USER MOD reduce.3.24.130724 H: found=0, std=0, add=1108, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1108 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 111 CYS SG : rot 180:sc= 0.145 USER MOD Set 1.2: A 118 TYR OH : rot -51:sc= 0.151 USER MOD Set 2.1: A 3 SER OG : rot 134:sc= 0.478 USER MOD Set 2.2: A 79 SER OG : rot -152:sc= -1.73! USER MOD Set 2.3: A 101 HIS : no HE2:sc= 0.148 K(o=-1.1,f=-2.5) USER MOD Set 3.1: A 33 SER OG : rot 180:sc= 0.0597 USER MOD Set 3.2: A 36 THR OG1 : rot -72:sc= -0.699 USER MOD Set 4.1: A 25 ASN : amide:sc= -1.73 K(o=-2.4,f=-7.8!) USER MOD Set 4.2: A 27 ASN :FLIP amide:sc= -0.618 F(o=-2.9,f=-2.4) USER MOD Set 5.1: A 15 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 63 ASN :FLIP amide:sc= -1.36 F(o=-3.3,f=-1.4) USER MOD Set 5.3: A 64 SER OG : rot -139:sc= 0.002 USER MOD Set 6.1: A 14 SER OG : rot 106:sc= 0.587 USER MOD Set 6.2: A 60 CYS SG : rot 141:sc= -2.8! USER MOD Single : A 1 HIS : no HD1:sc= -0.599 X(o=-0.6,f=-0.17) USER MOD Single : A 1 HIS N :NH3+ 141:sc= -0.395 (180deg=-1.76!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -5.96! C(o=-6!,f=-9.4!) USER MOD Single : A 19 THR OG1 : rot 180:sc= -0.0167 USER MOD Single : A 26 SER OG : rot -100:sc= -0.943 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN :FLIP amide:sc= -2.7 F(o=-3.5,f=-2.7) USER MOD Single : A 53 GLN : amide:sc= -2.25 K(o=-2.2,f=-8.6!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00849) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.0851 USER MOD Single : A 83 MET CE :methyl -154:sc= -2.66 (180deg=-5.01!) USER MOD Single : A 84 CYS SG : rot 22:sc= -2.54 USER MOD Single : A 87 HIS :FLIP no HE2:sc= -0.548 F(o=-2.7,f=-0.55) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 165:sc= -0.674 (180deg=-0.997) USER MOD Single : A 102 CYS SG : rot 180:sc= -0.192 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot -7:sc= 1.07 USER MOD Single : A 108 GLN :FLIP amide:sc= 1.24 F(o=-0.92,f=1.2) USER MOD Single : A 109 ASN : amide:sc= 1.01 K(o=1,f=-7.4!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN :FLIP amide:sc= -0.544 F(o=-2.4,f=-0.54) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 CYS SG : rot 180:sc= 0.083 USER MOD Single : A 126 SER OG : rot 180:sc= 0.0253 USER MOD Single : A 131 HIS :FLIP no HE2:sc= -3.16 F(o=-6.1!,f=-3.2) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 TYR OH : rot 20:sc= -1.25 USER MOD Single : A 146 SER OG : rot -106:sc= 0.237 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 7.744 10.226 14.285 1.00 0.00 N ATOM 2 CA HIS A 1 8.586 10.231 13.060 1.00 0.00 C ATOM 3 C HIS A 1 8.356 8.976 12.222 1.00 0.00 C ATOM 4 O HIS A 1 8.056 9.060 11.032 1.00 0.00 O ATOM 5 CB HIS A 1 10.055 10.326 13.479 1.00 0.00 C ATOM 6 CG HIS A 1 10.621 11.707 13.363 1.00 0.00 C ATOM 7 ND1 HIS A 1 11.848 12.064 13.880 1.00 0.00 N ATOM 8 CD2 HIS A 1 10.121 12.823 12.782 1.00 0.00 C ATOM 9 CE1 HIS A 1 12.078 13.340 13.624 1.00 0.00 C ATOM 10 NE2 HIS A 1 11.045 13.823 12.959 1.00 0.00 N ATOM 0 H1 HIS A 1 8.290 10.610 15.083 1.00 0.00 H new ATOM 0 H2 HIS A 1 6.900 10.813 14.128 1.00 0.00 H new ATOM 0 H3 HIS A 1 7.453 9.251 14.502 1.00 0.00 H new ATOM 0 HA HIS A 1 8.314 11.088 12.444 1.00 0.00 H new ATOM 0 HB2 HIS A 1 10.153 9.987 14.510 1.00 0.00 H new ATOM 0 HB3 HIS A 1 10.645 9.647 12.863 1.00 0.00 H new ATOM 0 HD2 HIS A 1 9.172 12.910 12.274 1.00 0.00 H new ATOM 0 HE1 HIS A 1 12.960 13.893 13.910 1.00 0.00 H new ATOM 0 HE2 HIS A 1 10.949 14.784 12.630 1.00 0.00 H new ATOM 21 N SER A 2 8.499 7.814 12.852 1.00 0.00 N ATOM 22 CA SER A 2 8.308 6.540 12.165 1.00 0.00 C ATOM 23 C SER A 2 6.936 6.473 11.501 1.00 0.00 C ATOM 24 O SER A 2 6.101 7.359 11.683 1.00 0.00 O ATOM 25 CB SER A 2 8.470 5.380 13.148 1.00 0.00 C ATOM 26 OG SER A 2 9.740 5.414 13.775 1.00 0.00 O ATOM 0 H SER A 2 8.747 7.728 13.838 1.00 0.00 H new ATOM 0 HA SER A 2 9.068 6.460 11.387 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.687 5.429 13.904 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.347 4.434 12.621 1.00 0.00 H new ATOM 0 HG SER A 2 9.817 4.663 14.400 1.00 0.00 H new ATOM 32 N SER A 3 6.711 5.413 10.729 1.00 0.00 N ATOM 33 CA SER A 3 5.443 5.224 10.034 1.00 0.00 C ATOM 34 C SER A 3 4.754 3.944 10.500 1.00 0.00 C ATOM 35 O SER A 3 5.314 3.174 11.280 1.00 0.00 O ATOM 36 CB SER A 3 5.668 5.175 8.522 1.00 0.00 C ATOM 37 OG SER A 3 6.718 4.282 8.192 1.00 0.00 O ATOM 0 H SER A 3 7.392 4.671 10.569 1.00 0.00 H new ATOM 0 HA SER A 3 4.798 6.070 10.270 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.750 4.862 8.024 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.906 6.173 8.154 1.00 0.00 H new ATOM 0 HG SER A 3 6.440 3.711 7.445 1.00 0.00 H new ATOM 43 N GLY A 4 3.536 3.724 10.014 1.00 0.00 N ATOM 44 CA GLY A 4 2.791 2.537 10.392 1.00 0.00 C ATOM 45 C GLY A 4 1.503 2.394 9.607 1.00 0.00 C ATOM 46 O GLY A 4 1.253 3.150 8.671 1.00 0.00 O ATOM 0 H GLY A 4 3.052 4.346 9.366 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.411 1.655 10.232 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.563 2.578 11.457 1.00 0.00 H new ATOM 50 N LEU A 5 0.681 1.421 9.990 1.00 0.00 N ATOM 51 CA LEU A 5 -0.589 1.186 9.311 1.00 0.00 C ATOM 52 C LEU A 5 -1.743 1.829 10.074 1.00 0.00 C ATOM 53 O LEU A 5 -1.876 1.650 11.284 1.00 0.00 O ATOM 54 CB LEU A 5 -0.841 -0.316 9.158 1.00 0.00 C ATOM 55 CG LEU A 5 -1.947 -0.691 8.167 1.00 0.00 C ATOM 56 CD1 LEU A 5 -3.313 -0.341 8.736 1.00 0.00 C ATOM 57 CD2 LEU A 5 -1.729 0.006 6.831 1.00 0.00 C ATOM 0 H LEU A 5 0.871 0.785 10.764 1.00 0.00 H new ATOM 0 HA LEU A 5 -0.531 1.641 8.322 1.00 0.00 H new ATOM 0 HB2 LEU A 5 0.086 -0.794 8.842 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -1.095 -0.728 10.135 1.00 0.00 H new ATOM 0 HG LEU A 5 -1.909 -1.768 8.001 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -4.087 -0.614 8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.471 -0.888 9.666 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -3.362 0.730 8.932 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -2.525 -0.273 6.141 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -1.739 1.086 6.978 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.767 -0.295 6.416 1.00 0.00 H new ATOM 69 N GLU A 6 -2.575 2.578 9.356 1.00 0.00 N ATOM 70 CA GLU A 6 -3.718 3.246 9.966 1.00 0.00 C ATOM 71 C GLU A 6 -4.962 3.097 9.095 1.00 0.00 C ATOM 72 O GLU A 6 -4.869 3.037 7.869 1.00 0.00 O ATOM 73 CB GLU A 6 -3.412 4.729 10.188 1.00 0.00 C ATOM 74 CG GLU A 6 -3.136 5.082 11.641 1.00 0.00 C ATOM 75 CD GLU A 6 -4.396 5.114 12.483 1.00 0.00 C ATOM 76 OE1 GLU A 6 -5.482 5.366 11.918 1.00 0.00 O ATOM 77 OE2 GLU A 6 -4.298 4.887 13.706 1.00 0.00 O ATOM 0 H GLU A 6 -2.479 2.737 8.353 1.00 0.00 H new ATOM 0 HA GLU A 6 -3.911 2.774 10.930 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.548 5.008 9.585 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.254 5.323 9.832 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.441 4.356 12.062 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.647 6.055 11.688 1.00 0.00 H new ATOM 84 N VAL A 7 -6.124 3.040 9.737 1.00 0.00 N ATOM 85 CA VAL A 7 -7.385 2.901 9.021 1.00 0.00 C ATOM 86 C VAL A 7 -8.031 4.261 8.785 1.00 0.00 C ATOM 87 O VAL A 7 -8.657 4.826 9.682 1.00 0.00 O ATOM 88 CB VAL A 7 -8.372 2.001 9.785 1.00 0.00 C ATOM 89 CG1 VAL A 7 -9.600 1.710 8.936 1.00 0.00 C ATOM 90 CG2 VAL A 7 -7.695 0.709 10.215 1.00 0.00 C ATOM 0 H VAL A 7 -6.218 3.088 10.752 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.155 2.437 8.062 1.00 0.00 H new ATOM 0 HB VAL A 7 -8.696 2.530 10.681 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.285 1.072 9.494 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.099 2.646 8.685 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -9.297 1.203 8.020 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.409 0.086 10.754 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.339 0.174 9.334 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -6.851 0.939 10.866 1.00 0.00 H new ATOM 100 N LEU A 8 -7.873 4.785 7.574 1.00 0.00 N ATOM 101 CA LEU A 8 -8.439 6.081 7.221 1.00 0.00 C ATOM 102 C LEU A 8 -9.831 5.922 6.621 1.00 0.00 C ATOM 103 O LEU A 8 -10.308 4.804 6.421 1.00 0.00 O ATOM 104 CB LEU A 8 -7.528 6.807 6.230 1.00 0.00 C ATOM 105 CG LEU A 8 -6.069 6.944 6.672 1.00 0.00 C ATOM 106 CD1 LEU A 8 -5.207 5.882 6.007 1.00 0.00 C ATOM 107 CD2 LEU A 8 -5.543 8.335 6.350 1.00 0.00 C ATOM 0 H LEU A 8 -7.357 4.331 6.820 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.520 6.673 8.133 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.555 6.276 5.279 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.932 7.803 6.051 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.022 6.799 7.751 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.173 5.996 6.333 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.569 4.892 6.286 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.260 5.996 4.924 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.504 8.415 6.671 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.605 8.508 5.276 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.142 9.081 6.872 1.00 0.00 H new ATOM 119 N PHE A 9 -10.477 7.046 6.333 1.00 0.00 N ATOM 120 CA PHE A 9 -11.814 7.030 5.754 1.00 0.00 C ATOM 121 C PHE A 9 -11.933 8.060 4.635 1.00 0.00 C ATOM 122 O PHE A 9 -11.519 9.210 4.788 1.00 0.00 O ATOM 123 CB PHE A 9 -12.865 7.300 6.833 1.00 0.00 C ATOM 124 CG PHE A 9 -13.556 6.057 7.319 1.00 0.00 C ATOM 125 CD1 PHE A 9 -12.991 5.282 8.320 1.00 0.00 C ATOM 126 CD2 PHE A 9 -14.767 5.663 6.774 1.00 0.00 C ATOM 127 CE1 PHE A 9 -13.623 4.138 8.769 1.00 0.00 C ATOM 128 CE2 PHE A 9 -15.403 4.520 7.218 1.00 0.00 C ATOM 129 CZ PHE A 9 -14.831 3.757 8.217 1.00 0.00 C ATOM 0 H PHE A 9 -10.096 7.979 6.491 1.00 0.00 H new ATOM 0 HA PHE A 9 -11.989 6.041 5.331 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -12.388 7.795 7.679 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -13.611 7.990 6.439 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -12.046 5.576 8.754 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -15.219 6.256 5.993 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -13.173 3.543 9.550 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -16.347 4.223 6.784 1.00 0.00 H new ATOM 0 HZ PHE A 9 -15.327 2.864 8.566 1.00 0.00 H new ATOM 139 N GLN A 10 -12.500 7.639 3.509 1.00 0.00 N ATOM 140 CA GLN A 10 -12.673 8.523 2.362 1.00 0.00 C ATOM 141 C GLN A 10 -13.956 9.336 2.487 1.00 0.00 C ATOM 142 O GLN A 10 -14.716 9.176 3.442 1.00 0.00 O ATOM 143 CB GLN A 10 -12.696 7.710 1.066 1.00 0.00 C ATOM 144 CG GLN A 10 -11.514 6.765 0.920 1.00 0.00 C ATOM 145 CD GLN A 10 -10.578 7.167 -0.203 1.00 0.00 C ATOM 146 OE1 GLN A 10 -10.955 7.919 -1.101 1.00 0.00 O ATOM 147 NE2 GLN A 10 -9.349 6.665 -0.158 1.00 0.00 N ATOM 0 H GLN A 10 -12.848 6.691 3.366 1.00 0.00 H new ATOM 0 HA GLN A 10 -11.830 9.213 2.337 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -13.620 7.132 1.025 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -12.710 8.394 0.218 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -10.959 6.737 1.858 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -11.882 5.755 0.737 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -9.079 6.045 0.606 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.675 6.900 -0.887 1.00 0.00 H new ATOM 156 N GLY A 11 -14.192 10.209 1.513 1.00 0.00 N ATOM 157 CA GLY A 11 -15.383 11.037 1.526 1.00 0.00 C ATOM 158 C GLY A 11 -15.654 11.675 0.176 1.00 0.00 C ATOM 159 O GLY A 11 -16.644 11.347 -0.479 1.00 0.00 O ATOM 0 H GLY A 11 -13.577 10.358 0.713 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -16.241 10.431 1.818 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -15.272 11.817 2.279 1.00 0.00 H new ATOM 163 N PRO A 12 -14.783 12.594 -0.271 1.00 0.00 N ATOM 164 CA PRO A 12 -14.944 13.271 -1.562 1.00 0.00 C ATOM 165 C PRO A 12 -14.685 12.337 -2.739 1.00 0.00 C ATOM 166 O PRO A 12 -14.619 11.119 -2.574 1.00 0.00 O ATOM 167 CB PRO A 12 -13.890 14.379 -1.515 1.00 0.00 C ATOM 168 CG PRO A 12 -12.846 13.869 -0.583 1.00 0.00 C ATOM 169 CD PRO A 12 -13.573 13.044 0.443 1.00 0.00 C ATOM 0 HA PRO A 12 -15.960 13.638 -1.708 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.476 14.574 -2.504 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.316 15.316 -1.157 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -12.108 13.268 -1.115 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.308 14.692 -0.112 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.970 12.201 0.781 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -13.823 13.632 1.326 1.00 0.00 H new ATOM 177 N GLY A 13 -14.541 12.913 -3.927 1.00 0.00 N ATOM 178 CA GLY A 13 -14.291 12.115 -5.113 1.00 0.00 C ATOM 179 C GLY A 13 -12.914 11.481 -5.109 1.00 0.00 C ATOM 180 O GLY A 13 -11.955 12.059 -5.620 1.00 0.00 O ATOM 0 H GLY A 13 -14.593 13.919 -4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -15.047 11.333 -5.186 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -14.395 12.743 -5.998 1.00 0.00 H new ATOM 184 N SER A 14 -12.815 10.287 -4.530 1.00 0.00 N ATOM 185 CA SER A 14 -11.545 9.572 -4.463 1.00 0.00 C ATOM 186 C SER A 14 -10.999 9.306 -5.860 1.00 0.00 C ATOM 187 O SER A 14 -11.759 9.090 -6.804 1.00 0.00 O ATOM 188 CB SER A 14 -11.720 8.252 -3.711 1.00 0.00 C ATOM 189 OG SER A 14 -12.333 7.274 -4.533 1.00 0.00 O ATOM 0 H SER A 14 -13.599 9.795 -4.101 1.00 0.00 H new ATOM 0 HA SER A 14 -10.831 10.196 -3.926 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.749 7.891 -3.373 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.327 8.415 -2.820 1.00 0.00 H new ATOM 0 HG SER A 14 -11.663 6.618 -4.816 1.00 0.00 H new ATOM 195 N THR A 15 -9.677 9.324 -5.988 1.00 0.00 N ATOM 196 CA THR A 15 -9.033 9.085 -7.274 1.00 0.00 C ATOM 197 C THR A 15 -8.566 7.642 -7.394 1.00 0.00 C ATOM 198 O THR A 15 -7.495 7.286 -6.904 1.00 0.00 O ATOM 199 CB THR A 15 -7.845 10.033 -7.455 1.00 0.00 C ATOM 200 OG1 THR A 15 -8.242 11.377 -7.249 1.00 0.00 O ATOM 201 CG2 THR A 15 -7.212 9.945 -8.826 1.00 0.00 C ATOM 0 H THR A 15 -9.031 9.501 -5.218 1.00 0.00 H new ATOM 0 HA THR A 15 -9.767 9.274 -8.058 1.00 0.00 H new ATOM 0 HB THR A 15 -7.109 9.720 -6.714 1.00 0.00 H new ATOM 0 HG1 THR A 15 -7.469 11.968 -7.367 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.377 10.643 -8.887 1.00 0.00 H new ATOM 0 HG22 THR A 15 -6.851 8.931 -8.996 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.952 10.198 -9.585 1.00 0.00 H new ATOM 209 N VAL A 16 -9.364 6.819 -8.067 1.00 0.00 N ATOM 210 CA VAL A 16 -9.012 5.422 -8.266 1.00 0.00 C ATOM 211 C VAL A 16 -8.108 5.284 -9.481 1.00 0.00 C ATOM 212 O VAL A 16 -8.537 5.480 -10.619 1.00 0.00 O ATOM 213 CB VAL A 16 -10.257 4.529 -8.448 1.00 0.00 C ATOM 214 CG1 VAL A 16 -9.850 3.070 -8.596 1.00 0.00 C ATOM 215 CG2 VAL A 16 -11.216 4.701 -7.278 1.00 0.00 C ATOM 0 H VAL A 16 -10.254 7.096 -8.481 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.490 5.088 -7.370 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.770 4.837 -9.359 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -10.741 2.455 -8.723 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.205 2.959 -9.467 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.313 2.750 -7.703 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.087 4.063 -7.425 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.714 4.422 -6.352 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -11.534 5.742 -7.218 1.00 0.00 H new ATOM 225 N VAL A 17 -6.853 4.954 -9.227 1.00 0.00 N ATOM 226 CA VAL A 17 -5.866 4.795 -10.288 1.00 0.00 C ATOM 227 C VAL A 17 -5.566 3.324 -10.539 1.00 0.00 C ATOM 228 O VAL A 17 -5.093 2.947 -11.611 1.00 0.00 O ATOM 229 CB VAL A 17 -4.553 5.533 -9.953 1.00 0.00 C ATOM 230 CG1 VAL A 17 -4.567 6.940 -10.529 1.00 0.00 C ATOM 231 CG2 VAL A 17 -4.333 5.575 -8.448 1.00 0.00 C ATOM 0 H VAL A 17 -6.489 4.789 -8.288 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.295 5.233 -11.189 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.727 4.985 -10.407 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.632 7.444 -10.282 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.676 6.889 -11.612 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.403 7.498 -10.106 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.402 6.099 -8.231 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -5.163 6.098 -7.973 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.276 4.558 -8.060 1.00 0.00 H new ATOM 241 N ALA A 18 -5.855 2.498 -9.543 1.00 0.00 N ATOM 242 CA ALA A 18 -5.629 1.066 -9.649 1.00 0.00 C ATOM 243 C ALA A 18 -6.806 0.291 -9.071 1.00 0.00 C ATOM 244 O ALA A 18 -7.350 0.658 -8.031 1.00 0.00 O ATOM 245 CB ALA A 18 -4.340 0.674 -8.940 1.00 0.00 C ATOM 0 H