USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1185 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 114 MET CE :methyl 142:sc= -0.71 (180deg=-2.3!) USER MOD Set 1.2: A 118 GLN :FLIP amide:sc= -1.96! F(o=-4,f=-2.7!) USER MOD Set 2.1: A 86 SER OG : rot 180:sc= 1.09 USER MOD Set 2.2: A 105 THR OG1 : rot -140:sc= 1.2 USER MOD Set 3.1: A 98 ASN : amide:sc= -0.138 K(o=-0.14,f=-2.3!) USER MOD Set 3.2: A 100 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 55 CYS SG : rot 57:sc= -0.883 USER MOD Set 4.2: A 84 GLN : amide:sc= -0.461 K(o=-1.3,f=-3.2) USER MOD Set 4.3: A 87 GLN : amide:sc= 0 X(o=-1.3,f=-1.4) USER MOD Set 5.1: A 38 GLN : amide:sc= -1.49! C(o=-5.7!,f=-7.2!) USER MOD Set 5.2: A 43 ASN : amide:sc= -4.23! C(o=-5.7!,f=-7.2!) USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.0757 (180deg=0) USER MOD Single : A 2 SER OG : rot 31:sc= 0.17 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc=-0.00301 X(o=-0.003,f=-0.003) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -1.17 K(o=-1.2,f=-2.7!) USER MOD Single : A 14 TYR OH : rot -34:sc= -0.591 USER MOD Single : A 20 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 24 GLN :FLIP amide:sc= -4.23! C(o=-4.9!,f=-4.2!) USER MOD Single : A 27 THR OG1 : rot -81:sc= 0.876 USER MOD Single : A 28 THR OG1 : rot 75:sc= 1.28 USER MOD Single : A 29 GLN : amide:sc= 0.21 K(o=0.21,f=-3.6!) USER MOD Single : A 30 CYS SG : rot -119:sc= -0.77 USER MOD Single : A 32 LYS NZ :NH3+ 146:sc= 0.0183 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -5.06! C(o=-5.1!,f=-12!) USER MOD Single : A 46 ASN : amide:sc= -0.04 X(o=-0.04,f=-0.5) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot -19:sc= 0.746 USER MOD Single : A 59 ASN : amide:sc= -7.73! C(o=-7.7!,f=-11!) USER MOD Single : A 62 TYR OH : rot 30:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -1.83! C(o=-1.8!,f=-5.3!) USER MOD Single : A 70 LYS NZ :NH3+ 149:sc= -0.175 (180deg=-1.31!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl -110:sc= -0.792 (180deg=-4.74!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -4.34 K(o=-4.3,f=-9.7!) USER MOD Single : A 82 MET CE :methyl -127:sc= -0.929 (180deg=-3.3!) USER MOD Single : A 90 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.72) USER MOD Single : A 95 TYR OH : rot -83:sc= -2.18 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -0.127 K(o=-0.13,f=-2.1!) USER MOD Single : A 116 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 130:sc= -0.707 USER MOD Single : A 122 MET CE :methyl -109:sc= -1.28 (180deg=-2.88!) USER MOD Single : A 123 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.61) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.311 X(o=-0.31,f=0) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 165:sc= -0.0147 (180deg=-0.204) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00292) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.923 -25.508 -23.736 1.00 0.00 N ATOM 2 CA GLY A 1 -9.564 -25.179 -22.369 1.00 0.00 C ATOM 3 C GLY A 1 -8.086 -24.877 -22.215 1.00 0.00 C ATOM 4 O GLY A 1 -7.323 -24.971 -23.175 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.664 -24.857 -24.067 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.086 -25.418 -24.346 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.277 -26.485 -23.776 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.144 -24.316 -22.042 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.832 -26.010 -21.716 1.00 0.00 H new ATOM 8 N SER A 2 -7.683 -24.510 -21.002 1.00 0.00 N ATOM 9 CA SER A 2 -6.288 -24.187 -20.727 1.00 0.00 C ATOM 10 C SER A 2 -5.353 -25.085 -21.531 1.00 0.00 C ATOM 11 O SER A 2 -5.469 -26.310 -21.497 1.00 0.00 O ATOM 12 CB SER A 2 -5.994 -24.333 -19.233 1.00 0.00 C ATOM 13 OG SER A 2 -6.322 -25.633 -18.773 1.00 0.00 O ATOM 0 H SER A 2 -8.302 -24.429 -20.195 1.00 0.00 H new ATOM 0 HA SER A 2 -6.115 -23.153 -21.025 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.939 -24.133 -19.046 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.563 -23.591 -18.673 1.00 0.00 H new ATOM 0 HG SER A 2 -6.192 -26.279 -19.498 1.00 0.00 H new ATOM 19 N SER A 3 -4.425 -24.466 -22.255 1.00 0.00 N ATOM 20 CA SER A 3 -3.472 -25.208 -23.071 1.00 0.00 C ATOM 21 C SER A 3 -2.461 -25.942 -22.195 1.00 0.00 C ATOM 22 O SER A 3 -2.264 -27.148 -22.332 1.00 0.00 O ATOM 23 CB SER A 3 -2.743 -24.262 -24.027 1.00 0.00 C ATOM 24 OG SER A 3 -3.660 -23.559 -24.847 1.00 0.00 O ATOM 0 H SER A 3 -4.313 -23.453 -22.293 1.00 0.00 H new ATOM 0 HA SER A 3 -4.026 -25.946 -23.652 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.144 -23.553 -23.455 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.054 -24.831 -24.651 1.00 0.00 H new ATOM 0 HG SER A 3 -3.169 -22.960 -25.448 1.00 0.00 H new ATOM 30 N GLY A 4 -1.823 -25.202 -21.292 1.00 0.00 N ATOM 31 CA GLY A 4 -0.840 -25.798 -20.406 1.00 0.00 C ATOM 32 C GLY A 4 -0.715 -25.051 -19.093 1.00 0.00 C ATOM 33 O GLY A 4 -1.715 -24.765 -18.436 1.00 0.00 O ATOM 0 H GLY A 4 -1.970 -24.201 -21.159 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.116 -26.834 -20.207 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.130 -25.816 -20.904 1.00 0.00 H new ATOM 37 N SER A 5 0.518 -24.735 -18.710 1.00 0.00 N ATOM 38 CA SER A 5 0.772 -24.022 -17.464 1.00 0.00 C ATOM 39 C SER A 5 -0.243 -22.900 -17.264 1.00 0.00 C ATOM 40 O SER A 5 -0.473 -22.089 -18.160 1.00 0.00 O ATOM 41 CB SER A 5 2.190 -23.448 -17.459 1.00 0.00 C ATOM 42 OG SER A 5 2.556 -23.003 -16.165 1.00 0.00 O ATOM 0 H SER A 5 1.357 -24.962 -19.245 1.00 0.00 H new ATOM 0 HA SER A 5 0.672 -24.731 -16.642 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.894 -24.208 -17.798 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.252 -22.618 -18.163 1.00 0.00 H new ATOM 0 HG SER A 5 3.467 -22.642 -16.189 1.00 0.00 H new ATOM 48 N SER A 6 -0.848 -22.862 -16.081 1.00 0.00 N ATOM 49 CA SER A 6 -1.842 -21.843 -15.763 1.00 0.00 C ATOM 50 C SER A 6 -2.018 -21.708 -14.253 1.00 0.00 C ATOM 51 O SER A 6 -2.032 -22.701 -13.528 1.00 0.00 O ATOM 52 CB SER A 6 -3.182 -22.187 -16.415 1.00 0.00 C ATOM 53 OG SER A 6 -4.205 -21.311 -15.972 1.00 0.00 O ATOM 0 H SER A 6 -0.667 -23.525 -15.327 1.00 0.00 H new ATOM 0 HA SER A 6 -1.488 -20.890 -16.157 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.089 -22.124 -17.499 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.452 -23.216 -16.178 1.00 0.00 H new ATOM 0 HG SER A 6 -5.051 -21.551 -16.405 1.00 0.00 H new ATOM 59 N GLY A 7 -2.152 -20.470 -13.788 1.00 0.00 N ATOM 60 CA GLY A 7 -2.325 -20.226 -12.368 1.00 0.00 C ATOM 61 C GLY A 7 -3.034 -18.916 -12.087 1.00 0.00 C ATOM 62 O GLY A 7 -4.171 -18.716 -12.512 1.00 0.00 O ATOM 0 H GLY A 7 -2.144 -19.632 -14.369 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.894 -21.045 -11.928 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.349 -20.219 -11.882 1.00 0.00 H new ATOM 66 N GLN A 8 -2.362 -18.024 -11.366 1.00 0.00 N ATOM 67 CA GLN A 8 -2.937 -16.728 -11.027 1.00 0.00 C ATOM 68 C GLN A 8 -3.121 -15.871 -12.275 1.00 0.00 C ATOM 69 O GLN A 8 -2.210 -15.153 -12.689 1.00 0.00 O ATOM 70 CB GLN A 8 -2.046 -15.999 -10.020 1.00 0.00 C ATOM 71 CG GLN A 8 -2.263 -16.443 -8.582 1.00 0.00 C ATOM 72 CD GLN A 8 -1.526 -17.725 -8.250 1.00 0.00 C ATOM 73 OE1 GLN A 8 -2.086 -18.818 -8.340 1.00 0.00 O ATOM 74 NE2 GLN A 8 -0.262 -17.598 -7.864 1.00 0.00 N ATOM 0 H GLN A 8 -1.420 -18.175 -11.006 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.916 -16.899 -10.578 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.002 -16.161 -10.288 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -2.231 -14.927 -10.092 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -1.932 -15.653 -7.908 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -3.329 -16.586 -8.407 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.162 -16.672 -7.803 1.00 0.00 H new ATOM 0 HE22 GLN A 8 0.285 -18.426 -7.628 1.00 0.00 H new ATOM 83 N LYS A 9 -4.306 -15.950 -12.872 1.00 0.00 N ATOM 84 CA LYS A 9 -4.611 -15.181 -14.072 1.00 0.00 C ATOM 85 C LYS A 9 -4.444 -13.686 -13.818 1.00 0.00 C ATOM 86 O LYS A 9 -4.892 -13.167 -12.796 1.00 0.00 O ATOM 87 CB LYS A 9 -6.038 -15.473 -14.541 1.00 0.00 C ATOM 88 CG LYS A 9 -7.080 -14.554 -13.926 1.00 0.00 C ATOM 89 CD LYS A 9 -8.468 -15.170 -13.979 1.00 0.00 C ATOM 90 CE LYS A 9 -9.545 -14.146 -13.658 1.00 0.00 C ATOM 91 NZ LYS A 9 -10.819 -14.793 -13.238 1.00 0.00 N ATOM 0 H LYS A 9 -5.071 -16.539 -12.544 1.00 0.00 H new ATOM 0 HA LYS A 9 -3.910 -15.479 -14.852 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.081 -15.382 -15.626 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.287 -16.506 -14.298 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -6.814 -14.343 -12.890 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.083 -13.601 -14.455 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.645 -15.587 -14.971 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.528 -15.996 -13.271 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.194 -13.487 -12.864 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.726 -13.523 -14.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.527 -14.061 -13.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -11.168 -15.403 -14.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -10.653 -15.368 -12.387 1.00 0.00 H new ATOM 105 N ILE A 10 -3.798 -13.000 -14.755 1.00 0.00 N ATOM 106 CA ILE A 10 -3.575 -11.565 -14.633 1.00 0.00 C ATOM 107 C ILE A 10 -4.629 -10.777 -15.403 1.00 0.00 C ATOM 108 O ILE A 10 -4.342 -10.195 -16.449 1.00 0.00 O ATOM 109 CB ILE A 10 -2.177 -11.167 -15.145 1.00 0.00 C ATOM 110 CG1 ILE A 10 -1.107 -12.065 -14.521 1.00 0.00 C ATOM 111 CG2 ILE A 10 -1.896 -9.705 -14.834 1.00 0.00 C ATOM 112 CD1 ILE A 10 -0.929 -11.850 -13.035 1.00 0.00 C ATOM 0 H ILE A 10 -3.420 -13.415 -15.607 1.00 0.00 H new ATOM 0 HA ILE A 10 -3.647 -11.324 -13.573 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.151 -11.300 -16.227 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -1.370 -13.108 -14.700 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -0.156 -11.885 -15.022 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -0.905 -9.439 -15.202 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -2.644 -9.079 -15.321 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.937 -9.548 -13.756 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -0.155 -12.520 -12.661 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -0.636 -10.817 -12.849 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -1.868 -12.058 -12.522 1.00 0.00 H new ATOM 124 N GLU A 11 -5.850 -10.762 -14.877 1.00 0.00 N ATOM 125 CA GLU A 11 -6.947 -10.044 -15.515 1.00 0.00 C ATOM 126 C GLU A 11 -7.657 -9.135 -14.516 1.00 0.00 C ATOM 127 O GLU A 11 -7.434 -9.227 -13.308 1.00 0.00 O ATOM 128 CB GLU A 11 -7.946 -11.031 -16.123 1.00 0.00 C ATOM 129 CG GLU A 11 -7.536 -11.546 -17.492 1.00 0.00 C ATOM 130 CD GLU A 11 -7.139 -10.431 -18.441 1.00 0.00 C ATOM 131 OE1 GLU A 11 -7.911 -9.458 -18.569 1.00 0.00 O ATOM 132 OE2 GLU A 11 -6.056 -10.533 -19.055 1.00 0.00 O ATOM 0 H GLU A 11 -6.104 -11.238 -14.012 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.529 -9.425 -16.309 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -8.065 -11.877 -15.447 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -8.919 -10.547 -16.203 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.701 -12.238 -17.381 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.361 -12.110 -17.926 1.00 0.00 H new ATOM 139 N LYS A 12 -8.513 -8.258 -15.027 1.00 0.00 N ATOM 140 CA LYS A 12 -9.258 -7.332 -14.182 1.00 0.00 C ATOM 141 C LYS A 12 -8.311 -6.485 -13.338 1.00 0.00 C ATOM 142 O LYS A 12 -8.463 -6.397 -12.120 1.00 0.00 O ATOM 143 CB LYS A 12 -10.220 -8.100 -13.273 1.00 0.00 C ATOM 144 CG LYS A 12 -11.540 -8.447 -13.939 1.00 0.00 C ATOM 145 CD LYS A 12 -12.483 -7.256 -13.962 1.00 0.00 C ATOM 146 CE LYS A 12 -13.643 -7.482 -14.918 1.00 0.00 C ATOM 147 NZ LYS A 12 -14.836 -6.672 -14.545 1.00 0.00 N ATOM 0 H LYS A 12 -8.709 -8.169 -16.024 1.00 0.00 H new ATOM 0 HA LYS A 12 -9.832 -6.669 -14.830 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -9.737 -9.019 -12.941 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -10.418 -7.504 -12.382 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.356 -8.786 -14.958 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -12.010 -9.274 -13.408 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -12.867 -7.076 -12.958 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -11.935 -6.362 -14.259 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -13.333 -7.227 -15.931 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.909 -8.539 -14.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -15.605 -6.855 -15.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -15.148 -6.933 -13.