.282 -30.908 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.268 -4.598 -30.479 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.157 -5.872 -28.851 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.044 -4.615 -28.011 1.00 0.00 H new ATOM 112 N PRO A 31 -103.846 -2.178 -29.910 1.00 0.00 N ATOM 113 CA PRO A 31 -103.608 -0.731 -29.830 1.00 0.00 C ATOM 114 C PRO A 31 -103.045 -0.282 -28.484 1.00 0.00 C ATOM 115 O PRO A 31 -102.474 0.805 -28.374 1.00 0.00 O ATOM 116 CB PRO A 31 -104.998 -0.130 -30.056 1.00 0.00 C ATOM 117 CG PRO A 31 -105.949 -1.196 -29.638 1.00 0.00 C ATOM 118 CD PRO A 31 -105.282 -2.503 -29.963 1.00 0.00 C ATOM 0 HA PRO A 31 -102.860 -0.412 -30.556 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.137 0.777 -29.467 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.145 0.143 -31.101 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.169 -1.126 -28.573 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -106.897 -1.101 -30.167 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.545 -3.278 -29.243 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.575 -2.869 -30.947 1.00 0.00 H new ATOM 126 N ASP A 32 -103.186 -1.125 -27.469 1.00 0.00 N ATOM 127 CA ASP A 32 -102.754 -0.773 -26.122 1.00 0.00 C ATOM 128 C ASP A 32 -101.346 -1.288 -25.848 1.00 0.00 C ATOM 129 O ASP A 32 -100.800 -1.080 -24.764 1.00 0.00 O ATOM 130 CB ASP A 32 -103.724 -1.332 -25.074 1.00 0.00 C ATOM 131 CG ASP A 32 -105.147 -0.846 -25.272 1.00 0.00 C ATOM 132 OD1 ASP A 32 -105.448 0.304 -24.894 1.00 0.00 O ATOM 133 OD2 ASP A 32 -105.974 -1.614 -25.805 1.00 0.00 O ATOM 0 H ASP A 32 -103.595 -2.056 -27.552 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.748 0.315 -26.052 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -103.708 -2.421 -25.115 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.382 -1.045 -24.080 1.00 0.00 H new ATOM 138 N PHE A 33 -100.762 -1.957 -26.834 1.00 0.00 N ATOM 139 CA PHE A 33 -99.410 -2.485 -26.709 1.00 0.00 C ATOM 140 C PHE A 33 -98.402 -1.488 -27.283 1.00 0.00 C ATOM 141 O PHE A 33 -98.674 -0.832 -28.291 1.00 0.00 O ATOM 142 CB PHE A 33 -99.302 -3.826 -27.440 1.00 0.00 C ATOM 143 CG PHE A 33 -97.936 -4.448 -27.369 1.00 0.00 C ATOM 144 CD1 PHE A 33 -97.464 -4.963 -26.178 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.129 -4.521 -28.493 1.00 0.00 C ATOM 146 CE1 PHE A 33 -96.214 -5.542 -26.103 1.00 0.00 C ATOM 147 CE2 PHE A 33 -95.876 -5.097 -28.425 1.00 0.00 C ATOM 148 CZ PHE A 33 -95.418 -5.608 -27.228 1.00 0.00 C ATOM 0 H PHE A 33 -101.206 -2.147 -27.732 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.187 -2.641 -25.654 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.029 -4.519 -27.017 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.571 -3.681 -28.486 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -98.082 -4.912 -25.293 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.484 -4.123 -29.432 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -95.859 -5.943 -25.165 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.255 -5.147 -29.307 1.00 0.00 H new ATOM 0 HZ PHE A 33 -94.438 -6.059 -27.172 1.00 0.00 H new ATOM 158 N GLN A 34 -97.251 -1.366 -26.634 1.00 0.00 N ATOM 159 CA GLN A 34 -96.211 -0.459 -27.098 1.00 0.00 C ATOM 160 C GLN A 34 -95.083 -1.230 -27.777 1.00 0.00 C ATOM 161 O GLN A 34 -94.434 -2.079 -27.161 1.00 0.00 O ATOM 162 CB GLN A 34 -95.647 0.376 -25.942 1.00 0.00 C ATOM 163 CG GLN A 34 -96.678 1.256 -25.250 1.00 0.00 C ATOM 164 CD GLN A 34 -97.305 0.600 -24.031 1.00 0.00 C ATOM 165 OE1 GLN A 34 -97.414 -0.624 -23.944 1.00 0.00 O ATOM 166 NE2 GLN A 34 -97.731 1.415 -23.079 1.00 0.00 N ATOM 0 H GLN A 34 -97.015 -1.883 -25.787 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.665 0.216 -27.823 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.205 -0.295 -25.205 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.843 1.007 -26.322 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -96.205 2.190 -24.948 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -97.464 1.512 -25.961 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -97.624 2.424 -23.186 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -98.166 1.034 -22.239 1.00 0.00 H new ATOM 175 N ALA A 35 -94.859 -0.928 -29.048 1.00 0.00 N ATOM 176 CA ALA A 35 -93.788 -1.549 -29.814 1.00 0.00 C ATOM 177 C ALA A 35 -93.146 -0.520 -30.731 1.00 0.00 C ATOM 178 O ALA A 35 -93.793 0.461 -31.102 1.00 0.00 O ATOM 179 CB ALA A 35 -94.324 -2.720 -30.622 1.00 0.00 C ATOM 0 H ALA A 35 -95.410 -0.250 -29.574 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.033 -1.927 -29.124 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.511 -3.173 -31.189 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.753 -3.461 -29.948 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.092 -2.366 -31.309 1.00 0.00 H new ATOM 185 N ARG A 36 -91.881 -0.733 -31.091 1.00 0.00 N ATOM 186 CA ARG A 36 -91.148 0.238 -31.896 1.00 0.00 C ATOM 187 C ARG A 36 -89.762 -0.281 -32.262 1.00 0.00 C ATOM 188 O ARG A 36 -89.404 -1.411 -31.939 1.00 0.00 O ATOM 189 CB ARG A 36 -90.986 1.547 -31.114 1.00 0.00 C ATOM 190 CG ARG A 36 -90.136 1.364 -29.863 1.00 0.00 C ATOM 191 CD ARG A 36 -89.928 2.655 -29.095 1.00 0.00 C ATOM 192 NE ARG A 36 -88.980 2.461 -27.995 1.00 0.00 N ATOM 193 CZ ARG A 36 -88.684 3.378 -27.078 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.311 4.548 -27.071 1.00 0.00 N ATOM 195 NH2 ARG A 36 -87.778 3.101 -26.151 1.00 0.00 N ATOM 0 H ARG A 36 -91.347 -1.565 -30.839 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.718 0.407 -32.810 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.528 2.299 -31.757 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -91.969 1.925 -30.832 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.612 0.632 -29.211 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.166 0.955 -30.146 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.557 3.428 -29.768 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.882 3.006 -28.701 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.513 1.557 -27.927 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.025 4.748 -27.772 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.079 5.247 -26.365 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.315 2.192 -26.146 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -87.543 3.797 -25.443 1.00 0.00 H new ATOM 209 N LEU A 37 -88.996 0.564 -32.942 1.00 0.00 N ATOM 210 CA LEU A 37 -87.646 0.226 -33.365 1.00 0.00 C ATOM 211 C LEU A 37 -86.617 1.092 -32.649 1.00 0.00 C ATOM 212 O LEU A 37 -86.858 2.276 -32.401 1.00 0.00 O ATOM 213 CB LEU A 37 -87.522 0.441 -34.866 1.00 0.00 C ATOM 214 CG LEU A 37 -88.584 -0.271 -35.691 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.602 0.265 -37.108 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.321 -1.764 -35.678 1.00 0.00 C ATOM 0 H LEU A 37 -89.294 1.501 -33.214 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.456 -0.818 -33.115 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.574 1.510 -35.073 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.538 0.101 -35.190 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.564 -0.085 -35.252 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.367 -0.255 -37.684 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.824 1.332 -37.091 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.628 0.104 -37.570 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.082 -2.273 -36.269 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.338 -1.964 -36.103 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.354 -2.130 -34.652 1.00 0.00 H new ATOM 228 N THR A 38 -85.481 0.497 -32.314 1.00 0.00 N ATOM 229 CA THR A 38 -84.370 1.232 -31.729 1.00 0.00 C ATOM 230 C THR A 38 -83.050 0.787 -32.357 1.00 0.00 C ATOM 231 O THR A 38 -83.043 -0.049 -33.266 1.00 0.00 O ATOM 232 CB THR A 38 -84.297 1.041 -30.197 1.00 0.00 C ATOM 233 OG1 THR A 38 -84.342 -0.350 -29.867 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.433 1.769 -29.494 1.00 0.00 C ATOM 0 H THR A 38 -85.305 -0.500 -32.439 1.00 0.00 H new ATOM 0 HA THR A 38 -84.539 2.289 -31.934 1.00 0.00 H new ATOM 0 HB THR A 38 -83.353 1.465 -29.856 1.00 0.00 H new ATOM 0 HG1 THR A 38 -84.461 -0.453 -28.900 1.00 0.00 H new ATOM 0 HG21 THR A 38 -85.353 1.615 -28.418 1.00 0.00 H new ATOM 0 HG22 THR A 38 -85.373 2.835 -29.713 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.388 1.379 -29.846 1.00 0.00 H new ATOM 242 N ARG A 39 -81.945 1.371 -31.885 1.00 0.00 N ATOM 243 CA ARG A 39 -80.592 1.021 -32.338 1.00 0.00 C ATOM 244 C ARG A 39 -80.356 1.464 -33.781 1.00 0.00 C ATOM 245 O ARG A 39 -79.370 1.076 -34.410 1.00 0.00 O ATOM 246 CB ARG A 39 -80.327 -0.487 -32.201 1.00 0.00 C ATOM 247 CG ARG A 39 -80.533 -1.033 -30.795 1.00 0.00 C ATOM 248 CD ARG A 39 -79.735 -0.253 -29.763 1.00 0.00 C ATOM 249 NE ARG A 39 -79.875 -0.820 -28.422 1.00 0.00 N ATOM 250 CZ ARG A 39 -80.867 -0.523 -27.580 1.00 0.00 C ATOM 251 NH1 ARG A 39 -81.827 0.320 -27.940 1.00 0.00 N ATOM 252 NH2 ARG A 39 -80.900 -1.081 -26.377 1.00 0.00 N ATOM 0 H ARG A 39 -81.962 2.103 -31.175 1.00 0.00 H new ATOM 0 HA ARG A 39 -79.893 1.554 -31.694 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -80.983 -1.023 -32.886 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.303 -0.694 -32.512 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -81.592 -0.993 -30.541 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -80.238 -2.082 -30.766 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -78.683 -0.247 -30.047 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -80.068 0.785 -29.755 1.00 0.00 H new ATOM 0 HE ARG A 39 -79.168 -1.486 -28.110 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -81.810 0.746 -28.866 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -82.581 0.541 -27.290 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -80.169 -1.735 -26.098 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -81.657 -0.856 -25.731 1.00 0.00 H new ATOM 266 N SER A 40 -81.259 2.282 -34.298 1.00 0.00 N ATOM 267 CA SER A 40 -81.152 2.793 -35.655 1.00 0.00 C ATOM 268 C SER A 40 -81.859 4.138 -35.759 1.00 0.00 C ATOM 269 O SER A 40 -82.821 4.399 -35.035 1.00 0.00 O ATOM 270 CB SER A 40 -81.758 1.796 -36.647 1.00 0.00 C ATOM 271 OG SER A 40 -81.145 0.523 -36.522 1.00 0.00 O ATOM 0 H SER A 40 -82.082 2.609 -33.792 1.00 0.00 H new ATOM 0 HA SER A 40 -80.099 2.928 -35.900 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.830 1.707 -36.471 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.632 2.167 -37.664 1.00 0.00 H new ATOM 0 HG SER A 40 -81.634 -0.012 -35.863 1.00 0.00 H new ATOM 277 N ASN A 41 -81.382 4.994 -36.652 1.00 0.00 N ATOM 278 CA ASN A 41 -81.974 6.312 -36.819 1.00 0.00 C ATOM 279 C ASN A 41 -83.142 6.247 -37.797 1.00 0.00 C ATOM 280 O ASN A 41 -83.023 6.634 -38.962 1.00 0.00 O ATOM 281 CB ASN A 41 -80.922 7.329 -37.283 1.00 0.00 C ATOM 282 CG ASN A 41 -81.458 8.749 -37.333 1.00 0.00 C ATOM 283 OD1 ASN A 41 -81.458 9.463 -36.328 1.00 0.00 O ATOM 284 ND2 ASN A 41 -81.898 9.181 -38.506 1.00 0.00 N ATOM 0 H ASN A 41 -80.592 4.801 -37.268 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.354 6.645 -35.853 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.066 7.292 -36.609 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.562 7.046 -38.272 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -82.252 10.133 -38.599 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -81.883 8.561 -39.316 1.00 0.00 H new ATOM 291 N SER A 42 -84.251 5.698 -37.316 1.00 0.00 N ATOM 292 CA SER A 42 -85.490 5.626 -38.075 1.00 0.00 C ATOM 293 C SER A 42 -86.565 4.950 -37.245 1.00 0.00 C ATOM 294 O SER A 42 -86.381 3.841 -36.747 1.00 0.00 O ATOM 295 CB SER A 42 -85.303 4.870 -39.397 1.00 0.00 C ATOM 296 OG SER A 42 -86.513 4.837 -40.142 1.00 0.00 O ATOM 0 H SER A 42 -84.315 5.289 -36.384 1.00 0.00 H new ATOM 0 HA SER A 42 -85.794 6.645 -38.313 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.522 5.350 -39.987 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.969 3.852 -39.194 1.00 0.00 H new ATOM 0 HG SER A 42 -86.368 4.351 -40.981 1.00 0.00 H new ATOM 302 N LYS A 43 -87.688 5.622 -37.094 1.00 0.00 N ATOM 303 CA LYS A 43 -88.825 5.037 -36.408 1.00 0.00 C ATOM 304 C LYS A 43 -89.536 4.063 -37.336 1.00 0.00 C ATOM 305 O LYS A 43 -90.491 3.395 -36.945 1.00 0.00 O ATOM 306 CB LYS A 43 -89.780 6.128 -35.921 1.00 0.00 C ATOM 307 CG LYS A 43 -89.095 7.147 -35.032 1.00 0.00 C ATOM 308 CD LYS A 43 -90.077 8.107 -34.389 1.00 0.00 C ATOM 309 CE LYS A 43 -89.348 9.115 -33.514 1.00 0.00 C ATOM 310 NZ LYS A 43 -88.535 8.454 -32.455 1.00 0.00 N ATOM 0 H LYS A 43 -87.839 6.571 -37.436 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.472 4.491 -35.533 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.215 6.636 -36.782 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -90.603 5.668 -35.373 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.536 6.628 -34.253 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -88.372 7.711 -35.621 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -90.641 8.629 -35.161 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -90.797 7.551 -33.789 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -88.699 9.732 -34.136 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -90.074 9.783 -33.