ALA A 18 -6.248 2.798 -8.651 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.535 0.814 -10.705 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -4.188 -0.402 -9.030 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.500 1.199 -9.395 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -4.408 0.944 -7.886 1.00 0.00 H new ATOM 251 N THR A 19 -7.196 -0.781 -9.747 1.00 0.00 N ATOM 252 CA THR A 19 -8.304 -1.602 -9.287 1.00 0.00 C ATOM 253 C THR A 19 -7.966 -3.083 -9.404 1.00 0.00 C ATOM 254 O THR A 19 -7.912 -3.635 -10.503 1.00 0.00 O ATOM 255 CB THR A 19 -9.571 -1.294 -10.086 1.00 0.00 C ATOM 256 OG1 THR A 19 -9.875 0.089 -10.029 1.00 0.00 O ATOM 257 CG2 THR A 19 -10.783 -2.052 -9.591 1.00 0.00 C ATOM 0 H THR A 19 -6.762 -1.101 -10.613 1.00 0.00 H new ATOM 0 HA THR A 19 -8.482 -1.366 -8.238 1.00 0.00 H new ATOM 0 HB THR A 19 -9.356 -1.608 -11.107 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.688 0.267 -10.547 1.00 0.00 H new ATOM 0 HG21 THR A 19 -11.649 -1.790 -10.199 1.00 0.00 H new ATOM 0 HG22 THR A 19 -10.598 -3.124 -9.666 1.00 0.00 H new ATOM 0 HG23 THR A 19 -10.977 -1.789 -8.551 1.00 0.00 H new ATOM 265 N ALA A 20 -7.741 -3.718 -8.261 1.00 0.00 N ATOM 266 CA ALA A 20 -7.412 -5.138 -8.225 1.00 0.00 C ATOM 267 C ALA A 20 -8.633 -5.960 -7.815 1.00 0.00 C ATOM 268 O ALA A 20 -9.280 -5.658 -6.812 1.00 0.00 O ATOM 269 CB ALA A 20 -6.254 -5.379 -7.273 1.00 0.00 C ATOM 0 H ALA A 20 -7.780 -3.272 -7.345 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.111 -5.456 -9.223 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -6.015 -6.442 -7.252 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -5.383 -4.818 -7.611 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.532 -5.050 -6.272 1.00 0.00 H new ATOM 275 N ARG A 21 -8.963 -6.986 -8.602 1.00 0.00 N ATOM 276 CA ARG A 21 -10.131 -7.817 -8.307 1.00 0.00 C ATOM 277 C ARG A 21 -9.894 -9.291 -8.615 1.00 0.00 C ATOM 278 O ARG A 21 -9.327 -9.640 -9.651 1.00 0.00 O ATOM 279 CB ARG A 21 -11.343 -7.332 -9.113 1.00 0.00 C ATOM 280 CG ARG A 21 -11.380 -5.828 -9.340 1.00 0.00 C ATOM 281 CD ARG A 21 -10.418 -5.404 -10.434 1.00 0.00 C ATOM 282 NE ARG A 21 -11.111 -5.034 -11.667 1.00 0.00 N ATOM 283 CZ ARG A 21 -11.348 -5.874 -12.674 1.00 0.00 C ATOM 284 NH1 ARG A 21 -10.951 -7.139 -12.606 1.00 0.00 N ATOM 285 NH2 ARG A 21 -11.987 -5.447 -13.754 1.00 0.00 N ATOM 0 H ARG A 21 -8.446 -7.259 -9.438 1.00 0.00 H new ATOM 0 HA ARG A 21 -10.319 -7.721 -7.238 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.346 -7.834 -10.080 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -12.254 -7.632 -8.595 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.392 -5.525 -9.607 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.127 -5.313 -8.413 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -9.824 -4.559 -10.086 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.723 -6.218 -10.640 1.00 0.00 H new ATOM 0 HE ARG A 21 -11.434 -4.071 -11.763 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -10.460 -7.476 -11.778 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -11.137 -7.774 -13.382 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -12.296 -4.477 -13.813 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -12.169 -6.089 -14.526 1.00 0.00 H new ATOM 299 N GLY A 22 -10.357 -10.153 -7.710 1.00 0.00 N ATOM 300 CA GLY A 22 -10.217 -11.582 -7.900 1.00 0.00 C ATOM 301 C GLY A 22 -11.210 -12.370 -7.069 1.00 0.00 C ATOM 302 O GLY A 22 -11.311 -12.176 -5.855 1.00 0.00 O ATOM 0 H GLY A 22 -10.828 -9.882 -6.847 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.357 -11.822 -8.954 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.204 -11.884 -7.636 1.00 0.00 H new ATOM 306 N ILE A 23 -11.943 -13.267 -7.720 1.00 0.00 N ATOM 307 CA ILE A 23 -12.921 -14.092 -7.023 1.00 0.00 C ATOM 308 C ILE A 23 -12.209 -15.202 -6.266 1.00 0.00 C ATOM 309 O ILE A 23 -11.414 -15.946 -6.840 1.00 0.00 O ATOM 310 CB ILE A 23 -13.956 -14.699 -7.994 1.00 0.00 C ATOM 311 CG1 ILE A 23 -14.877 -13.595 -8.536 1.00 0.00 C ATOM 312 CG2 ILE A 23 -14.760 -15.797 -7.302 1.00 0.00 C ATOM 313 CD1 ILE A 23 -16.232 -13.529 -7.861 1.00 0.00 C ATOM 0 H ILE A 23 -11.879 -13.440 -8.723 1.00 0.00 H new ATOM 0 HA ILE A 23 -13.459 -13.453 -6.323 1.00 0.00 H new ATOM 0 HB ILE A 23 -13.431 -15.152 -8.835 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -14.379 -12.632 -8.420 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -15.023 -13.752 -9.605 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -15.485 -16.213 -8.002 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -14.086 -16.585 -6.966 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -15.284 -15.378 -6.443 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -16.819 -12.724 -8.302 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -16.754 -14.476 -7.999 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -16.099 -13.340 -6.796 1.00 0.00 H new ATOM 325 N PHE A 24 -12.477 -15.293 -4.972 1.00 0.00 N ATOM 326 CA PHE A 24 -11.835 -16.297 -4.140 1.00 0.00 C ATOM 327 C PHE A 24 -12.849 -17.208 -3.463 1.00 0.00 C ATOM 328 O PHE A 24 -13.928 -16.777 -3.053 1.00 0.00 O ATOM 329 CB PHE A 24 -10.936 -15.602 -3.119 1.00 0.00 C ATOM 330 CG PHE A 24 -10.100 -14.517 -3.741 1.00 0.00 C ATOM 331 CD1 PHE A 24 -9.520 -14.707 -4.987 1.00 0.00 C ATOM 332 CD2 PHE A 24 -9.903 -13.308 -3.096 1.00 0.00 C ATOM 333 CE1 PHE A 24 -8.761 -13.717 -5.573 1.00 0.00 C ATOM 334 CE2 PHE A 24 -9.145 -12.313 -3.680 1.00 0.00 C ATOM 335 CZ PHE A 24 -8.574 -12.519 -4.920 1.00 0.00 C ATOM 0 H PHE A 24 -13.132 -14.686 -4.478 1.00 0.00 H new ATOM 0 HA PHE A 24 -11.225 -16.940 -4.775 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -11.551 -15.175 -2.327 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -10.282 -16.339 -2.652 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -9.665 -15.644 -5.505 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -10.347 -13.142 -2.126 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -8.314 -13.880 -6.542 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -8.999 -11.374 -3.167 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.981 -11.741 -5.378 1.00 0.00 H new ATOM 345 N ASN A 25 -12.484 -18.479 -3.368 1.00 0.00 N ATOM 346 CA ASN A 25 -13.330 -19.501 -2.767 1.00 0.00 C ATOM 347 C ASN A 25 -12.659 -20.099 -1.540 1.00 0.00 C ATOM 348 O ASN A 25 -11.473 -19.870 -1.300 1.00 0.00 O ATOM 349 CB ASN A 25 -13.644 -20.598 -3.783 1.00 0.00 C ATOM 350 CG ASN A 25 -12.395 -21.283 -4.302 1.00 0.00 C ATOM 351 OD1 ASN A 25 -11.310 -20.701 -4.303 1.00 0.00 O ATOM 352 ND2 ASN A 25 -12.543 -22.525 -4.747 1.00 0.00 N ATOM 0 H ASN A 25 -11.589 -18.832 -3.707 1.00 0.00 H new ATOM 0 HA ASN A 25 -14.264 -19.033 -2.457 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -14.296 -21.340 -3.322 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -14.193 -20.167 -4.620 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.738 -23.036 -5.109 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.462 -22.968 -4.727 1.00 0.00 H new ATOM 359 N SER A 26 -13.425 -20.853 -0.753 1.00 0.00 N ATOM 360 CA SER A 26 -12.904 -21.472 0.467 1.00 0.00 C ATOM 361 C SER A 26 -11.512 -22.063 0.244 1.00 0.00 C ATOM 362 O SER A 26 -10.711 -22.146 1.176 1.00 0.00 O ATOM 363 CB SER A 26 -13.860 -22.568 0.950 1.00 0.00 C ATOM 364 OG SER A 26 -13.410 -23.856 0.565 1.00 0.00 O ATOM 0 H SER A 26 -14.409 -21.051 -0.938 1.00 0.00 H new ATOM 0 HA SER A 26 -12.825 -20.695 1.227 1.00 0.00 H new ATOM 0 HB2 SER A 26 -13.949 -22.522 2.035 1.00 0.00 H new ATOM 0 HB3 SER A 26 -14.855 -22.391 0.540 1.00 0.00 H new ATOM 0 HG SER A 26 -13.905 -24.152 -0.227 1.00 0.00 H new ATOM 370 N ASN A 27 -11.214 -22.447 -0.995 1.00 0.00 N ATOM 371 CA ASN A 27 -9.905 -22.995 -1.323 1.00 0.00 C ATOM 372 C ASN A 27 -8.824 -21.992 -0.922 1.00 0.00 C ATOM 373 O ASN A 27 -7.837 -22.346 -0.275 1.00 0.00 O ATOM 374 CB ASN A 27 -9.839 -23.323 -2.821 1.00 0.00 C ATOM 375 CG ASN A 27 -8.532 -22.914 -3.474 1.00 0.00 C ATOM 376 OD1 ASN A 27 -8.496 -21.696 -3.996 1.00 0.00 O flip ATOM 377 ND2 ASN A 27 -7.571 -23.682 -3.506 1.00 0.00 N flip ATOM 0 H ASN A 27 -11.859 -22.388 -1.783 1.00 0.00 H new ATOM 0 HA ASN A 27 -9.737 -23.920 -0.771 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -9.984 -24.395 -2.957 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -10.663 -22.823 -3.331 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -7.646 -24.611 -3.091 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -6.699 -23.390 -3.948 1.00 0.00 H new ATOM 384 N GLY A 28 -9.042 -20.734 -1.291 1.00 0.00 N ATOM 385 CA GLY A 28 -8.109 -19.679 -0.944 1.00 0.00 C ATOM 386 C GLY A 28 -7.402 -19.073 -2.138 1.00 0.00 C ATOM 387 O GLY A 28 -7.732 -19.361 -3.288 1.00 0.00 O ATOM 0 H GLY A 28 -9.853 -20.426 -1.827 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.645 -18.892 -0.413 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.364 -20.077 -0.256 1.00 0.00 H new ATOM 391 N GLY A 29 -6.430 -18.214 -1.849 1.00 0.00 N ATOM 392 CA GLY A 29 -5.673 -17.547 -2.891 1.00 0.00 C ATOM 393 C GLY A 29 -5.204 -16.177 -2.446 1.00 0.00 C ATOM 394 O GLY A 29 -5.336 -15.826 -1.275 1.00 0.00 O ATOM 0 H GLY A 29 -6.151 -17.966 -0.900 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -4.812 -18.157 -3.164 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -6.290 -17.449 -3.784 1.00 0.00 H new ATOM 398 N VAL A 30 -4.667 -15.392 -3.373 1.00 0.00 N ATOM 399 CA VAL A 30 -4.196 -14.053 -3.042 1.00 0.00 C ATOM 400 C VAL A 30 -4.484 -13.077 -4.173 1.00 0.00 C ATOM 401 O VAL A 30 -4.357 -13.415 -5.350 1.00 0.00 O ATOM 402 CB VAL A 30 -2.681 -14.025 -2.712 1.00 0.00 C ATOM 403 CG1 VAL A 30 -2.243 -15.326 -2.061 1.00 0.00 C ATOM 404 CG2 VAL A 30 -1.844 -13.739 -3.955 1.00 0.00 C ATOM 0 H VAL A 30 -4.548 -15.656 -4.351 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.743 -13.748 -2.150 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.516 -13.213 -2.004 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.177 -15.281 -1.839 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.800 -15.475 -1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.438 -16.156 -2.740 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.787 -13.727 -3.687 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.021 -14.516 -4.699 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.125 -12.770 -4.368 1.00 0.00 H new ATOM 414 N LEU A 31 -4.861 -11.862 -3.807 1.00 0.00 N ATOM 415 CA LEU A 31 -5.153 -10.832 -4.789 1.00 0.00 C ATOM 416 C LEU A 31 -3.986 -9.864 -4.882 1.00 0.00 C ATOM 417 O LEU A 31 -3.768 -9.054 -3.984 1.00 0.00 O ATOM 418 CB LEU A 31 -6.431 -10.089 -4.397 1.00 0.00 C ATOM 419 CG LEU A 31 -7.139 -9.311 -5.517 1.00 0.00 C ATOM 420 CD1 LEU A 31 -6.458 -7.976 -5.757 1.00 0.00 C ATOM 421 CD2 LEU A 31 -7.200 -10.115 -6.813 1.00 0.00 C ATOM 0 H LEU A 31 -4.972 -11.566 -2.837 1.00 0.00 H new ATOM 0 HA LEU A 31 -5.303 -11.296 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.135 -10.813 -3.986 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.188 -9.390 -3.596 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.163 -9.130 -5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -6.975 -7.442 -6.554 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -6.488 -7.383 -4.843 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.421 -8.144 -6.047 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.708 -9.531 -7.580 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.188 -10.348 -7.145 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.748 -11.042 -6.641 1.00 0.00 H new ATOM 433 N SER A 32 -3.232 -9.959 -5.968 1.00 0.00 N ATOM 434 CA SER A 32 -2.079 -9.098 -6.165 1.00 0.00 C ATOM 435 C SER A 32 -2.428 -7.901 -7.045 1.00 0.00 C ATOM 436 O SER A 32 -3.222 -8.013 -7.978 1.00 0.00 O ATOM 437 CB SER A 32 -0.930 -9.889 -6.794 1.00 0.00 C ATOM 438 OG SER A 32 -1.090 -9.994 -8.198 1.00 0.00 O ATOM 0 H SER A 32 -3.399 -10.623 -6.724 1.00 0.00 H new ATOM 0 HA SER A 32 -1.768 -8.725 -5.189 1.00 0.00 H new ATOM 0 HB2 SER A 32 0.018 -9.400 -6.569 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.887 -10.886 -6.354 1.00 0.00 H new ATOM 0 HG SER A 32 -0.342 -10.502 -8.575 1.00 0.00 H new ATOM 444 N SER A 33 -1.818 -6.758 -6.745 1.00 0.00 N ATOM 445 CA SER A 33 -2.048 -5.542 -7.510 1.00 0.00 C ATOM 446 C SER A 33 -0.719 -4.954 -7.960 1.00 0.00 C ATOM 447 O SER A 33 -0.093 -4.186 -7.234 1.00 0.00 O ATOM 448 CB SER A 33 -2.813 -4.520 -6.669 1.00 0.00 C ATOM 449 OG SER A 33 -2.838 -3.253 -7.302 1.00 0.00 O ATOM 0 H SER A 33 -1.159 -6.651 -5.974 1.00 0.00 H new ATOM 0 HA SER A 33 -2.646 -5.789 -8.388 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.833 -4.869 -6.507 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.347 -4.430 -5.688 1.00 0.00 H new ATOM 0 HG SER A 33 -3.334 -2.618 -6.744 1.00 0.00 H new ATOM 455 N ILE A 34 -0.290 -5.329 -9.157 1.00 0.00 N ATOM 456 CA ILE A 34 0.971 -4.848 -9.704 1.00 0.00 C ATOM 457 C ILE A 34 0.939 -3.342 -9.941 1.00 0.00 C ATOM 458 O ILE A 34 1.964 -2.667 -9.848 1.00 0.00 O ATOM 459 CB ILE A 34 1.306 -5.565 -11.021 1.00 0.00 C ATOM 460 CG1 ILE A 34 2.682 -5.121 -11.532 1.00 0.00 C ATOM 461 CG2 ILE A 34 0.215 -5.317 -12.052 1.00 0.00 C ATOM 462 CD1 ILE A 34 2.670 -3.830 -12.327 1.00 0.00 C ATOM 0 H ILE A 34 -0.798 -5.967 -9.769 1.00 0.00 H new ATOM 0 HA ILE A 34 1.744 -5.068 -8.968 1.00 0.00 H new ATOM 0 HB ILE A 34 1.350 -6.639 -10.841 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.351 -5.002 -10.680 1.00 0.00 H new ATOM 0 HG13 ILE A 34 3.097 -5.913 -12.155 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.467 -5.831 -12.979 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.735 -5.695 -11.674 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.130 -4.247 -12.242 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.684 -3.591 -12.649 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.030 -3.947 -13.201 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.288 -3.022 -11.703 1.00 0.00 H new ATOM 474 N GLU A 35 -0.243 -2.822 -10.252 1.00 0.00 N ATOM 475 CA GLU A 35 -0.412 -1.395 -10.510 1.00 0.00 C ATOM 476 C GLU A 35 0.135 -0.549 -9.360 1.00 0.00 C ATOM 477 O GLU A 35 0.489 0.615 -9.551 1.00 0.00 O ATOM 478 CB GLU A 35 -1.890 -1.071 -10.735 1.00 0.00 C ATOM 479 CG GLU A 35 -2.551 -1.952 -11.782 1.00 0.00 C ATOM 480 CD GLU A 35 -3.530 -1.186 -12.652 1.00 0.00 C ATOM 481 OE1 GLU A 35 -4.457 -0.563 -12.095 1.00 0.00 O ATOM 482 OE2 GLU A 35 -3.370 -1.212 -13.890 1.00 0.00 O ATOM 0 H GLU A 35 -1.101 -3.368 -10.332 1.00 0.00 H new ATOM 0 HA GLU A 35 0.154 -1.151 -11.409 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.425 -1.178 -9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.983 -0.028 -11.038 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.783 -2.400 -12.413 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.074 -2.770 -11.286 1.00 0.00 H new ATOM 489 N THR A 36 0.194 -1.134 -8.168 1.00 0.00 N ATOM 490 CA THR A 36 0.691 -0.423 -6.995 1.00 0.00 C ATOM 491 C THR A 36 1.703 -1.263 -6.222 1.00 0.00 C ATOM 492 O THR A 36 2.719 -0.752 -5.752 1.00 0.00 O ATOM 493 CB THR A 36 -0.473 -0.039 -6.082 1.00 0.00 C ATOM 494 OG1 THR A 36 -1.116 -1.194 -5.576 1.00 0.00 O ATOM 495 CG2 THR A 36 -1.519 0.803 -6.777 1.00 0.00 C ATOM 0 H THR A 36 -0.095 -2.096 -7.989 1.00 0.00 H new ATOM 0 HA THR A 36 1.195 0.480 -7.339 1.00 0.00 H new ATOM 0 HB THR A 36 -0.031 0.548 -5.277 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.619 -1.630 -6.295 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.318 1.042 -6.076 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.063 1.726 -7.136 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.930 0.249 -7.621 1.00 0.00 H new ATOM 503 N GLY A 37 1.416 -2.552 -6.090 1.00 0.00 N ATOM 504 CA GLY A 37 2.305 -3.443 -5.369 1.00 0.00 C ATOM 505 C GLY A 37 1.655 -4.032 -4.134 1.00 0.00 C ATOM 506 O GLY A 37 2.339 -4.534 -3.243 1.00 0.00 O ATOM 0 H GLY A 37 0.581 -2.997 -6.471 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.621 -4.250 -6.030 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.204 -2.899 -5.079 1.00 0.00 H new ATOM 510 N VAL A 38 0.333 -3.957 -4.079 1.00 0.00 N ATOM 511 CA VAL A 38 -0.419 -4.468 -2.946 1.00 0.00 C ATOM 512 C VAL A 38 -0.977 -5.859 -3.242 1.00 0.00 C ATOM 513 O VAL A 38 -1.592 -6.082 -4.284 1.00 0.00 O ATOM 514 CB VAL A 38 -1.570 -3.510 -2.601 1.00 0.00 C ATOM 515 CG1 VAL A 38 -2.459 -4.084 -1.507 1.00 0.00 C ATOM 516 CG2 VAL A 38 -1.027 -2.149 -2.198 1.00 0.00 C ATOM 0 H VAL A 38 -0.243 -3.544 -4.812 1.00 0.00 H new ATOM 0 HA VAL A 38 0.258 -4.541 -2.095 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.184 -3.387 -3.493 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.263 -3.382 -1.286 