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -14.590 -5.662 -14.565 1.00 0.00 H new ATOM 161 N GLN A 13 -7.337 -5.863 -13.994 1.00 0.00 N ATOM 162 CA GLN A 13 -6.366 -5.022 -13.302 1.00 0.00 C ATOM 163 C GLN A 13 -7.068 -3.980 -12.438 1.00 0.00 C ATOM 164 O GLN A 13 -6.785 -3.856 -11.246 1.00 0.00 O ATOM 165 CB GLN A 13 -5.448 -4.331 -14.312 1.00 0.00 C ATOM 166 CG GLN A 13 -4.636 -5.298 -15.157 1.00 0.00 C ATOM 167 CD GLN A 13 -5.354 -5.709 -16.427 1.00 0.00 C ATOM 168 OE1 GLN A 13 -6.161 -4.953 -16.970 1.00 0.00 O ATOM 169 NE2 GLN A 13 -5.064 -6.912 -16.909 1.00 0.00 N ATOM 0 H GLN A 13 -7.199 -5.925 -15.003 1.00 0.00 H new ATOM 0 HA GLN A 13 -5.766 -5.660 -12.654 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -6.051 -3.705 -14.970 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -4.767 -3.668 -13.778 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.683 -4.836 -15.416 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -4.410 -6.187 -14.568 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -4.389 -7.506 -16.427 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -5.516 -7.242 -17.762 1.00 0.00 H new ATOM 178 N TYR A 14 -7.983 -3.233 -13.046 1.00 0.00 N ATOM 179 CA TYR A 14 -8.723 -2.199 -12.332 1.00 0.00 C ATOM 180 C TYR A 14 -10.128 -2.679 -11.981 1.00 0.00 C ATOM 181 O TYR A 14 -10.805 -3.302 -12.798 1.00 0.00 O ATOM 182 CB TYR A 14 -8.803 -0.926 -13.176 1.00 0.00 C ATOM 183 CG TYR A 14 -9.665 0.154 -12.562 1.00 0.00 C ATOM 184 CD1 TYR A 14 -9.125 1.087 -11.686 1.00 0.00 C ATOM 185 CD2 TYR A 14 -11.020 0.240 -12.857 1.00 0.00 C ATOM 186 CE1 TYR A 14 -9.910 2.075 -11.122 1.00 0.00 C ATOM 187 CE2 TYR A 14 -11.812 1.225 -12.299 1.00 0.00 C ATOM 188 CZ TYR A 14 -11.252 2.140 -11.432 1.00 0.00 C ATOM 189 OH TYR A 14 -12.037 3.122 -10.873 1.00 0.00 O ATOM 0 H TYR A 14 -8.230 -3.324 -14.031 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.191 -1.981 -11.406 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.797 -0.535 -13.325 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.196 -1.177 -14.161 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -8.074 1.040 -11.441 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -11.462 -0.476 -13.534 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -9.475 2.792 -10.442 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.863 1.278 -12.540 1.00 0.00 H new ATOM 0 HH TYR A 14 -11.723 3.315 -9.965 1.00 0.00 H new ATOM 199 N ASP A 15 -10.558 -2.383 -10.759 1.00 0.00 N ATOM 200 CA ASP A 15 -11.883 -2.782 -10.298 1.00 0.00 C ATOM 201 C ASP A 15 -12.435 -1.775 -9.294 1.00 0.00 C ATOM 202 O ASP A 15 -11.724 -1.326 -8.395 1.00 0.00 O ATOM 203 CB ASP A 15 -11.828 -4.173 -9.666 1.00 0.00 C ATOM 204 CG ASP A 15 -11.659 -5.272 -10.697 1.00 0.00 C ATOM 205 OD1 ASP A 15 -12.389 -5.253 -11.710 1.00 0.00 O ATOM 206 OD2 ASP A 15 -10.795 -6.149 -10.491 1.00 0.00 O ATOM 0 H ASP A 15 -10.009 -1.869 -10.070 1.00 0.00 H new ATOM 0 HA ASP A 15 -12.548 -2.809 -11.161 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -11.001 -4.214 -8.957 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.743 -4.348 -9.100 1.00 0.00 H new ATOM 211 N ALA A 16 -13.706 -1.423 -9.455 1.00 0.00 N ATOM 212 CA ALA A 16 -14.353 -0.469 -8.562 1.00 0.00 C ATOM 213 C ALA A 16 -14.784 -1.140 -7.262 1.00 0.00 C ATOM 214 O ALA A 16 -14.728 -0.533 -6.192 1.00 0.00 O ATOM 215 CB ALA A 16 -15.551 0.169 -9.250 1.00 0.00 C ATOM 0 H ALA A 16 -14.308 -1.784 -10.195 1.00 0.00 H new ATOM 0 HA ALA A 16 -13.631 0.310 -8.317 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -16.024 0.879 -8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -15.220 0.691 -10.148 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -16.268 -0.605 -9.524 1.00 0.00 H new ATOM 221 N ASP A 17 -15.214 -2.392 -7.361 1.00 0.00 N ATOM 222 CA ASP A 17 -15.653 -3.145 -6.192 1.00 0.00 C ATOM 223 C ASP A 17 -14.571 -3.161 -5.118 1.00 0.00 C ATOM 224 O ASP A 17 -14.859 -3.012 -3.929 1.00 0.00 O ATOM 225 CB ASP A 17 -16.017 -4.577 -6.589 1.00 0.00 C ATOM 226 CG ASP A 17 -17.208 -4.634 -7.524 1.00 0.00 C ATOM 227 OD1 ASP A 17 -18.346 -4.443 -7.048 1.00 0.00 O ATOM 228 OD2 ASP A 17 -17.003 -4.871 -8.733 1.00 0.00 O ATOM 0 H ASP A 17 -15.268 -2.908 -8.239 1.00 0.00 H new ATOM 0 HA ASP A 17 -16.536 -2.653 -5.784 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -15.159 -5.047 -7.070 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -16.236 -5.155 -5.691 1.00 0.00 H new ATOM 233 N LEU A 18 -13.326 -3.344 -5.542 1.00 0.00 N ATOM 234 CA LEU A 18 -12.199 -3.380 -4.616 1.00 0.00 C ATOM 235 C LEU A 18 -11.737 -1.969 -4.264 1.00 0.00 C ATOM 236 O LEU A 18 -11.082 -1.757 -3.245 1.00 0.00 O ATOM 237 CB LEU A 18 -11.040 -4.172 -5.222 1.00 0.00 C ATOM 238 CG LEU A 18 -11.325 -5.640 -5.544 1.00 0.00 C ATOM 239 CD1 LEU A 18 -10.363 -6.150 -6.605 1.00 0.00 C ATOM 240 CD2 LEU A 18 -11.232 -6.489 -4.284 1.00 0.00 C ATOM 0 H LEU A 18 -13.071 -3.470 -6.521 1.00 0.00 H new ATOM 0 HA LEU A 18 -12.529 -3.873 -3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.727 -3.674 -6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -10.197 -4.129 -4.532 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.339 -5.717 -5.936 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.581 -7.196 -6.821 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.478 -5.560 -7.514 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.339 -6.060 -6.241 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.438 -7.531 -4.531 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.230 -6.407 -3.863 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.962 -6.138 -3.554 1.00 0.00 H new ATOM 252 N GLU A 19 -12.086 -1.009 -5.114 1.00 0.00 N ATOM 253 CA GLU A 19 -11.708 0.382 -4.892 1.00 0.00 C ATOM 254 C GLU A 19 -12.453 0.963 -3.693 1.00 0.00 C ATOM 255 O GLU A 19 -11.855 1.610 -2.833 1.00 0.00 O ATOM 256 CB GLU A 19 -11.997 1.218 -6.140 1.00 0.00 C ATOM 257 CG GLU A 19 -11.787 2.709 -5.936 1.00 0.00 C ATOM 258 CD GLU A 19 -11.981 3.506 -7.212 1.00 0.00 C ATOM 259 OE1 GLU A 19 -11.000 3.665 -7.968 1.00 0.00 O ATOM 260 OE2 GLU A 19 -13.115 3.969 -7.454 1.00 0.00 O ATOM 0 H GLU A 19 -12.630 -1.168 -5.962 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.639 0.412 -4.683 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -11.355 0.877 -6.952 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -13.026 1.044 -6.453 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -12.482 3.070 -5.178 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -10.781 2.881 -5.554 1.00 0.00 H new ATOM 267 N GLN A 20 -13.760 0.728 -3.645 1.00 0.00 N ATOM 268 CA GLN A 20 -14.586 1.229 -2.554 1.00 0.00 C ATOM 269 C GLN A 20 -14.101 0.690 -1.212 1.00 0.00 C ATOM 270 O GLN A 20 -14.040 1.422 -0.224 1.00 0.00 O ATOM 271 CB GLN A 20 -16.049 0.840 -2.773 1.00 0.00 C ATOM 272 CG GLN A 20 -16.251 -0.641 -3.051 1.00 0.00 C ATOM 273 CD GLN A 20 -17.711 -1.047 -3.023 1.00 0.00 C ATOM 274 OE1 GLN A 20 -18.602 -0.199 -2.969 1.00 0.00 O ATOM 275 NE2 GLN A 20 -17.964 -2.350 -3.061 1.00 0.00 N ATOM 0 H GLN A 20 -14.269 0.194 -4.349 1.00 0.00 H new ATOM 0 HA GLN A 20 -14.504 2.316 -2.540 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -16.626 1.117 -1.891 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -16.448 1.415 -3.608 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -15.829 -0.884 -4.026 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -15.702 -1.224 -2.311 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -17.194 -3.018 -3.105 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -18.928 -2.683 -3.046 1.00 0.00 H new ATOM 284 N ILE A 21 -13.757 -0.594 -1.185 1.00 0.00 N ATOM 285 CA ILE A 21 -13.277 -1.229 0.036 1.00 0.00 C ATOM 286 C ILE A 21 -11.928 -0.658 0.459 1.00 0.00 C ATOM 287 O ILE A 21 -11.714 -0.345 1.631 1.00 0.00 O ATOM 288 CB ILE A 21 -13.144 -2.754 -0.139 1.00 0.00 C ATOM 289 CG1 ILE A 21 -14.493 -3.365 -0.523 1.00 0.00 C ATOM 290 CG2 ILE A 21 -12.612 -3.389 1.138 1.00 0.00 C ATOM 291 CD1 ILE A 21 -14.409 -4.828 -0.898 1.00 0.00 C ATOM 0 H ILE A 21 -13.802 -1.214 -1.994 1.00 0.00 H new ATOM 0 HA ILE A 21 -14.015 -1.022 0.811 1.00 0.00 H new ATOM 0 HB ILE A 21 -12.435 -2.953 -0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -15.185 -3.251 0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.910 -2.807 -1.361 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -12.523 -4.466 0.999 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -11.633 -2.972 1.371 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -13.299 -3.184 1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -15.402 -5.194 -1.158 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -13.743 -4.947 -1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -14.022 -5.398 -0.054 1.00 0.00 H new ATOM 303 N LEU A 22 -11.021 -0.522 -0.503 1.00 0.00 N ATOM 304 CA LEU A 22 -9.692 0.015 -0.231 1.00 0.00 C ATOM 305 C LEU A 22 -9.781 1.302 0.582 1.00 0.00 C ATOM 306 O LEU A 22 -9.097 1.457 1.595 1.00 0.00 O ATOM 307 CB LEU A 22 -8.948 0.275 -1.541 1.00 0.00 C ATOM 308 CG LEU A 22 -8.286 -0.941 -2.191 1.00 0.00 C ATOM 309 CD1 LEU A 22 -7.849 -0.615 -3.611 1.00 0.00 C ATOM 310 CD2 LEU A 22 -7.101 -1.410 -1.360 1.00 0.00 C ATOM 0 H LEU A 22 -11.182 -0.776 -1.478 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.141 -0.723 0.352 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.650 0.706 -2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -8.180 1.026 -1.356 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.016 -1.749 -2.234 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.380 -1.492 -4.058 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.718 -0.328 -4.202 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.135 0.208 -3.592 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.642 -2.276 -1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.369 -0.606 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.442 -1.684 -0.362 1.00 0.00 H new ATOM 322 N ILE A 23 -10.628 2.222 0.133 1.00 0.00 N ATOM 323 CA ILE A 23 -10.808 3.495 0.821 1.00 0.00 C ATOM 324 C ILE A 23 -11.258 3.282 2.262 1.00 0.00 C ATOM 325 O ILE A 23 -10.729 3.900 3.185 1.00 0.00 O ATOM 326 CB ILE A 23 -11.838 4.384 0.099 1.00 0.00 C ATOM 327 CG1 ILE A 23 -11.433 4.587 -1.363 1.00 0.00 C ATOM 328 CG2 ILE A 23 -11.970 5.723 0.808 1.00 0.00 C ATOM 329 CD1 ILE A 23 -12.544 5.144 -2.225 1.00 0.00 C ATOM 0 H ILE A 23 -11.200 2.110 -0.704 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.840 3.997 0.816 1.00 0.00 H new ATOM 0 HB ILE A 23 -12.807 3.885 0.122 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.578 5.262 -1.405 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -11.106 3.633 -1.777 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -12.701 6.340 0.286 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -12.299 5.560 1.834 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.005 6.229 0.812 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -12.186 5.262 -3.248 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -13.392 4.459 -2.214 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -12.856 6.113 -1.835 1.00 0.00 H new ATOM 341 N GLN A 24 -12.238 2.403 2.446 1.00 0.00 N ATOM 342 CA GLN A 24 -12.759 2.108 3.776 1.00 0.00 C ATOM 343 C GLN A 24 -11.653 1.591 4.691 1.00 0.00 C ATOM 344 O GLN A 24 -11.570 1.977 5.857 1.00 0.00 O ATOM 345 CB GLN A 24 -13.887 1.078 3.688 1.00 0.00 C ATOM 346 CG GLN A 24 -15.241 1.686 3.362 1.00 0.00 C ATOM 347 CD GLN A 24 -15.501 1.768 1.871 1.00 0.00 C ATOM 348 OE1 GLN A 24 -15.868 0.641 1.271 1.00 0.00 O flip ATOM 349 NE2 GLN A 24 -15.372 2.831 1.264 1.00 0.00 N flip ATOM 0 H GLN A 24 -12.687 1.883 1.692 1.00 0.00 H new ATOM 0 HA GLN A 24 -13.153 3.033 4.198 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -13.636 0.341 2.925 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -13.956 0.545 4.636 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -16.024 1.091 3.831 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -15.299 2.686 3.792 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -15.088 3.673 1.765 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -15.549 2.870 0.260 1.00 0.00 H new ATOM 358 N TRP A 25 -10.808 0.719 4.155 1.00 0.00 N ATOM 359 CA TRP A 25 -9.708 0.149 4.925 1.00 0.00 C ATOM 360 C TRP A 25 -8.620 1.189 5.171 1.00 0.00 C ATOM 361 O TRP A 25 -8.344 1.553 6.315 1.00 0.00 O ATOM 362 CB TRP A 25 -9.119 -1.059 4.195 1.00 0.00 C ATOM 363 CG TRP A 25 -7.895 -1.615 4.857 1.00 0.00 C ATOM 364 CD1 TRP A 25 -7.787 -2.049 6.147 1.00 0.00 C ATOM 365 CD2 TRP A 25 -6.605 -1.794 4.262 1.00 0.00 C ATOM 366 NE1 TRP A 25 -6.507 -2.487 6.390 1.00 0.00 N ATOM 367 CE2 TRP A 25 -5.763 -2.343 5.250 1.00 0.00 C ATOM 368 CE3 TRP A 25 -6.080 -1.547 2.991 1.00 0.00 C ATOM 369 CZ2 TRP A 25 -4.427 -2.645 5.004 1.00 0.00 C ATOM 370 CZ3 TRP A 25 -4.753 -1.848 2.748 1.00 0.00 C ATOM 371 CH2 TRP A 25 -3.939 -2.393 3.750 1.00 0.00 C ATOM 0 H TRP A 25 -10.863 0.391 3.191 1.00 0.00 H new ATOM 0 HA TRP A 25 -10.101 -0.174 5.889 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.876 -1.841 4.132 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.872 -0.772 3.173 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.589 -2.048 6.870 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -6.167 -2.859 7.277 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -6.700 -1.128 2.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -3.797 -3.063 5.