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -88.265 9.155 -31.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -89.094 7.699 -32.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -87.678 8.045 -32.880 1.00 0.00 H new ATOM 324 N CYS A 44 -89.048 3.980 -38.572 1.00 0.00 N ATOM 325 CA CYS A 44 -89.602 3.066 -39.553 1.00 0.00 C ATOM 326 C CYS A 44 -88.517 2.094 -40.040 1.00 0.00 C ATOM 327 O CYS A 44 -88.701 1.398 -41.036 1.00 0.00 O ATOM 328 CB CYS A 44 -90.201 3.845 -40.733 1.00 0.00 C ATOM 329 SG CYS A 44 -90.979 5.420 -40.263 1.00 0.00 S ATOM 0 H CYS A 44 -88.267 4.540 -38.913 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.400 2.489 -39.085 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.414 4.044 -41.461 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.943 3.219 -41.229 1.00 0.00 H new ATOM 334 N GLN A 45 -87.382 2.052 -39.331 1.00 0.00 N ATOM 335 CA GLN A 45 -86.322 1.075 -39.612 1.00 0.00 C ATOM 336 C GLN A 45 -85.421 0.893 -38.388 1.00 0.00 C ATOM 337 O GLN A 45 -84.864 1.863 -37.881 1.00 0.00 O ATOM 338 CB GLN A 45 -85.476 1.524 -40.811 1.00 0.00 C ATOM 339 CG GLN A 45 -84.330 0.580 -41.137 1.00 0.00 C ATOM 340 CD GLN A 45 -83.434 1.106 -42.240 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.284 2.316 -42.410 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.833 0.202 -43.000 1.00 0.00 N ATOM 0 H GLN A 45 -87.174 2.684 -38.558 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.797 0.123 -39.850 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -86.120 1.615 -41.685 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -85.072 2.516 -40.608 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.735 0.414 -40.239 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.735 -0.387 -41.434 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -82.984 -0.792 -42.826 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -82.220 0.500 -43.759 1.00 0.00 H new ATOM 351 N GLY A 46 -85.261 -0.346 -37.926 1.00 0.00 N ATOM 352 CA GLY A 46 -84.453 -0.590 -36.743 1.00 0.00 C ATOM 353 C GLY A 46 -84.717 -1.946 -36.118 1.00 0.00 C ATOM 354 O GLY A 46 -85.507 -2.736 -36.638 1.00 0.00 O ATOM 0 H GLY A 46 -85.673 -1.179 -38.346 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.398 -0.517 -37.008 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.651 0.189 -36.007 1.00 0.00 H new ATOM 358 N GLN A 47 -84.025 -2.234 -35.025 1.00 0.00 N ATOM 359 CA GLN A 47 -84.238 -3.469 -34.279 1.00 0.00 C ATOM 360 C GLN A 47 -85.470 -3.318 -33.390 1.00 0.00 C ATOM 361 O GLN A 47 -85.716 -2.241 -32.849 1.00 0.00 O ATOM 362 CB GLN A 47 -82.995 -3.794 -33.447 1.00 0.00 C ATOM 363 CG GLN A 47 -81.739 -3.942 -34.296 1.00 0.00 C ATOM 364 CD GLN A 47 -80.462 -3.996 -33.481 1.00 0.00 C ATOM 365 OE1 GLN A 47 -80.433 -4.497 -32.358 1.00 0.00 O ATOM 366 NE2 GLN A 47 -79.387 -3.478 -34.054 1.00 0.00 N ATOM 0 H GLN A 47 -83.307 -1.626 -34.632 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.408 -4.294 -34.970 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -82.840 -3.005 -32.711 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.165 -4.718 -32.894 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.818 -4.850 -34.893 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.681 -3.106 -34.993 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -79.452 -3.072 -34.987 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -78.493 -3.485 -33.562 1.00 0.00 H new ATOM 375 N LEU A 48 -86.247 -4.386 -33.252 1.00 0.00 N ATOM 376 CA LEU A 48 -87.532 -4.306 -32.564 1.00 0.00 C ATOM 377 C LEU A 48 -87.365 -4.260 -31.050 1.00 0.00 C ATOM 378 O LEU A 48 -86.824 -5.181 -30.439 1.00 0.00 O ATOM 379 CB LEU A 48 -88.428 -5.488 -32.945 1.00 0.00 C ATOM 380 CG LEU A 48 -89.854 -5.436 -32.385 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.615 -4.251 -32.955 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.592 -6.731 -32.682 1.00 0.00 C ATOM 0 H LEU A 48 -86.012 -5.314 -33.605 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.004 -3.377 -32.883 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.484 -5.545 -34.032 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -87.954 -6.408 -32.602 1.00 0.00 H new ATOM 0 HG LEU A 48 -89.789 -5.314 -31.304 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.624 -4.235 -32.543 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.100 -3.327 -32.691 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.667 -4.340 -34.040 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.602 -6.675 -32.277 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.641 -6.883 -33.760 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.062 -7.565 -32.222 1.00 0.00 H new ATOM 394 N GLU A 49 -87.850 -3.182 -30.464 1.00 0.00 N ATOM 395 CA GLU A 49 -87.881 -3.018 -29.023 1.00 0.00 C ATOM 396 C GLU A 49 -89.340 -2.904 -28.584 1.00 0.00 C ATOM 397 O GLU A 49 -90.047 -1.980 -28.993 1.00 0.00 O ATOM 398 CB GLU A 49 -87.092 -1.766 -28.630 1.00 0.00 C ATOM 399 CG GLU A 49 -86.877 -1.604 -27.134 1.00 0.00 C ATOM 400 CD GLU A 49 -86.131 -0.327 -26.795 1.00 0.00 C ATOM 401 OE1 GLU A 49 -84.879 -0.335 -26.828 1.00 0.00 O ATOM 402 OE2 GLU A 49 -86.794 0.691 -26.510 1.00 0.00 O ATOM 0 H GLU A 49 -88.236 -2.390 -30.978 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.421 -3.874 -28.529 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.121 -1.794 -29.124 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.616 -0.888 -29.007 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -87.843 -1.603 -26.628 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.319 -2.460 -26.754 1.00 0.00 H new ATOM 409 N VAL A 50 -89.802 -3.858 -27.786 1.00 0.00 N ATOM 410 CA VAL A 50 -91.214 -3.918 -27.413 1.00 0.00 C ATOM 411 C VAL A 50 -91.404 -3.900 -25.899 1.00 0.00 C ATOM 412 O VAL A 50 -90.635 -4.506 -25.158 1.00 0.00 O ATOM 413 CB VAL A 50 -91.894 -5.161 -28.021 1.00 0.00 C ATOM 414 CG1 VAL A 50 -92.064 -4.979 -29.520 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.081 -6.416 -27.738 1.00 0.00 C ATOM 0 H VAL A 50 -89.226 -4.598 -27.385 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.689 -3.025 -27.819 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.875 -5.276 -27.560 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -92.545 -5.862 -29.941 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -92.682 -4.102 -29.712 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.087 -4.843 -29.983 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -91.581 -7.280 -28.177 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.087 -6.312 -28.174 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.992 -6.557 -26.661 1.00 0.00 H new ATOM 425 N TYR A 51 -92.442 -3.209 -25.452 1.00 0.00 N ATOM 426 CA TYR A 51 -92.651 -2.961 -24.031 1.00 0.00 C ATOM 427 C TYR A 51 -93.668 -3.933 -23.442 1.00 0.00 C ATOM 428 O TYR A 51 -94.872 -3.788 -23.657 1.00 0.00 O ATOM 429 CB TYR A 51 -93.123 -1.515 -23.834 1.00 0.00 C ATOM 430 CG TYR A 51 -93.202 -1.065 -22.393 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.056 -0.941 -21.621 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.424 -0.751 -21.812 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.123 -0.519 -20.310 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.500 -0.324 -20.500 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.346 -0.211 -19.753 1.00 0.00 C ATOM 436 OH TYR A 51 -93.415 0.209 -18.444 1.00 0.00 O ATOM 0 H TYR A 51 -93.158 -2.807 -26.057 1.00 0.00 H new ATOM 0 HA TYR A 51 -91.707 -3.115 -23.508 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.446 -0.850 -24.371 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.107 -1.404 -24.289 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.096 -1.179 -22.054 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.329 -0.842 -22.395 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.221 -0.430 -19.722 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.457 -0.080 -20.062 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.349 0.386 -18.206 1.00 0.00 H new ATOM 446 N LEU A 52 -93.181 -4.921 -22.698 1.00 0.00 N ATOM 447 CA LEU A 52 -94.054 -5.895 -22.052 1.00 0.00 C ATOM 448 C LEU A 52 -93.541 -6.264 -20.676 1.00 0.00 C ATOM 449 O LEU A 52 -92.332 -6.390 -20.473 1.00 0.00 O ATOM 450 CB LEU A 52 -94.220 -7.135 -22.923 1.00 0.00 C ATOM 451 CG LEU A 52 -92.927 -7.778 -23.457 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.304 -8.718 -22.431 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.200 -8.521 -24.753 1.00 0.00 C ATOM 0 H LEU A 52 -92.186 -5.068 -22.527 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.034 -5.434 -21.927 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.762 -7.886 -22.348 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.847 -6.872 -23.775 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.215 -6.976 -23.651 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.393 -9.154 -22.842 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.063 -8.160 -21.526 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.010 -9.513 -22.190 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.276 -8.970 -25.117 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -93.938 -9.304 -24.575 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -93.583 -7.824 -25.498 1.00 0.00 H new ATOM 465 N LYS A 53 -94.468 -6.424 -19.734 1.00 0.00 N ATOM 466 CA LYS A 53 -94.130 -6.634 -18.330 1.00 0.00 C ATOM 467 C LYS A 53 -93.139 -5.562 -17.884 1.00 0.00 C ATOM 468 O LYS A 53 -92.256 -5.812 -17.073 1.00 0.00 O ATOM 469 CB LYS A 53 -93.573 -8.052 -18.108 1.00 0.00 C ATOM 470 CG LYS A 53 -93.548 -8.485 -16.642 1.00 0.00 C ATOM 471 CD LYS A 53 -94.895 -8.265 -15.964 1.00 0.00 C ATOM 472 CE LYS A 53 -96.012 -9.061 -16.627 1.00 0.00 C ATOM 473 NZ LYS A 53 -97.348 -8.663 -16.112 1.00 0.00 N ATOM 0 H LYS A 53 -95.470 -6.412 -19.922 1.00 0.00 H new ATOM 0 HA LYS A 53 -95.031 -6.547 -17.722 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -94.175 -8.761 -18.676 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.560 -8.101 -18.508 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -93.277 -9.539 -16.579 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -92.778 -7.926 -16.111 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -94.822 -8.550 -14.914 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -95.143 -7.204 -15.989 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -95.977 -8.909 -17.706 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -95.856 -10.125 -16.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -98.084 -9.225 -16.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -97.389 -8.832 -15.