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.884 -5.030 -1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.867 -4.252 -0.607 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.856 -1.483 -1.957 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.384 -2.258 -1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.452 -1.728 -3.023 1.00 0.00 H new ATOM 526 N SER A 39 -0.757 -6.791 -2.318 1.00 0.00 N ATOM 527 CA SER A 39 -1.239 -8.160 -2.485 1.00 0.00 C ATOM 528 C SER A 39 -1.891 -8.678 -1.206 1.00 0.00 C ATOM 529 O SER A 39 -1.315 -8.580 -0.122 1.00 0.00 O ATOM 530 CB SER A 39 -0.086 -9.083 -2.892 1.00 0.00 C ATOM 531 OG SER A 39 1.065 -8.338 -3.251 1.00 0.00 O ATOM 0 H SER A 39 -0.250 -6.624 -1.449 1.00 0.00 H new ATOM 0 HA SER A 39 -1.992 -8.154 -3.274 1.00 0.00 H new ATOM 0 HB2 SER A 39 0.155 -9.754 -2.067 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.395 -9.707 -3.731 1.00 0.00 H new ATOM 0 HG SER A 39 1.786 -8.952 -3.505 1.00 0.00 H new ATOM 537 N ILE A 40 -3.092 -9.236 -1.338 1.00 0.00 N ATOM 538 CA ILE A 40 -3.812 -9.775 -0.191 1.00 0.00 C ATOM 539 C ILE A 40 -3.838 -11.299 -0.231 1.00 0.00 C ATOM 540 O ILE A 40 -4.478 -11.896 -1.093 1.00 0.00 O ATOM 541 CB ILE A 40 -5.265 -9.253 -0.136 1.00 0.00 C ATOM 542 CG1 ILE A 40 -5.280 -7.725 -0.073 1.00 0.00 C ATOM 543 CG2 ILE A 40 -6.002 -9.846 1.061 1.00 0.00 C ATOM 544 CD1 ILE A 40 -6.671 -7.139 0.043 1.00 0.00 C ATOM 0 H ILE A 40 -3.585 -9.326 -2.226 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.281 -9.441 0.700 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.780 -9.566 -1.044 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.685 -7.399 0.780 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.800 -7.328 -0.968 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -7.024 -9.467 1.083 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.020 -10.932 0.976 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.490 -9.563 1.980 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.606 -6.052 0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.264 -7.435 -0.822 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.146 -7.507 0.952 1.00 0.00 H new ATOM 556 N ILE A 41 -3.141 -11.920 0.714 1.00 0.00 N ATOM 557 CA ILE A 41 -3.085 -13.373 0.796 1.00 0.00 C ATOM 558 C ILE A 41 -4.178 -13.905 1.720 1.00 0.00 C ATOM 559 O ILE A 41 -4.305 -13.466 2.863 1.00 0.00 O ATOM 560 CB ILE A 41 -1.706 -13.848 1.302 1.00 0.00 C ATOM 561 CG1 ILE A 41 -0.615 -13.452 0.305 1.00 0.00 C ATOM 562 CG2 ILE A 41 -1.700 -15.353 1.532 1.00 0.00 C ATOM 563 CD1 ILE A 41 -0.288 -11.975 0.321 1.00 0.00 C ATOM 0 H ILE A 41 -2.606 -11.437 1.436 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.244 -13.764 -0.209 1.00 0.00 H new ATOM 0 HB ILE A 41 -1.503 -13.362 2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.290 -14.018 0.525 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.932 -13.735 -0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.717 -15.663 1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.454 -15.610 2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.925 -15.865 0.596 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.493 -11.767 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -1.181 -11.402 0.071 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.060 -11.690 1.314 1.00 0.00 H new ATOM 575 N ILE A 42 -4.966 -14.850 1.216 1.00 0.00 N ATOM 576 CA ILE A 42 -6.048 -15.437 1.997 1.00 0.00 C ATOM 577 C ILE A 42 -5.748 -16.890 2.361 1.00 0.00 C ATOM 578 O ILE A 42 -5.628 -17.744 1.483 1.00 0.00 O ATOM 579 CB ILE A 42 -7.387 -15.384 1.234 1.00 0.00 C ATOM 580 CG1 ILE A 42 -7.762 -13.936 0.908 1.00 0.00 C ATOM 581 CG2 ILE A 42 -8.490 -16.053 2.044 1.00 0.00 C ATOM 582 CD1 ILE A 42 -7.787 -13.645 -0.574 1.00 0.00 C ATOM 0 H ILE A 42 -4.875 -15.225 0.272 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.129 -14.845 2.909 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.271 -15.928 0.297 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -8.743 -13.718 1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -7.051 -13.266 1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.428 -16.006 1.490 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.227 -17.095 2.225 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.606 -15.537 2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -8.060 -12.602 -0.735 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.800 -13.832 -0.998 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -8.519 -14.291 -1.059 1.00 0.00 H new ATOM 594 N PRO A 43 -5.635 -17.195 3.665 1.00 0.00 N ATOM 595 CA PRO A 43 -5.362 -18.555 4.132 1.00 0.00 C ATOM 596 C PRO A 43 -6.513 -19.503 3.823 1.00 0.00 C ATOM 597 O PRO A 43 -7.682 -19.138 3.947 1.00 0.00 O ATOM 598 CB PRO A 43 -5.197 -18.397 5.645 1.00 0.00 C ATOM 599 CG PRO A 43 -5.914 -17.135 5.982 1.00 0.00 C ATOM 600 CD PRO A 43 -5.770 -16.245 4.782 1.00 0.00 C ATOM 0 HA PRO A 43 -4.488 -18.984 3.643 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.622 -19.247 6.179 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.145 -18.339 5.923 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -6.964 -17.329 6.200 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -5.485 -16.667 6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.638 -15.598 4.656 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -4.898 -15.597 4.865 1.00 0.00 H new ATOM 608 N GLN A 44 -6.174 -20.718 3.420 1.00 0.00 N ATOM 609 CA GLN A 44 -7.179 -21.724 3.090 1.00 0.00 C ATOM 610 C GLN A 44 -8.109 -21.978 4.273 1.00 0.00 C ATOM 611 O GLN A 44 -7.818 -22.806 5.137 1.00 0.00 O ATOM 612 CB GLN A 44 -6.504 -23.030 2.670 1.00 0.00 C ATOM 613 CG GLN A 44 -7.478 -24.082 2.164 1.00 0.00 C ATOM 614 CD GLN A 44 -8.183 -24.814 3.289 1.00 0.00 C ATOM 615 OE1 GLN A 44 -9.420 -24.416 3.570 1.00 0.00 O flip ATOM 616 NE2 GLN A 44 -7.625 -25.725 3.897 1.00 0.00 N flip ATOM 0 H GLN A 44 -5.210 -21.034 3.313 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.774 -21.345 2.259 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -5.774 -22.817 1.889 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -5.954 -23.435 3.519 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.221 -23.606 1.524 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -6.941 -24.803 1.547 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.674 -25.997 3.647 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -8.113 -26.209 4.651 1.00 0.00 H new ATOM 625 N GLY A 45 -9.229 -21.262 4.307 1.00 0.00 N ATOM 626 CA GLY A 45 -10.183 -21.430 5.388 1.00 0.00 C ATOM 627 C GLY A 45 -10.969 -20.164 5.682 1.00 0.00 C ATOM 628 O GLY A 45 -12.044 -20.221 6.278 1.00 0.00 O ATOM 0 H GLY A 45 -9.492 -20.569 3.606 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.876 -22.232 5.133 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -9.654 -21.741 6.289 1.00 0.00 H new ATOM 632 N ALA A 46 -10.433 -19.019 5.268 1.00 0.00 N ATOM 633 CA ALA A 46 -11.093 -17.739 5.496 1.00 0.00 C ATOM 634 C ALA A 46 -12.506 -17.735 4.921 1.00 0.00 C ATOM 635 O ALA A 46 -13.457 -17.319 5.583 1.00 0.00 O ATOM 636 CB ALA A 46 -10.275 -16.608 4.894 1.00 0.00 C ATOM 0 H ALA A 46 -9.544 -18.952 4.773 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.168 -17.587 6.573 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -10.780 -15.659 5.072 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.288 -16.586 5.357 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.169 -16.767 3.821 1.00 0.00 H new ATOM 642 N ILE A 47 -12.637 -18.202 3.685 1.00 0.00 N ATOM 643 CA ILE A 47 -13.927 -18.257 3.017 1.00 0.00 C ATOM 644 C ILE A 47 -14.565 -19.635 3.193 1.00 0.00 C ATOM 645 O ILE A 47 -13.880 -20.655 3.133 1.00 0.00 O ATOM 646 CB ILE A 47 -13.775 -17.930 1.509 1.00 0.00 C ATOM 647 CG1 ILE A 47 -13.415 -16.450 1.331 1.00 0.00 C ATOM 648 CG2 ILE A 47 -15.043 -18.270 0.729 1.00 0.00 C ATOM 649 CD1 ILE A 47 -13.440 -15.984 -0.108 1.00 0.00 C ATOM 0 H ILE A 47 -11.859 -18.549 3.124 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.577 -17.510 3.472 1.00 0.00 H new ATOM 0 HB ILE A 47 -12.970 -18.547 1.108 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -14.111 -15.844 1.911 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -12.421 -16.276 1.742 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -14.899 -18.027 -0.324 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -15.258 -19.334 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.879 -17.692 1.123 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.175 -14.928 -0.153 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -12.723 -16.563 -0.690 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.440 -16.125 -0.519 1.00 0.00 H new ATOM 661 N PRO A 48 -15.890 -19.684 3.413 1.00 0.00 N ATOM 662 CA PRO A 48 -16.611 -20.943 3.591 1.00 0.00 C ATOM 663 C PRO A 48 -16.692 -21.739 2.294 1.00 0.00 C ATOM 664 O PRO A 48 -16.452 -21.206 1.211 1.00 0.00 O ATOM 665 CB PRO A 48 -18.005 -20.502 4.044 1.00 0.00 C ATOM 666 CG PRO A 48 -18.160 -19.117 3.519 1.00 0.00 C ATOM 667 CD PRO A 48 -16.780 -18.516 3.499 1.00 0.00 C ATOM 0 HA PRO A 48 -16.116 -21.603 4.303 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -18.776 -21.163 3.648 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -18.093 -20.525 5.130 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -18.595 -19.126 2.519 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -18.829 -18.534 4.152 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -16.647 -17.848 2.648 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -16.586 -17.930 4.397 1.00 0.00 H new ATOM 675 N GLU A 49 -17.019 -23.017 2.414 1.00 0.00 N ATOM 676 CA GLU A 49 -17.120 -23.899 1.255 1.00 0.00 C ATOM 677 C GLU A 49 -18.447 -23.716 0.522 1.00 0.00 C ATOM 678 O GLU A 49 -19.450 -23.328 1.118 1.00 0.00 O ATOM 679 CB GLU A 49 -16.964 -25.359 1.686 1.00 0.00 C ATOM 680 CG GLU A 49 -15.558 -25.709 2.148 1.00 0.00 C ATOM 681 CD GLU A 49 -15.372 -27.196 2.372 1.00 0.00 C ATOM 682 OE1 GLU A 49 -15.864 -27.987 1.539 1.00 0.00 O ATOM 683 OE2 GLU A 49 -14.735 -27.570 3.378 1.00 0.00 O ATOM 0 H GLU A 49 -17.220 -23.470 3.305 1.00 0.00 H new ATOM 0 HA GLU A 49 -16.316 -23.634 0.569 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -17.666 -25.568 2.494 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -17.236 -26.007 0.852 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -14.839 -25.364 1.405 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -15.340 -25.176 3.073 1.00 0.00 H new ATOM 690 N GLY A 50 -18.438 -24.007 -0.777 1.00 0.00 N ATOM 691 CA GLY A 50 -19.640 -23.880 -1.580 1.00 0.00 C ATOM 692 C GLY A 50 -20.046 -22.438 -1.811 1.00 0.00 C ATOM 693 O GLY A 50 -21.233 -22.136 -1.939 1.00 0.00 O ATOM 0 H GLY A 50 -17.616 -24.329 -1.288 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -19.481 -24.366 -2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -20.457 -24.408 -1.088 1.00 0.00 H new ATOM 697 N VAL A 51 -19.065 -21.544 -1.866 1.00 0.00 N ATOM 698 CA VAL A 51 -19.339 -20.129 -2.083 1.00 0.00 C ATOM 699 C VAL A 51 -18.223 -19.455 -2.878 1.00 0.00 C ATOM 700 O VAL A 51 -17.086 -19.927 -2.899 1.00 0.00 O ATOM 701 CB VAL A 51 -19.524 -19.384 -0.747 1.00 0.00 C ATOM 702 CG1 VAL A 51 -18.275 -19.509 0.111 1.00 0.00 C ATOM 703 CG2 VAL A 51 -19.869 -17.922 -0.989 1.00 0.00 C ATOM 0 H VAL A 51 -18.076 -21.773 -1.764 1.00 0.00 H new ATOM 0 HA VAL A 51 -20.264 -20.076 -2.657 1.00 0.00 H new ATOM 0 HB VAL A 51 -20.354 -19.843 -0.211 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -18.424 -18.977 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -18.079 -20.561 0.317 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -17.425 -19.079 -0.419 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -19.995 -17.415 -0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -19.064 -17.446 -1.549 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -20.795 -17.856 -1.560 1.00 0.00 H new ATOM 713 N GLU A 52 -18.561 -18.339 -3.519 1.00 0.00 N ATOM 714 CA GLU A 52 -17.600 -17.579 -4.308 1.00 0.00 C ATOM 715 C GLU A 52 -17.726 -16.090 -4.006 1.00 0.00 C ATOM 716 O GLU A 52 -18.704 -15.450 -4.395 1.00 0.00 O ATOM 717 CB GLU A 52 -17.817 -17.832 -5.801 1.00 0.00 C ATOM 718 CG GLU A 52 -16.840 -18.832 -6.395 1.00 0.00 C ATOM 719 CD GLU A 52 -17.530 -19.931 -7.179 1.00 0.00 C ATOM 720 OE1 GLU A 52 -18.516 -20.498 -6.664 1.00 0.00 O ATOM 721 OE2 GLU A 52 -17.085 -20.222 -8.310 1.00 0.00 O ATOM 0 H GLU A 52 -19.500 -17.940 -3.506 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.596 -17.908 -4.039 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.834 -18.193 -5.956 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.729 -16.887 -6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -16.143 -18.308 -7.049 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -16.251 -19.278 -5.594 1.00 0.00 H new ATOM 728 N GLN A 53 -16.739 -15.544 -3.303 1.00 0.00 N ATOM 729 CA GLN A 53 -16.752 -14.130 -2.945 1.00 0.00 C ATOM 730 C GLN A 53 -15.752 -13.334 -3.775 1.00 0.00 C ATOM 731 O GLN A 53 -14.553 -13.610 -3.749 1.00 0.00 O ATOM 732 CB GLN A 53 -16.433 -13.954 -1.457 1.00 0.00 C ATOM 733 CG GLN A 53 -17.407 -14.663 -0.532 1.00 0.00 C ATOM 734 CD GLN A 53 -18.854 -14.329 -0.840 1.00 0.00 C ATOM 735 OE1 GLN A 53 -19.722 -15.202 -0.826 1.00 0.00 O ATOM 736 NE2 GLN A 53 -19.121 -13.059 -1.120 1.00 0.00 N ATOM 0 H GLN A 53 -15.922 -16.057 -2.971 1.00 0.00 H new ATOM 0 HA GLN A 53 -17.752 -13.750 -3.153 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -15.427 -14.327 -1.264 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -16.430 -12.890 -1.219 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -17.261 -15.740 -0.614 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -17.187 -14.389 0.500 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -18.371 -12.368 -1.120 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -20.077 -12.774 -1.335 1.00 0.00 H new ATOM 745 N GLU A 54 -16.248 -12.334 -4.499 1.00 0.00 N ATOM 746 CA GLU A 54 -15.384 -11.493 -5.315 1.00 0.00 C ATOM 747 C GLU A 54 -14.675 -10.470 -4.443 1.00 0.00 C ATOM 748 O GLU A 54 -15.266 -9.461 -4.055 1.00 0.00 O ATOM 749 CB GLU A 54 -16.186 -10.768 -6.399 1.00 0.00 C ATOM 750 CG GLU A 54 -15.334 -10.286 -7.561 1.00 0.00 C ATOM 751 CD GLU A 54 -16.022 -10.448 -8.900 1.00 0.00 C ATOM 752 OE1 GLU A 54 -17.077 -9.812 -9.107 1.00 0.00 O ATOM 753 OE2 GLU A 54 -15.507 -11.212 -9.744 1.00 0.00 O ATOM 0 H GLU A 54 -17.237 -12.089 -4.536 1.00 0.00 H new ATOM 0 HA GLU A 54 -14.648 -12.137 -5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -16.958 -11.438 -6.778 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -16.695 -9.914 -5.953 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -15.084 -9.236 -7.411 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -14.395 -10.839 -7.571 1.00 0.00 H new ATOM 760 N ILE A 55 -13.409 -10.723 -4.140 1.00 0.00 N ATOM 761 CA ILE A 55 -12.644 -9.801 -3.318 1.00 0.00 C ATOM 762 C ILE A 55 -11.764 -8.925 -4.193 1.00 0.00 C ATOM 763 O ILE A 55 -10.876 -9.414 -4.890 1.00 0.00 O ATOM 764 CB ILE A 55 -11.781 -10.542 -2.279 1.00 0.00 C ATOM 765 CG1 ILE A 55 -12.668 -11.435 -1.407 1.00 0.00 C ATOM 766 CG2 ILE A 55 -11.002 -9.548 -1.423 1.00 0.00 C ATOM 767 CD1 ILE A 55 -11.928 -12.111 -0.272 1.00 0.00 C ATOM 0 H ILE A 55 -12.896 -11.549 -4.448 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.354 -9.176 -2.776 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.061 -11.171 -2.802 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.477 -10.834 -0.993 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.127 -12.199 -2.035 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.398 -10.090 -0.695 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.351 -8.950 -2.061 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.699 -8.893 -0.901 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.623 -12.726 0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.136 -12.740 -0.678 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.492 -11.354 0.380 1.00 0.00 H new ATOM 779 N TYR A 56 -12.028 -7.629 -4.158 1.00 0.00 N ATOM 780 CA TYR A 56 -11.278 -6.676 -4.953 1.00 0.00 C ATOM 781 C TYR A 56 -11.019 -5.403 -4.171 1.00 0.00 C ATOM 782 O TYR A 56 -11.872 -4.941 -3.416 1.00 0.00 O ATOM 783 CB TYR A 56 -12.040 -6.352 -6.234 1.00 0.00 C ATOM 784 CG TYR A 56 -13.423 -5.794 -6.006 1.00 0.00 C ATOM 785 CD1 TYR A 56 -14.473 -6.622 -5.637 1.00 0.00 C ATOM 786 CD2 TYR A 56 -13.679 -4.440 -6.171 1.00 0.00 C ATOM 787 CE1 TYR A 56 -15.741 -6.117 -5.436 1.00 0.00 C ATOM 788 CE2 TYR A 56 -14.944 -3.925 -5.973 1.00 0.00 C ATOM 789 CZ TYR A 56 -15.973 -4.767 -5.605 1.00 0.00 C ATOM 790 OH TYR A 56 -17.237 -4.260 -5.408 1.00 0.00 O ATOM 0 H TYR A 