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -4.337 -1.660 1.769 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.906 -2.619 3.529 1.00 0.00 H new ATOM 382 N ILE A 26 -8.007 1.665 4.093 1.00 0.00 N ATOM 383 CA ILE A 26 -6.951 2.665 4.194 1.00 0.00 C ATOM 384 C ILE A 26 -7.240 3.659 5.313 1.00 0.00 C ATOM 385 O ILE A 26 -6.420 3.858 6.210 1.00 0.00 O ATOM 386 CB ILE A 26 -6.777 3.435 2.871 1.00 0.00 C ATOM 387 CG1 ILE A 26 -6.283 2.494 1.770 1.00 0.00 C ATOM 388 CG2 ILE A 26 -5.810 4.595 3.057 1.00 0.00 C ATOM 389 CD1 ILE A 26 -6.417 3.071 0.378 1.00 0.00 C ATOM 0 H ILE A 26 -8.223 1.375 3.139 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.029 2.129 4.417 1.00 0.00 H new ATOM 0 HB ILE A 26 -7.744 3.838 2.572 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.237 2.250 1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.843 1.560 1.823 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.697 5.129 2.114 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -6.199 5.275 3.815 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.840 4.213 3.376 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.048 2.350 -0.352 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -7.465 3.289 0.174 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.835 3.990 0.307 1.00 0.00 H new ATOM 401 N THR A 27 -8.414 4.280 5.257 1.00 0.00 N ATOM 402 CA THR A 27 -8.813 5.254 6.266 1.00 0.00 C ATOM 403 C THR A 27 -8.880 4.616 7.649 1.00 0.00 C ATOM 404 O THR A 27 -8.503 5.231 8.647 1.00 0.00 O ATOM 405 CB THR A 27 -10.182 5.878 5.934 1.00 0.00 C ATOM 406 OG1 THR A 27 -11.176 4.852 5.832 1.00 0.00 O ATOM 407 CG2 THR A 27 -10.118 6.661 4.632 1.00 0.00 C ATOM 0 H THR A 27 -9.106 4.126 4.523 1.00 0.00 H new ATOM 0 HA THR A 27 -8.055 6.038 6.266 1.00 0.00 H new ATOM 0 HB THR A 27 -10.449 6.563 6.738 1.00 0.00 H new ATOM 0 HG1 THR A 27 -11.127 4.436 4.946 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.096 7.092 4.418 1.00 0.00 H new ATOM 0 HG22 THR A 27 -9.381 7.459 4.723 1.00 0.00 H new ATOM 0 HG23 THR A 27 -9.831 5.993 3.820 1.00 0.00 H new ATOM 415 N THR A 28 -9.361 3.378 7.702 1.00 0.00 N ATOM 416 CA THR A 28 -9.478 2.656 8.963 1.00 0.00 C ATOM 417 C THR A 28 -8.105 2.333 9.541 1.00 0.00 C ATOM 418 O THR A 28 -7.753 2.798 10.625 1.00 0.00 O ATOM 419 CB THR A 28 -10.270 1.347 8.790 1.00 0.00 C ATOM 420 OG1 THR A 28 -11.593 1.633 8.321 1.00 0.00 O ATOM 421 CG2 THR A 28 -10.347 0.583 10.103 1.00 0.00 C ATOM 0 H THR A 28 -9.676 2.854 6.886 1.00 0.00 H new ATOM 0 HA THR A 28 -10.015 3.308 9.652 1.00 0.00 H new ATOM 0 HB THR A 28 -9.751 0.729 8.058 1.00 0.00 H new ATOM 0 HG1 THR A 28 -11.558 1.878 7.373 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.911 -0.338 9.956 1.00 0.00 H new ATOM 0 HG22 THR A 28 -9.340 0.341 10.443 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.845 1.198 10.853 1.00 0.00 H new ATOM 429 N GLN A 29 -7.333 1.536 8.809 1.00 0.00 N ATOM 430 CA GLN A 29 -5.997 1.152 9.251 1.00 0.00 C ATOM 431 C GLN A 29 -5.280 2.329 9.903 1.00 0.00 C ATOM 432 O GLN A 29 -4.722 2.201 10.994 1.00 0.00 O ATOM 433 CB GLN A 29 -5.177 0.630 8.069 1.00 0.00 C ATOM 434 CG GLN A 29 -3.781 0.169 8.454 1.00 0.00 C ATOM 435 CD GLN A 29 -3.796 -1.056 9.347 1.00 0.00 C ATOM 436 OE1 GLN A 29 -4.137 -2.154 8.908 1.00 0.00 O ATOM 437 NE2 GLN A 29 -3.426 -0.873 10.610 1.00 0.00 N ATOM 0 H GLN A 29 -7.609 1.144 7.909 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.100 0.359 9.991 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.710 -0.200 7.606 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.097 1.416 7.318 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.213 -0.052 7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -3.263 0.980 8.965 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -3.151 0.055 10.931 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.417 -1.661 11.258 1.00 0.00 H new ATOM 446 N CYS A 30 -5.297 3.473 9.229 1.00 0.00 N ATOM 447 CA CYS A 30 -4.647 4.674 9.742 1.00 0.00 C ATOM 448 C CYS A 30 -5.289 5.122 11.051 1.00 0.00 C ATOM 449 O CYS A 30 -6.468 4.865 11.296 1.00 0.00 O ATOM 450 CB CYS A 30 -4.722 5.800 8.711 1.00 0.00 C ATOM 451 SG CYS A 30 -4.041 7.374 9.286 1.00 0.00 S ATOM 0 H CYS A 30 -5.754 3.595 8.325 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.600 4.437 9.934 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -4.187 5.492 7.812 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -5.764 5.949 8.427 1.00 0.00 H new ATOM 0 HG CYS A 30 -4.973 8.280 9.275 1.00 0.00 H new ATOM 457 N ARG A 31 -4.505 5.792 11.889 1.00 0.00 N ATOM 458 CA ARG A 31 -4.997 6.274 13.175 1.00 0.00 C ATOM 459 C ARG A 31 -5.823 7.545 13.000 1.00 0.00 C ATOM 460 O ARG A 31 -6.956 7.632 13.473 1.00 0.00 O ATOM 461 CB ARG A 31 -3.827 6.540 14.125 1.00 0.00 C ATOM 462 CG ARG A 31 -4.259 6.944 15.524 1.00 0.00 C ATOM 463 CD ARG A 31 -3.091 6.921 16.497 1.00 0.00 C ATOM 464 NE ARG A 31 -2.213 8.076 16.327 1.00 0.00 N ATOM 465 CZ ARG A 31 -2.453 9.266 16.866 1.00 0.00 C ATOM 466 NH1 ARG A 31 -3.536 9.456 17.607 1.00 0.00 N ATOM 467 NH2 ARG A 31 -1.607 10.269 16.666 1.00 0.00 N ATOM 0 H ARG A 31 -3.527 6.014 11.701 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.636 5.502 13.603 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.211 5.643 14.189 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.201 7.328 13.705 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.692 7.944 15.498 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -5.039 6.268 15.874 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.471 6.902 17.519 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.517 6.005 16.353 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.370 7.963 15.764 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.188 8.687 17.764 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.718 10.371 18.020 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.772 10.126 16.098 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.792 11.183 17.080 1.00 0.00 H new ATOM 481 N LYS A 32 -5.247 8.529 12.317 1.00 0.00 N ATOM 482 CA LYS A 32 -5.929 9.795 12.078 1.00 0.00 C ATOM 483 C LYS A 32 -6.663 9.774 10.741 1.00 0.00 C ATOM 484 O LYS A 32 -6.249 9.088 9.806 1.00 0.00 O ATOM 485 CB LYS A 32 -4.926 10.951 12.103 1.00 0.00 C ATOM 486 CG LYS A 32 -4.246 11.195 10.767 1.00 0.00 C ATOM 487 CD LYS A 32 -5.037 12.169 9.909 1.00 0.00 C ATOM 488 CE LYS A 32 -4.844 13.604 10.374 1.00 0.00 C ATOM 489 NZ LYS A 32 -5.628 14.565 9.549 1.00 0.00 N ATOM 0 H LYS A 32 -4.309 8.474 11.919 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.661 9.940 12.872 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.441 11.861 12.411 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.165 10.745 12.856 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -3.243 11.588 10.934 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -4.134 10.249 10.237 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.724 12.077 8.869 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.096 11.912 9.947 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.146 13.691 11.418 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.786 13.862 10.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -5.953 15.351 10.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.028 14.936 8.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.451 14.079 9.138 1.00 0.00 H new ATOM 503 N ASP A 33 -7.752 10.530 10.657 1.00 0.00 N ATOM 504 CA ASP A 33 -8.542 10.600 9.433 1.00 0.00 C ATOM 505 C ASP A 33 -7.868 11.500 8.402 1.00 0.00 C ATOM 506 O ASP A 33 -8.142 12.698 8.335 1.00 0.00 O ATOM 507 CB ASP A 33 -9.948 11.117 9.737 1.00 0.00 C ATOM 508 CG ASP A 33 -10.706 10.209 10.686 1.00 0.00 C ATOM 509 OD1 ASP A 33 -11.290 9.212 10.213 1.00 0.00 O ATOM 510 OD2 ASP A 33 -10.716 10.496 11.902 1.00 0.00 O ATOM 0 H ASP A 33 -8.108 11.103 11.422 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.615 9.594 9.019 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -9.879 12.115 10.171 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -10.506 11.212 8.806 1.00 0.00 H new ATOM 515 N VAL A 34 -6.983 10.914 7.601 1.00 0.00 N ATOM 516 CA VAL A 34 -6.270 11.663 6.573 1.00 0.00 C ATOM 517 C VAL A 34 -7.222 12.552 5.780 1.00 0.00 C ATOM 518 O VAL A 34 -6.841 13.622 5.309 1.00 0.00 O ATOM 519 CB VAL A 34 -5.534 10.721 5.601 1.00 0.00 C ATOM 520 CG1 VAL A 34 -4.325 10.094 6.278 1.00 0.00 C ATOM 521 CG2 VAL A 34 -6.480 9.649 5.081 1.00 0.00 C ATOM 0 H VAL A 34 -6.743 9.924 7.644 1.00 0.00 H new ATOM 0 HA VAL A 34 -5.538 12.287 7.086 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.182 11.306 4.751 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.818 9.432 5.576 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -3.639 10.879 6.597 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.651 9.521 7.146 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.944 8.992 4.396 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.864 9.065 5.918 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -7.311 10.120 4.556 1.00 0.00 H new ATOM 531 N GLY A 35 -8.464 12.099 5.636 1.00 0.00 N ATOM 532 CA GLY A 35 -9.452 12.866 4.900 1.00 0.00 C ATOM 533 C GLY A 35 -10.063 12.078 3.758 1.00 0.00 C ATOM 534 O GLY A 35 -9.731 12.301 2.593 1.00 0.00 O ATOM 0 H GLY A 35 -8.803 11.215 6.016 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.241 13.185 5.581 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -8.987 13.770 4.506 1.00 0.00 H new ATOM 538 N ARG A 36 -10.957 11.153 4.091 1.00 0.00 N ATOM 539 CA ARG A 36 -11.613 10.328 3.084 1.00 0.00 C ATOM 540 C ARG A 36 -12.257 11.194 2.006 1.00 0.00 C ATOM 541 O ARG A 36 -13.272 11.855 2.230 1.00 0.00 O ATOM 542 CB ARG A 36 -12.671 9.436 3.736 1.00 0.00 C ATOM 543 CG ARG A 36 -13.099 8.263 2.868 1.00 0.00 C ATOM 544 CD ARG A 36 -14.359 7.603 3.404 1.00 0.00 C ATOM 545 NE ARG A 36 -15.159 7.005 2.339 1.00 0.00 N ATOM 546 CZ ARG A 36 -15.740 7.708 1.373 1.00 0.00 C ATOM 547 NH1 ARG A 36 -15.609 9.027 1.338 1.00 0.00 N ATOM 548 NH2 ARG A 36 -16.452 7.091 0.439 1.00 0.00 N ATOM 0 H ARG A 36 -11.244 10.956 5.050 1.00 0.00 H new ATOM 0 HA ARG A 36 -10.855 9.700 2.616 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -12.281 9.055 4.680 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -13.547 10.040 3.973 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -13.273 8.608 1.849 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -12.294 7.530 2.823 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -14.086 6.835 4.127 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -14.958 8.343 3.935 1.00 0.00 H new ATOM 0 HE ARG A 36 -15.278 5.992 2.337 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -15.061 9.504 2.054 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -16.056 9.564 0.595 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -16.554 6.076 0.462 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -16.898 7.631 -0.302 1.00 0.00 H new ATOM 562 N PRO A 37 -11.655 11.193 0.807 1.00 0.00 N ATOM 563 CA PRO A 37 -12.152 11.974 -0.329 1.00 0.00 C ATOM 564 C PRO A 37 -13.464 11.426 -0.879 1.00 0.00 C ATOM 565 O PRO A 37 -14.047 10.502 -0.313 1.00 0.00 O ATOM 566 CB PRO A 37 -11.037 11.837 -1.369 1.00 0.00 C ATOM 567 CG PRO A 37 -10.355 10.557 -1.026 1.00 0.00 C ATOM 568 CD PRO A 37 -10.442 10.430 0.470 1.00 0.00 C ATOM 0 HA PRO A 37 -12.369 13.005 -0.051 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -11.441 11.812 -2.381 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -10.346 12.679 -1.322 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.838 9.713 -1.518 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -9.317 10.567 -1.357 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -10.523 9.388 0.781 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.560 10.841 0.960 1.00 0.00 H new ATOM 576 N GLN A 38 -13.923 12.001 -1.986 1.00 0.00 N ATOM 577 CA GLN A 38 -15.167 11.569 -2.612 1.00 0.00 C ATOM 578 C GLN A 38 -14.971 10.257 -3.364 1.00 0.00 C ATOM 579 O GLN A 38 -13.895 9.969 -3.888 1.00 0.00 O ATOM 580 CB GLN A 38 -15.683 12.646 -3.568 1.00 0.00 C ATOM 581 CG GLN A 38 -14.688 13.024 -4.653 1.00 0.00 C ATOM 582 CD GLN A 38 -13.739 14.124 -4.217 1.00 0.00 C ATOM 583 OE1 GLN A 38 -13.973 14.800 -3.214 1.00 0.00 O ATOM 584 NE2 GLN A 38 -12.661 14.309 -4.970 1.00 0.00 N ATOM 0 H GLN A 38 -13.452 12.767 -2.468 1.00 0.00 H new ATOM 0 HA GLN A 38 -15.904 11.409 -1.825 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -16.602 12.294 -4.036 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -15.938 13.537 -2.994 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -14.112 12.143 -4.935 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -15.230 13.348 -5.541 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -12.507 13.726 -5.792 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -11.987 15.035 -4.726 1.00 0.00 H new ATOM 593 N PRO A 39 -16.034 9.441 -3.419 1.00 0.00 N ATOM 594 CA PRO A 39 -16.004 8.146 -4.105 1.00 0.00 C ATOM 595 C PRO A 39 -15.916 8.294 -5.620 1.00 0.00 C ATOM 596 O PRO A 39 -16.814 8.848 -6.253 1.00 0.00 O ATOM 597 CB PRO A 39 -17.334 7.502 -3.707 1.00 0.00 C ATOM 598 CG PRO A 39 -18.232 8.650 -3.395 1.00 0.00 C ATOM 599 CD PRO A 39 -17.348 9.721 -2.817 1.00 0.00 C ATOM 0 HA PRO A 39 -15.130 7.558 -3.826 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -17.737 6.893 -4.516 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -17.214 6.847 -2.844 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -18.739 9.004 -4.293 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -19.007 