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -97.507 -7.653 -16.303 1.00 0.00 H new ATOM 487 N ASP A 54 -93.291 -4.379 -18.499 1.00 0.00 N ATOM 488 CA ASP A 54 -92.506 -3.159 -18.192 1.00 0.00 C ATOM 489 C ASP A 54 -91.060 -3.291 -18.668 1.00 0.00 C ATOM 490 O ASP A 54 -90.243 -2.385 -18.495 1.00 0.00 O ATOM 491 CB ASP A 54 -92.586 -2.732 -16.701 1.00 0.00 C ATOM 492 CG ASP A 54 -91.639 -3.455 -15.748 1.00 0.00 C ATOM 493 OD1 ASP A 54 -90.408 -3.259 -15.843 1.00 0.00 O ATOM 494 OD2 ASP A 54 -92.130 -4.192 -14.864 1.00 0.00 O ATOM 0 H ASP A 54 -93.976 -4.234 -19.241 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.972 -2.350 -18.755 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -92.386 -1.662 -16.638 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.608 -2.886 -16.353 1.00 0.00 H new ATOM 499 N GLY A 55 -90.777 -4.408 -19.311 1.00 0.00 N ATOM 500 CA GLY A 55 -89.497 -4.626 -19.942 1.00 0.00 C ATOM 501 C GLY A 55 -89.519 -4.217 -21.384 1.00 0.00 C ATOM 502 O GLY A 55 -90.224 -4.826 -22.189 1.00 0.00 O ATOM 0 H GLY A 55 -91.429 -5.186 -19.408 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -88.729 -4.061 -19.414 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.227 -5.679 -19.865 1.00 0.00 H new ATOM 506 N TRP A 56 -88.789 -3.158 -21.706 1.00 0.00 N ATOM 507 CA TRP A 56 -88.489 -2.858 -23.091 1.00 0.00 C ATOM 508 C TRP A 56 -87.603 -3.967 -23.624 1.00 0.00 C ATOM 509 O TRP A 56 -86.375 -3.856 -23.647 1.00 0.00 O ATOM 510 CB TRP A 56 -87.800 -1.498 -23.245 1.00 0.00 C ATOM 511 CG TRP A 56 -88.755 -0.348 -23.344 1.00 0.00 C ATOM 512 CD1 TRP A 56 -88.933 0.658 -22.438 1.00 0.00 C ATOM 513 CD2 TRP A 56 -89.667 -0.089 -24.416 1.00 0.00 C ATOM 514 NE1 TRP A 56 -89.898 1.529 -22.884 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.364 1.091 -24.099 1.00 0.00 C ATOM 516 CE3 TRP A 56 -89.956 -0.742 -25.616 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.338 1.627 -24.941 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -90.920 -0.210 -26.450 1.00 0.00 C ATOM 519 CH2 TRP A 56 -91.601 0.962 -26.111 1.00 0.00 C ATOM 0 H TRP A 56 -88.399 -2.500 -21.031 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.418 -2.801 -23.658 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.138 -1.337 -22.394 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.174 -1.517 -24.137 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -88.394 0.755 -21.507 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.216 2.364 -22.393 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.434 -1.648 -25.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -91.866 2.533 -24.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.151 -0.708 -27.380 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.350 1.352 -26.784 1.00 0.00 H new ATOM 530 N HIS A 57 -88.236 -5.069 -23.977 1.00 0.00 N ATOM 531 CA HIS A 57 -87.524 -6.248 -24.382 1.00 0.00 C ATOM 532 C HIS A 57 -87.121 -6.133 -25.839 1.00 0.00 C ATOM 533 O HIS A 57 -87.943 -6.337 -26.731 1.00 0.00 O ATOM 534 CB HIS A 57 -88.372 -7.514 -24.174 1.00 0.00 C ATOM 535 CG HIS A 57 -88.298 -8.066 -22.782 1.00 0.00 C ATOM 536 ND1 HIS A 57 -88.651 -9.361 -22.458 1.00 0.00 N ATOM 537 CD2 HIS A 57 -87.914 -7.485 -21.621 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.484 -9.549 -21.162 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.038 -8.425 -20.632 1.00 0.00 N ATOM 0 H HIS A 57 -89.251 -5.164 -23.989 1.00 0.00 H new ATOM 0 HA HIS A 57 -86.632 -6.332 -23.761 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.412 -7.287 -24.411 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.044 -8.280 -24.877 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -87.573 -6.468 -21.497 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -88.679 -10.466 -20.626 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -87.821 -8.280 -19.646 1.00 0.00 H new ATOM 548 N MET A 58 -85.878 -5.761 -26.082 1.00 0.00 N ATOM 549 CA MET A 58 -85.368 -5.718 -27.440 1.00 0.00 C ATOM 550 C MET A 58 -85.255 -7.140 -27.963 1.00 0.00 C ATOM 551 O MET A 58 -84.522 -7.953 -27.407 1.00 0.00 O ATOM 552 CB MET A 58 -84.011 -5.008 -27.489 1.00 0.00 C ATOM 553 CG MET A 58 -83.429 -4.895 -28.889 1.00 0.00 C ATOM 554 SD MET A 58 -81.914 -3.913 -28.931 1.00 0.00 S ATOM 555 CE MET A 58 -80.885 -4.819 -27.781 1.00 0.00 C ATOM 0 H MET A 58 -85.208 -5.486 -25.364 1.00 0.00 H new ATOM 0 HA MET A 58 -86.054 -5.152 -28.071 1.00 0.00 H new ATOM 0 HB2 MET A 58 -84.119 -4.008 -27.068 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.306 -5.546 -26.855 1.00 0.00 H new ATOM 0 HG2 MET A 58 -83.222 -5.893 -29.275 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.169 -4.445 -29.551 1.00 0.00 H new ATOM 0 HE1 MET A 58 -79.845 -4.517 -27.908 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.203 -4.604 -26.761 1.00 0.00 H new ATOM 0 HE3 MET A 58 -80.979 -5.888 -27.973 1.00 0.00 H new ATOM 565 N VAL A 59 -86.004 -7.447 -29.004 1.00 0.00 N ATOM 566 CA VAL A 59 -86.061 -8.807 -29.519 1.00 0.00 C ATOM 567 C VAL A 59 -85.102 -8.978 -30.685 1.00 0.00 C ATOM 568 O VAL A 59 -84.476 -8.015 -31.127 1.00 0.00 O ATOM 569 CB VAL A 59 -87.485 -9.171 -29.989 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.501 -8.886 -28.898 1.00 0.00 C ATOM 571 CG2 VAL A 59 -87.842 -8.421 -31.259 1.00 0.00 C ATOM 0 H VAL A 59 -86.582 -6.777 -29.511 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.775 -9.472 -28.704 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.506 -10.239 -30.206 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.498 -9.150 -29.251 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.261 -9.477 -28.014 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.475 -7.826 -28.644 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -88.850 -8.694 -31.571 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -87.798 -7.348 -31.073 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.135 -8.682 -32.047 1.00 0.00 H new ATOM 581 N CYS A 60 -84.993 -10.196 -31.191 1.00 0.00 N ATOM 582 CA CYS A 60 -84.177 -10.444 -32.364 1.00 0.00 C ATOM 583 C CYS A 60 -85.049 -10.613 -33.610 1.00 0.00 C ATOM 584 O CYS A 60 -84.655 -11.259 -34.584 1.00 0.00 O ATOM 585 CB CYS A 60 -83.257 -11.646 -32.144 1.00 0.00 C ATOM 586 SG CYS A 60 -84.028 -13.131 -31.462 1.00 0.00 S ATOM 0 H CYS A 60 -85.456 -11.021 -30.810 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.541 -9.575 -32.530 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -82.800 -11.906 -33.099 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.451 -11.342 -31.476 1.00 0.00 H new ATOM 591 N SER A 61 -86.242 -10.011 -33.546 1.00 0.00 N ATOM 592 CA SER A 61 -87.155 -9.864 -34.687 1.00 0.00 C ATOM 593 C SER A 61 -87.804 -11.183 -35.120 1.00 0.00 C ATOM 594 O SER A 61 -89.028 -11.292 -35.142 1.00 0.00 O ATOM 595 CB SER A 61 -86.431 -9.206 -35.861 1.00 0.00 C ATOM 596 OG SER A 61 -85.898 -7.946 -35.482 1.00 0.00 O ATOM 0 H SER A 61 -86.607 -9.605 -32.685 1.00 0.00 H new ATOM 0 HA SER A 61 -87.970 -9.221 -34.355 1.00 0.00 H new ATOM 0 HB2 SER A 61 -85.628 -9.856 -36.209 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.122 -9.078 -36.694 1.00 0.00 H new ATOM 0 HG SER A 61 -85.000 -7.844 -35.860 1.00 0.00 H new ATOM 602 N GLN A 62 -86.995 -12.186 -35.446 1.00 0.00 N ATOM 603 CA GLN A 62 -87.516 -13.455 -35.958 1.00 0.00 C ATOM 604 C GLN A 62 -88.155 -14.280 -34.840 1.00 0.00 C ATOM 605 O GLN A 62 -88.689 -15.366 -35.085 1.00 0.00 O ATOM 606 CB GLN A 62 -86.402 -14.251 -36.655 1.00 0.00 C ATOM 607 CG GLN A 62 -85.300 -14.735 -35.722 1.00 0.00 C ATOM 608 CD GLN A 62 -85.629 -16.046 -35.027 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.229 -16.282 -33.889 1.00 0.00 O ATOM 610 NE2 GLN A 62 -86.334 -16.922 -35.721 1.00 0.00 N ATOM 0 H GLN A 62 -85.979 -12.148 -35.366 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.291 -13.232 -36.691 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.845 -15.113 -37.153 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -85.957 -13.628 -37.431 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.379 -14.856 -36.292 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -85.111 -13.971 -34.968 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -86.649 -16.691 -36.663 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -86.563 -17.829 -35.314 1.00 0.00 H new ATOM 619 N SER A 63 -88.086 -13.758 -33.617 1.00 0.00 N ATOM 620 CA SER A 63 -88.690 -14.393 -32.452 1.00 0.00 C ATOM 621 C SER A 63 -90.185 -14.648 -32.701 1.00 0.00 C ATOM 622 O SER A 63 -90.770 -14.030 -33.593 1.00 0.00 O ATOM 623 CB SER A 63 -88.507 -13.483 -31.242 1.00 0.00 C ATOM 624 OG SER A 63 -87.158 -13.065 -31.121 1.00 0.00 O ATOM 0 H SER A 63 -87.608 -12.881 -33.408 1.00 0.00 H new ATOM 0 HA SER A 63 -88.205 -15.351 -32.266 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.155 -12.611 -31.337 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.811 -14.009 -30.337 1.00 0.00 H new ATOM 0 HG SER A 63 -86.572 -13.722 -31.551 1.00 0.00 H new ATOM 630 N TRP A 64 -90.795 -15.538 -31.908 1.00 0.00 N ATOM 631 CA TRP A 64 -92.203 -15.930 -32.082 1.00 0.00 C ATOM 632 C TRP A 64 -92.377 -16.797 -33.326 1.00 0.00 C ATOM 633 O TRP A 64 -92.632 -17.994 -33.226 1.00 0.00 O ATOM 634 CB TRP A 64 -93.138 -14.712 -32.167 1.00 0.00 C ATOM 635 CG TRP A 64 -93.262 -13.941 -30.890 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.093 -14.225 -29.848 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.542 -12.759 -30.518 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.932 -13.300 -28.851 1.00 0.00 N ATOM 639 CE2 TRP A 64 -92.985 -12.390 -29.237 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.560 -11.978 -31.139 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.485 -11.279 -28.567 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.063 -10.875 -30.470 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.525 -10.536 -29.193 1.00 0.00 C ATOM 0 H TRP A 64 -90.330 -16.006 -31.130 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.479 -16.506 -31.199 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.775 -14.044 -32.948 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.129 -15.050 -32.472 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.779 -15.058 -29.813 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.436 -13.291 -27.964 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.197 -12.233 -32.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -92.844 -11.012 -27.584 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.306 -10.265 -30.940 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.115 -9.671 -28.693 1.00 0.00 H new ATOM 654 N GLY A 65 -92.205 -16.188 -34.495 1.00 0.00 N ATOM 655 CA GLY A 65 -92.374 -16.899 -35.747 1.00 0.00 C ATOM 656 C GLY A 65 -91.347 -17.996 -35.928 1.00 0.00 C ATOM 657 O GLY A 65 -91.541 -18.902 -36.741 1.00 0.00 O ATOM 0 H GLY A 65 -91.949 -15.206 -34.596 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -93.374 -17.331 -35.785 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -92.300 -16.194 -36.575 1.00 0.00 H new ATOM 661 N ARG A 66 -90.244 -17.892 -35.183 1.00 0.00 N ATOM 662 CA ARG A 66 -89.209 -18.927 -35.148 1.00 0.00 C ATOM 663 C ARG A 66 -88.627 -19.172 -36.531 1.00 0.00 C ATOM 664 O ARG A 66 -88.122 -20.252 -36.823 1.00 0.00 O ATOM 665 CB ARG A 66 -89.779 -20.224 -34.574 1.00 0.00 C ATOM 666 CG ARG A 66 -90.269 -20.084 -33.143 1.00 0.00 C ATOM 667 CD ARG A 66 -90.946 -21.352 -32.659 1.00 0.00 C ATOM 668 NE ARG A 66 -92.141 -21.667 -33.438 1.00 0.00 N ATOM 669 CZ ARG A 66 -92.771 -22.835 -33.388 1.00 0.00 C ATOM 670 NH1 ARG A 66 -92.327 -23.798 -32.589 1.00 0.00 N ATOM 671 NH2 ARG A 66 -93.849 -23.036 -34.133 1.00 0.00 N ATOM 0 H ARG A 66 -90.044 -17.088 -34.588 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.403 -18.577 -34.503 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -90.604 -20.559 -35.202 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -89.013 -20.998 -34.614 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -89.428 -19.848 -32.491 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.967 -19.250 -33.077 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -90.244 -22.184 -32.720 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -91.217 -21.240 -31.609 1.00 0.00 H new ATOM 0 HE ARG A 66 -92.514 -20.947 -34.057 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -91.501 -23.641 -32.012 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -92.812 -24.694 -32.552 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -94.193 -22.294 -34.743 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -94.334 -23.932 -34.096 1.00 0.00 H new ATOM 685 N SER A 67 -88.679 -18.154 -37.371 1.00 0.00 N ATOM 686 CA SER A 67 -88.200 -18.268 -38.733 1.00 0.00 C ATOM 687 C SER A 67 -87.468 -17.002 -39.158 1.00 0.00 C ATOM 688 O SER A 67 -88.027 -15.901 -39.115 1.00 0.00 O ATOM 689 CB SER A 67 -89.374 -18.546 -39.672 1.00 0.00 C ATOM 690 OG SER A 67 -90.453 -17.663 -39.406 1.00 0.00 O ATOM 0 H SER A 67 -89.051 -17.235 -37.130 1.00 0.00 H new ATOM 0 HA SER A 67 -87.496 -19.098 -38.787 1.00 0.00 H new ATOM 0 HB2 SER A 67 -89.052 -18.432 -40.707 1.00 0.00 H new ATOM 0 HB3 SER A 67 -89.705 -19.578 -39.552 1.00 0.00 H new ATOM 0 HG SER A 67 -90.922 -17.954 -38.596 1.00 0.00 H new ATOM 696 N SER A 68 -86.209 -17.156 -39.544 1.00 0.00 N ATOM 697 CA SER A 68 -85.428 -16.043 -40.048 1.00 0.00 C ATOM 698 C SER A 68 -85.855 -15.716 -41.474 1.00 0.00 C ATOM 699 O SER A 68 -85.396 -16.338 -42.435 1.00 0.00 O ATOM 700 CB SER A 68 -83.935 -16.374 -39.974 1.00 0.00 C ATOM 701 OG SER A 68 -83.692 -17.721 -40.340 1.00 0.00 O ATOM 0 H SER A 68 -85.709 -18.044 -39.516 1.00 0.00 H new ATOM 0 HA SER A 68 -85.607 -15.163 -39.430 1.00 0.00 H new ATOM 0 HB2 SER A 68 -83.379 -15.709 -40.634 1.00 0.00 H new ATOM 0 HB3 SER A 68 -83.570 -16.197 -38.962 1.00 0.00 H new ATOM 0 HG SER A 68 -84.119 -17.908 -41.202 1.00 0.00 H new ATOM 707 N LYS A 69 -86.769 -14.768 -41.599 1.00 0.00 N ATOM 708 CA LYS A 69 -87.346 -14.437 -42.887 1.00 0.00 C ATOM 709 C LYS A 69 -86.821 -13.110 -43.405 1.00 0.00 C ATOM 710 O LYS A 69 -86.561 -12.188 -42.636 1.00 0.00 O ATOM 711 CB LYS A 69 -88.873 -14.380 -42.795 1.00 0.00 C ATOM 712 CG LYS A 69 -89.521 -15.698 -42.391 1.00 0.00 C ATOM 713 CD LYS A 69 -91.043 -15.601 -42.394 1.00 0.00 C ATOM 714 CE LYS A 69 -91.545 -14.582 -41.381 1.00 0.00 C ATOM 715 NZ LYS A 69 -91.284 -15.011 -39.981 1.00 0.00 N ATOM 0 H LYS A 69 -87.127 -14.214 -40.821 1.00 0.00 H new ATOM 0 HA LYS A 69 -87.055 -15.222 -43.585 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -89.154 -13.613 -42.074 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -89.273 -14.072 -43.761 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -89.205 -16.484 -43.076 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -89.176 -15.984 -41.397 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -91.388 -15.324 -43.390 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -91.470 -16.578 -42.169 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -91.061 -13.622 -41.562 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -92.615 -14.430 -41.