56 -12.761 -7.213 -3.583 1.00 0.00 H new ATOM 0 HA TYR A 56 -10.318 -7.124 -5.207 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -11.462 -5.634 -6.816 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -12.120 -7.258 -6.835 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -14.295 -7.679 -5.505 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -12.875 -3.779 -6.459 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -16.548 -6.775 -5.148 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -15.127 -2.869 -6.105 1.00 0.00 H new ATOM 0 HH TYR A 56 -17.230 -3.293 -5.566 1.00 0.00 H new ATOM 800 N PHE A 57 -9.841 -4.833 -4.362 1.00 0.00 N ATOM 801 CA PHE A 57 -9.480 -3.603 -3.680 1.00 0.00 C ATOM 802 C PHE A 57 -8.942 -2.586 -4.673 1.00 0.00 C ATOM 803 O PHE A 57 -8.062 -2.892 -5.478 1.00 0.00 O ATOM 804 CB PHE A 57 -8.458 -3.873 -2.576 1.00 0.00 C ATOM 805 CG PHE A 57 -7.257 -4.655 -3.024 1.00 0.00 C ATOM 806 CD1 PHE A 57 -6.260 -4.056 -3.776 1.00 0.00 C ATOM 807 CD2 PHE A 57 -7.120 -5.990 -2.679 1.00 0.00 C ATOM 808 CE1 PHE A 57 -5.151 -4.773 -4.176 1.00 0.00 C ATOM 809 CE2 PHE A 57 -6.014 -6.711 -3.077 1.00 0.00 C ATOM 810 CZ PHE A 57 -5.026 -6.102 -3.825 1.00 0.00 C ATOM 0 H PHE A 57 -9.120 -5.202 -4.982 1.00 0.00 H new ATOM 0 HA PHE A 57 -10.377 -3.192 -3.216 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -8.124 -2.920 -2.165 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.949 -4.414 -1.767 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.352 -3.016 -4.052 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -7.888 -6.471 -2.092 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.381 -4.295 -4.763 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -5.921 -7.752 -2.804 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.157 -6.664 -4.135 1.00 0.00 H new ATOM 820 N LYS A 58 -9.487 -1.379 -4.621 1.00 0.00 N ATOM 821 CA LYS A 58 -9.071 -0.321 -5.527 1.00 0.00 C ATOM 822 C LYS A 58 -8.091 0.625 -4.848 1.00 0.00 C ATOM 823 O LYS A 58 -8.360 1.148 -3.769 1.00 0.00 O ATOM 824 CB LYS A 58 -10.287 0.455 -6.030 1.00 0.00 C ATOM 825 CG LYS A 58 -11.229 -0.374 -6.891 1.00 0.00 C ATOM 826 CD LYS A 58 -12.644 -0.363 -6.337 1.00 0.00 C ATOM 827 CE LYS A 58 -13.679 -0.410 -7.450 1.00 0.00 C ATOM 828 NZ LYS A 58 -15.058 -0.181 -6.938 1.00 0.00 N ATOM 0 H LYS A 58 -10.217 -1.109 -3.962 1.00 0.00 H new ATOM 0 HA LYS A 58 -8.568 -0.782 -6.377 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.839 0.843 -5.174 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -9.945 1.315 -6.606 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.232 0.017 -7.909 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -10.866 -1.400 -6.945 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -12.783 -1.217 -5.674 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.794 0.535 -5.737 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.440 0.345 -8.199 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -13.633 -1.379 -7.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.738 -0.272 -7.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.277 -0.885 -6.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.123 0.774 -6.531 1.00 0.00 H new ATOM 842 N VAL A 59 -6.956 0.842 -5.494 1.00 0.00 N ATOM 843 CA VAL A 59 -5.931 1.727 -4.965 1.00 0.00 C ATOM 844 C VAL A 59 -6.174 3.156 -5.437 1.00 0.00 C ATOM 845 O VAL A 59 -6.227 3.425 -6.638 1.00 0.00 O ATOM 846 CB VAL A 59 -4.525 1.263 -5.403 1.00 0.00 C ATOM 847 CG1 VAL A 59 -3.469 2.296 -5.036 1.00 0.00 C ATOM 848 CG2 VAL A 59 -4.195 -0.087 -4.782 1.00 0.00 C ATOM 0 H VAL A 59 -6.721 0.415 -6.390 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.984 1.695 -3.877 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.525 1.156 -6.488 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.488 1.943 -5.356 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.695 3.240 -5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -3.466 2.446 -3.956 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.201 -0.401 -5.100 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.219 -0.003 -3.695 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -4.929 -0.825 -5.105 1.00 0.00 H new ATOM 858 N CYS A 60 -6.337 4.067 -4.483 1.00 0.00 N ATOM 859 CA CYS A 60 -6.593 5.466 -4.801 1.00 0.00 C ATOM 860 C CYS A 60 -5.359 6.324 -4.550 1.00 0.00 C ATOM 861 O CYS A 60 -4.417 5.898 -3.881 1.00 0.00 O ATOM 862 CB CYS A 60 -7.765 5.991 -3.967 1.00 0.00 C ATOM 863 SG CYS A 60 -9.366 5.899 -4.800 1.00 0.00 S ATOM 0 H CYS A 60 -6.296 3.861 -3.485 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.844 5.528 -5.860 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.818 5.424 -3.038 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.568 7.028 -3.696 1.00 0.00 H new ATOM 0 HG CYS A 60 -10.281 5.549 -3.945 1.00 0.00 H new ATOM 869 N ARG A 61 -5.375 7.539 -5.086 1.00 0.00 N ATOM 870 CA ARG A 61 -4.264 8.464 -4.915 1.00 0.00 C ATOM 871 C ARG A 61 -4.339 9.143 -3.550 1.00 0.00 C ATOM 872 O ARG A 61 -5.412 9.238 -2.954 1.00 0.00 O ATOM 873 CB ARG A 61 -4.273 9.519 -6.023 1.00 0.00 C ATOM 874 CG ARG A 61 -4.135 8.936 -7.420 1.00 0.00 C ATOM 875 CD ARG A 61 -2.700 9.011 -7.919 1.00 0.00 C ATOM 876 NE ARG A 61 -2.596 9.733 -9.184 1.00 0.00 N ATOM 877 CZ ARG A 61 -2.596 11.061 -9.282 1.00 0.00 C ATOM 878 NH1 ARG A 61 -2.696 11.814 -8.194 1.00 0.00 N ATOM 879 NH2 ARG A 61 -2.493 11.637 -10.472 1.00 0.00 N ATOM 0 H ARG A 61 -6.147 7.906 -5.643 1.00 0.00 H new ATOM 0 HA ARG A 61 -3.335 7.897 -4.975 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.202 10.086 -5.965 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.459 10.222 -5.850 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.465 7.897 -7.416 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.788 9.475 -8.106 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -2.081 9.503 -7.169 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.307 8.002 -8.044 1.00 0.00 H new ATOM 0 HE ARG A 61 -2.519 9.188 -10.043 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -2.773 11.376 -7.276 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -2.695 12.831 -8.276 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -2.414 11.063 -11.311 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -2.493 12.654 -10.548 1.00 0.00 H new ATOM 893 N ASP A 62 -3.198 9.615 -3.061 1.00 0.00 N ATOM 894 CA ASP A 62 -3.143 10.285 -1.766 1.00 0.00 C ATOM 895 C ASP A 62 -3.508 11.761 -1.904 1.00 0.00 C ATOM 896 O ASP A 62 -2.666 12.640 -1.715 1.00 0.00 O ATOM 897 CB ASP A 62 -1.746 10.146 -1.157 1.00 0.00 C ATOM 898 CG ASP A 62 -0.663 10.708 -2.057 1.00 0.00 C ATOM 899 OD1 ASP A 62 -0.662 10.378 -3.261 1.00 0.00 O ATOM 900 OD2 ASP A 62 0.184 11.477 -1.557 1.00 0.00 O ATOM 0 H ASP A 62 -2.300 9.547 -3.540 1.00 0.00 H new ATOM 0 HA ASP A 62 -3.868 9.810 -1.105 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -1.719 10.660 -0.196 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -1.541 9.093 -0.961 1.00 0.00 H new ATOM 905 N ASN A 63 -4.768 12.028 -2.235 1.00 0.00 N ATOM 906 CA ASN A 63 -5.238 13.401 -2.398 1.00 0.00 C ATOM 907 C ASN A 63 -6.656 13.566 -1.854 1.00 0.00 C ATOM 908 O ASN A 63 -6.947 14.522 -1.136 1.00 0.00 O ATOM 909 CB ASN A 63 -5.184 13.812 -3.873 1.00 0.00 C ATOM 910 CG ASN A 63 -6.262 13.150 -4.713 1.00 0.00 C ATOM 911 OD1 ASN A 63 -6.199 11.828 -4.827 1.00 0.00 O flip ATOM 912 ND2 ASN A 63 -7.142 13.820 -5.254 1.00 0.00 N flip ATOM 0 H ASN A 63 -5.480 11.315 -2.395 1.00 0.00 H new ATOM 0 HA ASN A 63 -4.578 14.053 -1.826 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -5.287 14.895 -3.947 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -4.206 13.557 -4.280 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -7.154 14.834 -5.141 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -7.859 13.361 -5.816 1.00 0.00 H new ATOM 919 N SER A 64 -7.534 12.631 -2.203 1.00 0.00 N ATOM 920 CA SER A 64 -8.919 12.676 -1.750 1.00 0.00 C ATOM 921 C SER A 64 -9.142 11.708 -0.592 1.00 0.00 C ATOM 922 O SER A 64 -9.876 10.728 -0.721 1.00 0.00 O ATOM 923 CB SER A 64 -9.866 12.342 -2.904 1.00 0.00 C ATOM 924 OG SER A 64 -10.087 13.474 -3.728 1.00 0.00 O ATOM 0 H SER A 64 -7.311 11.833 -2.798 1.00 0.00 H new ATOM 0 HA SER A 64 -9.130 13.686 -1.400 1.00 0.00 H new ATOM 0 HB2 SER A 64 -9.446 11.531 -3.500 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.817 11.987 -2.507 1.00 0.00 H new ATOM 0 HG SER A 64 -11.032 13.513 -3.983 1.00 0.00 H new ATOM 930 N ILE A 65 -8.501 11.989 0.535 1.00 0.00 N ATOM 931 CA ILE A 65 -8.625 11.145 1.717 1.00 0.00 C ATOM 932 C ILE A 65 -8.667 11.985 2.989 1.00 0.00 C ATOM 933 O ILE A 65 -8.352 13.175 2.967 1.00 0.00 O ATOM 934 CB ILE A 65 -7.459 10.141 1.811 1.00 0.00 C ATOM 935 CG1 ILE A 65 -6.120 10.865 1.646 1.00 0.00 C ATOM 936 CG2 ILE A 65 -7.613 9.049 0.760 1.00 0.00 C ATOM 937 CD1 ILE A 65 -4.967 10.165 2.332 1.00 0.00 C ATOM 0 H ILE A 65 -7.889 12.796 0.656 1.00 0.00 H new ATOM 0 HA ILE A 65 -9.561 10.595 1.620 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.479 9.674 2.796 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.896 10.961 0.584 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.211 11.875 2.045 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.782 8.348 0.839 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -8.552 8.519 0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -7.616 9.498 -0.233 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.050 10.733 2.174 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.169 10.093 3.401 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.850 9.164 1.916 1.00 0.00 H new ATOM 949 N LEU A 66 -9.057 11.361 4.095 1.00 0.00 N ATOM 950 CA LEU A 66 -9.140 12.056 5.374 1.00 0.00 C ATOM 951 C LEU A 66 -8.004 11.628 6.301 1.00 0.00 C ATOM 952 O LEU A 66 -8.213 10.854 7.235 1.00 0.00 O ATOM 953 CB LEU A 66 -10.491 11.785 6.040 1.00 0.00 C ATOM 954 CG LEU A 66 -10.696 12.474 7.394 1.00 0.00 C ATOM 955 CD1 LEU A 66 -12.058 13.151 7.449 1.00 0.00 C ATOM 956 CD2 LEU A 66 -10.546 11.475 8.534 1.00 0.00 C ATOM 0 H LEU A 66 -9.320 10.376 4.132 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.046 13.125 5.185 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.283 12.105 5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.603 10.709 6.176 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.928 13.239 7.508 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.185 13.634 8.418 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.125 13.899 6.659 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.841 12.405 7.310 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.695 11.984 9.486 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.288 10.684 8.425 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.547 11.040 8.508 1.00 0.00 H new ATOM 968 N PRO A 67 -6.780 12.129 6.053 1.00 0.00 N ATOM 969 CA PRO A 67 -5.607 11.794 6.868 1.00 0.00 C ATOM 970 C PRO A 67 -5.654 12.443 8.251 1.00 0.00 C ATOM 971 O PRO A 67 -5.506 13.658 8.377 1.00 0.00 O ATOM 972 CB PRO A 67 -4.442 12.360 6.056 1.00 0.00 C ATOM 973 CG PRO A 67 -5.036 13.480 5.277 1.00 0.00 C ATOM 974 CD PRO A 67 -6.444 13.059 4.957 1.00 0.00 C ATOM 0 HA PRO A 67 -5.536 10.723 7.058 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -3.640 12.711 6.705 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.013 11.604 5.399 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -5.026 14.405 5.854 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -4.468 13.667 4.366 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -7.122 13.912 4.931 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.507 12.572 3.984 1.00 0.00 H new ATOM 982 N PRO A 68 -5.856 11.640 9.312 1.00 0.00 N ATOM 983 CA PRO A 68 -5.916 12.147 10.687 1.00 0.00 C ATOM 984 C PRO A 68 -4.566 12.673 11.167 1.00 0.00 C ATOM 985 O PRO A 68 -4.494 13.437 12.130 1.00 0.00 O ATOM 986 CB PRO A 68 -6.338 10.924 11.517 1.00 0.00 C ATOM 987 CG PRO A 68 -6.806 9.911 10.526 1.00 0.00 C ATOM 988 CD PRO A 68 -6.041 10.183 9.265 1.00 0.00 C ATOM 0 HA PRO A 68 -6.603 12.988 10.775 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.503 10.542 12.104 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -7.131 11.181 12.219 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.620 8.899 10.885 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.879 9.997 10.357 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.088 9.654 9.246 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.595 9.873 8.379 1.00 0.00 H new ATOM 996 N LEU A 69 -3.499 12.256 10.491 1.00 0.00 N ATOM 997 CA LEU A 69 -2.150 12.682 10.850 1.00 0.00 C ATOM 998 C LEU A 69 -2.023 14.201 10.800 1.00 0.00 C ATOM 999 O LEU A 69 -2.972 14.901 10.444 1.00 0.00 O ATOM 1000 CB LEU A 69 -1.126 12.043 9.909 1.00 0.00 C ATOM 1001 CG LEU A 69 -1.497 12.088 8.423 1.00 0.00 C ATOM 1002 CD1 LEU A 69 -0.554 13.007 7.661 1.00 0.00 C ATOM 1003 CD2 LEU A 69 -1.477 10.690 7.823 1.00 0.00 C ATOM 0 H LEU A 69 -3.543 11.624 9.692 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.954 12.355 11.871 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.168 12.545 10.044 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.985 11.003 10.202 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.508 12.486 8.337 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.835 13.025 6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.618 14.015 8.071 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.468 12.641 7.758 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.743 10.743 6.767 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.479 10.265 7.924 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.195 10.059 8.347 1.00 0.00 H new ATOM 1015 N ASP A 70 -0.847 14.703 11.160 1.00 0.00 N ATOM 1016 CA ASP A 70 -0.595 16.139 11.158 1.00 0.00 C ATOM 1017 C ASP A 70 0.568 16.487 10.233 1.00 0.00 C ATOM 1018 O ASP A 70 1.730 16.235 10.556 1.00 0.00 O ATOM 1019 CB ASP A 70 -0.296 16.628 12.576 1.00 0.00 C ATOM 1020 CG ASP A 70 -1.323 16.147 13.582 1.00 0.00 C ATOM 1021 OD1 ASP A 70 -1.502 14.917 13.705 1.00 0.00 O ATOM 1022 OD2 ASP A 70 -1.947 17.001 14.247 1.00 0.00 O ATOM 0 H ASP A 70 -0.053 14.136 11.457 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.491 16.638 10.790 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.693 16.281 12.876 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.267 17.718 12.583 1.00 0.00 H new ATOM 1027 N LYS A 71 0.249 17.070 9.083 1.00 0.00 N ATOM 1028 CA LYS A 71 1.264 17.456 8.110 1.00 0.00 C ATOM 1029 C LYS A 71 2.121 18.600 8.644 1.00 0.00 C ATOM 1030 O LYS A 71 3.292 18.730 8.287 1.00 0.00 O ATOM 1031 CB LYS A 71 0.606 17.869 6.792 1.00 0.00 C ATOM 1032 CG LYS A 71 -0.504 16.931 6.346 1.00 0.00 C ATOM 1033 CD LYS A 71 -0.772 17.054 4.855 1.00 0.00 C ATOM 1034 CE LYS A 71 -1.091 15.706 4.232 1.00 0.00 C ATOM 1035 NZ LYS A 71 -1.903 15.845 2.992 1.00 0.00 N ATOM 0 H LYS A 71 -0.707 17.286 8.801 1.00 0.00 H new ATOM 0 HA LYS A 71 1.908 16.595 7.932 1.00 0.00 H new ATOM 0 HB2 LYS A 71 0.200 18.875 6.898 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.368 17.913 6.014 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.231 15.903 6.584 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -1.416 17.155 6.900 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -1.604 17.738 4.689 1.00 0.00 H new ATOM 0 HD3 LYS A 71 0.099 17.486 4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -0.162 15.184 4.001 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -1.631 15.092 4.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.099 14.903 2.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -2.801 16.320 3.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -1.377 16.409 2.294 1.00 0.00 H new ATOM 1049 N GLU A 72 1.528 19.426 9.501 1.00 0.00 N ATOM 1050 CA GLU A 72 2.237 20.561 10.086 1.00 0.00 C ATOM 1051 C GLU A 72 3.506 20.103 10.798 1.00 0.00 C ATOM 1052 O GLU A 72 4.522 20.799 10.787 1.00 0.00 O ATOM 1053 CB GLU A 72 1.328 21.309 11.065 1.00 0.00 C ATOM 1054 CG GLU A 72 0.523 20.391 11.971 1.00 0.00 C ATOM 1055 CD GLU A 72 0.290 20.988 13.345 1.00 0.00 C ATOM 1056 OE1 GLU A 72 -0.222 22.125 13.419 1.00 0.00 O ATOM 1057 OE2 GLU A 72 0.618 20.319 14.347 1.00 0.00 O ATOM 0 H GLU A 72 0.559 19.331 9.806 1.00 0.00 H new ATOM 0 HA GLU A 72 2.520 21.235 9.278 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.938 21.970 11.681 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.642 21.941 10.501 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.438 20.177 11.504 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.045 19.440 12.076 1.00 0.00 H new ATOM 1064 N LYS A 73 3.443 18.924 11.409 1.00 0.00 N ATOM 1065 CA LYS A 73 4.589 18.370 12.120 1.00 0.00 C ATOM 1066 C LYS A 73 5.524 17.644 11.159 1.00 0.00 C ATOM 1067 O LYS A 73 6.720 17.515 11.418 1.00 0.00 O ATOM 1068 CB LYS A 73 4.122 17.405 13.213 1.00 0.00 C ATOM 1069 CG LYS A 73 2.967 17.937 14.045 1.00 0.00 C ATOM 1070 CD LYS A 73 2.687 17.038 15.239 1.00 0.00 C ATOM 1071 CE LYS A 73 1.267 17.220 15.751 1.00 0.00 C ATOM 1072 NZ LYS A 73 1.106 16.701 17.137 1.00 0.00 N ATOM 0 H LYS A 73 2.611 18.334 11.426 1.00 0.00 H new ATOM 0 HA LYS A 73 5.132 19.196 12.579 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.822 16.464 12.751 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.961 17.183 13.872 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.199 18.944 14.392 1.00 0.00 H new ATOM 0 HG3 LYS A 73 2.073 18.011 13.425 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.843 15.997 14.957 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.395 17.261 16.038 1.00 0.00 H new ATOM 0 HE2 LYS A 73 1.005 18.278 15.727 1.00 0.00 H new ATOM 0 HE3 LYS A 73 0.573 16.704 15.