8.358 -2.686 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.704 10.718 -3.075 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -17.311 9.668 -1.729 1.00 0.00 H new ATOM 607 N GLY A 40 -14.827 7.795 -6.197 1.00 0.00 N ATOM 608 CA GLY A 40 -14.642 7.882 -7.634 1.00 0.00 C ATOM 609 C GLY A 40 -13.408 7.139 -8.106 1.00 0.00 C ATOM 610 O GLY A 40 -12.784 6.407 -7.338 1.00 0.00 O ATOM 0 H GLY A 40 -14.069 7.332 -5.695 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -15.521 7.476 -8.135 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -14.565 8.930 -7.924 1.00 0.00 H new ATOM 614 N ARG A 41 -13.055 7.327 -9.374 1.00 0.00 N ATOM 615 CA ARG A 41 -11.889 6.667 -9.948 1.00 0.00 C ATOM 616 C ARG A 41 -10.767 7.669 -10.201 1.00 0.00 C ATOM 617 O ARG A 41 -9.605 7.290 -10.347 1.00 0.00 O ATOM 618 CB ARG A 41 -12.266 5.965 -11.254 1.00 0.00 C ATOM 619 CG ARG A 41 -12.656 6.922 -12.369 1.00 0.00 C ATOM 620 CD ARG A 41 -12.355 6.334 -13.738 1.00 0.00 C ATOM 621 NE ARG A 41 -13.152 6.960 -14.790 1.00 0.00 N ATOM 622 CZ ARG A 41 -13.114 6.584 -16.063 1.00 0.00 C ATOM 623 NH1 ARG A 41 -12.323 5.589 -16.441 1.00 0.00 N ATOM 624 NH2 ARG A 41 -13.870 7.202 -16.962 1.00 0.00 N ATOM 0 H ARG A 41 -13.560 7.931 -10.023 1.00 0.00 H new ATOM 0 HA ARG A 41 -11.534 5.924 -9.234 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -11.424 5.357 -11.586 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -13.096 5.284 -11.064 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -13.719 7.153 -12.297 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -12.117 7.862 -12.249 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -11.296 6.460 -13.962 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -12.552 5.262 -13.723 1.00 0.00 H new ATOM 0 HE ARG A 41 -13.772 7.728 -14.533 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -11.742 5.110 -15.753 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -12.296 5.302 -17.420 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -14.481 7.967 -16.675 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -13.840 6.912 -17.940 1.00 0.00 H new ATOM 638 N GLU A 42 -11.123 8.948 -10.252 1.00 0.00 N ATOM 639 CA GLU A 42 -10.146 10.004 -10.489 1.00 0.00 C ATOM 640 C GLU A 42 -9.601 10.547 -9.171 1.00 0.00 C ATOM 641 O GLU A 42 -8.427 10.901 -9.072 1.00 0.00 O ATOM 642 CB GLU A 42 -10.774 11.139 -11.300 1.00 0.00 C ATOM 643 CG GLU A 42 -10.942 10.813 -12.775 1.00 0.00 C ATOM 644 CD GLU A 42 -11.331 12.025 -13.600 1.00 0.00 C ATOM 645 OE1 GLU A 42 -10.426 12.789 -13.995 1.00 0.00 O ATOM 646 OE2 GLU A 42 -12.541 12.208 -13.849 1.00 0.00 O ATOM 0 H GLU A 42 -12.081 9.278 -10.132 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.319 9.577 -11.056 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.749 11.380 -10.877 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.154 12.030 -11.202 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -10.010 10.400 -13.160 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.704 10.041 -12.888 1.00 0.00 H new ATOM 653 N ASN A 43 -10.464 10.610 -8.162 1.00 0.00 N ATOM 654 CA ASN A 43 -10.070 11.110 -6.850 1.00 0.00 C ATOM 655 C ASN A 43 -9.013 10.209 -6.218 1.00 0.00 C ATOM 656 O ASN A 43 -7.903 10.650 -5.922 1.00 0.00 O ATOM 657 CB ASN A 43 -11.290 11.207 -5.931 1.00 0.00 C ATOM 658 CG ASN A 43 -12.569 11.489 -6.696 1.00 0.00 C ATOM 659 OD1 ASN A 43 -12.733 12.561 -7.279 1.00 0.00 O ATOM 660 ND2 ASN A 43 -13.482 10.525 -6.696 1.00 0.00 N ATOM 0 H ASN A 43 -11.440 10.321 -8.228 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.642 12.104 -6.981 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.399 10.275 -5.377 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.127 11.996 -5.197 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -14.363 10.657 -7.193 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -13.303 9.653 -6.199 1.00 0.00 H new ATOM 667 N PHE A 44 -9.367 8.944 -6.016 1.00 0.00 N ATOM 668 CA PHE A 44 -8.450 7.980 -5.419 1.00 0.00 C ATOM 669 C PHE A 44 -7.018 8.231 -5.885 1.00 0.00 C ATOM 670 O PHE A 44 -6.081 8.197 -5.088 1.00 0.00 O ATOM 671 CB PHE A 44 -8.872 6.554 -5.777 1.00 0.00 C ATOM 672 CG PHE A 44 -8.213 5.503 -4.929 1.00 0.00 C ATOM 673 CD1 PHE A 44 -6.972 4.994 -5.274 1.00 0.00 C ATOM 674 CD2 PHE A 44 -8.835 5.025 -3.787 1.00 0.00 C ATOM 675 CE1 PHE A 44 -6.364 4.027 -4.496 1.00 0.00 C ATOM 676 CE2 PHE A 44 -8.232 4.058 -3.005 1.00 0.00 C ATOM 677 CZ PHE A 44 -6.994 3.560 -3.360 1.00 0.00 C ATOM 0 H PHE A 44 -10.282 8.563 -6.257 1.00 0.00 H new ATOM 0 HA PHE A 44 -8.488 8.102 -4.336 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.954 6.467 -5.674 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.635 6.366 -6.824 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.474 5.357 -6.161 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -9.803 5.413 -3.504 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.397 3.637 -4.777 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.728 3.693 -2.118 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.519 2.806 -2.750 1.00 0.00 H new ATOM 687 N GLN A 45 -6.859 8.482 -7.180 1.00 0.00 N ATOM 688 CA GLN A 45 -5.543 8.737 -7.752 1.00 0.00 C ATOM 689 C GLN A 45 -4.849 9.887 -7.029 1.00 0.00 C ATOM 690 O GLN A 45 -3.696 9.767 -6.616 1.00 0.00 O ATOM 691 CB GLN A 45 -5.664 9.056 -9.243 1.00 0.00 C ATOM 692 CG GLN A 45 -4.326 9.126 -9.962 1.00 0.00 C ATOM 693 CD GLN A 45 -3.729 10.519 -9.948 1.00 0.00 C ATOM 694 OE1 GLN A 45 -3.601 11.142 -8.893 1.00 0.00 O ATOM 695 NE2 GLN A 45 -3.359 11.016 -11.122 1.00 0.00 N ATOM 0 H GLN A 45 -7.625 8.514 -7.853 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.941 7.837 -7.628 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.283 8.296 -9.719 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.181 10.008 -9.361 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.629 8.431 -9.493 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.455 8.800 -10.994 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -3.483 10.465 -11.971 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -2.950 11.949 -11.175 1.00 0.00 H new ATOM 704 N ASN A 46 -5.559 11.000 -6.880 1.00 0.00 N ATOM 705 CA ASN A 46 -5.010 12.173 -6.208 1.00 0.00 C ATOM 706 C ASN A 46 -4.789 11.895 -4.724 1.00 0.00 C ATOM 707 O ASN A 46 -3.829 12.381 -4.128 1.00 0.00 O ATOM 708 CB ASN A 46 -5.946 13.370 -6.380 1.00 0.00 C ATOM 709 CG ASN A 46 -5.710 14.106 -7.685 1.00 0.00 C ATOM 710 OD1 ASN A 46 -4.569 14.371 -8.063 1.00 0.00 O ATOM 711 ND2 ASN A 46 -6.791 14.440 -8.380 1.00 0.00 N ATOM 0 H ASN A 46 -6.515 11.115 -7.215 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.047 12.405 -6.664 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -6.980 13.028 -6.341 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.807 14.059 -5.547 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -6.695 14.937 -9.266 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.718 14.200 -8.028 1.00 0.00 H new ATOM 718 N TRP A 47 -5.684 11.110 -4.136 1.00 0.00 N ATOM 719 CA TRP A 47 -5.587 10.766 -2.721 1.00 0.00 C ATOM 720 C TRP A 47 -4.226 10.157 -2.401 1.00 0.00 C ATOM 721 O TRP A 47 -3.657 10.409 -1.338 1.00 0.00 O ATOM 722 CB TRP A 47 -6.700 9.791 -2.334 1.00 0.00 C ATOM 723 CG TRP A 47 -6.967 9.749 -0.860 1.00 0.00 C ATOM 724 CD1 TRP A 47 -6.909 10.797 0.014 1.00 0.00 C ATOM 725 CD2 TRP A 47 -7.331 8.600 -0.088 1.00 0.00 C ATOM 726 NE1 TRP A 47 -7.215 10.369 1.283 1.00 0.00 N ATOM 727 CE2 TRP A 47 -7.479 9.025 1.247 1.00 0.00 C ATOM 728 CE3 TRP A 47 -7.549 7.254 -0.394 1.00 0.00 C ATOM 729 CZ2 TRP A 47 -7.834 8.151 2.271 1.00 0.00 C ATOM 730 CZ3 TRP A 47 -7.900 6.388 0.624 1.00 0.00 C ATOM 731 CH2 TRP A 47 -8.041 6.839 1.943 1.00 0.00 C ATOM 0 H TRP A 47 -6.485 10.699 -4.616 1.00 0.00 H new ATOM 0 HA TRP A 47 -5.699 11.682 -2.141 1.00 0.00 H new ATOM 0 HB2 TRP A 47 -7.616 10.072 -2.854 1.00 0.00 H new ATOM 0 HB3 TRP A 47 -6.433 8.791 -2.676 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -6.659 11.813 -0.253 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -7.241 10.956 2.117 1.00 0.00 H new ATOM 0 HE3 TRP A 47 -7.445 6.897 -1.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 -7.942 8.497 3.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 -8.069 5.345 0.399 1.00 0.00 H new ATOM 0 HH2 TRP A 47 -8.318 6.137 2.716 1.00 0.00 H new ATOM 742 N LEU A 48 -3.709 9.356 -3.326 1.00 0.00 N ATOM 743 CA LEU A 48 -2.414 8.711 -3.142 1.00 0.00 C ATOM 744 C LEU A 48 -1.326 9.441 -3.924 1.00 0.00 C ATOM 745 O LEU A 48 -0.137 9.285 -3.647 1.00 0.00 O ATOM 746 CB LEU A 48 -2.483 7.249 -3.586 1.00 0.00 C ATOM 747 CG LEU A 48 -3.796 6.521 -3.299 1.00 0.00 C ATOM 748 CD1 LEU A 48 -3.727 5.082 -3.786 1.00 0.00 C ATOM 749 CD2 LEU A 48 -4.118 6.568 -1.812 1.00 0.00 C ATOM 0 H LEU A 48 -4.167 9.138 -4.211 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.163 8.751 -2.082 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.295 7.207 -4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.675 6.704 -3.099 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.595 7.028 -3.840 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.671 4.580 -3.573 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.544 5.070 -4.860 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.916 4.563 -3.274 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -5.056 6.045 -1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.317 6.087 -1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -4.212 7.606 -1.493 1.00 0.00 H new ATOM 761 N LYS A 49 -1.742 10.241 -4.900 1.00 0.00 N ATOM 762 CA LYS A 49 -0.804 10.999 -5.720 1.00 0.00 C ATOM 763 C LYS A 49 0.254 11.674 -4.853 1.00 0.00 C ATOM 764 O LYS A 49 1.445 11.624 -5.159 1.00 0.00 O ATOM 765 CB LYS A 49 -1.551 12.049 -6.545 1.00 0.00 C ATOM 766 CG LYS A 49 -0.632 13.000 -7.293 1.00 0.00 C ATOM 767 CD LYS A 49 -0.307 14.230 -6.462 1.00 0.00 C ATOM 768 CE LYS A 49 0.873 14.997 -7.039 1.00 0.00 C ATOM 769 NZ LYS A 49 0.548 15.605 -8.359 1.00 0.00 N ATOM 0 H LYS A 49 -2.723 10.381 -5.143 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.304 10.304 -6.395 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.198 11.543 -7.262 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.197 12.626 -5.884 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.291 12.484 -7.557 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.104 13.305 -8.227 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.180 14.882 -6.418 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.082 13.930 -5.439 1.00 0.00 H new ATOM 0 HE2 LYS A 49 1.173 15.780 -6.342 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.724 14.325 -7.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.378 16.119 -8.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.287 14.856 -9.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.248 16.266 -8.250 1.00 0.00 H new ATOM 783 N ASP A 50 -0.189 12.305 -3.771 1.00 0.00 N ATOM 784 CA ASP A 50 0.720 12.989 -2.859 1.00 0.00 C ATOM 785 C ASP A 50 1.598 11.987 -2.115 1.00 0.00 C ATOM 786 O ASP A 50 2.694 12.321 -1.666 1.00 0.00 O ATOM 787 CB ASP A 50 -0.069 13.835 -1.859 1.00 0.00 C ATOM 788 CG ASP A 50 -1.322 13.136 -1.370 1.00 0.00 C ATOM 789 OD1 ASP A 50 -1.195 12.152 -0.611 1.00 0.00 O ATOM 790 OD2 ASP A 50 -2.430 13.574 -1.745 1.00 0.00 O ATOM 0 H ASP A 50 -1.172 12.357 -3.504 1.00 0.00 H new ATOM 0 HA ASP A 50 1.364 13.642 -3.448 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.567 14.072 -1.006 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.343 14.782 -2.325 1.00 0.00 H new ATOM 795 N GLY A 51 1.108 10.758 -1.988 1.00 0.00 N ATOM 796 CA GLY A 51 1.861 9.727 -1.297 1.00 0.00 C ATOM 797 C GLY A 51 1.644 9.757 0.202 1.00 0.00 C ATOM 798 O GLY A 51 1.578 8.712 0.850 1.00 0.00 O ATOM 0 H GLY A 51 0.203 10.458 -2.351 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.572 8.750 -1.683 1.00 0.00 H new ATOM 0 HA3 GLY A 51 2.923 9.852 -1.510 1.00 0.00 H new ATOM 802 N THR A 52 1.535 10.960 0.759 1.00 0.00 N ATOM 803 CA THR A 52 1.327 11.123 2.192 1.00 0.00 C ATOM 804 C THR A 52 0.359 10.075 2.730 1.00 0.00 C ATOM 805 O THR A 52 0.645 9.401 3.720 1.00 0.00 O ATOM 806 CB THR A 52 0.784 12.525 2.525 1.00 0.00 C ATOM 807 OG1 THR A 52 -0.310 12.846 1.659 1.00 0.00 O ATOM 808 CG2 THR A 52 1.876 13.576 2.383 1.00 0.00 C ATOM 0 H THR A 52 1.587 11.836 0.238 1.00 0.00 H new ATOM 0 HA THR A 52 2.299 10.995 2.669 1.00 0.00 H new ATOM 0 HB THR A 52 0.438 12.520 3.559 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.287 12.262 0.873 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.469 14.558 2.623 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.694 13.345 3.065 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.248 13.578 1.358 1.00 0.00 H new ATOM 816 N VAL A 53 -0.788 9.942 2.071 1.00 0.00 N ATOM 817 CA VAL A 53 -1.798 8.974 2.483 1.00 0.00 C ATOM 818 C VAL A 53 -1.226 7.561 2.510 1.00 0.00 C ATOM 819 O VAL A 53 -1.400 6.827 3.484 1.00 0.00 O ATOM 820 CB VAL A 53 -3.019 9.004 1.544 1.00 0.00 C ATOM 821 CG1 VAL A 53 -3.906 7.791 1.783 1.00 0.00 C ATOM 822 CG2 VAL A 53 -3.803 10.294 1.732 1.00 0.00 C ATOM 0 H VAL A 53 -1.041 10.492 1.250 1.00 0.00 H new ATOM 0 HA VAL A 53 -2.114 9.254 3.488 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.665 