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -92.149 -14.897 -39.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -90.994 -16.010 -39.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -90.525 -14.427 -39.575 1.00 0.00 H new ATOM 729 N GLN A 70 -86.661 -13.046 -44.714 1.00 0.00 N ATOM 730 CA GLN A 70 -86.300 -11.822 -45.412 1.00 0.00 C ATOM 731 C GLN A 70 -87.075 -11.778 -46.719 1.00 0.00 C ATOM 732 O GLN A 70 -86.655 -11.171 -47.702 1.00 0.00 O ATOM 733 CB GLN A 70 -84.794 -11.786 -45.684 1.00 0.00 C ATOM 734 CG GLN A 70 -84.267 -13.054 -46.342 1.00 0.00 C ATOM 735 CD GLN A 70 -82.824 -12.935 -46.786 1.00 0.00 C ATOM 736 OE1 GLN A 70 -82.077 -13.910 -46.764 1.00 0.00 O ATOM 737 NE2 GLN A 70 -82.428 -11.750 -47.220 1.00 0.00 N ATOM 0 H GLN A 70 -86.779 -13.850 -45.331 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.548 -10.955 -44.799 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -84.568 -10.933 -46.324 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -84.266 -11.627 -44.744 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -84.359 -13.885 -45.642 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -84.888 -13.294 -47.205 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -83.078 -10.964 -47.223 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -81.472 -11.622 -47.552 1.00 0.00 H new ATOM 746 N TRP A 71 -88.230 -12.430 -46.699 1.00 0.00 N ATOM 747 CA TRP A 71 -88.981 -12.711 -47.910 1.00 0.00 C ATOM 748 C TRP A 71 -90.281 -11.908 -47.958 1.00 0.00 C ATOM 749 O TRP A 71 -90.336 -10.774 -47.482 1.00 0.00 O ATOM 750 CB TRP A 71 -89.266 -14.211 -47.976 1.00 0.00 C ATOM 751 CG TRP A 71 -88.046 -15.053 -47.734 1.00 0.00 C ATOM 752 CD1 TRP A 71 -87.743 -15.745 -46.596 1.00 0.00 C ATOM 753 CD2 TRP A 71 -86.959 -15.279 -48.642 1.00 0.00 C ATOM 754 NE1 TRP A 71 -86.537 -16.385 -46.739 1.00 0.00 N ATOM 755 CE2 TRP A 71 -86.036 -16.116 -47.987 1.00 0.00 C ATOM 756 CE3 TRP A 71 -86.679 -14.855 -49.945 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -84.854 -16.539 -48.591 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -85.504 -15.275 -50.543 1.00 0.00 C ATOM 759 CH2 TRP A 71 -84.605 -16.108 -49.866 1.00 0.00 C ATOM 0 H TRP A 71 -88.669 -12.777 -45.846 1.00 0.00 H new ATOM 0 HA TRP A 71 -88.389 -12.412 -48.775 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.027 -14.463 -47.237 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -89.679 -14.454 -48.955 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -88.362 -15.783 -45.712 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -86.087 -16.966 -46.032 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -87.367 -14.212 -50.474 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -84.160 -17.183 -48.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -85.276 -14.955 -51.549 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -83.696 -16.417 -50.360 1.00 0.00 H new ATOM 770 N GLU A 72 -91.321 -12.501 -48.537 1.00 0.00 N ATOM 771 CA GLU A 72 -92.569 -11.793 -48.804 1.00 0.00 C ATOM 772 C GLU A 72 -93.301 -11.422 -47.515 1.00 0.00 C ATOM 773 O GLU A 72 -93.778 -10.298 -47.361 1.00 0.00 O ATOM 774 CB GLU A 72 -93.482 -12.666 -49.660 1.00 0.00 C ATOM 775 CG GLU A 72 -94.481 -11.883 -50.491 1.00 0.00 C ATOM 776 CD GLU A 72 -93.819 -11.149 -51.635 1.00 0.00 C ATOM 777 OE1 GLU A 72 -93.590 -11.779 -52.690 1.00 0.00 O ATOM 778 OE2 GLU A 72 -93.513 -9.951 -51.489 1.00 0.00 O ATOM 0 H GLU A 72 -91.323 -13.477 -48.832 1.00 0.00 H new ATOM 0 HA GLU A 72 -92.318 -10.872 -49.330 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -92.868 -13.273 -50.325 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -94.024 -13.353 -49.011 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -95.235 -12.563 -50.886 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -95.000 -11.167 -49.854 1.00 0.00 H new ATOM 785 N ASP A 73 -93.385 -12.375 -46.596 1.00 0.00 N ATOM 786 CA ASP A 73 -94.163 -12.197 -45.372 1.00 0.00 C ATOM 787 C ASP A 73 -93.265 -11.814 -44.197 1.00 0.00 C ATOM 788 O ASP A 73 -92.481 -12.630 -43.712 1.00 0.00 O ATOM 789 CB ASP A 73 -94.940 -13.479 -45.058 1.00 0.00 C ATOM 790 CG ASP A 73 -95.652 -13.432 -43.721 1.00 0.00 C ATOM 791 OD1 ASP A 73 -96.532 -12.566 -43.535 1.00 0.00 O ATOM 792 OD2 ASP A 73 -95.344 -14.274 -42.850 1.00 0.00 O ATOM 0 H ASP A 73 -92.924 -13.282 -46.673 1.00 0.00 H new ATOM 0 HA ASP A 73 -94.869 -11.381 -45.529 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -95.672 -13.655 -45.846 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -94.252 -14.325 -45.067 1.00 0.00 H new ATOM 797 N PRO A 74 -93.348 -10.552 -43.752 1.00 0.00 N ATOM 798 CA PRO A 74 -92.537 -10.038 -42.652 1.00 0.00 C ATOM 799 C PRO A 74 -93.142 -10.256 -41.253 1.00 0.00 C ATOM 800 O PRO A 74 -92.760 -11.191 -40.544 1.00 0.00 O ATOM 801 CB PRO A 74 -92.449 -8.562 -42.991 1.00 0.00 C ATOM 802 CG PRO A 74 -93.778 -8.265 -43.573 1.00 0.00 C ATOM 803 CD PRO A 74 -94.201 -9.500 -44.324 1.00 0.00 C ATOM 0 HA PRO A 74 -91.579 -10.554 -42.579 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.254 -7.957 -42.106 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.646 -8.359 -43.699 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.498 -8.020 -42.792 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -93.726 -7.404 -44.240 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.259 -9.717 -44.178 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -94.042 -9.392 -45.397 1.00 0.00 H new ATOM 811 N SER A 75 -94.092 -9.403 -40.863 1.00 0.00 N ATOM 812 CA SER A 75 -94.634 -9.393 -39.522 1.00 0.00 C ATOM 813 C SER A 75 -95.972 -8.661 -39.525 1.00 0.00 C ATOM 814 O SER A 75 -96.155 -7.692 -40.254 1.00 0.00 O ATOM 815 CB SER A 75 -93.664 -8.699 -38.561 1.00 0.00 C ATOM 816 OG SER A 75 -92.422 -9.379 -38.498 1.00 0.00 O ATOM 0 H SER A 75 -94.502 -8.701 -41.479 1.00 0.00 H new ATOM 0 HA SER A 75 -94.779 -10.420 -39.187 1.00 0.00 H new ATOM 0 HB2 SER A 75 -93.502 -7.671 -38.885 1.00 0.00 H new ATOM 0 HB3 SER A 75 -94.106 -8.653 -37.566 1.00 0.00 H new ATOM 0 HG SER A 75 -91.952 -9.126 -37.676 1.00 0.00 H new ATOM 822 N GLN A 76 -96.895 -9.134 -38.714 1.00 0.00 N ATOM 823 CA GLN A 76 -98.240 -8.557 -38.642 1.00 0.00 C ATOM 824 C GLN A 76 -98.324 -7.432 -37.604 1.00 0.00 C ATOM 825 O GLN A 76 -99.272 -7.371 -36.820 1.00 0.00 O ATOM 826 CB GLN A 76 -99.264 -9.647 -38.304 1.00 0.00 C ATOM 827 CG GLN A 76 -99.359 -10.746 -39.352 1.00 0.00 C ATOM 828 CD GLN A 76 -99.846 -10.244 -40.702 1.00 0.00 C ATOM 829 OE1 GLN A 76 -99.464 -10.776 -41.746 1.00 0.00 O ATOM 830 NE2 GLN A 76 -100.694 -9.224 -40.694 1.00 0.00 N ATOM 0 H GLN A 76 -96.745 -9.924 -38.086 1.00 0.00 H new ATOM 0 HA GLN A 76 -98.465 -8.130 -39.619 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -99.002 -10.094 -37.345 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -100.245 -9.187 -38.184 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.379 -11.208 -39.475 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -100.035 -11.523 -38.995 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.986 -8.811 -39.808 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -101.054 -8.853 -41.573 1.00 0.00 H new ATOM 839 N ALA A 77 -97.351 -6.529 -37.623 1.00 0.00 N ATOM 840 CA ALA A 77 -97.329 -5.395 -36.697 1.00 0.00 C ATOM 841 C ALA A 77 -97.873 -4.142 -37.374 1.00 0.00 C ATOM 842 O ALA A 77 -97.386 -3.025 -37.151 1.00 0.00 O ATOM 843 CB ALA A 77 -95.915 -5.154 -36.203 1.00 0.00 C ATOM 0 H ALA A 77 -96.563 -6.557 -38.270 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.966 -5.629 -35.844 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.909 -4.309 -35.515 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.553 -6.044 -35.688 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.266 -4.936 -37.051 1.00 0.00 H new ATOM 849 N SER A 78 -98.897 -4.345 -38.190 1.00 0.00 N ATOM 850 CA SER A 78 -99.463 -3.294 -39.016 1.00 0.00 C ATOM 851 C SER A 78 -99.879 -2.078 -38.188 1.00 0.00 C ATOM 852 O SER A 78 -99.544 -0.951 -38.534 1.00 0.00 O ATOM 853 CB SER A 78 -100.663 -3.854 -39.781 1.00 0.00 C ATOM 854 OG SER A 78 -100.352 -5.123 -40.338 1.00 0.00 O ATOM 0 H SER A 78 -99.359 -5.248 -38.297 1.00 0.00 H new ATOM 0 HA SER A 78 -98.699 -2.956 -39.716 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.518 -3.944 -39.111 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.950 -3.163 -40.574 1.00 0.00 H new ATOM 0 HG SER A 78 -101.131 -5.467 -40.822 1.00 0.00 H new ATOM 860 N LYS A 79 -100.578 -2.313 -37.080 1.00 0.00 N ATOM 861 CA LYS A 79 -101.062 -1.224 -36.235 1.00 0.00 C ATOM 862 C LYS A 79 -99.904 -0.481 -35.565 1.00 0.00 C ATOM 863 O LYS A 79 -99.990 0.722 -35.327 1.00 0.00 O ATOM 864 CB LYS A 79 -102.051 -1.760 -35.187 1.00 0.00 C ATOM 865 CG LYS A 79 -102.518 -0.723 -34.167 1.00 0.00 C ATOM 866 CD LYS A 79 -103.159 0.505 -34.814 1.00 0.00 C ATOM 867 CE LYS A 79 -104.560 0.237 -35.353 1.00 0.00 C ATOM 868 NZ LYS A 79 -104.551 -0.453 -36.669 1.00 0.00 N ATOM 0 H LYS A 79 -100.822 -3.246 -36.747 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.584 -0.509 -36.871 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.923 -2.163 -35.702 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.584 -2.589 -34.655 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.235 -1.186 -33.489 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -101.667 -0.406 -33.563 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.206 1.311 -34.081 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -102.523 0.852 -35.629 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -105.110 -0.370 -34.634 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -105.094 1.182 -35.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.347 -1.120 -36.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -104.642 0.250 -37.