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 0.124 16.844 17.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 1.331 15.686 17.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 1.750 17.210 17.775 1.00 0.00 H new ATOM 1086 N GLY A 74 4.968 17.168 10.049 1.00 0.00 N ATOM 1087 CA GLY A 74 5.763 16.457 9.065 1.00 0.00 C ATOM 1088 C GLY A 74 5.159 15.117 8.683 1.00 0.00 C ATOM 1089 O GLY A 74 5.702 14.406 7.836 1.00 0.00 O ATOM 0 H GLY A 74 3.980 17.262 9.814 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.865 17.073 8.172 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.767 16.300 9.460 1.00 0.00 H new ATOM 1093 N GLU A 75 4.035 14.768 9.305 1.00 0.00 N ATOM 1094 CA GLU A 75 3.366 13.504 9.020 1.00 0.00 C ATOM 1095 C GLU A 75 2.861 13.470 7.582 1.00 0.00 C ATOM 1096 O GLU A 75 2.728 14.510 6.939 1.00 0.00 O ATOM 1097 CB GLU A 75 2.198 13.289 9.986 1.00 0.00 C ATOM 1098 CG GLU A 75 2.583 13.440 11.449 1.00 0.00 C ATOM 1099 CD GLU A 75 1.708 12.614 12.371 1.00 0.00 C ATOM 1100 OE1 GLU A 75 1.128 11.613 11.898 1.00 0.00 O ATOM 1101 OE2 GLU A 75 1.601 12.967 13.564 1.00 0.00 O ATOM 0 H GLU A 75 3.570 15.343 10.008 1.00 0.00 H new ATOM 0 HA GLU A 75 4.091 12.701 9.153 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.407 14.002 9.751 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.786 12.292 9.828 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.624 13.143 11.579 1.00 0.00 H new ATOM 0 HG3 GLU A 75 2.513 14.490 11.733 1.00 0.00 H new ATOM 1108 N THR A 76 2.578 12.269 7.083 1.00 0.00 N ATOM 1109 CA THR A 76 2.084 12.114 5.715 1.00 0.00 C ATOM 1110 C THR A 76 1.781 10.653 5.387 1.00 0.00 C ATOM 1111 O THR A 76 1.976 9.763 6.215 1.00 0.00 O ATOM 1112 CB THR A 76 3.106 12.666 4.718 1.00 0.00 C ATOM 1113 OG1 THR A 76 2.570 12.680 3.406 1.00 0.00 O ATOM 1114 CG2 THR A 76 4.395 11.872 4.676 1.00 0.00 C ATOM 0 H THR A 76 2.681 11.395 7.599 1.00 0.00 H new ATOM 0 HA THR A 76 1.155 12.678 5.635 1.00 0.00 H new ATOM 0 HB THR A 76 3.330 13.674 5.066 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.237 13.038 2.784 1.00 0.00 H new ATOM 0 HG21 THR A 76 5.074 12.318 3.949 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.861 11.882 5.661 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.179 10.843 4.387 1.00 0.00 H new ATOM 1122 N LEU A 77 1.309 10.421 4.164 1.00 0.00 N ATOM 1123 CA LEU A 77 0.978 9.076 3.703 1.00 0.00 C ATOM 1124 C LEU A 77 2.028 8.578 2.713 1.00 0.00 C ATOM 1125 O LEU A 77 2.112 9.067 1.585 1.00 0.00 O ATOM 1126 CB LEU A 77 -0.407 9.070 3.048 1.00 0.00 C ATOM 1127 CG LEU A 77 -1.336 7.939 3.496 1.00 0.00 C ATOM 1128 CD1 LEU A 77 -2.749 8.459 3.711 1.00 0.00 C ATOM 1129 CD2 LEU A 77 -1.334 6.815 2.473 1.00 0.00 C ATOM 0 H LEU A 77 1.147 11.152 3.472 1.00 0.00 H new ATOM 0 HA LEU A 77 0.966 8.407 4.563 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.894 10.023 3.257 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.280 9.007 1.967 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.967 7.547 4.444 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.394 7.640 4.029 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.739 9.232 4.479 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.128 8.878 2.779 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.999 6.019 2.806 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.678 7.197 1.512 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.323 6.422 2.366 1.00 0.00 H new ATOM 1141 N LEU A 78 2.837 7.614 3.143 1.00 0.00 N ATOM 1142 CA LEU A 78 3.890 7.064 2.294 1.00 0.00 C ATOM 1143 C LEU A 78 3.464 5.753 1.630 1.00 0.00 C ATOM 1144 O LEU A 78 4.303 5.010 1.123 1.00 0.00 O ATOM 1145 CB LEU A 78 5.161 6.832 3.115 1.00 0.00 C ATOM 1146 CG LEU A 78 5.530 7.966 4.072 1.00 0.00 C ATOM 1147 CD1 LEU A 78 6.360 7.433 5.231 1.00 0.00 C ATOM 1148 CD2 LEU A 78 6.284 9.062 3.335 1.00 0.00 C ATOM 0 H LEU A 78 2.784 7.198 4.073 1.00 0.00 H new ATOM 0 HA LEU A 78 4.085 7.792 1.506 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.040 5.915 3.692 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.993 6.670 2.430 1.00 0.00 H new ATOM 0 HG LEU A 78 4.611 8.393 4.473 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.615 8.252 5.903 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.786 6.683 5.775 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.275 6.982 4.846 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.538 9.861 4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.197 8.650 2.906 1.00 0.00 H new ATOM 0 HD23 LEU A 78 5.657 9.462 2.538 1.00 0.00 H new ATOM 1160 N SER A 79 2.164 5.471 1.630 1.00 0.00 N ATOM 1161 CA SER A 79 1.653 4.247 1.017 1.00 0.00 C ATOM 1162 C SER A 79 0.435 4.539 0.146 1.00 0.00 C ATOM 1163 O SER A 79 -0.253 5.539 0.342 1.00 0.00 O ATOM 1164 CB SER A 79 1.286 3.220 2.084 1.00 0.00 C ATOM 1165 OG SER A 79 2.448 2.638 2.651 1.00 0.00 O ATOM 0 H SER A 79 1.449 6.069 2.044 1.00 0.00 H new ATOM 0 HA SER A 79 2.444 3.838 0.388 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.696 3.698 2.866 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.662 2.441 1.645 1.00 0.00 H new ATOM 0 HG SER A 79 2.240 1.734 2.967 1.00 0.00 H new ATOM 1171 N PRO A 80 0.146 3.661 -0.828 1.00 0.00 N ATOM 1172 CA PRO A 80 -1.003 3.827 -1.722 1.00 0.00 C ATOM 1173 C PRO A 80 -2.316 3.469 -1.036 1.00 0.00 C ATOM 1174 O PRO A 80 -2.465 2.372 -0.499 1.00 0.00 O ATOM 1175 CB PRO A 80 -0.704 2.847 -2.853 1.00 0.00 C ATOM 1176 CG PRO A 80 0.101 1.769 -2.213 1.00 0.00 C ATOM 1177 CD PRO A 80 0.910 2.435 -1.131 1.00 0.00 C ATOM 0 HA PRO A 80 -1.126 4.858 -2.054 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -1.622 2.451 -3.288 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -0.151 3.329 -3.659 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.545 0.996 -1.796 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.750 1.283 -2.941 1.00 0.00 H new ATOM 0 HD2 PRO A 80 1.007 1.796 -0.253 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.920 2.666 -1.471 1.00 0.00 H new ATOM 1185 N LEU A 81 -3.267 4.398 -1.055 1.00 0.00 N ATOM 1186 CA LEU A 81 -4.563 4.167 -0.431 1.00 0.00 C ATOM 1187 C LEU A 81 -5.252 2.962 -1.062 1.00 0.00 C ATOM 1188 O LEU A 81 -4.832 2.478 -2.112 1.00 0.00 O ATOM 1189 CB LEU A 81 -5.444 5.414 -0.547 1.00 0.00 C ATOM 1190 CG LEU A 81 -5.202 6.479 0.529 1.00 0.00 C ATOM 1191 CD1 LEU A 81 -5.265 5.865 1.920 1.00 0.00 C ATOM 1192 CD2 LEU A 81 -3.863 7.165 0.305 1.00 0.00 C ATOM 0 H LEU A 81 -3.164 5.313 -1.494 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.404 3.957 0.627 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.283 5.865 -1.526 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.489 5.108 -0.505 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.990 7.228 0.454 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.090 6.639 2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.249 5.423 2.078 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.501 5.093 2.012 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.706 7.918 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.063 6.426 0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.859 7.643 -0.674 1.00 0.00 H new ATOM 1204 N VAL A 82 -6.300 2.469 -0.410 1.00 0.00 N ATOM 1205 CA VAL A 82 -7.024 1.307 -0.909 1.00 0.00 C ATOM 1206 C VAL A 82 -8.463 1.284 -0.398 1.00 0.00 C ATOM 1207 O VAL A 82 -8.723 1.543 0.776 1.00 0.00 O ATOM 1208 CB VAL A 82 -6.316 0.001 -0.496 1.00 0.00 C ATOM 1209 CG1 VAL A 82 -7.116 -1.212 -0.934 1.00 0.00 C ATOM 1210 CG2 VAL A 82 -4.911 -0.045 -1.074 1.00 0.00 C ATOM 0 H VAL A 82 -6.665 2.854 0.461 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.040 1.381 -1.996 1.00 0.00 H new ATOM 0 HB VAL A 82 -6.244 -0.019 0.591 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -6.595 -2.120 -0.631 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.101 -1.186 -0.468 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.227 -1.202 -2.018 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -4.424 -0.973 -0.774 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -4.963 0.002 -2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.336 0.803 -0.702 1.00 0.00 H new ATOM 1220 N MET A 83 -9.392 0.961 -1.291 1.00 0.00 N ATOM 1221 CA MET A 83 -10.805 0.892 -0.936 1.00 0.00 C ATOM 1222 C MET A 83 -11.326 -0.533 -1.072 1.00 0.00 C ATOM 1223 O MET A 83 -11.377 -1.084 -2.171 1.00 0.00 O ATOM 1224 CB MET A 83 -11.621 1.841 -1.816 1.00 0.00 C ATOM 1225 CG MET A 83 -12.030 3.123 -1.109 1.00 0.00 C ATOM 1226 SD MET A 83 -13.726 3.614 -1.478 1.00 0.00 S ATOM 1227 CE MET A 83 -14.028 4.794 -0.166 1.00 0.00 C ATOM 0 H MET A 83 -9.192 0.743 -2.267 1.00 0.00 H new ATOM 0 HA MET A 83 -10.912 1.199 0.104 1.00 0.00 H new ATOM 0 HB2 MET A 83 -11.038 2.094 -2.702 1.00 0.00 H new ATOM 0 HB3 MET A 83 -12.517 1.324 -2.161 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.921 2.990 -0.033 1.00 0.00 H new ATOM 0 HG3 MET A 83 -11.353 3.926 -1.401 1.00 0.00 H new ATOM 0 HE1 MET A 83 -15.097 4.841 0.042 1.00 0.00 H new ATOM 0 HE2 MET A 83 -13.497 4.482 0.733 1.00 0.00 H new ATOM 0 HE3 MET A 83 -13.674 5.778 -0.473 1.00 0.00 H new ATOM 1237 N CYS A 84 -11.710 -1.125 0.054 1.00 0.00 N ATOM 1238 CA CYS A 84 -12.227 -2.492 0.065 1.00 0.00 C ATOM 1239 C CYS A 84 -13.331 -2.674 -0.974 1.00 0.00 C ATOM 1240 O CYS A 84 -14.150 -1.780 -1.188 1.00 0.00 O ATOM 1241 CB CYS A 84 -12.756 -2.849 1.456 1.00 0.00 C ATOM 1242 SG CYS A 84 -14.227 -1.919 1.949 1.00 0.00 S ATOM 0 H CYS A 84 -11.674 -0.681 0.972 1.00 0.00 H new ATOM 0 HA CYS A 84 -11.405 -3.162 -0.189 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -12.987 -3.914 1.483 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -11.967 -2.675 2.188 1.00 0.00 H new ATOM 0 HG CYS A 84 -14.826 -1.461 0.890 1.00 0.00 H new ATOM 1248 N GLY A 85 -13.344 -3.838 -1.618 1.00 0.00 N ATOM 1249 CA GLY A 85 -14.350 -4.116 -2.627 1.00 0.00 C ATOM 1250 C GLY A 85 -15.721 -4.352 -2.028 1.00 0.00 C ATOM 1251 O GLY A 85 -16.557 -3.448 -2.014 1.00 0.00 O ATOM 0 H GLY A 85 -12.676 -4.593 -1.459 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.401 -3.280 -3.325 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -14.052 -4.993 -3.201 1.00 0.00 H new ATOM 1255 N PRO A 86 -15.988 -5.567 -1.518 1.00 0.00 N ATOM 1256 CA PRO A 86 -17.279 -5.898 -0.915 1.00 0.00 C ATOM 1257 C PRO A 86 -17.493 -5.189 0.415 1.00 0.00 C ATOM 1258 O PRO A 86 -16.614 -5.181 1.275 1.00 0.00 O ATOM 1259 CB PRO A 86 -17.204 -7.409 -0.707 1.00 0.00 C ATOM 1260 CG PRO A 86 -15.748 -7.711 -0.610 1.00 0.00 C ATOM 1261 CD PRO A 86 -15.053 -6.708 -1.488 1.00 0.00 C ATOM 0 HA PRO A 86 -18.112 -5.585 -1.544 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -17.731 -7.710 0.198 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -17.664 -7.945 -1.537 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -15.402 -7.632 0.421 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -15.539 -8.729 -0.940 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -14.084 -6.422 -1.080 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -14.873 -7.106 -2.487 1.00 0.00 H new ATOM 1269 N HIS A 87 -18.667 -4.594 0.575 1.00 0.00 N ATOM 1270 CA HIS A 87 -18.998 -3.880 1.803 1.00 0.00 C ATOM 1271 C HIS A 87 -19.690 -4.801 2.801 1.00 0.00 C ATOM 1272 O HIS A 87 -20.615 -5.534 2.451 1.00 0.00 O ATOM 1273 CB HIS A 87 -19.882 -2.666 1.502 1.00 0.00 C ATOM 1274 CG HIS A 87 -21.200 -3.006 0.871 1.00 0.00 C ATOM 1275 ND1 HIS A 87 -21.674 -4.172 0.369 1.00 0.00 N flip ATOM 1276 CD2 HIS A 87 -22.208 -2.080 0.698 1.00 0.00 C flip ATOM 1277 CE1 HIS A 87 -22.945 -3.930 -0.091 1.00 0.00 C flip ATOM 1278 NE2 HIS A 87 -23.244 -2.662 0.119 1.00 0.00 N flip ATOM 0 H HIS A 87 -19.406 -4.591 -0.128 1.00 0.00 H new ATOM 0 HA HIS A 87 -18.066 -3.531 2.248 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -20.065 -2.125 2.430 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -19.339 -1.990 0.841 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -21.179 -5.063 0.339 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -22.158 -1.041 0.990 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -23.595 -4.660 -0.551 1.00 0.00 H new ATOM 1287 N GLY A 88 -19.229 -4.762 4.044 1.00 0.00 N ATOM 1288 CA GLY A 88 -19.808 -5.600 5.074 1.00 0.00 C ATOM 1289 C GLY A 88 -19.471 -7.060 4.866 1.00 0.00 C ATOM 1290 O GLY A 88 -20.362 -7.907 4.789 1.00 0.00 O ATOM 0 H GLY A 88 -18.464 -4.164 4.357 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -19.445 -5.279 6.050 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -20.891 -5.474 5.079 1.00 0.00 H new ATOM 1294 N LEU A 89 -18.179 -7.356 4.770 1.00 0.00 N ATOM 1295 CA LEU A 89 -17.724 -8.722 4.565 1.00 0.00 C ATOM 1296 C LEU A 89 -17.127 -9.274 5.849 1.00 0.00 C ATOM 1297 O LEU A 89 -16.452 -8.559 6.580 1.00 0.00 O ATOM 1298 CB LEU A 89 -16.690 -8.766 3.438 1.00 0.00 C ATOM 1299 CG LEU A 89 -16.170 -10.157 3.079 1.00 0.00 C ATOM 1300 CD1 LEU A 89 -17.324 -11.097 2.765 1.00 0.00 C ATOM 1301 CD2 LEU A 89 -15.215 -10.072 1.899 1.00 0.00 C ATOM 0 H LEU A 89 -17.430 -6.666 4.831 1.00 0.00 H new ATOM 0 HA LEU A 89 -18.577 -9.340 4.284 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.131 -8.320 2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -15.842 -8.142 3.721 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.630 -10.557 3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.932 -12.082 2.512 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.975 -11.178 3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.893 -10.705 1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.851 -11.070 1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.736 -9.653 1.038 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.372 -9.432 2.159 1.00 0.00 H new ATOM 1313 N LYS A 90 -17.379 -10.544 6.127 1.00 0.00 N ATOM 1314 CA LYS A 90 -16.854 -11.161 7.336 1.00 0.00 C ATOM 1315 C LYS A 90 -16.341 -12.569 7.061 1.00 0.00 C ATOM 1316 O LYS A 90 -17.118 -13.515 6.940 1.00 0.00 O ATOM 1317 CB LYS A 90 -17.921 -11.190 8.428 1.00 0.00 C ATOM 1318 CG LYS A 90 -18.107 -9.850 9.120 1.00 0.00 C ATOM 1319 CD LYS A 90 -17.931 -9.965 10.627 1.00 0.00 C ATOM 1320 CE LYS A 90 -19.260 -10.208 11.327 1.00 0.00 C ATOM 1321 NZ LYS A 90 -19.760 -8.984 12.012 1.00 0.00 N ATOM 0 H LYS A 90 -17.938 -11.162 5.539 1.00 0.00 H new ATOM 0 HA LYS A 90 -16.014 -10.558 7.680 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -18.870 -11.501 7.991 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -17.651 -11.941 9.171 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -17.388 -9.133 8.723 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -19.101 -9.461 8.898 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -17.245 -10.781 10.853 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -17.477 -9.052 11.012 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -19.998 -10.543 10.598 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -19.145 -11.010 12.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -20.667 -9.192 12.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -19.068 -8.678 12.