8.968 0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -4.763 7.829 1.111 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -3.337 6.881 1.594 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -4.254 7.793 2.816 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.662 10.299 1.061 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -4.148 10.363 2.764 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.162 11.146 1.506 1.00 0.00 H new ATOM 832 N LEU A 54 -0.542 7.185 1.434 1.00 0.00 N ATOM 833 CA LEU A 54 0.057 5.858 1.334 1.00 0.00 C ATOM 834 C LEU A 54 0.964 5.579 2.529 1.00 0.00 C ATOM 835 O LEU A 54 1.042 4.447 3.009 1.00 0.00 O ATOM 836 CB LEU A 54 0.854 5.734 0.034 1.00 0.00 C ATOM 837 CG LEU A 54 0.036 5.486 -1.233 1.00 0.00 C ATOM 838 CD1 LEU A 54 0.756 6.045 -2.451 1.00 0.00 C ATOM 839 CD2 LEU A 54 -0.237 3.999 -1.409 1.00 0.00 C ATOM 0 H LEU A 54 -0.389 7.780 0.620 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.747 5.122 1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 54 1.431 6.648 -0.103 1.00 0.00 H new ATOM 0 HB3 LEU A 54 1.569 4.919 0.146 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.919 6.001 -1.132 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.159 5.859 -3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.900 7.118 -2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.726 5.558 -2.555 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.820 3.841 -2.316 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.708 3.462 -1.488 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.795 3.627 -0.549 1.00 0.00 H new ATOM 851 N CYS A 55 1.644 6.616 3.004 1.00 0.00 N ATOM 852 CA CYS A 55 2.544 6.482 4.144 1.00 0.00 C ATOM 853 C CYS A 55 1.778 6.071 5.397 1.00 0.00 C ATOM 854 O CYS A 55 2.112 5.079 6.042 1.00 0.00 O ATOM 855 CB CYS A 55 3.284 7.797 4.392 1.00 0.00 C ATOM 856 SG CYS A 55 4.123 8.459 2.934 1.00 0.00 S ATOM 0 H CYS A 55 1.590 7.559 2.618 1.00 0.00 H new ATOM 0 HA CYS A 55 3.270 5.702 3.913 1.00 0.00 H new ATOM 0 HB2 CYS A 55 2.573 8.538 4.756 1.00 0.00 H new ATOM 0 HB3 CYS A 55 4.019 7.644 5.183 1.00 0.00 H new ATOM 0 HG CYS A 55 3.260 8.629 1.977 1.00 0.00 H new ATOM 862 N GLU A 56 0.749 6.843 5.735 1.00 0.00 N ATOM 863 CA GLU A 56 -0.063 6.559 6.912 1.00 0.00 C ATOM 864 C GLU A 56 -0.480 5.092 6.945 1.00 0.00 C ATOM 865 O GLU A 56 -0.656 4.508 8.016 1.00 0.00 O ATOM 866 CB GLU A 56 -1.304 7.454 6.931 1.00 0.00 C ATOM 867 CG GLU A 56 -0.990 8.926 7.140 1.00 0.00 C ATOM 868 CD GLU A 56 -0.747 9.269 8.596 1.00 0.00 C ATOM 869 OE1 GLU A 56 -1.736 9.405 9.346 1.00 0.00 O ATOM 870 OE2 GLU A 56 0.432 9.403 8.986 1.00 0.00 O ATOM 0 H GLU A 56 0.459 7.669 5.211 1.00 0.00 H new ATOM 0 HA GLU A 56 0.540 6.767 7.796 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -1.841 7.336 5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.972 7.118 7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -0.109 9.192 6.556 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -1.817 9.527 6.762 1.00 0.00 H new ATOM 877 N LEU A 57 -0.637 4.501 5.766 1.00 0.00 N ATOM 878 CA LEU A 57 -1.034 3.101 5.658 1.00 0.00 C ATOM 879 C LEU A 57 0.082 2.180 6.140 1.00 0.00 C ATOM 880 O LEU A 57 -0.044 1.525 7.176 1.00 0.00 O ATOM 881 CB LEU A 57 -1.400 2.764 4.211 1.00 0.00 C ATOM 882 CG LEU A 57 -1.766 1.306 3.934 1.00 0.00 C ATOM 883 CD1 LEU A 57 -3.031 0.922 4.686 1.00 0.00 C ATOM 884 CD2 LEU A 57 -1.941 1.075 2.440 1.00 0.00 C ATOM 0 H LEU A 57 -0.496 4.969 4.871 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.907 2.947 6.292 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.240 3.391 3.914 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.559 3.034 3.572 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.952 0.673 4.286 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.277 -0.119 4.477 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.871 1.049 5.757 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.854 1.560 4.364 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.201 0.032 2.261 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.737 1.717 2.063 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.010 1.310 1.924 1.00 0.00 H new ATOM 896 N ILE A 58 1.174 2.136 5.385 1.00 0.00 N ATOM 897 CA ILE A 58 2.313 1.298 5.737 1.00 0.00 C ATOM 898 C ILE A 58 2.781 1.577 7.161 1.00 0.00 C ATOM 899 O ILE A 58 3.191 0.667 7.880 1.00 0.00 O ATOM 900 CB ILE A 58 3.492 1.514 4.770 1.00 0.00 C ATOM 901 CG1 ILE A 58 4.628 0.542 5.091 1.00 0.00 C ATOM 902 CG2 ILE A 58 3.981 2.953 4.844 1.00 0.00 C ATOM 903 CD1 ILE A 58 4.453 -0.823 4.461 1.00 0.00 C ATOM 0 H ILE A 58 1.294 2.671 4.525 1.00 0.00 H new ATOM 0 HA ILE A 58 1.978 0.263 5.663 1.00 0.00 H new ATOM 0 HB ILE A 58 3.150 1.319 3.754 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.570 0.972 4.751 1.00 0.00 H new ATOM 0 HG13 ILE A 58 4.702 0.427 6.172 1.00 0.00 H new ATOM 0 HG21 ILE A 58 4.814 3.090 4.155 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.170 3.628 4.571 1.00 0.00 H new ATOM 0 HG23 ILE A 58 4.310 3.174 5.859 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.296 -1.459 4.732 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.528 -1.274 4.820 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.409 -0.720 3.377 1.00 0.00 H new ATOM 915 N ASN A 59 2.715 2.843 7.562 1.00 0.00 N ATOM 916 CA ASN A 59 3.131 3.242 8.902 1.00 0.00 C ATOM 917 C ASN A 59 2.185 2.678 9.957 1.00 0.00 C ATOM 918 O ASN A 59 2.616 2.242 11.023 1.00 0.00 O ATOM 919 CB ASN A 59 3.181 4.768 9.009 1.00 0.00 C ATOM 920 CG ASN A 59 4.448 5.348 8.411 1.00 0.00 C ATOM 921 OD1 ASN A 59 5.557 4.983 8.803 1.00 0.00 O ATOM 922 ND2 ASN A 59 4.289 6.258 7.457 1.00 0.00 N ATOM 0 H ASN A 59 2.378 3.609 6.979 1.00 0.00 H new ATOM 0 HA ASN A 59 4.127 2.838 9.081 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.315 5.194 8.502 1.00 0.00 H new ATOM 0 HB3 ASN A 59 3.111 5.059 10.057 1.00 0.00 H new ATOM 0 HD21 ASN A 59 5.105 6.684 7.018 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.351 6.530 7.163 1.00 0.00 H new ATOM 929 N ALA A 60 0.892 2.689 9.650 1.00 0.00 N ATOM 930 CA ALA A 60 -0.116 2.177 10.570 1.00 0.00 C ATOM 931 C ALA A 60 0.180 0.732 10.959 1.00 0.00 C ATOM 932 O ALA A 60 0.097 0.365 12.132 1.00 0.00 O ATOM 933 CB ALA A 60 -1.501 2.285 9.949 1.00 0.00 C ATOM 0 H ALA A 60 0.518 3.047 8.771 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.088 2.783 11.475 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.244 1.899 10.647 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.720 3.329 9.727 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -1.533 1.704 9.027 1.00 0.00 H new ATOM 939 N LEU A 61 0.525 -0.083 9.969 1.00 0.00 N ATOM 940 CA LEU A 61 0.833 -1.489 10.208 1.00 0.00 C ATOM 941 C LEU A 61 2.000 -1.633 11.179 1.00 0.00 C ATOM 942 O LEU A 61 1.838 -2.139 12.290 1.00 0.00 O ATOM 943 CB LEU A 61 1.163 -2.191 8.889 1.00 0.00 C ATOM 944 CG LEU A 61 0.142 -2.018 7.764 1.00 0.00 C ATOM 945 CD1 LEU A 61 0.810 -2.179 6.407 1.00 0.00 C ATOM 946 CD2 LEU A 61 -0.998 -3.015 7.920 1.00 0.00 C ATOM 0 H LEU A 61 0.599 0.205 8.993 1.00 0.00 H new ATOM 0 HA LEU A 61 -0.045 -1.957 10.652 1.00 0.00 H new ATOM 0 HB2 LEU A 61 2.127 -1.825 8.537 1.00 0.00 H new ATOM 0 HB3 LEU A 61 1.279 -3.257 9.087 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.271 -1.011 7.826 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.068 -2.053 5.619 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.591 -1.427 6.294 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.251 -3.173 6.334 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.715 -2.877 7.111 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.601 -4.030 7.885 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.495 -2.853 8.877 1.00 0.00 H new ATOM 958 N TYR A 62 3.176 -1.184 10.754 1.00 0.00 N ATOM 959 CA TYR A 62 4.371 -1.263 11.586 1.00 0.00 C ATOM 960 C TYR A 62 4.188 -0.472 12.878 1.00 0.00 C ATOM 961 O TYR A 62 3.549 0.579 12.907 1.00 0.00 O ATOM 962 CB TYR A 62 5.586 -0.738 10.820 1.00 0.00 C ATOM 963 CG TYR A 62 6.177 -1.743 9.857 1.00 0.00 C ATOM 964 CD1 TYR A 62 6.794 -2.898 10.321 1.00 0.00 C ATOM 965 CD2 TYR A 62 6.117 -1.538 8.485 1.00 0.00 C ATOM 966 CE1 TYR A 62 7.336 -3.819 9.445 1.00 0.00 C ATOM 967 CE2 TYR A 62 6.655 -2.454 7.601 1.00 0.00 C ATOM 968 CZ TYR A 62 7.263 -3.593 8.086 1.00 0.00 C ATOM 969 OH TYR A 62 7.800 -4.508 7.210 1.00 0.00 O ATOM 0 H TYR A 62 3.327 -0.761 9.838 1.00 0.00 H new ATOM 0 HA TYR A 62 4.537 -2.309 11.843 1.00 0.00 H new ATOM 0 HB2 TYR A 62 5.298 0.156 10.267 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.353 -0.438 11.534 1.00 0.00 H new ATOM 0 HD1 TYR A 62 6.851 -3.079 11.384 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.642 -0.647 8.102 1.00 0.00 H new ATOM 0 HE1 TYR A 62 7.814 -4.711 9.822 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.600 -2.279 6.537 1.00 0.00 H new ATOM 0 HH TYR A 62 7.752 -5.404 7.603 1.00 0.00 H new ATOM 979 N PRO A 63 4.764 -0.990 13.973 1.00 0.00 N ATOM 980 CA PRO A 63 4.681 -0.349 15.289 1.00 0.00 C ATOM 981 C PRO A 63 5.487 0.944 15.356 1.00 0.00 C ATOM 982 O PRO A 63 5.976 1.434 14.338 1.00 0.00 O ATOM 983 CB PRO A 63 5.274 -1.398 16.232 1.00 0.00 C ATOM 984 CG PRO A 63 6.178 -2.213 15.373 1.00 0.00 C ATOM 985 CD PRO A 63 5.542 -2.240 14.011 1.00 0.00 C ATOM 0 HA PRO A 63 3.660 -0.060 15.538 1.00 0.00 H new ATOM 0 HB2 PRO A 63 5.821 -0.930 17.050 1.00 0.00 H new ATOM 0 HB3 PRO A 63 4.494 -2.013 16.681 1.00 0.00 H new ATOM 0 HG2 PRO A 63 7.175 -1.775 15.329 1.00 0.00 H new ATOM 0 HG3 PRO A 63 6.290 -3.221 15.771 1.00 0.00 H new ATOM 0 HD2 PRO A 63 6.290 -2.272 13.219 1.00 0.00 H new ATOM 0 HD3 PRO A 63 4.904 -3.114 13.883 1.00 0.00 H new ATOM 993 N GLU A 64 5.622 1.490 16.560 1.00 0.00 N ATOM 994 CA GLU A 64 6.370 2.726 16.758 1.00 0.00 C ATOM 995 C GLU A 64 7.863 2.501 16.538 1.00 0.00 C ATOM 996 O GLU A 64 8.454 1.583 17.105 1.00 0.00 O ATOM 997 CB GLU A 64 6.128 3.275 18.166 1.00 0.00 C ATOM 998 CG GLU A 64 4.679 3.646 18.434 1.00 0.00 C ATOM 999 CD GLU A 64 4.479 4.264 19.804 1.00 0.00 C ATOM 1000 OE1 GLU A 64 4.413 3.505 20.794 1.00 0.00 O ATOM 1001 OE2 GLU A 64 4.389 5.507 19.887 1.00 0.00 O ATOM 0 H GLU A 64 5.224 1.096 17.413 1.00 0.00 H new ATOM 0 HA GLU A 64 6.019 3.454 16.026 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.445 2.531 18.896 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.753 4.155 18.316 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.340 4.346 17.671 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.058 2.755 18.347 1.00 0.00 H new ATOM 1008 N GLY A 65 8.467 3.346 15.708 1.00 0.00 N ATOM 1009 CA GLY A 65 9.885 3.222 15.426 1.00 0.00 C ATOM 1010 C GLY A 65 10.161 2.371 14.202 1.00 0.00 C ATOM 1011 O GLY A 65 10.920 2.771 13.319 1.00 0.00 O ATOM 0 H GLY A 65 8.000 4.114 15.226 1.00 0.00 H new ATOM 0 HA2 GLY A 65 10.311 4.214 15.278 1.00 0.00 H new ATOM 0 HA3 GLY A 65 10.387 2.785 16.289 1.00 0.00 H new ATOM 1015 N GLN A 66 9.545 1.195 14.150 1.00 0.00 N ATOM 1016 CA GLN A 66 9.730 0.285 13.026 1.00 0.00 C ATOM 1017 C GLN A 66 9.277 0.931 11.722 1.00 0.00 C ATOM 1018 O GLN A 66 9.891 0.733 10.673 1.00 0.00 O ATOM 1019 CB GLN A 66 8.957 -1.014 13.261 1.00 0.00 C ATOM 1020 CG GLN A 66 9.748 -2.064 14.024 1.00 0.00 C ATOM 1021 CD GLN A 66 9.602 -1.928 15.527 1.00 0.00 C ATOM 1022 OE1 GLN A 66 9.815 -0.853 16.088 1.00 0.00 O ATOM 1023 NE2 GLN A 66 9.235 -3.020 16.187 1.00 0.00 N ATOM 0 H GLN A 66 8.914 0.850 14.873 1.00 0.00 H new ATOM 0 HA GLN A 66 10.793 0.058 12.947 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.043 -0.789 13.811 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.656 -1.427 12.298 1.00 0.00 H new ATOM 0 HG2 GLN A 66 9.416 -3.056 13.719 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.802 -1.985 13.757 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.069 -3.890 15.681 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.119 -2.989 17.200 1.00 0.00 H new ATOM 1032 N ALA A 67 8.199 1.705 11.793 1.00 0.00 N ATOM 1033 CA ALA A 67 7.665 2.382 10.618 1.00 0.00 C ATOM 1034 C ALA A 67 8.786 2.851 9.697 1.00 0.00 C ATOM 1035 O ALA A 67 9.693 3.577 10.104 1.00 0.00 O ATOM 1036 CB ALA A 67 6.796 3.559 11.037 1.00 0.00 C ATOM 0 H ALA A 67 7.678 1.879 12.653 1.00 0.00 H new ATOM 0 HA ALA A 67 7.052 1.670 10.066 1.00 0.00 H new ATOM 0 HB1 ALA A 67 6.404 4.056 10.150 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.968 3.200 11.648 1.00 0.00 H new ATOM 0 HB3 ALA A 67 7.393 4.265 11.614 1.00 0.00 H new ATOM 1042 N PRO A 68 8.726 2.426 8.427 1.00 0.00 N ATOM 1043 CA PRO A 68 9.729 2.790 7.422 1.00 0.00 C ATOM 1044 C PRO A 68 9.655 4.263 7.036 1.00 0.00 C ATOM 1045 O PRO A 68 10.676 4.898 6.771 1.00 0.00 O ATOM 1046 CB PRO A 68 9.371 1.905 6.225 1.00 0.00 C ATOM 1047 CG PRO A 68 7.918 1.616 6.390 1.00 0.00 C ATOM 1048 CD PRO A 68 7.673 1.558 7.873 1.00 0.00 C ATOM 0 HA PRO A 68 10.745 2.643 7.789 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.569 2.415 5.282 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.959 0.987 6.221 1.00 0.00 H new ATOM 0 HG2 PRO A 68 7.310 2.392 5.924 1.00 0.00 H new ATOM 0 HG3 PRO A 68 7.651 0.673 5.913 1.00 0.00 H new ATOM 0 HD2 PRO A 68 6.677 1.920 8.130 1.00 0.00 H new ATOM 0 HD3 PRO A 68 7.750 0.540 8.254 1.00 0.00 H new ATOM 1056 N VAL A 69 8.440 4.802 7.007 1.00 0.00 N ATOM 1057 CA VAL A 69 8.233 6.202 6.655 1.00 0.00 C ATOM 1058 C VAL A 69 7.756 7.007 7.859 1.00 0.00 C ATOM 1059 O VAL A 69 6.555 7.176 8.070 1.00 0.00 O ATOM 1060 CB VAL A 69 7.208 6.348 5.515 1.00 0.00 C ATOM 1061 CG1 VAL A 69 6.892 7.815 5.265 1.00 0.00 C ATOM 1062 CG2 VAL A 69 7.723 5.682 4.247 1.00 0.00 C ATOM 0 H VAL A 69 7.584 4.290 7.223 1.00 0.00 H new ATOM 0 HA VAL A 69 9.195 6.590 6.321 1.00 0.00 H new ATOM 0 HB VAL A 69 6.286 5.848 5.813 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.166 7.898 4.456 1.00 0.00 H new ATOM 0 HG12 VAL A 69 6.478 8.258 6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.805 8.342 4.988 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.986 5.795 3.452 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.659 6.151 3.944 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.893 4.622 4.436 1.00 0.00 H new ATOM 1072 N LYS A 70 8.705 7.501 8.647 1.00 0.00 N ATOM 1073 CA LYS A 70 8.383 8.290 9.830 1.00 0.00 C ATOM 1074 C LYS A 70 8.134 9.749 9.459 1.00 0.00 C ATOM 1075 O LYS A 70 7.272 10.409 10.040 1.00 0.00 O ATOM 1076 CB LYS A 70 9.518 8.200 10.853 1.00 0.00 C ATOM 1077 CG LYS A 70 9.726 6.801 11.407 1.00 0.00 C ATOM 1078 CD LYS A 70 8.615 6.410 12.367 1.00 0.00 C ATOM 1079 CE LYS A 70 8.938 6.829 13.793 1.00 0.00 C ATOM 1080 NZ LYS A 70 8.539 8.238 14.060 1.00 0.00 N ATOM 0 H LYS A 70 9.704 7.369 8.488 1.00 0.00 H new ATOM 0 HA LYS A 70 7.472 7.884 10.270 1.00 0.00 H new ATOM 0 HB2 LYS A 70 10.443 8.539 10.388 1.00 0.00 H new ATOM 0 HB3 LYS A 70 9.308 8.881 11.678 1.00 0.00 H new ATOM 0 HG2 LYS A 70 9.767 6.086 10.585 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.686 6.751 11.921 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.681 6.875 12.053 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.463 5.331 12.329 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.425 6.168 14.491 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.007 6.714 13.