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -103.657 -0.972 -36.783 1.00 0.00 H new ATOM 882 N VAL A 80 -98.814 -1.188 -35.290 1.00 0.00 N ATOM 883 CA VAL A 80 -97.662 -0.575 -34.637 1.00 0.00 C ATOM 884 C VAL A 80 -97.067 0.527 -35.510 1.00 0.00 C ATOM 885 O VAL A 80 -97.051 1.697 -35.122 1.00 0.00 O ATOM 886 CB VAL A 80 -96.568 -1.613 -34.309 1.00 0.00 C ATOM 887 CG1 VAL A 80 -95.327 -0.942 -33.735 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.101 -2.653 -33.341 1.00 0.00 C ATOM 0 H VAL A 80 -98.703 -2.179 -35.507 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.020 -0.145 -33.702 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.284 -2.108 -35.238 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -94.574 -1.698 -33.514 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -94.928 -0.234 -34.461 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -95.590 -0.413 -32.819 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -96.318 -3.378 -33.119 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -97.415 -2.164 -32.419 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -97.953 -3.164 -33.789 1.00 0.00 H new ATOM 898 N CYS A 81 -96.617 0.165 -36.704 1.00 0.00 N ATOM 899 CA CYS A 81 -96.003 1.144 -37.595 1.00 0.00 C ATOM 900 C CYS A 81 -97.044 2.120 -38.128 1.00 0.00 C ATOM 901 O CYS A 81 -96.720 3.246 -38.501 1.00 0.00 O ATOM 902 CB CYS A 81 -95.263 0.455 -38.739 1.00 0.00 C ATOM 903 SG CYS A 81 -93.914 -0.615 -38.165 1.00 0.00 S ATOM 0 H CYS A 81 -96.663 -0.784 -37.075 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.272 1.712 -37.019 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.971 -0.140 -39.317 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.859 1.212 -39.411 1.00 0.00 H new ATOM 908 N GLN A 82 -98.299 1.690 -38.135 1.00 0.00 N ATOM 909 CA GLN A 82 -99.397 2.548 -38.544 1.00 0.00 C ATOM 910 C GLN A 82 -99.523 3.719 -37.575 1.00 0.00 C ATOM 911 O GLN A 82 -99.708 4.864 -37.988 1.00 0.00 O ATOM 912 CB GLN A 82 -100.694 1.741 -38.601 1.00 0.00 C ATOM 913 CG GLN A 82 -101.851 2.457 -39.270 1.00 0.00 C ATOM 914 CD GLN A 82 -103.024 1.533 -39.521 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.901 1.372 -38.673 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.043 0.911 -40.690 1.00 0.00 N ATOM 0 H GLN A 82 -98.580 0.749 -37.861 1.00 0.00 H new ATOM 0 HA GLN A 82 -99.199 2.945 -39.540 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.504 0.809 -39.133 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.986 1.475 -37.585 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -102.173 3.289 -38.644 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.516 2.882 -40.216 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.296 1.072 -41.366 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -103.805 0.271 -40.915 1.00 0.00 H new ATOM 925 N ARG A 83 -99.386 3.433 -36.282 1.00 0.00 N ATOM 926 CA ARG A 83 -99.390 4.484 -35.271 1.00 0.00 C ATOM 927 C ARG A 83 -98.096 5.289 -35.337 1.00 0.00 C ATOM 928 O ARG A 83 -98.050 6.442 -34.909 1.00 0.00 O ATOM 929 CB ARG A 83 -99.566 3.913 -33.862 1.00 0.00 C ATOM 930 CG ARG A 83 -100.908 3.234 -33.631 1.00 0.00 C ATOM 931 CD ARG A 83 -101.251 3.172 -32.150 1.00 0.00 C ATOM 932 NE ARG A 83 -101.401 4.510 -31.582 1.00 0.00 N ATOM 933 CZ ARG A 83 -102.127 4.794 -30.503 1.00 0.00 C ATOM 934 NH1 ARG A 83 -102.720 3.822 -29.815 1.00 0.00 N ATOM 935 NH2 ARG A 83 -102.239 6.058 -30.106 1.00 0.00 N ATOM 0 H ARG A 83 -99.272 2.489 -35.913 1.00 0.00 H new ATOM 0 HA ARG A 83 -100.238 5.136 -35.483 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -98.769 3.194 -33.671 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -99.449 4.719 -33.138 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -101.689 3.776 -34.164 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -100.883 2.225 -34.043 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -102.175 2.611 -32.012 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -100.468 2.634 -31.616 1.00 0.00 H new ATOM 0 HE ARG A 83 -100.916 5.279 -32.044 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -102.620 2.852 -30.113 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -103.275 4.047 -28.989 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -101.771 6.800 -30.627 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -102.793 6.286 -29.281 1.00 0.00 H new ATOM 949 N LEU A 84 -97.054 4.681 -35.895 1.00 0.00 N ATOM 950 CA LEU A 84 -95.760 5.344 -36.033 1.00 0.00 C ATOM 951 C LEU A 84 -95.707 6.158 -37.321 1.00 0.00 C ATOM 952 O LEU A 84 -94.646 6.622 -37.713 1.00 0.00 O ATOM 953 CB LEU A 84 -94.628 4.311 -36.040 1.00 0.00 C ATOM 954 CG LEU A 84 -94.470 3.490 -34.759 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.420 2.408 -34.950 1.00 0.00 C ATOM 956 CD2 LEU A 84 -94.094 4.386 -33.590 1.00 0.00 C ATOM 0 H LEU A 84 -97.080 3.729 -36.260 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.633 6.014 -35.182 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.792 3.625 -36.871 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.689 4.829 -36.235 1.00 0.00 H new ATOM 0 HG LEU A 84 -95.426 3.016 -34.537 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -93.319 1.832 -34.030 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.723 1.746 -35.761 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -92.463 2.869 -35.196 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -93.987 3.782 -32.689 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -93.151 4.888 -33.805 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.875 5.131 -33.437 1.00 0.00 H new ATOM 968 N ASN A 85 -96.866 6.297 -37.975 1.00 0.00 N ATOM 969 CA ASN A 85 -97.020 7.023 -39.252 1.00 0.00 C ATOM 970 C ASN A 85 -96.124 6.453 -40.363 1.00 0.00 C ATOM 971 O ASN A 85 -96.059 7.001 -41.462 1.00 0.00 O ATOM 972 CB ASN A 85 -96.821 8.555 -39.098 1.00 0.00 C ATOM 973 CG ASN A 85 -95.380 9.049 -39.231 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.889 9.287 -40.335 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.712 9.267 -38.107 1.00 0.00 N ATOM 0 H ASN A 85 -97.741 5.903 -37.630 1.00 0.00 H new ATOM 0 HA ASN A 85 -98.054 6.865 -39.558 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -97.430 9.060 -39.848 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.201 8.857 -38.122 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -93.764 9.642 -38.142 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.146 9.060 -37.207 1.00 0.00 H new ATOM 982 N CYS A 86 -95.494 5.317 -40.094 1.00 0.00 N ATOM 983 CA CYS A 86 -94.624 4.668 -41.066 1.00 0.00 C ATOM 984 C CYS A 86 -95.443 3.777 -41.999 1.00 0.00 C ATOM 985 O CYS A 86 -94.939 3.270 -43.001 1.00 0.00 O ATOM 986 CB CYS A 86 -93.545 3.856 -40.340 1.00 0.00 C ATOM 987 SG CYS A 86 -92.568 4.832 -39.161 1.00 0.00 S ATOM 0 H CYS A 86 -95.570 4.823 -39.205 1.00 0.00 H new ATOM 0 HA CYS A 86 -94.134 5.430 -41.672 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -94.019 3.030 -39.810 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.874 3.417 -41.079 1.00 0.00 H new ATOM 992 N GLY A 87 -96.713 3.583 -41.650 1.00 0.00 N ATOM 993 CA GLY A 87 -97.632 2.887 -42.527 1.00 0.00 C ATOM 994 C GLY A 87 -97.799 1.425 -42.170 1.00 0.00 C ATOM 995 O GLY A 87 -98.221 1.092 -41.065 1.00 0.00 O ATOM 0 H GLY A 87 -97.121 3.898 -40.770 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -98.604 3.378 -42.488 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -97.276 2.966 -43.554 1.00 0.00 H new ATOM 999 N ASP A 88 -97.457 0.558 -43.107 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.591 -0.880 -42.915 1.00 0.00 C ATOM 1001 C ASP A 88 -96.432 -1.378 -42.062 1.00 0.00 C ATOM 1002 O ASP A 88 -95.484 -0.626 -41.820 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.630 -1.579 -44.279 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.893 -1.263 -45.056 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.913 -0.247 -45.781 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.877 -2.022 -44.937 1.00 0.00 O ATOM 0 H ASP A 88 -97.081 0.826 -44.017 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.522 -1.109 -42.396 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.762 -1.276 -44.864 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.556 -2.657 -44.134 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.473 -2.622 -41.559 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.481 -3.076 -40.601 1.00 0.00 C ATOM 1013 C PRO A 89 -94.116 -3.318 -41.180 1.00 0.00 C ATOM 1014 O PRO A 89 -93.950 -3.698 -42.339 1.00 0.00 O ATOM 1015 CB PRO A 89 -96.025 -4.378 -40.075 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.908 -4.889 -41.153 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.463 -3.677 -41.859 1.00 0.00 C ATOM 0 HA PRO A 89 -95.334 -2.303 -39.847 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.222 -5.082 -39.856 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.579 -4.229 -39.148 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.351 -5.520 -41.845 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.711 -5.500 -40.740 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.558 -3.845 -42.932 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.454 -3.415 -41.488 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.159 -3.033 -40.335 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.786 -3.379 -40.512 1.00 0.00 C ATOM 1027 C LEU A 90 -91.597 -4.739 -41.155 1.00 0.00 C ATOM 1028 O LEU A 90 -92.071 -5.767 -40.677 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.027 -3.258 -39.177 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.882 -3.169 -37.886 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.969 -4.214 -37.812 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.013 -3.288 -36.659 1.00 0.00 C ATOM 0 H LEU A 90 -93.332 -2.529 -39.465 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.358 -2.664 -41.215 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.364 -4.118 -39.085 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.395 -2.372 -39.226 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.363 -2.191 -37.922 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.527 -4.093 -36.884 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.644 -4.097 -38.660 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.521 -5.207 -37.839 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.634 -3.223 -35.766 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.495 -4.247 -36.672 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.281 -2.480 -36.652 1.00 0.00 H new ATOM 1044 N SER A 91 -90.955 -4.677 -42.296 1.00 0.00 N ATOM 1045 CA SER A 91 -90.544 -5.853 -43.043 1.00 0.00 C ATOM 1046 C SER A 91 -89.268 -6.428 -42.434 1.00 0.00 C ATOM 1047 O SER A 91 -88.587 -5.750 -41.664 1.00 0.00 O ATOM 1048 CB SER A 91 -90.319 -5.483 -44.513 1.00 0.00 C ATOM 1049 OG SER A 91 -90.098 -6.633 -45.310 1.00 0.00 O ATOM 0 H SER A 91 -90.697 -3.797 -42.743 1.00 0.00 H new ATOM 0 HA SER A 91 -91.328 -6.608 -42.991 1.00 0.00 H new ATOM 0 HB2 SER A 91 -91.186 -4.939 -44.889 1.00 0.00 H new ATOM 0 HB3 SER A 91 -89.463 -4.813 -44.594 1.00 0.00 H new ATOM 0 HG SER A 91 -89.960 -6.363 -46.242 1.00 0.00 H new ATOM 1055 N LEU A 92 -88.946 -7.663 -42.788 1.00 0.00 N ATOM 1056 CA LEU A 92 -87.805 -8.356 -42.205 1.00 0.00 C ATOM 1057 C LEU A 92 -86.666 -8.519 -43.202 1.00 0.00 C ATOM 1058 O LEU A 92 -86.870 -8.979 -44.325 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.232 -9.730 -41.683 1.00 0.00 C ATOM 1060 CG LEU A 92 -88.809 -9.741 -40.267 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -89.403 -11.102 -39.938 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -87.725 -9.385 -39.265 1.00 0.00 C ATOM 0 H LEU A 92 -89.461 -8.209 -43.479 1.00 0.00 H new ATOM 0 HA LEU A 92 -87.442 -7.744 -41.379 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -88.976 -10.144 -42.364 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -87.369 -10.395 -41.711 1.00 0.00 H new ATOM 0 HG LEU A 92 -89.605 -8.999 -40.210 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -89.808 -11.087 -38.926 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -90.201 -11.331 -40.645 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -88.627 -11.864 -40.007 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -88.143 -9.395 -38.258 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -86.917 -10.113 -39.329 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -87.336 -8.391 -39.487 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.472 -8.132 -42.779 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.278 -8.334 -43.578 1.00 0.00 C ATOM 1076 C GLY A 93 -83.045 -8.395 -42.696 1.00 0.00 C ATOM 1077 O GLY A 93 -83.108 -7.979 -41.542 1.00 0.00 O ATOM 0 H GLY A 93 -85.306 -7.675 -41.883 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.369 -9.258 -44.149 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.176 -7.523 -44.299 1.00 0.00 H new ATOM 1081 N PRO A 94 -81.910 -8.913 -43.191 1.00 0.00 N ATOM 1082 CA PRO A 94 -80.690 -9.013 -42.389 1.00 0.00 C ATOM 1083 C PRO A 94 -79.975 -7.665 -42.251 1.00 0.00 C ATOM 1084 O PRO A 94 -79.417 -7.126 -43.211 1.00 0.00 O ATOM 1085 CB PRO A 94 -79.853 -10.029 -43.163 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.264 -9.843 -44.585 1.00 0.00 C ATOM 1087 CD PRO A 94 -81.719 -9.436 -44.557 1.00 0.00 C ATOM 0 HA PRO A 94 -80.883 -9.315 -41.360 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -78.786 -9.848 -43.031 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.048 -11.046 -42.823 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -79.656 -9.079 -45.069 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.129 -10.764 -45.152 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -81.937 -8.679 -45.310 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.376 -10.283 -44.757 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.022 -7.127 -41.045 1.00 0.00 N ATOM 1096 CA PHE A 95 -79.463 -5.822 -40.733 1.00 0.00 C ATOM 1097 C PHE A 95 -78.201 -6.006 -39.877 1.00 0.00 C ATOM 1098 O PHE A 95 -77.548 -7.049 -39.949 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.533 -4.994 -39.993 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.257 -3.514 -39.927 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -79.874 -2.819 -41.061 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.376 -2.823 -38.730 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -79.616 -1.462 -41.004 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.118 -1.467 -38.669 1.00 0.00 C ATOM 1105 CZ PHE A 95 -79.738 -0.785 -39.807 1.00 0.00 C ATOM 0 H PHE A 95 -80.454 -7.589 -40.245 1.00 0.00 H new ATOM 0 HA PHE A 95 -79.179 -5.291 -41.642 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.494 -5.148 -40.484 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.629 -5.377 -38.977 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -79.776 -3.342 -42.001 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.674 -3.351 -37.836 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -79.319 -0.931 -41.896 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.214 -0.941 -37.731 1.00 0.00 H new ATOM 0 HZ PHE A 95 -79.537 0.275 -39.761 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.857 -5.002 -39.084 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.718 -5.083 -38.177 1.00 0.00 C ATOM 1117 C LEU A 96 -77.231 -5.396 -36.770 1.00 0.00 C ATOM 1118 O LEU A 96 -78.255 -4.858 -36.354 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.940 -3.757 -38.214 1.00 0.00 C ATOM 1120 CG LEU A 96 -74.516 -3.770 -37.623 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.546 -3.677 -36.107 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -73.760 -5.016 -38.068 1.00 0.00 C ATOM 0 H LEU A 96 -78.355 -4.113 -39.050 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.038 -5.878 -38.482 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -75.874 -3.431 -39.252 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -76.523 -3.006 -37.680 1.00 0.00 H new ATOM 0 HG LEU A 96 -73.991 -2.893 -38.001 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -73.527 -3.689 -35.722 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -75.036 -2.750 -35.809 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -75.097 -4.525 -35.701 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -72.758 -5.006 -37.640 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -74.291 -5.905 -37.727 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -73.690 -5.030 -39.156 1.00 0.00 H new ATOM 1134 N LYS A 97 -76.538 -6.276 -36.049 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.015 -6.724 -34.744 1.00 0.00 C ATOM 1136 C LYS A 97 -76.414 -5.889 -33.615 1.00 0.00 C ATOM 1137 O LYS A 97 -75.234 -5.537 -33.642 1.00 0.00 O ATOM 1138 CB LYS A 97 -76.692 -8.211 -34.520 1.00 0.00 C ATOM 1139 CG LYS A 97 -75.245 -8.489 -34.140 1.00 0.00 C ATOM 1140 CD LYS A 97 -74.998 -9.967 -33.883 1.00 0.00 C ATOM 1141 CE LYS A 97 -73.705 -10.192 -33.109 1.00 0.00 C ATOM 1142 NZ LYS A 97 -72.523 -9.593 -33.788 1.00 0.00 N ATOM 0 H LYS A 97 -75.653 -6.689 -36.344 1.00 0.00 H new ATOM 0 HA LYS A 97 -78.097 -6.592 -34.733 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -77.342 -8.597 -33.735 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -76.929 -8.763 -35.430 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -74.588 -8.145 -34.939 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -74.988 -7.918 -33.248 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -75.835 -10.385 -33.324 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -74.952 -10.500 -34.833 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -73.803 -9.763 -32.112 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -73.543 -11.262 -32.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -71.654 -9.901 -33.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -72.498 -9.903 -34.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -72.590 -8.556 -33.751 1.00 0.00 H new ATOM 1156 N THR A 98 -77.235 -5.570 -32.630 1.00 0.00 N ATOM 1157 CA THR A 98 -76.781 -4.855 -31.450 1.00 0.00 C ATOM 1158 C THR A 98 -77.402 -5.491 -30.204 1.00 0.00 C ATOM 1159 O THR A 98 -77.446 -4.897 -29.126 1.00 0.00 O ATOM 1160 CB THR A 98 -77.159 -3.359 -31.543 1.00 0.00 C ATOM 1161 OG1 THR A 98 -76.924 -2.888 -32.880 1.00 0.00 O ATOM 1162 CG2 THR A 98 -76.340 -2.518 -30.574 1.00 0.00 C ATOM 0 H THR A 98 -78.229 -5.798 -32.625 1.00 0.00 H new ATOM 0 HA THR A 98 -75.695 -4.923 -31.384 1.00 0.00 H new ATOM 0 HB THR A 98 -78.213 -3.262 -31.283 1.00 0.00 H new ATOM 0 HG1 THR A 98 -77.165 -1.940 -32.940 1.00 0.00 H new ATOM 0 HG21 THR A 98 -76.631 -1.471 -30.665 1.00 0.00 H new ATOM 0 HG22 THR A 98 -76.522 -2.858 -29.554 1.00 0.00 H new ATOM 0 HG23 THR A 98 -75.280 -2.622 -30.808 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.861 -6.726 -30.362 1.00 0.00 N ATOM 1171 CA TYR A 99 -78.528 -7.435 -29.281 1.00 0.00 C ATOM 1172 C TYR A 99 -77.548 -8.316 -28.507 1.00 0.00 C ATOM 1173 O TYR A 99 -76.433 -8.565 -28.964 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.694 -8.271 -29.827 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.324 -9.249 -30.922 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -78.587 -10.395 -30.647 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -79.721 -9.025 -32.235 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -78.248 -11.285 -31.646 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.388 -9.912 -33.242 1.00 0.00 C ATOM 1180 CZ TYR A 99 -78.651 -11.040 -32.941 1.00 0.00 C ATOM 1181 OH TYR A 99 -78.310 -11.920 -33.941 1.00 0.00 O ATOM 0 H TYR A 99 -77.783 -7.257 -31.230 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.926 -6.694 -28.588 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -80.141 -8.825 -29.002 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -80.459 -7.594 -30.208 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -78.274 -10.593 -29.633 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.299 -8.144 -32.472 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -77.671 -12.168 -31.414 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.702 -9.724 -34.258 1.00 0.00 H new ATOM 0 HH TYR A 99 -78.926 -12.682 -33.931 1.00 0.00 H new ATOM 1191 N THR A 100 -77.980 -8.791 -27.342 1.00 0.00 N ATOM 1192 CA THR A 100 -77.159 -9.629 -26.476 1.00 0.00 C ATOM 1193 C THR A 100 -78.050 -10.634 -25.762 1.00 0.00 C ATOM 1194 O THR A 100 -79.256 -10.421 -25.665 1.00 0.00 O ATOM 1195 CB THR A 100 -76.398 -8.799 -25.425 1.00 0.00 C ATOM 1196 OG1 THR A 100 -77.277 -7.833 -24.837 1.00 0.00 O ATOM 1197 CG2 THR A 100 -75.192 -8.107 -26.034 1.00 0.00 C ATOM 0 H THR A 100 -78.912 -8.605 -26.972 1.00 0.00 H new ATOM 0 HA THR A 100 -76.425 -10.137 -27.101 1.00 0.00 H new ATOM 0 HB THR A 100 -76.038 -9.478 -24.652 1.00 0.00 H new ATOM 0 HG1 THR A 100 -76.784 -7.299 -24.180 1.00 0.00 H new ATOM 0 HG21 THR A 100 -74.677 -7.530 -25.266 1.00 0.00 H new ATOM 0 HG22 THR A 100 -74.512 -8.854 -26.443 1.00 0.00 H new ATOM 0 HG23 THR A 100 -75.520 -7.439 -26.831 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.481 -11.728 -25.237 1.00 0.00 N ATOM 1206 CA PRO A 101 -78.257 -12.809 -24.621 1.00 0.00 C ATOM 1207 C PRO A 101 -78.863 -12.455 -23.260 1.00 0.00 C ATOM 1208 O PRO A 101 -79.280 -13.342 -22.512 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.243 -13.955 -24.472 1.00 0.00 C ATOM 1210 CG PRO A 101 -76.035 -13.530 -25.241 1.00 0.00 C ATOM 1211 CD PRO A 101 -76.046 -12.031 -25.235 1.00 0.00 C ATOM 0 HA PRO A 101 -79.122 -13.052 -25.238 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.999 -14.128 -23.424 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.647 -14.889 -24.863 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -75.125 -13.915 -24.781 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.066 -13.916 -26.260 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.546 -11.624 -24.356 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.542 -11.617 -26.108 1.00 0.00 H new ATOM 1219 N GLN A 102 -78.935 -11.172 -22.949 1.00 0.00 N ATOM 1220 CA GLN A 102 -79.540 -10.725 -21.693 1.00 0.00 C ATOM 1221 C GLN A 102 -80.241 -9.375 -21.838 1.00 0.00 C ATOM 1222 O GLN A 102 -81.273 -9.141 -21.207 1.00 0.00 O ATOM 1223 CB GLN A 102 -78.516 -10.711 -20.542 1.00 0.00 C ATOM 1224 CG GLN A 102 -77.147 -10.140 -20.885 1.00 0.00 C ATOM 1225 CD GLN A 102 -77.129 -8.629 -20.982 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -77.899 -7.938 -20.312 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -76.249 -8.108 -21.817 1.00 0.00 N ATOM 0 H GLN A 102 -78.585 -10.419 -23.542 1.00 0.00 H new ATOM 0 HA GLN A 102 -80.309 -11.454 -21.438 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -78.933 -10.135 -19.716 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -78.384 -11.732 -20.184 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -76.430 -10.456 -20.127 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -76.814 -10.561 -21.834 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -75.631 -8.718 -22.352 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -76.187 -7.096 -21.927 1.00 0.00 H new ATOM 1236 N SER A 103 -79.695 -8.489 -22.666 1.00 0.00 N ATOM 1237 CA SER A 103 -80.362 -7.224 -22.952 1.00 0.00 C ATOM 1238 C SER A 103 -81.408 -7.437 -24.040 1.00 0.00 C ATOM 1239 O SER A 103 -82.362 -6.668 -24.179 1.00 0.00 O ATOM 1240 CB SER A 103 -79.349 -6.161 -23.381 1.00 0.00 C ATOM 1241 OG SER A 103 -78.297 -6.046 -22.436 1.00 0.00 O ATOM 0 H SER A 103 -78.804 -8.621 -23.145 1.00 0.00 H new ATOM 0 HA SER A 103 -80.854 -6.870 -22.046 1.00 0.00 H new ATOM 0 HB2 SER A 103 -78.938 -6.419 -24.357 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.851 -5.199 -23.490 1.00 0.00 H new ATOM 0 HG SER A 103 -77.662 -5.361 -22.735 1.00 0.00 H new ATOM 1247 N SER A 104 -81.216 -8.499 -24.799 1.00 0.00 N ATOM 1248 CA SER A 104 -82.147 -8.897 -25.831 1.00 0.00 C ATOM 1249 C SER A 104 -82.664 -10.293 -25.517 1.00 0.00 C ATOM 1250 O SER A 104 -82.125 -10.975 -24.641 1.00 0.00 O ATOM 1251 CB SER A 104 -81.455 -8.868 -27.193 1.00 0.00 C ATOM 1252 OG SER A 104 -82.351 -9.164 -28.251 1.00 0.00 O ATOM 0 H SER A 104 -80.405 -9.111 -24.714 1.00 0.00 H new ATOM 0 HA SER A 104 -82.988 -8.204 -25.863 1.00 0.00 H new ATOM 0 HB2 SER A 104 -81.015 -7.884 -27.355 1.00 0.00 H new ATOM 0 HB3 SER A 104 -80.637 -9.588 -27.199 1.00 0.00 H new ATOM 0 HG SER A 104 -83.241 -8.818 -28.032 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.703 -10.711 -26.217 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.308 -12.010 -25.989 1.00 0.00 C ATOM 1260 C ILE A 105 -84.865 -12.603 -27.281 1.00 0.00 C ATOM 1261 O ILE A 105 -85.156 -11.888 -28.242 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.436 -11.942 -24.918 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.224 -10.630 -24.999 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.868 -12.104 -23.517 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.062 -10.470 -26.243 1.00 0.00 C ATOM 0 H ILE A 105 -84.148 -10.164 -26.954 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.515 -12.659 -25.617 1.00 0.00 H new ATOM 0 HB ILE A 105 -86.118 -12.766 -25.129 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.875 -10.560 -24.128 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.523 -9.797 -24.941 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.677 -12.053 -22.788 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -84.368 -13.069 -23.437 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -84.151 -11.307 -23.320 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.582 -9.513 -26.211 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.418 -10.504 -27.122 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.792 -11.278 -26.296 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.992 -13.918 -27.292 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.673 -14.628 -28.362 1.00 0.00 C ATOM 1279 C ILE A 106 -87.017 -15.104 -27.821 1.00 0.00 C ATOM 1280 O ILE A 106 -87.063 -16.059 -27.044 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.909 -15.887 -28.833 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.505 -15.534 -29.293 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.675 -16.574 -29.960 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.714 -16.724 -29.804 1.00 0.00 C ATOM 0 H ILE A 106 -84.626 -14.525 -26.559 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.760 -13.943 -29.206 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.827 -16.571 -27.988 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.568 -14.785 -30.082 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.964 -15.078 -28.464 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.128 -17.459 -30.284 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.662 -16.868 -29.603 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.782 -15.886 -30.799 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.722 -16.395 -30.115 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.619 -17.465 -29.011 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.232 -17.167 -30.654 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.099 -14.441 -28.169 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.399 -14.889 -27.695 1.00 0.00 C ATOM 1298 C CYS A 107 -89.936 -15.988 -28.605 1.00 0.00 C ATOM 1299 O CYS A 107 -89.406 -16.215 -29.695 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.403 -13.742 -27.618 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.766 -12.194 -26.926 1.00 0.00 S ATOM 0 H CYS A 107 -88.112 -13.611 -28.762 1.00 0.00 H new ATOM 0 HA CYS A 107 -89.265 -15.280 -26.687 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.779 -13.543 -28.622 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.253 -14.066 -27.017 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.982 -16.669 -28.161 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.564 -17.768 -28.917 1.00 0.00 C ATOM 1308 C TYR A 108 -93.082 -17.723 -28.815 1.00 0.00 C ATOM 1309 O TYR A 108 -93.636 -16.832 -28.169 1.00 0.00 O ATOM 1310 CB TYR A 108 -91.046 -19.114 -28.402 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.573 -19.352 -28.654 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -89.126 -19.792 -29.892 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.634 -19.144 -27.652 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.784 -20.016 -30.127 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -87.289 -19.365 -27.880 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.870 -19.802 -29.119 1.00 0.00 C ATOM 1317 OH TYR A 108 -85.531 -20.027 -29.353 1.00 0.00 O ATOM 0 H TYR A 108 -91.448 -16.478 -27.274 1.00 0.00 H new ATOM 0 HA TYR A 108 -91.271 -17.661 -29.961 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -91.234 -19.176 -27.330 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -91.617 -19.914 -28.873 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.840 -19.962 -30.685 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.960 -18.804 -26.680 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -87.453 -20.357 -31.097 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -86.570 -19.196 -27.092 1.00 0.00 H new ATOM 0 HH TYR A 108 -85.019 -19.828 -28.541 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.744 -18.681 -29.442 1.00 0.00 N ATOM 1328 CA GLY A 109 -95.190 -18.706 -29.437 1.00 0.00 C ATOM 1329 C GLY A 109 -95.762 -18.269 -30.767 1.00 0.00 C ATOM 1330 O GLY A 109 -95.095 -18.370 -31.795 1.00 0.00 O ATOM 0 H GLY A 109 -93.304 -19.444 -29.956 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -95.536 -19.714 -29.206 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.562 -18.052 -28.648 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.995 -17.789 -30.757 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.618 -17.273 -31.966 1.00 0.00 C ATOM 1336 C GLN A 110 -97.053 -15.900 -32.304 1.00 0.00 C ATOM 1337 O GLN A 110 -96.936 -15.045 -31.426 1.00 0.00 O ATOM 1338 CB GLN A 110 -99.131 -17.166 -31.785 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.847 -16.628 -33.013 1.00 0.00 C ATOM 1340 CD GLN A 110 -101.276 -16.219 -32.729 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -101.602 -15.796 -31.621 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -102.137 -16.336 -33.727 1.00 0.00 N ATOM 0 H GLN A 110 -97.584 -17.746 -29.926 1.00 0.00 H new ATOM 0 HA GLN A 110 -97.404 -17.964 -32.781 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -99.531 -18.150 -31.542 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.343 -16.517 -30.936 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -99.299 -15.769 -33.400 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -99.840 -17.389 -33.794 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -101.825 -16.692 -34.631 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -103.113 -16.071 -33.593 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.704 -15.692 -33.568 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.208 -14.398 -34.014 1.00 0.00 C ATOM 1353 C LEU A 111 -97.287 -13.337 -33.821 1.00 0.00 C ATOM 1354 O LEU A 111 -98.246 -13.260 -34.592 1.00 0.00 O ATOM 1355 CB LEU A 111 -95.783 -14.460 -35.484 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.067 -13.211 -36.000 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -93.697 -13.072 -35.354 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -94.945 -13.251 -37.511 1.00 0.00 C ATOM 0 H LEU A 111 -96.755 -16.401 -34.299 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.335 -14.133 -33.417 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.127 -15.320 -35.622 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.668 -14.633 -36.096 1.00 0.00 H new ATOM 0 HG LEU A 111 -95.662 -12.339 -35.728 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -93.204 -12.177 -35.735 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -93.811 -12.991 -34.273 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.093 -13.948 -35.591 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -94.433 -12.354 -37.859 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.375 -14.132 -37.807 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -95.939 -13.296 -37.955 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.133 -12.532 -32.782 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.149 -11.571 -32.436 1.00 0.00 C ATOM 1372 C GLY A 112 -98.514 -11.655 -30.975 1.00 0.00 C ATOM 1373 O GLY A 112 -98.798 -10.643 -30.344 1.00 0.00 O ATOM 0 H GLY A 112 -96.316 -12.530 -32.171 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -97.795 -10.566 -32.666 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.037 -11.743 -33.044 1.00 0.00 H new ATOM 1377 N SER A 113 -98.480 -12.861 -30.428 1.00 0.00 N ATOM 1378 CA SER A 113 -98.793 -13.067 -29.026 1.00 0.00 C ATOM 1379 C SER A 113 -97.538 -12.913 -28.172 1.00 0.00 C ATOM 1380 O SER A 113 -96.774 -13.860 -27.979 1.00 0.00 O ATOM 1381 CB SER A 113 -99.429 -14.444 -28.812 1.00 0.00 C ATOM 1382 OG SER A 113 -100.714 -14.514 -29.418 1.00 0.00 O ATOM 0 H SER A 113 -98.238 -13.712 -30.936 1.00 0.00 H new ATOM 0 HA SER A 113 -99.513 -12.309 -28.718 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.783 -15.215 -29.231 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.515 -14.646 -27.744 1.00 0.00 H new ATOM 0 HG SER A 113 -100.661 -15.051 -30.236 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.333 -11.704 -27.670 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.177 -11.376 -26.849 1.00 0.00 C ATOM 1390 C PHE A 114 -96.429 -11.819 -25.418 1.00 0.00 C ATOM 1391 O PHE A 114 -96.491 -11.009 -24.496 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.902 -9.867 -26.900 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.366 -9.381 -28.220 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -95.974 -9.735 -29.413 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.242 -8.580 -28.262 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.471 -9.298 -30.621 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.733 -8.140 -29.467 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.348 -8.499 -30.647 1.00 0.00 C ATOM 0 H PHE A 114 -97.967 -10.919 -27.822 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.302 -11.898 -27.235 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.826 -9.333 -26.677 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.189 -9.612 -26.115 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.854 -10.361 -29.397 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.755 -8.294 -27.341 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -95.956 -9.581 -31.544 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -92.853 -7.514 -29.485 1.00 0.00 H new ATOM 0 HZ PHE A 114 -93.951 -8.155 -31.590 1.00 0.00 H new ATOM 1408 N SER A 115 -96.613 -13.113 -25.253 1.00 0.00 N ATOM 1409 CA SER A 115 -96.937 -13.678 -23.959 1.00 0.00 C ATOM 1410 C SER A 115 -95.663 -13.999 -23.172 1.00 0.00 C ATOM 1411 O SER A 115 -95.513 -13.572 -22.027 1.00 0.00 O ATOM 1412 CB SER A 115 -97.791 -14.933 -24.152 1.00 0.00 C ATOM 1413 OG SER A 115 -98.604 -15.196 -23.019 1.00 0.00 O ATOM 0 H SER A 115 -96.543 -13.798 -26.006 1.00 0.00 H new ATOM 0 HA SER A 115 -97.505 -12.948 -23.382 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.422 -14.811 -25.032 1.00 0.00 H new ATOM 0 HB3 SER A 115 -97.143 -15.789 -24.341 1.00 0.00 H new ATOM 0 HG SER A 115 -99.136 -16.003 -23.179 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.741 -14.736 -23.790 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.518 -15.150 -23.105 1.00 0.00 C ATOM 1421 C ASN A 116 -92.318 -15.098 -24.037 1.00 0.00 C ATOM 1422 O ASN A 116 -92.459 -15.191 -25.259 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.655 -16.571 -22.544 1.00 0.00 C ATOM 1424 CG ASN A 116 -94.678 -16.675 -21.434 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -95.854 -16.949 -21.678 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -94.236 -16.466 -20.203 1.00 0.00 N ATOM 0 H ASN A 116 -94.816 -15.056 -24.755 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.361 -14.451 -22.283 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -93.933 -17.249 -23.351 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -92.686 -16.902 -22.170 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -94.878 -16.530 -19.413 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -93.254 -16.241 -20.045 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.136 -14.955 -23.457 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.905 -14.964 -24.228 1.00 0.00 C ATOM 1435 C CYS A 117 -88.874 -15.877 -23.569 1.00 0.00 C ATOM 1436 O CYS A 117 -89.155 -16.521 -22.555 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.320 -13.555 -24.349 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.428 -12.296 -25.027 1.00 0.00 S ATOM 0 H CYS A 117 -91.005 -14.831 -22.453 1.00 0.00 H new ATOM 0 HA CYS A 117 -90.142 -15.335 -25.225 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -88.995 -13.231 -23.360 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.430 -13.604 -24.977 1.00 0.00 H new ATOM 1443 N SER A 118 -87.687 -15.939 -24.156 1.00 0.00 N ATOM 1444 CA SER A 118 -86.573 -16.681 -23.587 1.00 0.00 C ATOM 1445 C SER A 118 -85.269 -15.985 -23.958 1.00 0.00 C ATOM 1446 O SER A 118 -85.271 -15.071 -24.778 1.00 0.00 O ATOM 1447 CB SER A 118 -86.586 -18.124 -24.093 1.00 0.00 C ATOM 1448 OG SER A 118 -87.796 -18.771 -23.720 1.00 0.00 O ATOM 0 H SER A 118 -87.470 -15.477 -25.039 1.00 0.00 H new ATOM 0 HA SER A 118 -86.664 -16.707 -22.501 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.479 -18.136 -25.178 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.735 -18.667 -23.683 1.00 0.00 H new ATOM 0 HG SER A 118 -87.790 -19.693 -24.052 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.162 -16.395 -23.358 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.882 -15.743 -23.620 1.00 0.00 C ATOM 1456 C HIS A 119 -82.279 -16.204 -24.939 1.00 0.00 C ATOM 1457 O HIS A 119 -82.523 -17.323 -25.391 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.894 -15.991 -22.480 1.00 0.00 C ATOM 1459 CG HIS A 119 -82.119 -15.108 -21.294 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -82.195 -15.581 -20.003 