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -19.895 -8.226 11.313 1.00 0.00 H new ATOM 1335 N PHE A 91 -15.023 -12.693 6.972 1.00 0.00 N ATOM 1336 CA PHE A 91 -14.383 -13.979 6.719 1.00 0.00 C ATOM 1337 C PHE A 91 -14.359 -14.834 7.979 1.00 0.00 C ATOM 1338 O PHE A 91 -14.518 -14.328 9.091 1.00 0.00 O ATOM 1339 CB PHE A 91 -12.943 -13.775 6.237 1.00 0.00 C ATOM 1340 CG PHE A 91 -12.791 -12.750 5.151 1.00 0.00 C ATOM 1341 CD1 PHE A 91 -13.225 -13.023 3.866 1.00 0.00 C ATOM 1342 CD2 PHE A 91 -12.203 -11.521 5.412 1.00 0.00 C ATOM 1343 CE1 PHE A 91 -13.079 -12.090 2.858 1.00 0.00 C ATOM 1344 CE2 PHE A 91 -12.055 -10.584 4.408 1.00 0.00 C ATOM 1345 CZ PHE A 91 -12.493 -10.869 3.130 1.00 0.00 C ATOM 0 H PHE A 91 -14.372 -11.914 7.072 1.00 0.00 H new ATOM 0 HA PHE A 91 -14.963 -14.488 5.949 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -12.327 -13.480 7.087 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -12.555 -14.728 5.877 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -13.683 -13.977 3.649 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -11.858 -11.295 6.410 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -13.422 -12.315 1.859 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -11.597 -9.630 4.622 1.00 0.00 H new ATOM 0 HZ PHE A 91 -12.378 -10.138 2.344 1.00 0.00 H new ATOM 1355 N LEU A 92 -14.127 -16.129 7.799 1.00 0.00 N ATOM 1356 CA LEU A 92 -14.042 -17.052 8.923 1.00 0.00 C ATOM 1357 C LEU A 92 -12.649 -16.976 9.545 1.00 0.00 C ATOM 1358 O LEU A 92 -12.457 -17.304 10.716 1.00 0.00 O ATOM 1359 CB LEU A 92 -14.339 -18.482 8.468 1.00 0.00 C ATOM 1360 CG LEU A 92 -15.488 -18.621 7.467 1.00 0.00 C ATOM 1361 CD1 LEU A 92 -15.583 -20.051 6.957 1.00 0.00 C ATOM 1362 CD2 LEU A 92 -16.802 -18.193 8.102 1.00 0.00 C ATOM 0 H LEU A 92 -13.995 -16.563 6.885 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.785 -16.769 9.669 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.436 -18.899 8.021 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -14.568 -19.086 9.346 1.00 0.00 H new ATOM 0 HG LEU A 92 -15.286 -17.967 6.619 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.406 -20.130 6.246 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -14.650 -20.324 6.464 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -15.761 -20.725 7.795 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -17.608 -18.298 7.376 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -17.009 -18.821 8.968 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -16.732 -17.152 8.418 1.00 0.00 H new ATOM 1374 N LYS A 93 -11.684 -16.525 8.745 1.00 0.00 N ATOM 1375 CA LYS A 93 -10.306 -16.381 9.190 1.00 0.00 C ATOM 1376 C LYS A 93 -9.713 -15.082 8.649 1.00 0.00 C ATOM 1377 O LYS A 93 -10.109 -14.607 7.585 1.00 0.00 O ATOM 1378 CB LYS A 93 -9.466 -17.573 8.726 1.00 0.00 C ATOM 1379 CG LYS A 93 -10.120 -18.918 8.994 1.00 0.00 C ATOM 1380 CD LYS A 93 -9.087 -19.982 9.333 1.00 0.00 C ATOM 1381 CE LYS A 93 -8.410 -20.524 8.084 1.00 0.00 C ATOM 1382 NZ LYS A 93 -6.968 -20.159 8.030 1.00 0.00 N ATOM 0 H LYS A 93 -11.838 -16.251 7.775 1.00 0.00 H new ATOM 0 HA LYS A 93 -10.295 -16.350 10.280 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -9.274 -17.478 7.657 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.499 -17.542 9.227 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.828 -18.822 9.817 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.689 -19.228 8.118 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -8.336 -19.561 10.001 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.569 -20.799 9.870 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -8.511 -21.609 8.059 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -8.916 -20.136 7.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.488 -20.745 7.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.873 -19.155 7.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -6.534 -20.322 8.961 1.00 0.00 H new ATOM 1396 N PRO A 94 -8.760 -14.485 9.379 1.00 0.00 N ATOM 1397 CA PRO A 94 -8.123 -13.230 8.968 1.00 0.00 C ATOM 1398 C PRO A 94 -7.264 -13.386 7.717 1.00 0.00 C ATOM 1399 O PRO A 94 -6.528 -14.361 7.572 1.00 0.00 O ATOM 1400 CB PRO A 94 -7.252 -12.858 10.169 1.00 0.00 C ATOM 1401 CG PRO A 94 -7.006 -14.146 10.878 1.00 0.00 C ATOM 1402 CD PRO A 94 -8.236 -14.980 10.663 1.00 0.00 C ATOM 0 HA PRO A 94 -8.862 -12.473 8.708 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -6.317 -12.397 9.851 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -7.757 -12.141 10.816 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -6.122 -14.646 10.483 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -6.829 -13.979 11.940 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -7.999 -16.043 10.618 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -8.957 -14.849 11.470 1.00 0.00 H new ATOM 1410 N VAL A 95 -7.362 -12.410 6.819 1.00 0.00 N ATOM 1411 CA VAL A 95 -6.593 -12.424 5.580 1.00 0.00 C ATOM 1412 C VAL A 95 -5.404 -11.473 5.672 1.00 0.00 C ATOM 1413 O VAL A 95 -5.542 -10.335 6.122 1.00 0.00 O ATOM 1414 CB VAL A 95 -7.465 -12.035 4.371 1.00 0.00 C ATOM 1415 CG1 VAL A 95 -8.562 -13.065 4.155 1.00 0.00 C ATOM 1416 CG2 VAL A 95 -8.056 -10.645 4.559 1.00 0.00 C ATOM 0 H VAL A 95 -7.969 -11.597 6.927 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.232 -13.442 5.436 1.00 0.00 H new ATOM 0 HB VAL A 95 -6.834 -12.015 3.482 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.169 -12.776 3.297 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.113 -14.041 3.969 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -9.191 -13.118 5.043 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.668 -10.390 3.694 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -8.673 -10.630 5.457 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -7.250 -9.918 4.660 1.00 0.00 H new ATOM 1426 N GLU A 96 -4.235 -11.949 5.257 1.00 0.00 N ATOM 1427 CA GLU A 96 -3.021 -11.141 5.308 1.00 0.00 C ATOM 1428 C GLU A 96 -2.924 -10.201 4.110 1.00 0.00 C ATOM 1429 O GLU A 96 -2.801 -10.645 2.971 1.00 0.00 O ATOM 1430 CB GLU A 96 -1.789 -12.047 5.357 1.00 0.00 C ATOM 1431 CG GLU A 96 -0.673 -11.510 6.239 1.00 0.00 C ATOM 1432 CD GLU A 96 0.164 -12.614 6.855 1.00 0.00 C ATOM 1433 OE1 GLU A 96 0.517 -13.567 6.129 1.00 0.00 O ATOM 1434 OE2 GLU A 96 0.465 -12.526 8.064 1.00 0.00 O ATOM 0 H GLU A 96 -4.102 -12.888 4.882 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.063 -10.533 6.212 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.086 -13.031 5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.408 -12.183 4.345 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.030 -10.858 5.648 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.104 -10.899 7.033 1.00 0.00 H new ATOM 1441 N LEU A 97 -2.962 -8.901 4.382 1.00 0.00 N ATOM 1442 CA LEU A 97 -2.860 -7.896 3.329 1.00 0.00 C ATOM 1443 C LEU A 97 -1.499 -7.213 3.390 1.00 0.00 C ATOM 1444 O LEU A 97 -1.074 -6.754 4.449 1.00 0.00 O ATOM 1445 CB LEU A 97 -3.978 -6.858 3.470 1.00 0.00 C ATOM 1446 CG LEU A 97 -3.907 -5.679 2.494 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -5.276 -5.036 2.344 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -2.888 -4.652 2.961 1.00 0.00 C ATOM 0 H LEU A 97 -3.063 -8.518 5.322 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.966 -8.390 2.363 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.936 -7.361 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.962 -6.467 4.487 1.00 0.00 H new ATOM 0 HG LEU A 97 -3.589 -6.057 1.522 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.211 -4.200 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.984 -5.772 1.962 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.617 -4.675 3.314 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.855 -3.824 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.173 -4.277 3.944 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.904 -5.117 3.022 1.00 0.00 H new ATOM 1460 N ARG A 98 -0.812 -7.157 2.254 1.00 0.00 N ATOM 1461 CA ARG A 98 0.508 -6.541 2.198 1.00 0.00 C ATOM 1462 C ARG A 98 0.540 -5.364 1.228 1.00 0.00 C ATOM 1463 O ARG A 98 0.166 -5.496 0.062 1.00 0.00 O ATOM 1464 CB ARG A 98 1.555 -7.579 1.792 1.00 0.00 C ATOM 1465 CG ARG A 98 1.461 -8.876 2.578 1.00 0.00 C ATOM 1466 CD ARG A 98 2.256 -9.988 1.914 1.00 0.00 C ATOM 1467 NE ARG A 98 2.373 -11.163 2.772 1.00 0.00 N ATOM 1468 CZ ARG A 98 3.150 -12.208 2.496 1.00 0.00 C ATOM 1469 NH1 ARG A 98 3.875 -12.229 1.384 1.00 0.00 N ATOM 1470 NH2 ARG A 98 3.201 -13.236 3.332 1.00 0.00 N ATOM 0 H ARG A 98 -1.145 -7.529 1.364 1.00 0.00 H new ATOM 0 HA ARG A 98 0.738 -6.161 3.193 1.00 0.00 H new ATOM 0 HB2 ARG A 98 1.444 -7.798 0.730 1.00 0.00 H new ATOM 0 HB3 ARG A 98 2.549 -7.153 1.928 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.832 -8.717 3.591 1.00 0.00 H new ATOM 0 HG3 ARG A 98 0.417 -9.176 2.664 1.00 0.00 H new ATOM 0 HD2 ARG A 98 1.774 -10.269 0.978 1.00 0.00 H new ATOM 0 HD3 ARG A 98 3.251 -9.622 1.663 1.00 0.00 H new ATOM 0 HE ARG A 98 1.827 -11.185 3.634 1.00 0.00 H new ATOM 0 HH11 ARG A 98 3.838 -11.442 0.736 1.00 0.00 H new ATOM 0 HH12 ARG A 98 4.469 -13.032 1.177 1.00 0.00 H new ATOM 0 HH21 ARG A 98 2.645 -13.226 4.187 1.00 0.00 H new ATOM 0 HH22 ARG A 98 3.796 -14.037 3.120 1.00 0.00 H new ATOM 1484 N LEU A 99 1.001 -4.216 1.717 1.00 0.00 N ATOM 1485 CA LEU A 99 1.098 -3.016 0.896 1.00 0.00 C ATOM 1486 C LEU A 99 2.558 -2.660 0.639 1.00 0.00 C ATOM 1487 O LEU A 99 3.422 -2.889 1.484 1.00 0.00 O ATOM 1488 CB LEU A 99 0.381 -1.842 1.568 1.00 0.00 C ATOM 1489 CG LEU A 99 -1.080 -2.101 1.947 1.00 0.00 C ATOM 1490 CD1 LEU A 99 -1.312 -1.814 3.423 1.00 0.00 C ATOM 1491 CD2 LEU A 99 -2.015 -1.258 1.088 1.00 0.00 C ATOM 0 H LEU A 99 1.314 -4.093 2.680 1.00 0.00 H new ATOM 0 HA LEU A 99 0.614 -3.219 -0.059 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.930 -1.569 2.469 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.419 -0.983 0.899 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.297 -3.153 1.763 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.356 -2.004 3.671 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.673 -2.460 4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.074 -0.771 3.633 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.048 -1.456 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.794 -0.201 1.238 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.873 -1.513 0.038 1.00 0.00 H new ATOM 1503 N PRO A 100 2.851 -2.096 -0.543 1.00 0.00 N ATOM 1504 CA PRO A 100 4.213 -1.710 -0.917 1.00 0.00 C ATOM 1505 C PRO A 100 4.708 -0.495 -0.142 1.00 0.00 C ATOM 1506 O PRO A 100 4.484 0.646 -0.546 1.00 0.00 O ATOM 1507 CB PRO A 100 4.092 -1.383 -2.405 1.00 0.00 C ATOM 1508 CG PRO A 100 2.670 -0.989 -2.597 1.00 0.00 C ATOM 1509 CD PRO A 100 1.876 -1.793 -1.606 1.00 0.00 C ATOM 0 HA PRO A 100 4.934 -2.497 -0.696 1.00 0.00 H new ATOM 0 HB2 PRO A 100 4.767 -0.575 -2.688 1.00 0.00 H new ATOM 0 HB3 PRO A 100 4.350 -2.245 -3.021 1.00 0.00 H new ATOM 0 HG2 PRO A 100 2.536 0.079 -2.428 1.00 0.00 H new ATOM 0 HG3 PRO A 100 2.343 -1.194 -3.616 1.00 0.00 H new ATOM 0 HD2 PRO A 100 1.026 -1.229 -1.221 1.00 0.00 H new ATOM 0 HD3 PRO A 100 1.478 -2.703 -2.055 1.00 0.00 H new ATOM 1517 N HIS A 101 5.386 -0.748 0.972 1.00 0.00 N ATOM 1518 CA HIS A 101 5.918 0.323 1.804 1.00 0.00 C ATOM 1519 C HIS A 101 7.439 0.237 1.880 1.00 0.00 C ATOM 1520 O HIS A 101 7.998 -0.817 2.179 1.00 0.00 O ATOM 1521 CB HIS A 101 5.314 0.255 3.209 1.00 0.00 C ATOM 1522 CG HIS A 101 5.842 1.300 4.143 1.00 0.00 C ATOM 1523 ND1 HIS A 101 5.617 2.650 3.969 1.00 0.00 N ATOM 1524 CD2 HIS A 101 6.588 1.189 5.269 1.00 0.00 C ATOM 1525 CE1 HIS A 101 6.202 3.322 4.944 1.00 0.00 C ATOM 1526 NE2 HIS A 101 6.797 2.459 5.746 1.00 0.00 N ATOM 0 H HIS A 101 5.580 -1.687 1.319 1.00 0.00 H new ATOM 0 HA HIS A 101 5.647 1.277 1.352 1.00 0.00 H new ATOM 0 HB2 HIS A 101 4.232 0.360 3.135 1.00 0.00 H new ATOM 0 HB3 HIS A 101 5.510 -0.730 3.632 1.00 0.00 H new ATOM 0 HD1 HIS A 101 5.082 3.065 3.206 1.00 0.00 H new ATOM 0 HD2 HIS A 101 6.951 0.272 5.709 1.00 0.00 H new ATOM 0 HE1 HIS A 101 6.195 4.395 5.065 1.00 0.00 H new ATOM 1535 N CYS A 102 8.103 1.354 1.603 1.00 0.00 N ATOM 1536 CA CYS A 102 9.559 1.404 1.638 1.00 0.00 C ATOM 1537 C CYS A 102 10.051 1.991 2.956 1.00 0.00 C ATOM 1538 O CYS A 102 9.262 2.487 3.762 1.00 0.00 O ATOM 1539 CB CYS A 102 10.089 2.232 0.467 1.00 0.00 C ATOM 1540 SG CYS A 102 9.338 1.822 -1.126 1.00 0.00 S ATOM 0 H CYS A 102 7.656 2.236 1.352 1.00 0.00 H new ATOM 0 HA CYS A 102 9.936 0.385 1.553 1.00 0.00 H new ATOM 0 HB2 CYS A 102 9.918 3.288 0.676 1.00 0.00 H new ATOM 0 HB3 CYS A 102 11.168 2.091 0.395 1.00 0.00 H new ATOM 0 HG CYS A 102 9.849 2.576 -2.053 1.00 0.00 H new ATOM 1546 N ASP A 103 11.360 1.932 3.169 1.00 0.00 N ATOM 1547 CA ASP A 103 11.965 2.455 4.388 1.00 0.00 C ATOM 1548 C ASP A 103 11.964 3.982 4.387 1.00 0.00 C ATOM 1549 O ASP A 103 11.784 4.610 3.343 1.00 0.00 O ATOM 1550 CB ASP A 103 13.395 1.934 4.535 1.00 0.00 C ATOM 1551 CG ASP A 103 13.467 0.666 5.364 1.00 0.00 C ATOM 1552 OD1 ASP A 103 12.782 0.599 6.406 1.00 0.00 O ATOM 1553 OD2 ASP A 103 14.206 -0.260 4.970 1.00 0.00 O ATOM 0 H ASP A 103 12.025 1.526 2.511 1.00 0.00 H new ATOM 0 HA ASP A 103 11.371 2.111 5.235 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.812 1.742 3.546 1.00 0.00 H new ATOM 0 HB3 ASP A 103 14.013 2.703 4.998 1.00 0.00 H new ATOM 1558 N PRO A 104 12.168 4.598 5.563 1.00 0.00 N ATOM 1559 CA PRO A 104 12.191 6.059 5.696 1.00 0.00 C ATOM 1560 C PRO A 104 13.423 6.687 5.046 1.00 0.00 C ATOM 1561 O PRO A 104 13.493 7.905 4.881 1.00 0.00 O ATOM 1562 CB PRO A 104 12.217 6.278 7.209 1.00 0.00 C ATOM 1563 CG PRO A 104 12.828 5.038 7.762 1.00 0.00 C ATOM 1564 CD PRO A 104 12.393 3.922 6.854 1.00 0.00 C ATOM 0 HA PRO A 104 11.341 6.524 5.197 1.00 0.00 H new ATOM 0 HB2 PRO A 104 12.803 7.159 7.471 1.00 0.00 H new ATOM 0 HB3 PRO A 104 11.213 6.434 7.603 1.00 0.00 H new ATOM 0 HG2 PRO A 104 13.915 5.117 7.790 1.00 0.00 H new ATOM 0 HG3 PRO A 104 12.495 4.861 8.785 1.00 0.00 H new ATOM 0 HD2 PRO A 104 13.157 3.148 6.774 1.00 0.00 H new ATOM 0 HD3 PRO A 104 11.486 3.439 7.218 1.00 0.00 H new ATOM 1572 N LYS A 105 14.391 5.852 4.679 1.00 0.00 N ATOM 1573 CA LYS A 105 15.617 6.334 4.050 1.00 0.00 C ATOM 1574 C LYS A 105 15.330 6.907 2.665 1.00 0.00 C ATOM 1575 O LYS A 105 15.936 7.897 2.254 1.00 0.00 O ATOM 1576 CB LYS A 105 16.638 5.200 3.944 1.00 0.00 C ATOM 1577 CG LYS A 105 17.154 4.721 5.290 1.00 0.00 C ATOM 1578 CD LYS A 105 18.439 3.922 5.142 1.00 0.00 C ATOM 1579 CE LYS A 105 19.025 3.552 6.495 1.00 0.00 C ATOM 1580 NZ LYS A 105 20.142 4.458 6.882 1.00 0.00 N ATOM 0 H LYS A 105 14.351 4.841 4.806 1.00 0.00 H new ATOM 0 HA LYS A 105 16.028 7.128 4.673 1.00 0.00 H new ATOM 0 HB2 LYS A 105 16.183 4.360 3.419 1.00 0.00 H new ATOM 0 HB3 LYS A 105 17.481 5.536 3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 105 17.330 5.579 5.939 1.00 0.00 H new ATOM 0 HG3 LYS A 105 16.395 4.106 5.774 1.00 0.00 H new ATOM 0 HD2 LYS A 105 18.241 3.015 4.570 1.00 0.00 H new ATOM 0 HD3 LYS A 105 19.167 4.503 4.576 1.00 0.00 H new ATOM 0 HE2 LYS A 105 18.243 3.595 7.253 1.00 0.00 H new ATOM 0 HE3 LYS A 105 19.385 2.524 6.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 20.515 4.173 7.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 20.899 4.398 6.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 19.793 5.436 6.935 1.00 0.00 H new ATOM 1594 N THR A 106 14.403 6.279 1.950 1.00 0.00 N ATOM 1595 CA THR A 106 14.035 6.727 0.610 1.00 0.00 C ATOM 1596 C THR A 106 12.898 7.747 0.658 1.00 0.00 C ATOM 1597 O THR A 106 12.354 8.129 -0.378 1.00 0.00 O ATOM 1598 CB THR A 106 13.627 5.532 -0.253 1.00 0.00 C ATOM 1599 OG1 THR A 106 13.038 5.968 -1.466 1.00 0.00 O ATOM 1600 CG2 THR A 106 12.642 4.607 0.429 1.00 0.00 C ATOM 0 H THR A 106 13.892 5.458 2.275 1.00 0.00 H new ATOM 0 HA THR A 106 14.906 7.210 0.168 1.00 0.00 H new ATOM 0 HB THR A 106 14.549 4.981 -0.436 1.00 0.00 H new ATOM 0 HG1 THR A 106 12.913 6.940 -1.438 1.00 0.00 H new ATOM 0 HG21 THR A 106 12.396 3.782 -0.239 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.086 4.214 1.344 1.00 0.00 H new ATOM 0 HG23 THR A 106 11.734 5.159 0.674 1.00 0.00 H new ATOM 1608 N TRP A 107 12.543 8.187 1.865 1.00 0.00 N ATOM 1609 CA TRP A 107 11.471 9.163 2.044 1.00 0.00 C ATOM 1610 C TRP A 107 11.627 10.344 1.087 1.00 0.00 C ATOM 1611 O TRP A 107 10.644 10.972 0.696 1.00 0.00 O ATOM 1612 CB TRP A 107 11.449 9.664 3.491 1.00 0.00 C ATOM 1613 CG TRP A 107 12.676 10.436 3.877 1.00 0.00 C ATOM 1614 CD1 TRP A 107 13.959 10.193 3.478 1.00 0.00 C ATOM 1615 CD2 TRP A 107 12.734 11.577 4.742 1.00 0.00 C ATOM 1616 NE1 TRP A 107 14.810 11.113 4.039 1.00 0.00 N ATOM 1617 CE2 TRP A 107 14.083 11.974 4.819 1.00 0.00 C ATOM 1618 CE3 TRP A 107 11.776 12.303 5.455 1.00 0.00 C ATOM 1619 CZ2 TRP A 107 14.496 13.063 5.583 1.00 0.00 C ATOM 1620 CZ3 TRP A 107 12.188 13.384 6.213 1.00 0.00 C ATOM 1621 CH2 TRP A 107 13.538 13.755 6.271 1.00 0.00 C ATOM 0 H TRP A 107 12.983 7.882 2.733 1.00 0.00 H new ATOM 0 HA TRP A 107 10.527 8.667 1.819 1.00 0.00 H new ATOM 0 HB2 TRP A 107 10.572 10.295 3.635 1.00 0.00 H new ATOM 0 HB3 TRP A 107 11.341 8.811 4.161 1.00 0.00 H new ATOM 0 HD1 TRP A 107 14.261 9.394 2.817 1.00 0.00 H new ATOM 0 HE1 TRP A 107 15.820 11.150 3.898 1.00 0.00 H new ATOM 0 HE3 TRP A 107 10.733 12.025 5.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 15.536 13.351 5.