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.272 -13.765 -21.209 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -82.387 -14.570 -19.177 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -82.436 -13.458 -19.886 1.00 0.00 N ATOM 0 H HIS A 119 -84.120 -17.167 -22.693 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.077 -14.673 -23.689 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.967 -17.032 -22.167 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.880 -15.839 -22.849 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -82.266 -13.066 -22.033 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -82.487 -14.641 -18.104 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -82.574 -12.521 -19.508 1.00 0.00 H new ATOM 1472 N SER A 120 -81.499 -15.324 -25.555 1.00 0.00 N ATOM 1473 CA SER A 120 -80.808 -15.640 -26.795 1.00 0.00 C ATOM 1474 C SER A 120 -79.656 -16.614 -26.533 1.00 0.00 C ATOM 1475 O SER A 120 -78.497 -16.217 -26.426 1.00 0.00 O ATOM 1476 CB SER A 120 -80.292 -14.349 -27.440 1.00 0.00 C ATOM 1477 OG SER A 120 -81.332 -13.388 -27.528 1.00 0.00 O ATOM 0 H SER A 120 -81.330 -14.379 -25.211 1.00 0.00 H new ATOM 0 HA SER A 120 -81.506 -16.121 -27.480 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.466 -13.947 -26.853 1.00 0.00 H new ATOM 0 HB3 SER A 120 -79.902 -14.563 -28.435 1.00 0.00 H new ATOM 0 HG SER A 120 -80.986 -12.569 -27.940 1.00 0.00 H new ATOM 1483 N ARG A 121 -79.998 -17.891 -26.394 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.017 -18.929 -26.083 1.00 0.00 C ATOM 1485 C ARG A 121 -78.308 -19.424 -27.338 1.00 0.00 C ATOM 1486 O ARG A 121 -77.180 -19.915 -27.275 1.00 0.00 O ATOM 1487 CB ARG A 121 -79.696 -20.107 -25.379 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.245 -19.767 -24.002 1.00 0.00 C ATOM 1489 CD ARG A 121 -79.148 -19.262 -23.081 1.00 0.00 C ATOM 1490 NE ARG A 121 -78.023 -20.192 -23.014 1.00 0.00 N ATOM 1491 CZ ARG A 121 -76.749 -19.813 -22.906 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -76.445 -18.525 -22.812 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -75.779 -20.720 -22.886 1.00 0.00 N ATOM 0 H ARG A 121 -80.953 -18.235 -26.492 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.271 -18.488 -25.421 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -80.511 -20.471 -26.005 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -78.979 -20.922 -25.283 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -81.023 -19.009 -24.095 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -80.711 -20.650 -23.566 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -78.797 -18.292 -23.432 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -79.554 -19.111 -22.081 1.00 0.00 H new ATOM 0 HE ARG A 121 -78.224 -21.191 -23.052 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -77.186 -17.824 -22.822 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -75.470 -18.236 -22.729 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -76.007 -21.712 -22.953 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -74.806 -20.425 -22.803 1.00 0.00 H new ATOM 1550 N CYS A 125 -81.744 -16.490 -34.089 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.926 -15.226 -34.757 1.00 0.00 C ATOM 1552 C CYS A 125 -80.595 -14.573 -35.054 1.00 0.00 C ATOM 1553 O CYS A 125 -79.847 -14.205 -34.145 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.802 -14.279 -33.935 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.737 -14.537 -32.144 1.00 0.00 S ATOM 0 HA CYS A 125 -82.434 -15.430 -35.699 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.503 -13.253 -34.150 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.835 -14.386 -34.265 1.00 0.00 H new ATOM 1560 N HIS A 126 -80.290 -14.473 -36.337 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.220 -13.610 -36.791 1.00 0.00 C ATOM 1562 C HIS A 126 -79.689 -12.172 -36.645 1.00 0.00 C ATOM 1563 O HIS A 126 -80.707 -11.916 -35.994 1.00 0.00 O ATOM 1564 CB HIS A 126 -78.839 -13.929 -38.248 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.265 -15.304 -38.409 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -78.650 -16.186 -39.400 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -77.327 -15.952 -37.679 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.974 -17.314 -39.266 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -77.168 -17.195 -38.232 1.00 0.00 N ATOM 0 H HIS A 126 -80.770 -14.980 -37.080 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.325 -13.770 -36.190 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.722 -13.832 -38.879 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.114 -13.194 -38.599 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -76.802 -15.561 -36.820 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -78.067 -18.185 -39.897 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -76.527 -17.914 -37.896 1.00 0.00 H new ATOM 1578 N SER A 127 -78.983 -11.234 -37.230 1.00 0.00 N ATOM 1579 CA SER A 127 -79.366 -9.846 -37.105 1.00 0.00 C ATOM 1580 C SER A 127 -80.581 -9.526 -37.975 1.00 0.00 C ATOM 1581 O SER A 127 -80.465 -8.845 -38.989 1.00 0.00 O ATOM 1582 CB SER A 127 -78.183 -8.950 -37.460 1.00 0.00 C ATOM 1583 OG SER A 127 -77.553 -9.380 -38.654 1.00 0.00 O ATOM 0 H SER A 127 -78.149 -11.402 -37.792 1.00 0.00 H new ATOM 0 HA SER A 127 -79.652 -9.655 -36.071 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.525 -7.922 -37.576 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.462 -8.956 -36.643 1.00 0.00 H new ATOM 0 HG SER A 127 -77.280 -8.599 -39.180 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.740 -10.053 -37.599 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.976 -9.722 -38.288 1.00 0.00 C ATOM 1591 C LEU A 128 -83.415 -8.319 -37.895 1.00 0.00 C ATOM 1592 O LEU A 128 -83.516 -7.999 -36.711 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.091 -10.735 -37.972 1.00 0.00 C ATOM 1594 CG LEU A 128 -84.045 -12.058 -38.751 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -83.999 -11.799 -40.251 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.865 -12.914 -38.317 1.00 0.00 C ATOM 0 H LEU A 128 -81.847 -10.708 -36.824 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.790 -9.763 -39.361 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.055 -10.963 -36.907 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -85.052 -10.258 -38.164 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.958 -12.609 -38.525 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.967 -12.750 -40.784 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.888 -11.244 -40.552 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.109 -11.217 -40.493 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.861 -13.843 -38.887 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.937 -12.373 -38.498 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.951 -13.140 -37.254 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.657 -7.487 -38.890 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.056 -6.124 -38.646 1.00 0.00 C ATOM 1610 C GLY A 129 -85.405 -5.838 -39.251 1.00 0.00 C ATOM 1611 O GLY A 129 -85.723 -6.342 -40.328 1.00 0.00 O ATOM 0 H GLY A 129 -83.582 -7.737 -39.876 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.088 -5.938 -37.573 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.314 -5.444 -39.065 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.193 -5.040 -38.562 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.537 -4.726 -39.004 1.00 0.00 C ATOM 1617 C LEU A 130 -87.617 -3.285 -39.501 1.00 0.00 C ATOM 1618 O LEU A 130 -87.016 -2.381 -38.923 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.521 -4.964 -37.859 1.00 0.00 C ATOM 1620 CG LEU A 130 -88.998 -6.410 -37.685 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.601 -6.608 -36.305 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.019 -6.765 -38.757 1.00 0.00 C ATOM 0 H LEU A 130 -85.924 -4.593 -37.686 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.801 -5.379 -39.836 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.054 -4.640 -36.929 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.393 -4.329 -38.015 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.137 -7.070 -37.788 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -89.935 -7.640 -36.198 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -88.851 -6.389 -35.545 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.451 -5.937 -36.180 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.348 -7.795 -38.619 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.877 -6.097 -38.678 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.565 -6.658 -39.742 1.00 0.00 H new ATOM 1634 N THR A 131 -88.338 -3.074 -40.588 1.00 0.00 N ATOM 1635 CA THR A 131 -88.443 -1.750 -41.168 1.00 0.00 C ATOM 1636 C THR A 131 -89.845 -1.479 -41.717 1.00 0.00 C ATOM 1637 O THR A 131 -90.255 -2.041 -42.731 1.00 0.00 O ATOM 1638 CB THR A 131 -87.362 -1.577 -42.239 1.00 0.00 C ATOM 1639 OG1 THR A 131 -87.417 -0.268 -42.820 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.452 -2.638 -43.328 1.00 0.00 C ATOM 0 H THR A 131 -88.856 -3.799 -41.084 1.00 0.00 H new ATOM 0 HA THR A 131 -88.279 -1.009 -40.386 1.00 0.00 H new ATOM 0 HB THR A 131 -86.403 -1.701 -41.736 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.799 0.361 -42.173 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.665 -2.472 -44.063 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.332 -3.626 -42.884 1.00 0.00 H new ATOM 0 HG23 THR A 131 -88.424 -2.576 -43.817 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.579 -0.634 -40.989 1.00 0.00 N ATOM 1649 CA CYS A 132 -92.009 -0.409 -41.205 1.00 0.00 C ATOM 1650 C CYS A 132 -92.364 -0.217 -42.667 1.00 0.00 C ATOM 1651 O CYS A 132 -91.997 0.779 -43.299 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.472 0.775 -40.371 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.279 0.495 -38.589 1.00 0.00 S ATOM 0 H CYS A 132 -90.192 -0.081 -40.224 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.534 -1.309 -40.884 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.905 1.661 -40.659 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.519 0.981 -40.591 1.00 0.00 H new ATOM 1658 N LEU A 133 -93.059 -1.225 -43.175 1.00 0.00 N ATOM 1659 CA LEU A 133 -93.600 -1.266 -44.518 1.00 0.00 C ATOM 1660 C LEU A 133 -92.525 -1.547 -45.566 1.00 0.00 C ATOM 1661 O LEU A 133 -92.610 -2.528 -46.307 1.00 0.00 O ATOM 1662 CB LEU A 133 -94.367 0.026 -44.842 1.00 0.00 C ATOM 1663 CG LEU A 133 -94.702 0.258 -46.321 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -95.571 -0.863 -46.869 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -95.392 1.600 -46.499 1.00 0.00 C ATOM 0 H LEU A 133 -93.267 -2.067 -42.639 1.00 0.00 H new ATOM 0 HA LEU A 133 -94.303 -2.098 -44.555 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -95.298 0.024 -44.275 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.779 0.872 -44.486 1.00 0.00 H new ATOM 0 HG LEU A 133 -93.768 0.264 -46.884 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -95.792 -0.672 -47.919 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -95.042 -1.812 -46.777 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -96.502 -0.910 -46.305 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -95.624 1.753 -47.553 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -96.314 1.615 -45.918 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.733 2.397 -46.154 1.00 0.00 H new ATOM 1677 N GLU A 134 -91.525 -0.689 -45.623 1.00 0.00 N ATOM 1678 CA GLU A 134 -90.483 -0.794 -46.638 1.00 0.00 C ATOM 1679 C GLU A 134 -89.262 -1.535 -46.103 1.00 0.00 C ATOM 1680 O GLU A 134 -89.140 -2.752 -46.263 1.00 0.00 O ATOM 1681 CB GLU A 134 -90.088 0.600 -47.126 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.537 1.493 -46.028 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.379 2.927 -46.474 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -88.350 3.254 -47.098 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -90.291 3.737 -46.198 1.00 0.00 O ATOM 0 H GLU A 134 -91.408 0.093 -44.978 1.00 0.00 H new ATOM 0 HA GLU A 134 -90.880 -1.367 -47.476 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -89.340 0.502 -47.913 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.959 1.081 -47.571 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.202 1.455 -45.165 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -88.570 1.109 -45.702 1.00 0.00 H new