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 11.457 13.952 6.770 1.00 0.00 H new ATOM 0 HH2 TRP A 107 13.828 14.605 6.871 1.00 0.00 H new ATOM 1632 N GLN A 108 12.869 10.641 0.717 1.00 0.00 N ATOM 1633 CA GLN A 108 13.152 11.748 -0.191 1.00 0.00 C ATOM 1634 C GLN A 108 13.984 11.289 -1.386 1.00 0.00 C ATOM 1635 O GLN A 108 13.950 11.909 -2.449 1.00 0.00 O ATOM 1636 CB GLN A 108 13.884 12.867 0.552 1.00 0.00 C ATOM 1637 CG GLN A 108 13.124 13.394 1.757 1.00 0.00 C ATOM 1638 CD GLN A 108 13.654 14.729 2.241 1.00 0.00 C ATOM 1639 OE1 GLN A 108 13.595 15.736 1.379 1.00 0.00 O flip ATOM 1640 NE2 GLN A 108 14.110 14.854 3.378 1.00 0.00 N flip ATOM 0 H GLN A 108 13.695 10.131 1.031 1.00 0.00 H new ATOM 0 HA GLN A 108 12.200 12.124 -0.564 1.00 0.00 H new ATOM 0 HB2 GLN A 108 14.857 12.499 0.879 1.00 0.00 H new ATOM 0 HB3 GLN A 108 14.070 13.690 -0.139 1.00 0.00 H new ATOM 0 HG2 GLN A 108 12.070 13.497 1.501 1.00 0.00 H new ATOM 0 HG3 GLN A 108 13.185 12.667 2.567 1.00 0.00 H new ATOM 0 HE21 GLN A 108 14.136 14.052 4.008 1.00 0.00 H new ATOM 0 HE22 GLN A 108 14.462 15.759 3.690 1.00 0.00 H new ATOM 1649 N ASN A 109 14.736 10.203 -1.208 1.00 0.00 N ATOM 1650 CA ASN A 109 15.579 9.668 -2.273 1.00 0.00 C ATOM 1651 C ASN A 109 14.821 9.582 -3.594 1.00 0.00 C ATOM 1652 O ASN A 109 13.653 9.193 -3.631 1.00 0.00 O ATOM 1653 CB ASN A 109 16.105 8.285 -1.889 1.00 0.00 C ATOM 1654 CG ASN A 109 17.281 7.857 -2.738 1.00 0.00 C ATOM 1655 OD1 ASN A 109 17.122 7.495 -3.904 1.00 0.00 O ATOM 1656 ND2 ASN A 109 18.473 7.897 -2.155 1.00 0.00 N ATOM 0 H ASN A 109 14.777 9.677 -0.335 1.00 0.00 H new ATOM 0 HA ASN A 109 16.418 10.351 -2.405 1.00 0.00 H new ATOM 0 HB2 ASN A 109 16.401 8.291 -0.840 1.00 0.00 H new ATOM 0 HB3 ASN A 109 15.303 7.554 -1.990 1.00 0.00 H new ATOM 0 HD21 ASN A 109 19.305 7.621 -2.676 1.00 0.00 H new ATOM 0 HD22 ASN A 109 18.557 8.204 -1.186 1.00 0.00 H new ATOM 1663 N LYS A 110 15.500 9.945 -4.674 1.00 0.00 N ATOM 1664 CA LYS A 110 14.906 9.911 -6.005 1.00 0.00 C ATOM 1665 C LYS A 110 14.616 8.477 -6.440 1.00 0.00 C ATOM 1666 O LYS A 110 13.791 8.244 -7.323 1.00 0.00 O ATOM 1667 CB LYS A 110 15.838 10.584 -7.016 1.00 0.00 C ATOM 1668 CG LYS A 110 16.104 12.051 -6.716 1.00 0.00 C ATOM 1669 CD LYS A 110 17.584 12.385 -6.823 1.00 0.00 C ATOM 1670 CE LYS A 110 18.065 12.331 -8.263 1.00 0.00 C ATOM 1671 NZ LYS A 110 19.477 12.786 -8.396 1.00 0.00 N ATOM 0 H LYS A 110 16.467 10.268 -4.654 1.00 0.00 H new ATOM 0 HA LYS A 110 13.962 10.455 -5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 110 16.787 10.048 -7.036 1.00 0.00 H new ATOM 0 HB3 LYS A 110 15.403 10.498 -8.012 1.00 0.00 H new ATOM 0 HG2 LYS A 110 15.539 12.673 -7.410 1.00 0.00 H new ATOM 0 HG3 LYS A 110 15.748 12.288 -5.713 1.00 0.00 H new ATOM 0 HD2 LYS A 110 17.764 13.380 -6.415 1.00 0.00 H new ATOM 0 HD3 LYS A 110 18.161 11.684 -6.219 1.00 0.00 H new ATOM 0 HE2 LYS A 110 17.976 11.311 -8.637 1.00 0.00 H new ATOM 0 HE3 LYS A 110 17.423 12.956 -8.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 19.766 12.734 -9.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 19.558 13.768 -8.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 20.094 12.174 -7.824 1.00 0.00 H new ATOM 1685 N CYS A 111 15.314 7.520 -5.822 1.00 0.00 N ATOM 1686 CA CYS A 111 15.154 6.102 -6.147 1.00 0.00 C ATOM 1687 C CYS A 111 16.022 5.738 -7.342 1.00 0.00 C ATOM 1688 O CYS A 111 15.760 6.163 -8.466 1.00 0.00 O ATOM 1689 CB CYS A 111 13.688 5.757 -6.433 1.00 0.00 C ATOM 1690 SG CYS A 111 13.179 4.132 -5.825 1.00 0.00 S ATOM 0 H CYS A 111 15.999 7.705 -5.089 1.00 0.00 H new ATOM 0 HA CYS A 111 15.473 5.520 -5.282 1.00 0.00 H new ATOM 0 HB2 CYS A 111 13.052 6.518 -5.980 1.00 0.00 H new ATOM 0 HB3 CYS A 111 13.519 5.799 -7.509 1.00 0.00 H new ATOM 0 HG CYS A 111 11.927 3.934 -6.112 1.00 0.00 H new ATOM 1696 N LEU A 112 17.069 4.962 -7.086 1.00 0.00 N ATOM 1697 CA LEU A 112 17.991 4.560 -8.138 1.00 0.00 C ATOM 1698 C LEU A 112 17.578 3.231 -8.762 1.00 0.00 C ATOM 1699 O LEU A 112 17.011 2.365 -8.096 1.00 0.00 O ATOM 1700 CB LEU A 112 19.418 4.454 -7.591 1.00 0.00 C ATOM 1701 CG LEU A 112 19.789 5.461 -6.494 1.00 0.00 C ATOM 1702 CD1 LEU A 112 19.111 6.804 -6.726 1.00 0.00 C ATOM 1703 CD2 LEU A 112 19.430 4.908 -5.123 1.00 0.00 C ATOM 0 H LEU A 112 17.299 4.600 -6.161 1.00 0.00 H new ATOM 0 HA LEU A 112 17.960 5.327 -8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 112 19.563 3.448 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 112 20.115 4.576 -8.420 1.00 0.00 H new ATOM 0 HG LEU A 112 20.866 5.621 -6.534 1.00 0.00 H new ATOM 0 HD11 LEU A 112 19.393 7.496 -5.933 1.00 0.00 H new ATOM 0 HD12 LEU A 112 19.424 7.208 -7.689 1.00 0.00 H new ATOM 0 HD13 LEU A 112 18.029 6.671 -6.723 1.00 0.00 H new ATOM 0 HD21 LEU A 112 19.699 5.634 -4.356 1.00 0.00 H new ATOM 0 HD22 LEU A 112 18.358 4.714 -5.078 1.00 0.00 H new ATOM 0 HD23 LEU A 112 19.975 3.980 -4.951 1.00 0.00 H new ATOM 1715 N PRO A 113 17.869 3.058 -10.061 1.00 0.00 N ATOM 1716 CA PRO A 113 17.540 1.833 -10.796 1.00 0.00 C ATOM 1717 C PRO A 113 18.437 0.659 -10.410 1.00 0.00 C ATOM 1718 O PRO A 113 18.198 -0.475 -10.822 1.00 0.00 O ATOM 1719 CB PRO A 113 17.785 2.229 -12.253 1.00 0.00 C ATOM 1720 CG PRO A 113 18.828 3.289 -12.180 1.00 0.00 C ATOM 1721 CD PRO A 113 18.549 4.051 -10.913 1.00 0.00 C ATOM 0 HA PRO A 113 16.525 1.493 -10.589 1.00 0.00 H new ATOM 0 HB2 PRO A 113 18.124 1.378 -12.844 1.00 0.00 H new ATOM 0 HB3 PRO A 113 16.874 2.600 -12.722 1.00 0.00 H new ATOM 0 HG2 PRO A 113 19.827 2.854 -12.163 1.00 0.00 H new ATOM 0 HG3 PRO A 113 18.781 3.945 -13.049 1.00 0.00 H new ATOM 0 HD2 PRO A 113 19.467 4.415 -10.452 1.00 0.00 H new ATOM 0 HD3 PRO A 113 17.919 4.921 -11.098 1.00 0.00 H new ATOM 1729 N GLY A 114 19.472 0.937 -9.621 1.00 0.00 N ATOM 1730 CA GLY A 114 20.386 -0.109 -9.203 1.00 0.00 C ATOM 1731 C GLY A 114 19.866 -0.905 -8.022 1.00 0.00 C ATOM 1732 O GLY A 114 20.192 -2.081 -7.868 1.00 0.00 O ATOM 0 H GLY A 114 19.693 1.867 -9.265 1.00 0.00 H new ATOM 0 HA2 GLY A 114 20.566 -0.784 -10.040 1.00 0.00 H new ATOM 0 HA3 GLY A 114 21.346 0.336 -8.941 1.00 0.00 H new ATOM 1736 N ASP A 115 19.060 -0.262 -7.185 1.00 0.00 N ATOM 1737 CA ASP A 115 18.501 -0.922 -6.011 1.00 0.00 C ATOM 1738 C ASP A 115 17.099 -0.402 -5.699 1.00 0.00 C ATOM 1739 O ASP A 115 16.834 0.068 -4.594 1.00 0.00 O ATOM 1740 CB ASP A 115 19.416 -0.716 -4.802 1.00 0.00 C ATOM 1741 CG ASP A 115 20.822 -1.232 -5.047 1.00 0.00 C ATOM 1742 OD1 ASP A 115 21.567 -0.584 -5.812 1.00 0.00 O ATOM 1743 OD2 ASP A 115 21.175 -2.283 -4.474 1.00 0.00 O ATOM 0 H ASP A 115 18.780 0.712 -7.297 1.00 0.00 H new ATOM 0 HA ASP A 115 18.428 -1.988 -6.228 1.00 0.00 H new ATOM 0 HB2 ASP A 115 19.459 0.346 -4.559 1.00 0.00 H new ATOM 0 HB3 ASP A 115 18.991 -1.225 -3.937 1.00 0.00 H new ATOM 1748 N PRO A 116 16.175 -0.481 -6.671 1.00 0.00 N ATOM 1749 CA PRO A 116 14.800 -0.017 -6.489 1.00 0.00 C ATOM 1750 C PRO A 116 13.923 -1.043 -5.775 1.00 0.00 C ATOM 1751 O PRO A 116 12.714 -0.853 -5.647 1.00 0.00 O ATOM 1752 CB PRO A 116 14.324 0.190 -7.923 1.00 0.00 C ATOM 1753 CG PRO A 116 15.065 -0.834 -8.713 1.00 0.00 C ATOM 1754 CD PRO A 116 16.395 -1.025 -8.025 1.00 0.00 C ATOM 0 HA PRO A 116 14.744 0.875 -5.865 1.00 0.00 H new ATOM 0 HB2 PRO A 116 13.246 0.053 -8.007 1.00 0.00 H new ATOM 0 HB3 PRO A 116 14.545 1.198 -8.273 1.00 0.00 H new ATOM 0 HG2 PRO A 116 14.510 -1.771 -8.751 1.00 0.00 H new ATOM 0 HG3 PRO A 116 15.204 -0.504 -9.742 1.00 0.00 H new ATOM 0 HD2 PRO A 116 16.680 -2.076 -7.992 1.00 0.00 H new ATOM 0 HD3 PRO A 116 17.193 -0.494 -8.544 1.00 0.00 H new ATOM 1762 N ASN A 117 14.536 -2.126 -5.307 1.00 0.00 N ATOM 1763 CA ASN A 117 13.809 -3.175 -4.603 1.00 0.00 C ATOM 1764 C ASN A 117 14.468 -3.487 -3.260 1.00 0.00 C ATOM 1765 O ASN A 117 14.113 -4.462 -2.597 1.00 0.00 O ATOM 1766 CB ASN A 117 13.740 -4.442 -5.457 1.00 0.00 C ATOM 1767 CG ASN A 117 15.057 -4.752 -6.142 1.00 0.00 C ATOM 1768 OD1 ASN A 117 15.412 -3.944 -7.134 1.00 0.00 O flip ATOM 1769 ND2 ASN A 117 15.747 -5.707 -5.783 1.00 0.00 N flip ATOM 0 H ASN A 117 15.537 -2.300 -5.403 1.00 0.00 H new ATOM 0 HA ASN A 117 12.796 -2.817 -4.417 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.454 -5.285 -4.828 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.961 -4.327 -6.210 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.435 -6.302 -5.015 1.00 0.00 H new ATOM 0 HD22 ASN A 117 16.631 -5.903 -6.253 1.00 0.00 H new ATOM 1776 N TYR A 118 15.434 -2.657 -2.866 1.00 0.00 N ATOM 1777 CA TYR A 118 16.146 -2.849 -1.606 1.00 0.00 C ATOM 1778 C TYR A 118 15.184 -3.054 -0.434 1.00 0.00 C ATOM 1779 O TYR A 118 15.544 -3.666 0.571 1.00 0.00 O ATOM 1780 CB TYR A 118 17.085 -1.666 -1.309 1.00 0.00 C ATOM 1781 CG TYR A 118 16.611 -0.310 -1.811 1.00 0.00 C ATOM 1782 CD1 TYR A 118 15.263 -0.033 -2.012 1.00 0.00 C ATOM 1783 CD2 TYR A 118 17.527 0.701 -2.077 1.00 0.00 C ATOM 1784 CE1 TYR A 118 14.843 1.202 -2.464 1.00 0.00 C ATOM 1785 CE2 TYR A 118 17.114 1.941 -2.529 1.00 0.00 C ATOM 1786 CZ TYR A 118 15.772 2.185 -2.721 1.00 0.00 C ATOM 1787 OH TYR A 118 15.358 3.418 -3.170 1.00 0.00 O ATOM 0 H TYR A 118 15.740 -1.845 -3.403 1.00 0.00 H new ATOM 0 HA TYR A 118 16.744 -3.753 -1.719 1.00 0.00 H new ATOM 0 HB2 TYR A 118 17.232 -1.603 -0.231 1.00 0.00 H new ATOM 0 HB3 TYR A 118 18.058 -1.878 -1.752 1.00 0.00 H new ATOM 0 HD1 TYR A 118 14.530 -0.800 -1.810 1.00 0.00 H new ATOM 0 HD2 TYR A 118 18.580 0.515 -1.928 1.00 0.00 H new ATOM 0 HE1 TYR A 118 13.791 1.396 -2.615 1.00 0.00 H new ATOM 0 HE2 TYR A 118 17.840 2.714 -2.731 1.00 0.00 H new ATOM 0 HH TYR A 118 14.762 3.303 -3.939 1.00 0.00 H new ATOM 1797 N LEU A 119 13.964 -2.539 -0.563 1.00 0.00 N ATOM 1798 CA LEU A 119 12.969 -2.674 0.495 1.00 0.00 C ATOM 1799 C LEU A 119 11.559 -2.351 -0.003 1.00 0.00 C ATOM 1800 O LEU A 119 10.659 -2.098 0.798 1.00 0.00 O ATOM 1801 CB LEU A 119 13.324 -1.770 1.685 1.00 0.00 C ATOM 1802 CG LEU A 119 13.639 -0.297 1.363 1.00 0.00 C ATOM 1803 CD1 LEU A 119 15.123 -0.106 1.088 1.00 0.00 C ATOM 1804 CD2 LEU A 119 12.809 0.210 0.188 1.00 0.00 C ATOM 0 H LEU A 119 13.643 -2.027 -1.385 1.00 0.00 H new ATOM 0 HA LEU A 119 12.979 -3.715 0.817 1.00 0.00 H new ATOM 0 HB2 LEU A 119 12.494 -1.794 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 119 14.187 -2.200 2.193 1.00 0.00 H new ATOM 0 HG LEU A 119 13.371 0.292 2.240 1.00 0.00 H new ATOM 0 HD11 LEU A 119 15.319 0.942 0.863 1.00 0.00 H new ATOM 0 HD12 LEU A 119 15.697 -0.403 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 119 15.417 -0.721 0.237 1.00 0.00 H new ATOM 0 HD21 LEU A 119 13.058 1.252 -0.010 1.00 0.00 H new ATOM 0 HD22 LEU A 119 13.026 -0.389 -0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 119 11.749 0.130 0.430 1.00 0.00 H new ATOM 1816 N VAL A 120 11.363 -2.367 -1.319 1.00 0.00 N ATOM 1817 CA VAL A 120 10.054 -2.081 -1.889 1.00 0.00 C ATOM 1818 C VAL A 120 9.072 -3.201 -1.551 1.00 0.00 C ATOM 1819 O VAL A 120 7.859 -2.993 -1.524 1.00 0.00 O ATOM 1820 CB VAL A 120 10.138 -1.892 -3.421 1.00 0.00 C ATOM 1821 CG1 VAL A 120 8.760 -1.985 -4.066 1.00 0.00 C ATOM 1822 CG2 VAL A 120 10.791 -0.560 -3.751 1.00 0.00 C ATOM 0 H VAL A 120 12.090 -2.574 -2.004 1.00 0.00 H new ATOM 0 HA VAL A 120 9.696 -1.149 -1.452 1.00 0.00 H new ATOM 0 HB VAL A 120 10.751 -2.696 -3.828 1.00 0.00 H new ATOM 0 HG11 VAL A 120 8.853 -1.848 -5.143 1.00 0.00 H new ATOM 0 HG12 VAL A 120 8.327 -2.964 -3.861 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.113 -1.209 -3.656 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.844 -0.439 -4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 120 10.200 0.250 -3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 120 11.797 -0.535 -3.333 1.00 0.00 H new ATOM 1832 N GLY A 121 9.611 -4.387 -1.282 1.00 0.00 N ATOM 1833 CA GLY A 121 8.781 -5.524 -0.935 1.00 0.00 C ATOM 1834 C GLY A 121 9.152 -6.116 0.414 1.00 0.00 C ATOM 1835 O GLY A 121 8.537 -7.083 0.865 1.00 0.00 O ATOM 0 H GLY A 121 10.612 -4.580 -1.299 1.00 0.00 H new ATOM 0 HA2 GLY A 121 7.735 -5.217 -0.920 1.00 0.00 H new ATOM 0 HA3 GLY A 121 8.877 -6.290 -1.705 1.00 0.00 H new ATOM 1839 N ALA A 122 10.162 -5.533 1.058 1.00 0.00 N ATOM 1840 CA ALA A 122 10.618 -6.004 2.359 1.00 0.00 C ATOM 1841 C ALA A 122 9.775 -5.410 3.480 1.00 0.00 C ATOM 1842 O ALA A 122 9.052 -6.125 4.175 1.00 0.00 O ATOM 1843 CB ALA A 122 12.083 -5.647 2.556 1.00 0.00 C ATOM 0 H ALA A 122 10.679 -4.732 0.696 1.00 0.00 H new ATOM 0 HA ALA A 122 10.507 -7.088 2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 122 12.416 -6.003 3.531 1.00 0.00 H new ATOM 0 HB2 ALA A 122 12.680 -6.117 1.775 1.00 0.00 H new ATOM 0 HB3 ALA A 122 12.204 -4.565 2.504 1.00 0.00 H new ATOM 1849 N ASN A 123 9.874 -4.096 3.650 1.00 0.00 N ATOM 1850 CA ASN A 123 9.122 -3.398 4.686 1.00 0.00 C ATOM 1851 C ASN A 123 7.674 -3.179 4.248 1.00 0.00 C ATOM 1852 O ASN A 123 7.201 -2.046 4.169 1.00 0.00 O ATOM 1853 CB ASN A 123 9.790 -2.058 5.005 1.00 0.00 C ATOM 1854 CG ASN A 123 10.537 -2.083 6.323 1.00 0.00 C ATOM 1855 OD1 ASN A 123 10.093 -1.503 7.313 1.00 0.00 O ATOM 1856 ND2 ASN A 123 11.681 -2.759 6.341 1.00 0.00 N ATOM 0 H ASN A 123 10.469 -3.492 3.083 1.00 0.00 H new ATOM 0 HA ASN A 123 9.117 -4.014 5.585 1.00 0.00 H new ATOM 0 HB2 ASN A 123 10.482 -1.800 4.203 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.032 -1.275 5.035 1.00 0.00 H new ATOM 0 HD21 ASN A 123 12.229 -2.812 7.200 1.00 0.00 H new ATOM 0 HD22 ASN A 123 12.011 -3.225 5.496 1.00 0.00 H new ATOM 1863 N CYS A 124 6.977 -4.275 3.965 1.00 0.00 N ATOM 1864 CA CYS A 124 5.586 -4.206 3.533 1.00 0.00 C ATOM 1865 C CYS A 124 4.652 -4.083 4.730 1.00 0.00 C ATOM 1866 O CYS A 124 4.934 -4.602 5.809 1.00 0.00 O ATOM 1867 CB CYS A 124 5.221 -5.447 2.715 1.00 0.00 C ATOM 1868 SG CYS A 124 5.544 -7.012 3.562 1.00 0.00 S ATOM 0 H CYS A 124 7.353 -5.221 4.027 1.00 0.00 H new ATOM 0 HA CYS A 124 5.469 -3.320 2.909 1.00 0.00 H new ATOM 0 HB2 CYS A 124 4.164 -5.399 2.454 1.00 0.00 H new ATOM 0 HB3 CYS A 124 5.781 -5.430 1.780 1.00 0.00 H new ATOM 0 HG CYS A 124 5.201 -8.001 2.791 1.00 0.00 H new ATOM 1874 N VAL A 125 3.535 -3.394 4.529 1.00 0.00 N ATOM 1875 CA VAL A 125 2.554 -3.203 5.588 1.00 0.00 C ATOM 1876 C VAL A 125 1.610 -4.395 5.670 1.00 0.00 C ATOM 1877 O VAL A 125 0.809 -4.627 4.763 1.00 0.00 O ATOM 1878 CB VAL A 125 1.733 -1.919 5.369 1.00 0.00 C ATOM 1879 CG1 VAL A 125 0.997 -1.531 6.643 1.00 0.00 C ATOM 1880 CG2 VAL A 125 2.631 -0.785 4.896 1.00 0.00 C ATOM 0 H VAL A 125 3.287 -2.958 3.641 1.00 0.00 H new ATOM 0 HA VAL A 125 3.104 -3.111 6.524 1.00 0.00 H new ATOM 0 HB VAL A 125 0.991 -2.112 4.594 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.422 -0.621 6.469 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.322 -2.336 6.933 1.00 0.00 H new ATOM 0 HG13 VAL A 125 1.718 -1.357 7.441 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.033 0.114 4.747 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.397 -0.591 5.646 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.106 -1.065 3.956 1.00 0.00 H new ATOM 1890 N SER A 126 1.716 -5.155 6.754 1.00 0.00 N ATOM 1891 CA SER A 126 0.879 -6.332 6.947 1.00 0.00 C ATOM 1892 C SER A 126 -0.306 -6.032 7.862 1.00 0.00 C ATOM 1893 O SER A 126 -0.151 -5.422 8.920 1.00 0.00 O ATOM 1894 CB SER A 126 1.706 -7.480 7.529 1.00 0.00 C ATOM 1895 OG SER A 126 2.731 -6.994 8.378 1.00 0.00 O ATOM 0 H SER A 126 2.374 -4.977 7.513 1.00 0.00 H new ATOM 0 HA SER A 126 0.489 -6.624 5.972 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.056 -8.153 8.088 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.146 -8.062 6.719 1.00 0.00 H new ATOM 0 HG SER A 126 3.243 -7.748 8.738 1.00 0.00 H new ATOM 1901 N VAL A 127 -1.486 -6.480 7.445 1.00 0.00 N ATOM 1902 CA VAL A 127 -2.706 -6.280 8.218 1.00 0.00 C ATOM 1903 C VAL A 127 -3.657 -7.456 8.018 1.00 0.00 C ATOM 1904 O VAL A 127 -3.991 -7.814 6.889 1.00 0.00 O ATOM 1905 CB VAL A 127 -3.418 -4.968 7.830 1.00 0.00 C ATOM 1906 CG1 VAL A 127 -3.681 -4.925 6.336 1.00 0.00 C ATOM 1907 CG2 VAL A 127 -4.714 -4.805 8.612 1.00 0.00 C ATOM 0 H VAL A 127 -1.623 -6.987 6.571 1.00 0.00 H new ATOM 0 HA VAL A 127 -2.420 -6.214 9.268 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.763 -4.135 8.085 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -4.184 -3.992 6.082 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.735 -4.986 5.798 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -4.313 -5.767 6.054 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -5.199 -3.873 8.322 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.378 -5.642 8.395 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.495 -4.783 9.679 1.00 0.00 H new ATOM 1917 N LEU A 128 -4.076 -8.062 9.123 1.00 0.00 N ATOM 1918 CA LEU A 128 -4.973 -9.210 9.070 1.00 0.00 C ATOM 1919 C LEU A 128 -6.434 -8.787 9.133 1.00 0.00 C ATOM 1920 O LEU A 128 -6.861 -8.126 10.079 1.00 0.00 O ATOM 1921 CB LEU A 128 -4.662 -10.169 10.221 1.00 0.00 C ATOM 1922 CG LEU A 128 -3.446 -11.072 10.005 1.00 0.00 C ATOM 1923 CD1 LEU A 128 -3.246 -11.990 11.201 1.00 0.00 C ATOM 1924 CD2 LEU A 128 -3.602 -11.881 8.727 1.00 0.00 C ATOM 0 H LEU A 128 -3.809 -7.778 10.066 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.811 -9.714 8.117 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -4.504 -9.584 11.127 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -5.535 -10.798 10.395 1.00 0.00 H new ATOM 0 HG LEU A 128 -2.562 -10.442 9.904 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -2.377 -12.625 11.031 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -3.087 -11.390 12.097 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -4.131 -12.613 11.333 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.728 -12.517 8.590 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -4.495 -12.502 8.796 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -3.695 -11.205 7.877 1.00 0.00 H new ATOM 1936 N ILE A 129 -7.200 -9.178 8.117 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.612 -8.845 8.058 1.00 0.00 C ATOM 1938 C ILE A 129 -9.488 -10.077 8.109 1.00 0.00 C ATOM 1939 O ILE A 129 -9.544 -10.861 7.161 1.00 0.00 O ATOM 1940 CB ILE A 129 -8.960 -8.068 6.782 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -7.985 -6.917 6.596 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -10.390 -7.552 6.846 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.261 -6.935 5.267 1.00 0.00 C ATOM 0 H ILE A 129 -6.862 -9.726 7.326 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.804 -8.224 8.933 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.879 -8.739 5.927 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.527 -5.976 6.691 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.249 -6.944 7.400 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -10.620 -7.003 5.933 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -11.076 -8.393 6.947 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -10.500 -6.890 7.705 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -6.584 -6.083 5.210 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.690 -7.859 5.176 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -7.987 -6.876 4.456 1.00 0.00 H new ATOM 1955 N ASP A 130 -10.208 -10.210 9.202 1.00 0.00 N ATOM 1956 CA ASP A 130 -11.133 -11.311 9.366 1.00 0.00 C ATOM 1957 C ASP A 130 -12.475 -10.884 8.807 1.00 0.00 C ATOM 1958 O ASP A 130 -13.183 -11.660 8.174 1.00 0.00 O ATOM 1959 CB ASP A 130 -11.266 -11.693 10.842 1.00 0.00 C ATOM 1960 CG ASP A 130 -11.574 -10.498 11.722 1.00 0.00 C ATOM 1961 OD1 ASP A 130 -10.831 -9.498 11.646 1.00 0.00 O ATOM 1962 OD2 ASP A 130 -12.559 -10.562 12.487 1.00 0.00 O ATOM 0 H ASP A 130 -10.170 -9.567 9.993 1.00 0.00 H new ATOM 0 HA ASP A 130 -10.764 -12.187 8.833 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -12.056 -12.436 10.953 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -10.340 -12.160 11.179 1.00 0.00 H new ATOM 1967 N HIS A 131 -12.793 -9.614 9.034 1.00 0.00 N ATOM 1968 CA HIS A 131 -14.027 -9.019 8.545 1.00 0.00 C ATOM 1969 C HIS A 131 -13.760 -7.610 8.016 1.00 0.00 C ATOM 1970 O HIS A 131 -13.105 -6.805 8.679 1.00 0.00 O ATOM 1971 CB HIS A 131 -15.098 -9.019 9.647 1.00 0.00 C ATOM 1972 CG HIS A 131 -15.748 -7.689 9.897 1.00 0.00 C ATOM 1973 ND1 HIS A 131 -16.455 -6.880 9.074 1.00 0.00 N flip ATOM 1974 CD2 HIS A 131 -15.709 -7.050 11.117 1.00 0.00 C flip ATOM 1975 CE1 HIS A 131 -16.826 -5.779 9.806 1.00 0.00 C flip ATOM 1976 NE2 HIS A 131 -16.364 -5.906 11.036 1.00 0.00 N flip ATOM 0 H HIS A 131 -12.202 -8.971 9.561 1.00 0.00 H new ATOM 0 HA HIS A 131 -14.408 -9.618 7.718 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -15.871 -9.741 9.382 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -14.643 -9.365 10.575 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -16.672 -7.055 8.093 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.219 -7.426 12.003 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -17.402 -4.944 9.435 1.00 0.00 H new ATOM 1985 N PHE A 132 -14.273 -7.313 6.829 1.00 0.00 N ATOM 1986 CA PHE A 132 -14.088 -5.998 6.231 1.00 0.00 C ATOM 1987 C PHE A 132 -15.299 -5.110 6.505 1.00 0.00 C ATOM 1988 O PHE A 132 -16.442 -5.564 6.439 1.00 0.00 O ATOM 1989 CB PHE A 132 -13.848 -6.121 4.727 1.00 0.00 C ATOM 1990 CG PHE A 132 -12.391 -6.201 4.353 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -11.529 -5.146 4.620 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -11.884 -7.328 3.723 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -10.196 -5.216 4.263 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -10.552 -7.403 3.368 1.00 0.00 C ATOM 1995 CZ PHE A 132 -9.707 -6.345 3.636 1.00 0.00 C ATOM 0 H PHE A 132 -14.819 -7.963 6.263 1.00 0.00 H new ATOM 0 HA PHE A 132 -13.211 -5.536 6.684 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -14.359 -7.010 4.358 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -14.297 -5.264 4.225 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -11.904 -4.261 5.112 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -12.540 -8.158 3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -9.536 -4.387 4.474 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -10.171 -8.289 2.881 1.00 0.00 H new ATOM 0 HZ PHE A 132 -8.665 -6.400 3.356 1.00 0.00 H new ATOM 2005 N GLY A 133 -15.036 -3.848 6.833 1.00 0.00 N ATOM 2006 CA GLY A 133 -16.104 -2.912 7.136 1.00 0.00 C ATOM 2007 C GLY A 133 -17.160 -2.826 6.050 1.00 0.00 C ATOM 2008 O GLY A 133 -17.202 -3.659 5.146 1.00 0.00 O ATOM 0 H GLY A 133 -14.097 -3.456 6.894 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -16.580 -3.206 8.072 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -15.675 -1.922 7.294 1.00 0.00 H new ATOM 2012 N SER A 134 -18.020 -1.815 6.149 1.00 0.00 N ATOM 2013 CA SER A 134 -19.096 -1.617 5.181 1.00 0.00 C ATOM 2014 C SER A 134 -18.646 -0.773 3.989 1.00 0.00 C ATOM 2015 O SER A 134 -19.473 -0.177 3.299 1.00 0.00 O ATOM 2016 CB SER A 134 -20.296 -0.953 5.858 1.00 0.00 C ATOM 2017 OG SER A 134 -21.138 -1.919 6.464 1.00 0.00 O ATOM 0 H SER A 134 -17.992 -1.118 6.893 1.00 0.00 H new ATOM 0 HA SER A 134 -19.381 -2.600 4.805 1.00 0.00 H new ATOM 0 HB2 SER A 134 -19.948 -0.246 6.611 1.00 0.00 H new ATOM 0 HB3 SER A 134 -20.863 -0.382 5.122 1.00 0.00 H new ATOM 0 HG SER A 134 -21.897 -1.470 6.891 1.00 0.00 H new ATOM 2023 N GLY A 135 -17.338 -0.727 3.744 1.00 0.00 N ATOM 2024 CA GLY A 135 -16.817 0.046 2.629 1.00 0.00 C ATOM 2025 C GLY A 135 -17.417 1.436 2.542 1.00 0.00 C ATOM 2026 O GLY A 135 -17.834 2.005 3.551 1.00 0.00 O ATOM 0 H GLY A 135 -16.631 -1.211 4.297 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -15.734 0.129 2.725 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -17.014 -0.488 1.700 1.00 0.00 H new ATOM 2030 N SER A 136 -17.462 1.983 1.331 1.00 0.00 N ATOM 2031 CA SER A 136 -18.017 3.313 1.109 1.00 0.00 C ATOM 2032 C SER A 136 -17.306 4.360 1.963 1.00 0.00 C ATOM 2033 O SER A 136 -17.853 5.430 2.230 1.00 0.00 O ATOM 2034 CB SER A 136 -19.515 3.319 1.419 1.00 0.00 C ATOM 2035 OG SER A 136 -20.229 2.504 0.506 1.00 0.00 O ATOM 0 H SER A 136 -17.120 1.524 0.487 1.00 0.00 H new ATOM 0 HA SER A 136 -17.865 3.568 0.060 1.00 0.00 H new ATOM 0 HB2 SER A 136 -19.680 2.962 2.436 1.00 0.00 H new ATOM 0 HB3 SER A 136 -19.895 4.340 1.374 1.00 0.00 H new ATOM 0 HG SER A 136 -21.184 2.524 0.727 1.00 0.00 H new ATOM 2041 N GLY A 137 -16.085 4.050 2.391 1.00 0.00 N ATOM 2042 CA GLY A 137 -15.331 4.980 3.208 1.00 0.00 C ATOM 2043 C GLY A 137 -14.084 4.355 3.799 1.00 0.00 C ATOM 2044 O GLY A 137 -13.007 4.947 3.758 1.00 0.00 O ATOM 0 H GLY A 137 -15.607 3.173 2.186 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -15.050 5.843 2.605 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -15.966 5.348 4.014 1.00 0.00 H new ATOM 2048 N VAL A 138 -14.231 3.155 4.350 1.00 0.00 N ATOM 2049 CA VAL A 138 -13.111 2.449 4.954 1.00 0.00 C ATOM 2050 C VAL A 138 -11.966 2.279 3.960 1.00 0.00 C ATOM 2051 O VAL A 138 -12.152 1.748 2.865 1.00 0.00 O ATOM 2052 CB VAL A 138 -13.538 1.065 5.486 1.00 0.00 C ATOM 2053 CG1 VAL A 138 -14.730 1.195 6.424 1.00 0.00 C ATOM 2054 CG2 VAL A 138 -13.856 0.117 4.337 1.00 0.00 C ATOM 0 H VAL A 138 -15.117 2.652 4.390 1.00 0.00 H new ATOM 0 HA VAL A 138 -12.768 3.056 5.792 1.00 0.00 H new ATOM 0 HB VAL A 138 -12.704 0.645 6.049 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -15.016 0.208 6.788 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -14.461 1.830 7.268 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -15.568 1.640 5.888 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -14.154 -0.852 4.737 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -14.669 0.529 3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -12.972 -0.005 3.711 1.00 0.00 H new ATOM 2064 N VAL A 139 -10.785 2.738 4.349 1.00 0.00 N ATOM 2065 CA VAL A 139 -9.607 2.643 3.494 1.00 0.00 C ATOM 2066 C VAL A 139 -8.333 2.525 4.325 1.00 0.00 C ATOM 2067 O VAL A 139 -8.199 3.153 5.375 1.00 0.00 O ATOM 2068 CB VAL A 139 -9.498 3.865 2.553 1.00 0.00 C ATOM 2069 CG1 VAL A 139 -9.803 5.147 3.305 1.00 0.00 C ATOM 2070 CG2 VAL A 139 -8.125 3.945 1.903 1.00 0.00 C ATOM 0 H VAL A 139 -10.615 3.181 5.252 1.00 0.00 H new ATOM 0 HA VAL A 139 -9.720 1.743 2.890 1.00 0.00 H new ATOM 0 HB VAL A 139 -10.236 3.740 1.761 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -9.721 5.996 2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -10.815 5.101 3.707 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -9.092 5.267 4.123 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.083 4.815 1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -7.361 4.035 2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -7.946 3.042 1.319 1.00 0.00 H new ATOM 2080 N TYR A 140 -7.396 1.724 3.833 1.00 0.00 N ATOM 2081 CA TYR A 140 -6.124 1.523 4.512 1.00 0.00 C ATOM 2082 C TYR A 140 -5.091 2.524 4.010 1.00 0.00 C ATOM 2083 O TYR A 140 -5.107 2.911 2.842 1.00 0.00 O ATOM 2084 CB TYR A 140 -5.618 0.099 4.286 1.00 0.00 C ATOM 2085 CG TYR A 140 -6.423 -0.952 5.013 1.00 0.00 C ATOM 2086 CD1 TYR A 140 -7.713 -1.267 4.607 1.00 0.00 C ATOM 2087 CD2 TYR A 140 -5.895 -1.625 6.106 1.00 0.00 C ATOM 2088 CE1 TYR A 140 -8.454 -2.225 5.272 1.00 0.00 C ATOM 2089 CE2 TYR A 140 -6.627 -2.585 6.774 1.00 0.00 C ATOM 2090 CZ TYR A 140 -7.908 -2.882 6.355 1.00 0.00 C ATOM 2091 OH TYR A 140 -8.643 -3.834 7.024 1.00 0.00 O ATOM 0 H TYR A 140 -7.495 1.202 2.963 1.00 0.00 H new ATOM 0 HA TYR A 140 -6.277 1.678 5.580 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -5.634 -0.118 3.218 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -4.579 0.036 4.609 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -8.144 -0.756 3.759 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -4.894 -1.393 6.439 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -9.457 -2.458 4.945 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -6.200 -3.102 7.621 1.00 0.00 H new ATOM 0 HH TYR A 140 -9.369 -4.152 6.447 1.00 0.00 H new ATOM 2101 N GLY A 141 -4.196 2.941 4.897 1.00 0.00 N ATOM 2102 CA GLY A 141 -3.173 3.892 4.515 1.00 0.00 C ATOM 2103 C GLY A 141 -2.069 4.005 5.544 1.00 0.00 C ATOM 2104 O GLY A 141 -2.333 4.146 6.739 1.00 0.00 O ATOM 0 H GLY A 141 -4.161 2.638 5.870 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.744 3.594 3.559 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.629 4.871 4.368 1.00 0.00 H new ATOM 2108 N VAL A 142 -0.829 3.947 5.077 1.00 0.00 N ATOM 2109 CA VAL A 142 0.324 4.049 5.958 1.00 0.00 C ATOM 2110 C VAL A 142 0.418 5.451 6.553 1.00 0.00 C ATOM 2111 O VAL A 142 0.450 6.443 5.824 1.00 0.00 O ATOM 2112 CB VAL A 142 1.630 3.700 5.208 1.00 0.00 C ATOM 2113 CG1 VAL A 142 2.140 4.885 4.401 1.00 0.00 C ATOM 2114 CG2 VAL A 142 2.697 3.215 6.170 1.00 0.00 C ATOM 0 H VAL A 142 -0.597 3.830 4.091 1.00 0.00 H new ATOM 0 HA VAL A 142 0.193 3.330 6.767 1.00 0.00 H new ATOM 0 HB VAL A 142 1.401 2.892 4.513 1.00 0.00 H new ATOM 0 HG11 VAL A 142 3.059 4.606 3.886 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.388 5.177 3.668 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.339 5.722 5.070 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.605 2.976 5.616 1.00 0.00 H new ATOM 0 HG22 VAL A 142 2.911 3.996 6.899 1.00 0.00 H new ATOM 0 HG23 VAL A 142 2.343 2.323 6.687 1.00 0.00 H new ATOM 2124 N VAL A 143 0.452 5.531 7.877 1.00 0.00 N ATOM 2125 CA VAL A 143 0.530 6.817 8.552 1.00 0.00 C ATOM 2126 C VAL A 143 1.959 7.140 8.968 1.00 0.00 C ATOM 2127 O VAL A 143 2.545 6.454 9.807 1.00 0.00 O ATOM 2128 CB VAL A 143 -0.382 6.857 9.796 1.00 0.00 C ATOM 2129 CG1 VAL A 143 0.074 5.843 10.836 1.00 0.00 C ATOM 2130 CG2 VAL A 143 -0.418 8.258 10.388 1.00 0.00 C ATOM 0 H VAL A 143 0.427 4.724 8.501 1.00 0.00 H new ATOM 0 HA VAL A 143 0.189 7.567 7.838 1.00 0.00 H new ATOM 0 HB VAL A 143 -1.392 6.590 9.486 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -0.584 5.890 11.703 1.00 0.00 H new ATOM 0 HG12 VAL A 143 0.038 4.841 10.408 1.00 0.00 H new ATOM 0 HG13 VAL A 143 1.095 6.070 11.143 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -1.066 8.266 11.264 1.00 0.00 H new ATOM 0 HG22 VAL A 143 0.589 8.556 10.679 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -0.803 8.957 9.645 1.00 0.00 H new ATOM 2140 N ARG A 144 2.514 8.195 8.382 1.00 0.00 N ATOM 2141 CA ARG A 144 3.870 8.615 8.701 1.00 0.00 C ATOM 2142 C ARG A 144 3.850 9.631 9.836 1.00 0.00 C ATOM 2143 O ARG A 144 3.412 10.766 9.654 1.00 0.00 O ATOM 2144 CB ARG A 144 4.551 9.215 7.469 1.00 0.00 C ATOM 2145 CG ARG A 144 6.035 9.476 7.663 1.00 0.00 C ATOM 2146 CD ARG A 144 6.576 10.435 6.616 1.00 0.00 C ATOM 2147 NE ARG A 144 8.012 10.266 6.408 1.00 0.00 N ATOM 2148 CZ ARG A 144 8.937 10.601 7.306 1.00 0.00 C ATOM 2149 NH1 ARG A 144 8.582 11.131 8.470 1.00 0.00 N ATOM 2150 NH2 ARG A 144 10.221 10.408 7.038 1.00 0.00 N ATOM 0 H ARG A 144 2.045 8.773 7.685 1.00 0.00 H new ATOM 0 HA ARG A 144 4.438 7.740 9.018 1.00 0.00 H new ATOM 0 HB2 ARG A 144 4.417 8.539 6.624 1.00 0.00 H new ATOM 0 HB3 ARG A 144 4.056 10.151 7.210 1.00 0.00 H new ATOM 0 HG2 ARG A 144 6.205 9.888 8.658 1.00 0.00 H new ATOM 0 HG3 ARG A 144 6.581 8.534 7.611 1.00 0.00 H new ATOM 0 HD2 ARG A 144 6.052 10.276 5.674 1.00 0.00 H new ATOM 0 HD3 ARG A 144 6.373 11.461 6.924 1.00 0.00 H new ATOM 0 HE ARG A 144 8.325 9.868 5.523 1.00 0.00 H new ATOM 0 HH11 ARG A 144 7.596 11.284 8.681 1.00 0.00 H new ATOM 0 HH12 ARG A 144 9.295 11.385 9.153 1.00 0.00 H new ATOM 0 HH21 ARG A 144 10.500 10.003 6.144 1.00 0.00 H new ATOM 0 HH22 ARG A 144 10.930 10.664 7.725 1.00 0.00 H new ATOM 2164 N ARG A 145 4.314 9.207 11.007 1.00 0.00 N ATOM 2165 CA ARG A 145 4.340 10.071 12.182 1.00 0.00 C ATOM 2166 C ARG A 145 5.400 11.159 12.046 1.00 0.00 C ATOM 2167 O ARG A 145 6.301 11.063 11.212 1.00 0.00 O ATOM 2168 CB ARG A 145 4.604 9.241 13.440 1.00 0.00 C ATOM 2169 CG ARG A 145 3.725 8.006 13.550 1.00 0.00 C ATOM 2170 CD ARG A 145 2.515 8.259 14.437 1.00 0.00 C ATOM 2171 NE ARG A 145 2.898 8.577 15.810 1.00 0.00 N ATOM 2172 CZ ARG A 145 2.030 8.900 16.766 1.00 0.00 C ATOM 2173 NH1 ARG A 145 0.729 8.948 16.504 1.00 0.00 N ATOM 2174 NH2 ARG A 145 2.462 9.174 17.989 1.00 0.00 N ATOM 0 H ARG A 145 4.678 8.268 11.168 1.00 0.00 H new ATOM 0 HA ARG A 145 3.366 10.554 12.265 1.00 0.00 H new ATOM 0 HB2 ARG A 145 5.650 8.934 13.450 1.00 0.00 H new ATOM 0 HB3 ARG A 145 4.447 9.868 14.318 1.00 0.00 H new ATOM 0 HG2 ARG A 145 3.392 7.705 12.556 1.00 0.00 H new ATOM 0 HG3 ARG A 145 4.308 7.179 13.955 1.00 0.00 H new ATOM 0 HD2 ARG A 145 1.929 9.081 14.025 1.00 0.00 H new ATOM 0 HD3 ARG A 145 1.874 7.378 14.435 1.00 0.00 H new ATOM 0 HE ARG A 145 3.889 8.550 16.050 1.00 0.00 H new ATOM 0 HH11 ARG A 145 0.390 8.737 15.566 1.00 0.00 H new ATOM 0 HH12 ARG A 145 0.069 9.196 17.241 1.00 0.00 H new ATOM 0 HH21 ARG A 145 3.460 9.137 18.198 1.00 0.00 H new ATOM 0 HH22 ARG A 145 1.797 9.422 18.721 1.00 0.00 H new ATOM 2188 N SER A 146 5.283 12.193 12.873 1.00 0.00 N ATOM 2189 CA SER A 146 6.228 13.304 12.850 1.00 0.00 C ATOM 2190 C SER A 146 6.220 14.050 14.181 1.00 0.00 C ATOM 2191 O SER A 146 5.229 13.912 14.929 1.00 0.00 O ATOM 2192 CB SER A 146 5.888 14.267 11.711 1.00 0.00 C ATOM 2193 OG SER A 146 7.060 14.866 11.183 1.00 0.00 O ATOM 2194 OXT SER A 146 7.204 14.764 14.464 1.00 0.00 O ATOM 0 H SER A 146 4.542 12.285 13.568 1.00 0.00 H new ATOM 0 HA SER A 146 7.226 12.897 12.686 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.363 13.730 10.921 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.212 15.041 12.074 1.00 0.00 H new ATOM 0 HG SER A 146 7.114 15.798 11.482 1.00 0.00 H new TER 2200 SER A 146