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.273 8.340 15.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.337 8.871 13.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.729 8.489 13.459 1.00 0.00 H new ATOM 1094 N LYS A 71 8.892 10.246 8.488 1.00 0.00 N ATOM 1095 CA LYS A 71 8.752 11.626 8.038 1.00 0.00 C ATOM 1096 C LYS A 71 7.617 11.756 7.028 1.00 0.00 C ATOM 1097 O LYS A 71 7.811 11.541 5.831 1.00 0.00 O ATOM 1098 CB LYS A 71 10.062 12.116 7.415 1.00 0.00 C ATOM 1099 CG LYS A 71 11.047 12.671 8.429 1.00 0.00 C ATOM 1100 CD LYS A 71 10.822 14.153 8.673 1.00 0.00 C ATOM 1101 CE LYS A 71 9.604 14.395 9.551 1.00 0.00 C ATOM 1102 NZ LYS A 71 9.666 15.717 10.235 1.00 0.00 N ATOM 0 H LYS A 71 9.610 9.713 7.997 1.00 0.00 H new ATOM 0 HA LYS A 71 8.516 12.243 8.905 1.00 0.00 H new ATOM 0 HB2 LYS A 71 10.531 11.291 6.879 1.00 0.00 H new ATOM 0 HB3 LYS A 71 9.838 12.888 6.678 1.00 0.00 H new ATOM 0 HG2 LYS A 71 10.948 12.128 9.369 1.00 0.00 H new ATOM 0 HG3 LYS A 71 12.065 12.510 8.074 1.00 0.00 H new ATOM 0 HD2 LYS A 71 11.705 14.583 9.147 1.00 0.00 H new ATOM 0 HD3 LYS A 71 10.692 14.664 7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.701 14.343 8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 71 9.531 13.603 10.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.818 15.844 10.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 10.514 15.757 10.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.710 16.474 9.524 1.00 0.00 H new ATOM 1116 N ILE A 72 6.434 12.110 7.517 1.00 0.00 N ATOM 1117 CA ILE A 72 5.269 12.271 6.656 1.00 0.00 C ATOM 1118 C ILE A 72 4.831 13.730 6.591 1.00 0.00 C ATOM 1119 O ILE A 72 4.496 14.334 7.610 1.00 0.00 O ATOM 1120 CB ILE A 72 4.086 11.413 7.142 1.00 0.00 C ATOM 1121 CG1 ILE A 72 4.576 10.031 7.579 1.00 0.00 C ATOM 1122 CG2 ILE A 72 3.037 11.288 6.047 1.00 0.00 C ATOM 1123 CD1 ILE A 72 3.561 9.260 8.393 1.00 0.00 C ATOM 0 H ILE A 72 6.257 12.291 8.505 1.00 0.00 H new ATOM 0 HA ILE A 72 5.564 11.938 5.661 1.00 0.00 H new ATOM 0 HB ILE A 72 3.629 11.904 8.001 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.837 9.450 6.694 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.488 10.146 8.165 1.00 0.00 H new ATOM 0 HG21 ILE A 72 2.207 10.679 6.406 1.00 0.00 H new ATOM 0 HG22 ILE A 72 2.670 12.279 5.780 1.00 0.00 H new ATOM 0 HG23 ILE A 72 3.481 10.816 5.170 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.976 8.290 8.668 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.318 9.820 9.296 1.00 0.00 H new ATOM 0 HD13 ILE A 72 2.657 9.113 7.802 1.00 0.00 H new ATOM 1135 N GLN A 73 4.834 14.290 5.385 1.00 0.00 N ATOM 1136 CA GLN A 73 4.436 15.679 5.187 1.00 0.00 C ATOM 1137 C GLN A 73 3.908 15.898 3.773 1.00 0.00 C ATOM 1138 O GLN A 73 4.407 15.306 2.816 1.00 0.00 O ATOM 1139 CB GLN A 73 5.617 16.614 5.454 1.00 0.00 C ATOM 1140 CG GLN A 73 5.289 18.083 5.246 1.00 0.00 C ATOM 1141 CD GLN A 73 6.281 19.005 5.928 1.00 0.00 C ATOM 1142 OE1 GLN A 73 6.082 19.412 7.072 1.00 0.00 O ATOM 1143 NE2 GLN A 73 7.358 19.338 5.227 1.00 0.00 N ATOM 0 H GLN A 73 5.107 13.804 4.531 1.00 0.00 H new ATOM 0 HA GLN A 73 3.637 15.905 5.893 1.00 0.00 H new ATOM 0 HB2 GLN A 73 5.960 16.469 6.478 1.00 0.00 H new ATOM 0 HB3 GLN A 73 6.443 16.338 4.799 1.00 0.00 H new ATOM 0 HG2 GLN A 73 5.272 18.300 4.178 1.00 0.00 H new ATOM 0 HG3 GLN A 73 4.288 18.286 5.628 1.00 0.00 H new ATOM 0 HE21 GLN A 73 7.483 18.977 4.281 1.00 0.00 H new ATOM 0 HE22 GLN A 73 8.061 19.955 5.634 1.00 0.00 H new ATOM 1152 N ALA A 74 2.897 16.751 3.650 1.00 0.00 N ATOM 1153 CA ALA A 74 2.303 17.049 2.352 1.00 0.00 C ATOM 1154 C ALA A 74 2.996 18.236 1.691 1.00 0.00 C ATOM 1155 O ALA A 74 2.807 19.382 2.096 1.00 0.00 O ATOM 1156 CB ALA A 74 0.814 17.323 2.504 1.00 0.00 C ATOM 0 H ALA A 74 2.472 17.248 4.433 1.00 0.00 H new ATOM 0 HA ALA A 74 2.438 16.179 1.710 1.00 0.00 H new ATOM 0 HB1 ALA A 74 0.383 17.544 1.527 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.324 16.446 2.927 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.667 18.176 3.167 1.00 0.00 H new ATOM 1162 N SER A 75 3.801 17.952 0.671 1.00 0.00 N ATOM 1163 CA SER A 75 4.526 18.995 -0.044 1.00 0.00 C ATOM 1164 C SER A 75 3.950 19.197 -1.442 1.00 0.00 C ATOM 1165 O SER A 75 3.752 18.239 -2.190 1.00 0.00 O ATOM 1166 CB SER A 75 6.011 18.641 -0.138 1.00 0.00 C ATOM 1167 OG SER A 75 6.644 18.757 1.124 1.00 0.00 O ATOM 0 H SER A 75 3.967 17.008 0.322 1.00 0.00 H new ATOM 0 HA SER A 75 4.416 19.926 0.513 1.00 0.00 H new ATOM 0 HB2 SER A 75 6.122 17.623 -0.512 1.00 0.00 H new ATOM 0 HB3 SER A 75 6.500 19.300 -0.856 1.00 0.00 H new ATOM 0 HG SER A 75 7.592 18.524 1.037 1.00 0.00 H new ATOM 1173 N THR A 76 3.682 20.452 -1.790 1.00 0.00 N ATOM 1174 CA THR A 76 3.127 20.781 -3.096 1.00 0.00 C ATOM 1175 C THR A 76 4.097 20.414 -4.214 1.00 0.00 C ATOM 1176 O THR A 76 3.682 20.042 -5.311 1.00 0.00 O ATOM 1177 CB THR A 76 2.786 22.280 -3.201 1.00 0.00 C ATOM 1178 OG1 THR A 76 1.983 22.678 -2.084 1.00 0.00 O ATOM 1179 CG2 THR A 76 2.046 22.578 -4.496 1.00 0.00 C ATOM 0 H THR A 76 3.841 21.257 -1.184 1.00 0.00 H new ATOM 0 HA THR A 76 2.212 20.199 -3.206 1.00 0.00 H new ATOM 0 HB THR A 76 3.719 22.844 -3.197 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.772 23.632 -2.157 1.00 0.00 H new ATOM 0 HG21 THR A 76 1.816 23.642 -4.547 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.671 22.301 -5.345 1.00 0.00 H new ATOM 0 HG23 THR A 76 1.119 22.005 -4.526 1.00 0.00 H new ATOM 1187 N MET A 77 5.390 20.519 -3.927 1.00 0.00 N ATOM 1188 CA MET A 77 6.419 20.196 -4.908 1.00 0.00 C ATOM 1189 C MET A 77 6.061 18.925 -5.673 1.00 0.00 C ATOM 1190 O MET A 77 5.849 17.870 -5.076 1.00 0.00 O ATOM 1191 CB MET A 77 7.775 20.026 -4.220 1.00 0.00 C ATOM 1192 CG MET A 77 8.526 21.333 -4.026 1.00 0.00 C ATOM 1193 SD MET A 77 10.314 21.104 -3.962 1.00 0.00 S ATOM 1194 CE MET A 77 10.531 20.610 -2.254 1.00 0.00 C ATOM 0 H MET A 77 5.750 20.825 -3.023 1.00 0.00 H new ATOM 0 HA MET A 77 6.481 21.021 -5.618 1.00 0.00 H new ATOM 0 HB2 MET A 77 7.624 19.556 -3.248 1.00 0.00 H new ATOM 0 HB3 MET A 77 8.390 19.347 -4.810 1.00 0.00 H new ATOM 0 HG2 MET A 77 8.280 22.013 -4.841 1.00 0.00 H new ATOM 0 HG3 MET A 77 8.191 21.807 -3.103 1.00 0.00 H new ATOM 0 HE1 MET A 77 11.031 21.408 -1.705 1.00 0.00 H new ATOM 0 HE2 MET A 77 9.557 20.416 -1.805 1.00 0.00 H new ATOM 0 HE3 MET A 77 11.137 19.705 -2.211 1.00 0.00 H new ATOM 1204 N ALA A 78 5.995 19.035 -6.995 1.00 0.00 N ATOM 1205 CA ALA A 78 5.664 17.894 -7.841 1.00 0.00 C ATOM 1206 C ALA A 78 6.740 16.817 -7.755 1.00 0.00 C ATOM 1207 O ALA A 78 6.484 15.646 -8.038 1.00 0.00 O ATOM 1208 CB ALA A 78 5.476 18.343 -9.282 1.00 0.00 C ATOM 0 H ALA A 78 6.166 19.902 -7.504 1.00 0.00 H new ATOM 0 HA ALA A 78 4.729 17.465 -7.482 1.00 0.00 H new ATOM 0 HB1 ALA A 78 5.229 17.481 -9.902 1.00 0.00 H new ATOM 0 HB2 ALA A 78 4.666 19.071 -9.334 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.397 18.799 -9.644 1.00 0.00 H new ATOM 1214 N PHE A 79 7.944 17.220 -7.365 1.00 0.00 N ATOM 1215 CA PHE A 79 9.060 16.289 -7.244 1.00 0.00 C ATOM 1216 C PHE A 79 8.959 15.483 -5.952 1.00 0.00 C ATOM 1217 O PHE A 79 8.976 14.252 -5.972 1.00 0.00 O ATOM 1218 CB PHE A 79 10.389 17.046 -7.283 1.00 0.00 C ATOM 1219 CG PHE A 79 11.507 16.330 -6.580 1.00 0.00 C ATOM 1220 CD1 PHE A 79 12.014 15.143 -7.084 1.00 0.00 C ATOM 1221 CD2 PHE A 79 12.051 16.845 -5.414 1.00 0.00 C ATOM 1222 CE1 PHE A 79 13.043 14.483 -6.440 1.00 0.00 C ATOM 1223 CE2 PHE A 79 13.080 16.188 -4.765 1.00 0.00 C ATOM 1224 CZ PHE A 79 13.576 15.006 -5.278 1.00 0.00 C ATOM 0 H PHE A 79 8.172 18.185 -7.127 1.00 0.00 H new ATOM 0 HA PHE A 79 9.018 15.599 -8.086 1.00 0.00 H new ATOM 0 HB2 PHE A 79 10.672 17.214 -8.322 1.00 0.00 H new ATOM 0 HB3 PHE A 79 10.253 18.027 -6.827 1.00 0.00 H new ATOM 0 HD1 PHE A 79 11.600 14.729 -7.991 1.00 0.00 H new ATOM 0 HD2 PHE A 79 11.667 17.769 -5.008 1.00 0.00 H new ATOM 0 HE1 PHE A 79 13.430 13.559 -6.845 1.00 0.00 H new ATOM 0 HE2 PHE A 79 13.496 16.599 -3.857 1.00 0.00 H new ATOM 0 HZ PHE A 79 14.379 14.491 -4.772 1.00 0.00 H new ATOM 1234 N LYS A 80 8.853 16.186 -4.830 1.00 0.00 N ATOM 1235 CA LYS A 80 8.748 15.539 -3.528 1.00 0.00 C ATOM 1236 C LYS A 80 7.657 14.472 -3.537 1.00 0.00 C ATOM 1237 O LYS A 80 7.927 13.295 -3.300 1.00 0.00 O ATOM 1238 CB LYS A 80 8.452 16.576 -2.442 1.00 0.00 C ATOM 1239 CG LYS A 80 9.689 17.301 -1.941 1.00 0.00 C ATOM 1240 CD LYS A 80 10.334 16.567 -0.778 1.00 0.00 C ATOM 1241 CE LYS A 80 11.471 17.374 -0.170 1.00 0.00 C ATOM 1242 NZ LYS A 80 12.773 17.083 -0.831 1.00 0.00 N ATOM 0 H LYS A 80 8.838 17.205 -4.796 1.00 0.00 H new ATOM 0 HA LYS A 80 9.702 15.057 -3.312 1.00 0.00 H new ATOM 0 HB2 LYS A 80 7.745 17.308 -2.833 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.966 16.081 -1.601 1.00 0.00 H new ATOM 0 HG2 LYS A 80 10.408 17.399 -2.754 1.00 0.00 H new ATOM 0 HG3 LYS A 80 9.419 18.310 -1.630 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.583 16.362 -0.015 1.00 0.00 H new ATOM 0 HD3 LYS A 80 10.713 15.604 -1.120 1.00 0.00 H new ATOM 0 HE2 LYS A 80 11.249 18.438 -0.258 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.546 17.151 0.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 13.522 17.653 -0.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 12.998 16.073 -0.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 12.710 17.320 -1.842 1.00 0.00 H new ATOM 1256 N GLN A 81 6.427 14.893 -3.813 1.00 0.00 N ATOM 1257 CA GLN A 81 5.297 13.972 -3.853 1.00 0.00 C ATOM 1258 C GLN A 81 5.715 12.622 -4.424 1.00 0.00 C ATOM 1259 O GLN A 81 5.704 11.610 -3.723 1.00 0.00 O ATOM 1260 CB GLN A 81 4.160 14.563 -4.689 1.00 0.00 C ATOM 1261 CG GLN A 81 3.653 15.898 -4.170 1.00 0.00 C ATOM 1262 CD GLN A 81 2.784 15.752 -2.936 1.00 0.00 C ATOM 1263 OE1 GLN A 81 2.967 14.832 -2.139 1.00 0.00 O ATOM 1264 NE2 GLN A 81 1.831 16.662 -2.772 1.00 0.00 N ATOM 0 H GLN A 81 6.188 15.864 -4.012 1.00 0.00 H new ATOM 0 HA GLN A 81 4.947 13.821 -2.832 1.00 0.00 H new ATOM 0 HB2 GLN A 81 4.503 14.689 -5.716 1.00 0.00 H new ATOM 0 HB3 GLN A 81 3.332 13.854 -4.714 1.00 0.00 H new ATOM 0 HG2 GLN A 81 4.503 16.540 -3.937 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.083 16.396 -4.954 1.00 0.00 H new ATOM 0 HE21 GLN A 81 1.715 17.408 -3.458 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.215 16.615 -1.960 1.00 0.00 H new ATOM 1273 N MET A 82 6.083 12.613 -5.701 1.00 0.00 N ATOM 1274 CA MET A 82 6.505 11.386 -6.366 1.00 0.00 C ATOM 1275 C MET A 82 7.344 10.521 -5.430 1.00 0.00 C ATOM 1276 O MET A 82 6.989 9.379 -5.142 1.00 0.00 O ATOM 1277 CB MET A 82 7.305 11.714 -7.629 1.00 0.00 C ATOM 1278 CG MET A 82 6.436 11.944 -8.855 1.00 0.00 C ATOM 1279 SD MET A 82 7.396 12.033 -10.379 1.00 0.00 S ATOM 1280 CE MET A 82 7.490 13.805 -10.617 1.00 0.00 C ATOM 0 H MET A 82 6.097 13.442 -6.296 1.00 0.00 H new ATOM 0 HA MET A 82 5.611 10.828 -6.645 1.00 0.00 H new ATOM 0 HB2 MET A 82 7.906 12.605 -7.447 1.00 0.00 H new ATOM 0 HB3 MET A 82 7.998 10.898 -7.833 1.00 0.00 H new ATOM 0 HG2 MET A 82 5.707 11.137 -8.936 1.00 0.00 H new ATOM 0 HG3 MET A 82 5.874 12.870 -8.729 1.00 0.00 H new ATOM 0 HE1 MET A 82 7.145 14.056 -11.620 1.00 0.00 H new ATOM 0 HE2 MET A 82 6.861 14.305 -9.881 1.00 0.00 H new ATOM 0 HE3 MET A 82 8.522 14.134 -10.496 1.00 0.00 H new ATOM 1290 N GLU A 83 8.457 11.074 -4.959 1.00 0.00 N ATOM 1291 CA GLU A 83 9.345 10.352 -4.056 1.00 0.00 C ATOM 1292 C GLU A 83 8.570 9.775 -2.875 1.00 0.00 C ATOM 1293 O GLU A 83 8.852 8.670 -2.415 1.00 0.00 O ATOM 1294 CB GLU A 83 10.455 11.275 -3.549 1.00 0.00 C ATOM 1295 CG GLU A 83 11.288 10.670 -2.432 1.00 0.00 C ATOM 1296 CD GLU A 83 12.411 9.792 -2.952 1.00 0.00 C ATOM 1297 OE1 GLU A 83 13.357 10.337 -3.557 1.00 0.00 O ATOM 1298 OE2 GLU A 83 12.342 8.561 -2.753 1.00 0.00 O ATOM 0 H GLU A 83 8.765 12.019 -5.188 1.00 0.00 H new ATOM 0 HA GLU A 83 9.793 9.528 -4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 83 11.110 11.532 -4.381 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.009 12.205 -3.196 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.709 11.470 -1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 83 10.643 10.081 -1.781 1.00 0.00 H new ATOM 1305 N GLN A 84 7.591 10.533 -2.391 1.00 0.00 N ATOM 1306 CA GLN A 84 6.776 10.099 -1.263 1.00 0.00 C ATOM 1307 C GLN A 84 6.134 8.744 -1.546 1.00 0.00 C ATOM 1308 O GLN A 84 5.956 7.930 -0.639 1.00 0.00 O ATOM 1309 CB GLN A 84 5.693 11.136 -0.960 1.00 0.00 C ATOM 1310 CG GLN A 84 5.283 11.177 0.504 1.00 0.00 C ATOM 1311 CD GLN A 84 6.418 11.599 1.416 1.00 0.00 C ATOM 1312 OE1 GLN A 84 7.502 11.957 0.953 1.00 0.00 O ATOM 1313 NE2 GLN A 84 6.176 11.559 2.721 1.00 0.00 N ATOM 0 H GLN A 84 7.343 11.450 -2.762 1.00 0.00 H new ATOM 0 HA GLN A 84 7.426 9.999 -0.394 1.00 0.00 H new ATOM 0 HB2 GLN A 84 6.052 12.122 -1.256 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.815 10.921 -1.569 1.00 0.00 H new ATOM 0 HG2 GLN A 84 4.449 11.868 0.625 1.00 0.00 H new ATOM 0 HG3 GLN A 84 4.927 10.192 0.805 1.00 0.00 H new ATOM 0 HE21 GLN A 84 5.263 11.256 3.061 1.00 0.00 H new ATOM 0 HE22 GLN A 84 6.903 11.831 3.383 1.00 0.00 H new ATOM 1322 N ILE A 85 5.788 8.511 -2.807 1.00 0.00 N ATOM 1323 CA ILE A 85 5.167 7.255 -3.208 1.00 0.00 C ATOM 1324 C ILE A 85 6.178 6.113 -3.199 1.00 0.00 C ATOM 1325 O ILE A 85 5.866 4.997 -2.786 1.00 0.00 O ATOM 1326 CB ILE A 85 4.540 7.359 -4.611 1.00 0.00 C ATOM 1327 CG1 ILE A 85 3.488 8.470 -4.642 1.00 0.00 C ATOM 1328 CG2 ILE A 85 3.926 6.028 -5.017 1.00 0.00 C ATOM 1329 CD1 ILE A 85 2.983 8.785 -6.033 1.00 0.00 C ATOM 0 H ILE A 85 5.927 9.175 -3.569 1.00 0.00 H new ATOM 0 HA ILE A 85 4.381 7.047 -2.482 1.00 0.00 H new ATOM 0 HB ILE A 85 5.324 7.607 -5.326 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.645 8.179 -4.015 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.913 9.374 -4.205 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.487 6.118 -6.011 1.00 0.00 H new ATOM 0 HG22 ILE A 85 4.699 5.260 -5.030 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.151 5.751 -4.302 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.241 9.581 -5.979 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.816 9.107 -6.658 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.528 7.894 -6.466 1.00 0.00 H new ATOM 1341 N SER A 86 7.392 6.403 -3.656 1.00 0.00 N ATOM 1342 CA SER A 86 8.450 5.400 -3.703 1.00 0.00 C ATOM 1343 C SER A 86 8.803 4.917 -2.300 1.00 0.00 C ATOM 1344 O SER A 86 9.116 3.744 -2.097 1.00 0.00 O ATOM 1345 CB SER A 86 9.694 5.972 -4.385 1.00 0.00 C ATOM 1346 OG SER A 86 9.401 6.403 -5.703 1.00 0.00 O ATOM 0 H SER A 86 7.667 7.323 -3.999 1.00 0.00 H new ATOM 0 HA SER A 86 8.086 4.550 -4.280 1.00 0.00 H new ATOM 0 HB2 SER A 86 10.079 6.809 -3.803 1.00 0.00 H new ATOM 0 HB3 SER A 86 10.478 5.215 -4.412 1.00 0.00 H new ATOM 0 HG SER A 86 10.212 6.765 -6.117 1.00 0.00 H new ATOM 1352 N GLN A 87 8.750 5.830 -1.335 1.00 0.00 N ATOM 1353 CA GLN A 87 9.064 5.497 0.049 1.00 0.00 C ATOM 1354 C GLN A 87 8.177 4.363 0.552 1.00 0.00 C ATOM 1355 O GLN A 87 8.622 3.502 1.311 1.00 0.00 O ATOM 1356 CB GLN A 87 8.895 6.727 0.942 1.00 0.00 C ATOM 1357 CG GLN A 87 9.943 7.802 0.702 1.00 0.00 C ATOM 1358 CD GLN A 87 9.931 8.877 1.771 1.00 0.00 C ATOM 1359 OE1 GLN A 87 10.059 8.588 2.961 1.00 0.00 O ATOM 1360 NE2 GLN A 87 9.778 10.128 1.351 1.00 0.00 N ATOM 0 H GLN A 87 8.493 6.805 -1.486 1.00 0.00 H new ATOM 0 HA GLN A 87 10.102 5.166 0.090 1.00 0.00 H new ATOM 0 HB2 GLN A 87 7.905 7.153 0.776 1.00 0.00 H new ATOM 0 HB3 GLN A 87 8.938 6.416 1.986 1.00 0.00 H new ATOM 0 HG2 GLN A 87 10.930 7.341 0.667 1.00 0.00 H new ATOM 0 HG3 GLN A 87 9.771 8.261 -0.272 1.00 0.00 H new ATOM 0 HE21 GLN A 87 9.675 10.323 0.355 1.00 0.00 H new ATOM 0 HE22 GLN A 87 9.763 10.894 2.025 1.00 0.00 H new ATOM 1369 N PHE A 88 6.918 4.369 0.123 1.00 0.00 N ATOM 1370 CA PHE A 88 5.967 3.342 0.531 1.00 0.00 C ATOM 1371 C PHE A 88 6.260 2.020 -0.172 1.00 0.00 C ATOM 1372 O PHE A 88 6.339 0.968 0.465 1.00 0.00 O ATOM 1373 CB PHE A 88 4.537 3.790 0.224 1.00 0.00 C ATOM 1374 CG PHE A 88 3.556 2.655 0.150 1.00 0.00 C ATOM 1375 CD1 PHE A 88 3.436 1.756 1.197 1.00 0.00 C ATOM 1376 CD2 PHE A 88 2.754 2.487 -0.967 1.00 0.00 C ATOM 1377 CE1 PHE A 88 2.535 0.711 1.131 1.00 0.00 C ATOM 1378 CE2 PHE A 88 1.850 1.444 -1.039 1.00 0.00 C ATOM 1379 CZ PHE A 88 1.740 0.555 0.012 1.00 0.00 C ATOM 0 H PHE A 88 6.534 5.074 -0.507 1.00 0.00 H new ATOM 0 HA PHE A 88 6.070 3.193 1.606 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.212 4.491 0.992 1.00 0.00 H new ATOM 0 HB3 PHE A 88 4.529 4.329 -0.723 1.00 0.00 H new ATOM 0 HD1 PHE A 88 4.054 1.873 2.075 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.836 3.180 -1.792 1.00 0.00 H new ATOM 0 HE1 PHE A 88 2.452 0.016 1.954 1.00 0.00 H new ATOM 0 HE2 PHE A 88 1.231 1.324 -1.916 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.034 -0.261 -0.041 1.00 0.00 H new ATOM 1389 N LEU A 89 6.420 2.080 -1.489 1.00 0.00 N ATOM 1390 CA LEU A 89 6.704 0.888 -2.281 1.00 0.00 C ATOM 1391 C LEU A 89 7.965 0.190 -1.782 1.00 0.00 C ATOM 1392 O LEU A 89 7.951 -1.006 -1.495 1.00 0.00 O ATOM 1393 CB LEU A 89 6.862 1.258 -3.757 1.00 0.00 C ATOM 1394 CG LEU A 89 5.718 2.064 -4.373 1.00 0.00 C ATOM 1395 CD1 LEU A 89 6.105 2.571 -5.754 1.00 0.00 C ATOM 1396 CD2 LEU A 89 4.452 1.224 -4.447 1.00 0.00 C ATOM 0 H LEU A 89 6.358 2.942 -2.032 1.00 0.00 H new ATOM 0 HA LEU A 89 5.864 0.202 -2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.784 1.828 -3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.982 0.339 -4.330 1.00 0.00 H new ATOM 0 HG LEU A 89 5.521 2.925 -3.734 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.279 3.142 -6.177 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.984 3.210 -5.674 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.330 1.724 -6.403 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.649 1.814 -4.888 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.635 0.343 -5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.164 0.911 -3.443 1.00 0.00 H new ATOM 1408 N GLN A 90 9.053 0.947 -1.680 1.00 0.00 N ATOM 1409 CA GLN A 90 10.322 0.401 -1.214 1.00 0.00 C ATOM 1410 C GLN A 90 10.103 -0.590 -0.076 1.00 0.00 C ATOM 1411 O GLN A 90 10.612 -1.710 -0.109 1.00 0.00 O ATOM 1412 CB GLN A 90 11.248 1.529 -0.754 1.00 0.00 C ATOM 1413 CG GLN A 90 11.856 2.322 -1.899 1.00 0.00 C ATOM 1414 CD GLN A 90 12.852 1.512 -2.706 1.00 0.00 C ATOM 1415 OE1 GLN A 90 12.473 0.740 -3.587 1.00 0.00 O ATOM 1416 NE2 GLN A 90 14.135 1.685 -2.409 1.00 0.00 N ATOM 0 H GLN A 90 9.081 1.939 -1.914 1.00 0.00 H new ATOM 0 HA GLN A 90 10.789 -0.127 -2.045 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.688 2.207 -0.110 1.00 0.00 H new ATOM 0 HB3 GLN A 90 12.050 1.106 -0.150 1.00 0.00 H new ATOM 0 HG2 GLN A 90 11.060 2.672 -2.557 1.00 0.00 H new ATOM 0 HG3 GLN A 90 12.352 3.207 -1.500 1.00 0.00 H new ATOM 0 HE21 GLN A 90 14.404 2.335 -1.671 1.00 0.00 H new ATOM 0 HE22 GLN A 90 14.851 1.167 -2.919 1.00 0.00 H new ATOM 1425 N ALA A 91 9.343 -0.169 0.930 1.00 0.00 N ATOM 1426 CA ALA A 91 9.055 -1.021 2.078 1.00 0.00 C ATOM 1427 C ALA A 91 7.994 -2.061 1.737 1.00 0.00 C ATOM 1428 O ALA A 91 8.023 -3.181 2.246 1.00 0.00 O ATOM 1429 CB ALA A 91 8.609 -0.177 3.262 1.00 0.00 C ATOM 0 H ALA A 91 8.916 0.756 0.973 1.00 0.00 H new ATOM 0 HA ALA A 91 9.970 -1.549 2.347 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.397 -0.826 4.112 1.00 0.00 H new ATOM 0 HB2 ALA A 91 9.401 0.523 3.528 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.709 0.377 2.995 1.00 0.00 H new ATOM 1435 N ALA A 92 7.057 -1.683 0.874 1.00 0.00 N ATOM 1436 CA ALA A 92 5.987 -2.584 0.465 1.00 0.00 C ATOM 1437 C ALA A 92 6.533 -3.966 0.123 1.00 0.00 C ATOM 1438 O ALA A 92 5.962 -4.983 0.514 1.00 0.00 O ATOM 1439 CB ALA A 92 5.233 -2.004 -0.723 1.00 0.00 C ATOM 0 H ALA A 92 7.017 -0.759 0.445 1.00 0.00 H new ATOM 0 HA ALA A 92 5.297 -2.691 1.302 1.00 0.00 H new ATOM 0 HB1 ALA A 92 4.437 -2.688 -1.018 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.801 -1.042 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 92 5.920 -1.866 -1.558 1.00 0.00 H new ATOM 1445 N GLU A 93 7.642 -3.994 -0.610 1.00 0.00 N ATOM 1446 CA GLU A 93 8.264 -5.252 -1.006 1.00 0.00 C ATOM 1447 C GLU A 93 9.013 -5.881 0.165 1.00 0.00 C ATOM 1448 O GLU A 93 8.917 -7.085 0.403 1.00 0.00 O ATOM 1449 CB GLU A 93 9.223 -5.027 -2.177 1.00 0.00 C ATOM 1450 CG GLU A 93 10.275 -3.965 -1.906 1.00 0.00 C ATOM 1451 CD GLU A 93 11.222 -3.770 -3.074 1.00 0.00 C ATOM 1452 OE1 GLU A 93 12.043 -4.676 -3.329 1.00 0.00 O ATOM 1453 OE2 GLU A 93 11.142 -2.713 -3.733 1.00 0.00 O ATOM 0 H GLU A 93 8.128 -3.160 -0.941 1.00 0.00 H new ATOM 0 HA GLU A 93 7.474 -5.935 -1.319 1.00 0.00 H new ATOM 0 HB2 GLU A 93 9.721 -5.967 -2.414 1.00 0.00 H new ATOM 0 HB3 GLU A 93 8.648 -4.740 -3.057 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.782 -3.019 -1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.848 -4.244 -1.021 1.00 0.00 H new ATOM 1460 N ARG A 94 9.759 -5.057 0.894 1.00 0.00 N ATOM 1461 CA ARG A 94 10.526 -5.531 2.039 1.00 0.00 C ATOM 1462 C ARG A 94 9.613 -6.191 3.069 1.00 0.00 C ATOM 1463 O ARG A 94 10.056 -7.017 3.867 1.00 0.00 O ATOM 1464 CB ARG A 94 11.288 -4.373 2.685 1.00 0.00 C ATOM 1465 CG ARG A 94 12.510 -3.932 1.896 1.00 0.00 C ATOM 1466 CD ARG A 94 13.108 -2.654 2.463 1.00 0.00 C ATOM 1467 NE ARG A 94 14.004 -2.919 3.586 1.00 0.00 N ATOM 1468 CZ ARG A 94 13.589 -3.061 4.839 1.00 0.00 C ATOM 1469 NH1 ARG A 94 12.298 -2.964 5.129 1.00 0.00 N ATOM 1470 NH2 ARG A 94 14.465 -3.302 5.806 1.00 0.00 N ATOM 0 H ARG A 94 9.848 -4.057 0.711 1.00 0.00 H new ATOM 0 HA ARG A 94 11.241 -6.273 1.683 1.00 0.00 H new ATOM 0 HB2 ARG A 94 10.614 -3.524 2.799 1.00 0.00 H new ATOM 0 HB3 ARG A 94 11.600 -4.669 3.687 1.00 0.00 H new ATOM 0 HG2 ARG A 94 13.259 -4.723 1.911 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.234 -3.774 0.853 1.00 0.00 H new ATOM 0 HD2 ARG A 94 13.655 -2.131 1.679 1.00 0.00 H new ATOM 0 HD3 ARG A 94 12.306 -1.992 2.788 1.00 0.00 H new ATOM 0 HE ARG A 94 15.003 -2.999 3.397 1.00 0.00 H new ATOM 0 HH11 ARG A 94 11.621 -2.780 4.388 1.00 0.00 H new ATOM 0 HH12 ARG A 94 11.982 -3.074 6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 94 15.458 -3.378 5.587 1.00 0.00 H new ATOM 0 HH22 ARG A 94 14.145 -3.411 6.768 1.00 0.00 H new ATOM 1484 N TYR A 95 8.338 -5.820 3.045 1.00 0.00 N ATOM 1485 CA TYR A 95 7.364 -6.374 3.978 1.00 0.00 C ATOM 1486 C TYR A 95 6.977 -7.796 3.583 1.00 0.00 C ATOM 1487 O TYR A 95 6.895 -8.686 4.427 1.00 0.00 O ATOM 1488 CB TYR A 95 6.116 -5.490 4.030 1.00 0.00 C ATOM 1489 CG TYR A 95 4.870 -6.226 4.466 1.00 0.00 C ATOM 1490 CD1 TYR A 95 4.597 -6.434 5.812 1.00 0.00 C ATOM 1491 CD2 TYR A 95 3.964 -6.713 3.531 1.00 0.00 C ATOM 1492 CE1 TYR A 95 3.460 -7.107 6.215 1.00 0.00 C ATOM 1493 CE2 TYR A 95 2.824 -7.386 3.925 1.00 0.00 C ATOM 1494 CZ TYR A 95 2.576 -7.581 5.267 1.00 0.00 C ATOM 1495 OH TYR A 95 1.442 -8.250 5.665 1.00 0.00 O ATOM 0 H TYR A 95 7.955 -5.138 2.390 1.00 0.00 H new ATOM 0 HA TYR A 95 7.823 -6.403 4.966 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.296 -4.661 4.715 1.00 0.00 H new ATOM 0 HB3 TYR A 95 5.946 -5.058 3.044 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.286 -6.063 6.557 1.00 0.00 H new ATOM 0 HD2 TYR A 95 4.155 -6.563 2.479 1.00 0.00 H new ATOM 0 HE1 TYR A 95 3.264 -7.261 7.266 1.00 0.00 H new ATOM 0 HE2 TYR A 95 2.130 -7.758 3.185 1.00 0.00 H new ATOM 0 HH TYR A 95 1.660 -9.190 5.837 1.00 0.00 H new ATOM 1505 N GLY A 96 6.741 -8.000 2.290 1.00 0.00 N ATOM 1506 CA GLY A 96 6.366 -9.315 1.804 1.00 0.00 C ATOM 1507 C GLY A 96 5.862 -9.282 0.375 1.00 0.00 C ATOM 1508 O GLY A 96 6.113 -10.205 -0.400 1.00 0.00 O ATOM 0 H GLY A 96 6.803 -7.279 1.571 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.226 -9.981 1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.592 -9.731 2.450 1.00 0.00 H new ATOM 1512 N ILE A 97 5.147 -8.218 0.026 1.00 0.00 N ATOM 1513 CA ILE A 97 4.605 -8.070 -1.319 1.00 0.00 C ATOM 1514 C ILE A 97 5.689 -8.271 -2.373 1.00 0.00 C ATOM 1515 O ILE A 97 6.866 -8.014 -2.125 1.00 0.00 O ATOM 1516 CB ILE A 97 3.962 -6.685 -1.518 1.00 0.00 C ATOM 1517 CG1 ILE A 97 2.850 -6.463 -0.491 1.00 0.00 C ATOM 1518 CG2 ILE A 97 3.419 -6.551 -2.933 1.00 0.00 C ATOM 1519 CD1 ILE A 97 2.296 -5.055 -0.495 1.00 0.00 C ATOM 0 H ILE A 97 4.930 -7.446 0.656 1.00 0.00 H new ATOM 0 HA ILE A 97 3.839 -8.837 -1.437 1.00 0.00 H new ATOM 0 HB ILE A 97 4.726 -5.921 -1.370 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.039 -7.164 -0.688 1.00 0.00 H new ATOM 0 HG13 ILE A 97 3.234 -6.691 0.503 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.968 -5.567 -3.058 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.233 -6.670 -3.648 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.667 -7.320 -3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.512 -4.970 0.258 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.095 -4.349 -0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.881 -4.830 -1.478 1.00 0.00 H new ATOM 1531 N ASN A 98 5.282 -8.730 -3.552 1.00 0.00 N ATOM 1532 CA ASN A 98 6.218 -8.964 -4.646 1.00 0.00 C ATOM 1533 C ASN A 98 6.291 -7.751 -5.568 1.00 0.00 C ATOM 1534 O ASN A 98 5.275 -7.127 -5.875 1.00 0.00 O ATOM 1535 CB ASN A 98 5.803 -10.201 -5.444 1.00 0.00 C ATOM 1536 CG ASN A 98 6.982 -10.881 -6.112 1.00 0.00 C ATOM 1537 OD1 ASN A 98 8.127 -10.456 -5.957 1.00 0.00 O ATOM 1538 ND2 ASN A 98 6.707 -11.942 -6.861 1.00 0.00 N ATOM 0 H ASN A 98 4.311 -8.947 -3.774 1.00 0.00 H new ATOM 0 HA ASN A 98 7.206 -9.132 -4.217 1.00 0.00 H new ATOM 0 HB2 ASN A 98 5.307 -10.909 -4.780 1.00 0.00 H new ATOM 0 HB3 ASN A 98 5.075 -9.913 -6.203 1.00 0.00 H new ATOM 0 HD21 ASN A 98 7.460 -12.440 -7.336 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.743 -12.259 -6.961 1.00 0.00 H new ATOM 1545 N THR A 99 7.502 -7.421 -6.009 1.00 0.00 N ATOM 1546 CA THR A 99 7.709 -6.283 -6.895 1.00 0.00 C ATOM 1547 C THR A 99 6.996 -6.487 -8.227 1.00 0.00 C ATOM 1548 O THR A 99 6.868 -5.557 -9.024 1.00 0.00 O ATOM 1549 CB THR A 99 9.207 -6.043 -7.160 1.00 0.00 C ATOM 1550 OG1 THR A 99 9.827 -7.256 -7.602 1.00 0.00 O ATOM 1551 CG2 THR A 99 9.905 -5.539 -5.905 1.00 0.00 C ATOM 0 H THR A 99 8.354 -7.927 -5.766 1.00 0.00 H new ATOM 0 HA THR A 99 7.292 -5.411 -6.392 1.00 0.00 H new ATOM 0 HB THR A 99 9.299 -5.284 -7.937 1.00 0.00 H new ATOM 0 HG1 THR A 99 10.779 -7.094 -7.770 1.00 0.00 H new ATOM 0 HG21 THR A 99 10.962 -5.377 -6.117 1.00 0.00 H new ATOM 0 HG22 THR A 99 9.450 -4.601 -5.588 1.00 0.00 H new ATOM 0 HG23 THR A 99 9.803 -6.278 -5.110 1.00 0.00 H new ATOM 1559 N THR A 100 6.530 -7.710 -8.463 1.00 0.00 N ATOM 1560 CA THR A 100 5.829 -8.035 -9.699 1.00 0.00 C ATOM 1561 C THR A 100 4.442 -7.405 -9.727 1.00 0.00 C ATOM 1562 O THR A 100 3.870 -7.187 -10.795 1.00 0.00 O ATOM 1563 CB THR A 100 5.692 -9.559 -9.882 1.00 0.00 C ATOM 1564 OG1 THR A 100 4.869 -10.105 -8.845 1.00 0.00 O ATOM 1565 CG2 THR A 100 7.056 -10.231 -9.861 1.00 0.00 C ATOM 0 H THR A 100 6.626 -8.491 -7.814 1.00 0.00 H new ATOM 0 HA THR A 100 6.425 -7.630 -10.517 1.00 0.00 H new ATOM 0 HB THR A 100 5.227 -9.746 -10.850 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.786 -11.074 -8.969 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.934 -11.306 -9.992 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.670 -9.834 -10.670 1.00 0.00 H new ATOM 0 HG23 THR A 100 7.544 -10.035 -8.906 1.00 0.00 H new ATOM 1573 N ASP A 101 3.906 -7.113 -8.547 1.00 0.00 N ATOM 1574 CA ASP A 101 2.585 -6.505 -8.436 1.00 0.00 C ATOM 1575 C ASP A 101 2.697 -5.012 -8.142 1.00 0.00 C ATOM 1576 O ASP A 101 1.950 -4.203 -8.693 1.00 0.00 O ATOM 1577 CB ASP A 101 1.773 -7.194 -7.338 1.00 0.00 C ATOM 1578 CG ASP A 101 1.231 -8.540 -7.778 1.00 0.00 C ATOM 1579 OD1 ASP A 101 2.037 -9.481 -7.934 1.00 0.00 O ATOM 1580 OD2 ASP A 101 0.002 -8.652 -7.966 1.00 0.00 O ATOM 0 H ASP A 101 4.366 -7.288 -7.654 1.00 0.00 H new ATOM 0 HA ASP A 101 2.073 -6.632 -9.390 1.00 0.00 H new ATOM 0 HB2 ASP A 101 2.400 -7.328 -6.456 1.00 0.00 H new ATOM 0 HB3 ASP A 101 0.944 -6.550 -7.045 1.00 0.00 H new ATOM 1585 N ILE A 102 3.634 -4.654 -7.270 1.00 0.00 N ATOM 1586 CA ILE A 102 3.843 -3.259 -6.903 1.00 0.00 C ATOM 1587 C ILE A 102 3.756 -2.351 -8.124 1.00 0.00 C ATOM 1588 O ILE A 102 4.366 -2.623 -9.159 1.00 0.00 O ATOM 1589 CB ILE A 102 5.209 -3.055 -6.221 1.00 0.00 C ATOM 1590 CG1 ILE A 102 5.322 -3.944 -4.981 1.00 0.00 C ATOM 1591 CG2 ILE A 102 5.402 -1.592 -5.850 1.00 0.00 C ATOM 1592 CD1 ILE A 102 6.587 -3.711 -4.184 1.00 0.00 C ATOM 0 H ILE A 102 4.260 -5.311 -6.805 1.00 0.00 H new ATOM 0 HA ILE A 102 3.053 -2.995 -6.200 1.00 0.00 H new ATOM 0 HB ILE A 102 5.995 -3.339 -6.921 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.460 -3.768 -4.338 1.00 0.00 H new ATOM 0 HG13 ILE A 102 5.283 -4.989 -5.288 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.372 -1.463 -5.369 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.360 -0.980 -6.751 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.613 -1.283 -5.164 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.600 -4.375 -3.320 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.455 -3.915 -4.811 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.619 -2.675 -3.846 1.00 0.00 H new ATOM 1604 N PHE A 103 2.996 -1.268 -7.997 1.00 0.00 N ATOM 1605 CA PHE A 103 2.830 -0.318 -9.090 1.00 0.00 C ATOM 1606 C PHE A 103 4.039 0.609 -9.194 1.00 0.00 C ATOM 1607 O PHE A 103 4.943 0.560 -8.361 1.00 0.00 O ATOM 1608 CB PHE A 103 1.557 0.507 -8.889 1.00 0.00 C ATOM 1609 CG PHE A 103 1.583 1.355 -7.650 1.00 0.00 C ATOM 1610 CD1 PHE A 103 1.259 0.813 -6.416 1.00 0.00 C ATOM 1611 CD2 PHE A 103 1.931 2.695 -7.718 1.00 0.00 C ATOM 1612 CE1 PHE A 103 1.281 1.592 -5.275 1.00 0.00 C ATOM 1613 CE2 PHE A 103 1.955 3.479 -6.580 1.00 0.00 C ATOM 1614 CZ PHE A 103 1.630 2.926 -5.356 1.00 0.00 C ATOM 0 H PHE A 103 2.485 -1.027 -7.148 1.00 0.00 H new ATOM 0 HA PHE A 103 2.746 -0.883 -10.019 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.409 1.150 -9.757 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.701 -0.166 -8.841 1.00 0.00 H new ATOM 0 HD1 PHE A 103 0.986 -0.230 -6.346 1.00 0.00 H new ATOM 0 HD2 PHE A 103 2.187 3.132 -8.672 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.025 1.158 -4.320 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.227 4.522 -6.647 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.649 3.536 -4.465 1.00 0.00 H new ATOM 1624 N GLN A 104 4.045 1.450 -10.222 1.00 0.00 N ATOM 1625 CA GLN A 104 5.142 2.387 -10.436 1.00 0.00 C ATOM 1626 C GLN A 104 4.805 3.760 -9.865 1.00 0.00 C ATOM 1627 O GLN A 104 3.659 4.208 -9.930 1.00 0.00 O ATOM 1628 CB GLN A 104 5.456 2.505 -11.928 1.00 0.00 C ATOM 1629 CG GLN A 104 6.383 1.416 -12.443 1.00 0.00 C ATOM 1630 CD GLN A 104 6.711 1.575 -13.914 1.00 0.00 C ATOM 1631 OE1 GLN A 104 6.775 2.692 -14.430 1.00 0.00 O ATOM 1632 NE2 GLN A 104 6.922 0.457 -14.599 1.00 0.00 N ATOM 0 H GLN A 104 3.303 1.502 -10.920 1.00 0.00 H new ATOM 0 HA GLN A 104 6.020 2.004 -9.916 1.00 0.00 H new ATOM 0 HB2 GLN A 104 4.523 2.472 -12.491 1.00 0.00 H new ATOM 0 HB3 GLN A 104 5.910 3.477 -12.119 1.00 0.00 H new ATOM 0 HG2 GLN A 104 7.307 1.428 -11.865 1.00 0.00 H new ATOM 0 HG3 GLN A 104 5.919 0.443 -12.281 1.00 0.00 H new ATOM 0 HE21 GLN A 104 6.859 -0.447 -14.131 1.00 0.00 H new ATOM 0 HE22 GLN A 104 7.147 0.503 -15.593 1.00 0.00 H new ATOM 1641 N THR A 105 5.810 4.426 -9.304 1.00 0.00 N ATOM 1642 CA THR A 105 5.619 5.748 -8.720 1.00 0.00 C ATOM 1643 C THR A 105 4.862 6.666 -9.673 1.00 0.00 C ATOM 1644 O THR A 105 3.936 7.368 -9.269 1.00 0.00 O ATOM 1645 CB THR A 105 6.966 6.401 -8.358 1.00 0.00 C ATOM 1646 OG1 THR A 105 7.668 5.585 -7.412 1.00 0.00 O ATOM 1647 CG2 THR A 105 6.755 7.791 -7.777 1.00 0.00 C ATOM 0 H THR A 105 6.764 4.071 -9.242 1.00 0.00 H new ATOM 0 HA THR A 105 5.034 5.611 -7.811 1.00 0.00 H new ATOM 0 HB THR A 105 7.557 6.491 -9.269 1.00 0.00 H new ATOM 0 HG1 THR A 105 8.095 6.157 -6.740 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.720 8.232 -7.529 1.00 0.00 H new ATOM 0 HG22 THR A 105 6.247 8.418 -8.509 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.146 7.720 -6.876 1.00 0.00 H new ATOM 1655 N VAL A 106 5.263 6.655 -10.941 1.00 0.00 N ATOM 1656 CA VAL A 106 4.621 7.486 -11.952 1.00 0.00 C ATOM 1657 C VAL A 106 3.219 6.978 -12.272 1.00 0.00 C ATOM 1658 O VAL A 106 2.264 7.752 -12.325 1.00 0.00 O ATOM 1659 CB VAL A 106 5.448 7.531 -13.250 1.00 0.00 C ATOM 1660 CG1 VAL A 106 5.365 6.200 -13.982 1.00 0.00 C ATOM 1661 CG2 VAL A 106 4.978 8.670 -14.142 1.00 0.00 C ATOM 0 H VAL A 106 6.029 6.080 -11.292 1.00 0.00 H new ATOM 0 HA VAL A 106 4.554 8.492 -11.538 1.00 0.00 H new ATOM 0 HB VAL A 106 6.491 7.711 -12.990 1.00 0.00 H new ATOM 0 HG11 VAL A 106 5.955 6.250 -14.897 1.00 0.00 H new ATOM 0 HG12 VAL A 106 5.754 5.408 -13.342 1.00 0.00 H new ATOM 0 HG13 VAL A 106 4.326 5.987 -14.232 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.574 8.687 -15.055 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.928 8.524 -14.396 1.00 0.00 H new ATOM 0 HG23 VAL A 106 5.095 9.617 -13.615 1.00 0.00 H new ATOM 1671 N ASP A 107 3.104 5.672 -12.485 1.00 0.00 N ATOM 1672 CA ASP A 107 1.819 5.058 -12.799 1.00 0.00 C ATOM 1673 C ASP A 107 0.697 5.706 -11.994 1.00 0.00 C ATOM 1674 O ASP A 107 -0.323 6.116 -12.549 1.00 0.00 O ATOM 1675 CB ASP A 107 1.865 3.556 -12.517 1.00 0.00 C ATOM 1676 CG ASP A 107 2.419 2.764 -13.685 1.00 0.00 C ATOM 1677 OD1 ASP A 107 2.754 3.384 -14.717 1.00 0.00 O ATOM 1678 OD2 ASP A 107 2.518 1.525 -13.568 1.00 0.00 O ATOM 0 H ASP A 107 3.885 5.018 -12.446 1.00 0.00 H new ATOM 0 HA ASP A 107 1.618 5.214 -13.859 1.00 0.00 H new ATOM 0 HB2 ASP A 107 2.478 3.374 -11.635 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.860 3.202 -12.286 1.00 0.00 H new ATOM 1683 N LEU A 108 0.891 5.793 -10.682 1.00 0.00 N ATOM 1684 CA LEU A 108 -0.105 6.390 -9.799 1.00 0.00 C ATOM 1685 C LEU A 108 -0.025 7.913 -9.839 1.00 0.00 C ATOM 1686 O LEU A 108 -1.047 8.598 -9.820 1.00 0.00 O ATOM 1687 CB LEU A 108 0.093 5.894 -8.366 1.00 0.00 C ATOM 1688 CG LEU A 108 -0.731 6.603 -7.291 1.00 0.00 C ATOM 1689 CD1 LEU A 108 -2.190 6.181 -7.370 1.00 0.00 C ATOM 1690 CD2 LEU A 108 -0.165 6.315 -5.908 1.00 0.00 C ATOM 0 H LEU A 108 1.729 5.458 -10.207 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.092 6.088 -10.148 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -0.144 4.831 -8.335 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.148 5.993 -8.111 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.675 7.677 -7.468 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.760 6.696 -6.597 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.591 6.440 -8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.266 5.104 -7.220 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.764 6.828 -5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -0.189 5.241 -5.721 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.864 6.669 -5.855 1.00 0.00 H new ATOM 1702 N TRP A 109 1.195 8.434 -9.895 1.00 0.00 N ATOM 1703 CA TRP A 109 1.408 9.877 -9.939 1.00 0.00 C ATOM 1704 C TRP A 109 0.728 10.490 -11.158 1.00 0.00 C ATOM 1705 O TRP A 109 -0.231 11.250 -11.027 1.00 0.00 O ATOM 1706 CB TRP A 109 2.905 10.191 -9.962 1.00 0.00 C ATOM 1707 CG TRP A 109 3.224 11.591 -9.531 1.00 0.00 C ATOM 1708 CD1 TRP A 109 3.212 12.078 -8.256 1.00 0.00 C ATOM 1709 CD2 TRP A 109 3.601 12.683 -10.377 1.00 0.00 C ATOM 1710 NE1 TRP A 109 3.559 13.408 -8.257 1.00 0.00 N ATOM 1711 CE2 TRP A 109 3.803 13.802 -9.546 1.00 0.00 C ATOM 1712 CE3 TRP A 109 3.790 12.824 -11.754 1.00 0.00 C ATOM 1713 CZ2 TRP A 109 4.183 15.044 -10.049 1.00 0.00 C ATOM 1714 CZ3 TRP A 109 4.166 14.056 -12.252 1.00 0.00 C ATOM 1715 CH2 TRP A 109 4.360 15.153 -11.402 1.00 0.00 C ATOM 0 H TRP A 109 2.051 7.880 -9.911 1.00 0.00 H new ATOM 0 HA TRP A 109 0.966 10.313 -9.043 1.00 0.00 H new ATOM 0 HB2 TRP A 109 3.426 9.490 -9.310 1.00 0.00 H new ATOM 0 HB3 TRP A 109 3.287 10.033 -10.971 1.00 0.00 H new ATOM 0 HD1 TRP A 109 2.966 11.503 -7.376 1.00 0.00 H new ATOM 0 HE1 TRP A 109 3.624 14.004 -7.432 1.00 0.00 H new ATOM 0 HE3 TRP A 109 3.645 11.984 -12.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 4.333 15.890 -9.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 4.313 14.176 -13.315 1.00 0.00 H new ATOM 0 HH2 TRP A 109 4.655 16.103 -11.823 1.00 0.00 H new ATOM 1726 N GLU A 110 1.231 10.155 -12.342 1.00 0.00 N ATOM 1727 CA GLU A 110 0.671 10.675 -13.584 1.00 0.00 C ATOM 1728 C GLU A 110 -0.707 10.077 -13.851 1.00 0.00 C ATOM 1729 O GLU A 110 -1.454 10.564 -14.699 1.00 0.00 O ATOM 1730 CB GLU A 110 1.606 10.374 -14.757 1.00 0.00 C ATOM 1731 CG GLU A 110 2.742 11.373 -14.901 1.00 0.00 C ATOM 1732 CD GLU A 110 3.217 11.513 -16.334 1.00 0.00 C ATOM 1733 OE1 GLU A 110 2.363 11.676 -17.230 1.00 0.00 O ATOM 1734 OE2 GLU A 110 4.444 11.460 -16.560 1.00 0.00 O ATOM 0 H GLU A 110 2.024 9.526 -12.467 1.00 0.00 H new ATOM 0 HA GLU A 110 0.566 11.755 -13.481 1.00 0.00 H new ATOM 0 HB2 GLU A 110 2.025 9.376 -14.630 1.00 0.00 H new ATOM 0 HB3 GLU A 110 1.026 10.361 -15.679 1.00 0.00 H new ATOM 0 HG2 GLU A 110 2.414 12.346 -14.534 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.577 11.061 -14.274 1.00 0.00 H new ATOM 1741 N GLY A 111 -1.037 9.015 -13.122 1.00 0.00 N ATOM 1742 CA GLY A 111 -2.324 8.367 -13.295 1.00 0.00 C ATOM 1743 C GLY A 111 -2.456 7.693 -14.646 1.00 0.00 C ATOM 1744 O GLY A 111 -3.566 7.464 -15.128 1.00 0.00 O ATOM 0 H GLY A 111 -0.436 8.592 -12.415 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -2.463 7.626 -12.508 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -3.118 9.106 -13.182 1.00 0.00 H new ATOM 1748 N LYS A 112 -1.322 7.377 -15.262 1.00 0.00 N ATOM 1749 CA LYS A 112 -1.315 6.726 -16.567 1.00 0.00 C ATOM 1750 C LYS A 112 -1.706 5.257 -16.444 1.00 0.00 C ATOM 1751 O LYS A 112 -2.525 4.758 -17.214 1.00 0.00 O ATOM 1752 CB LYS A 112 0.069 6.844 -17.210 1.00 0.00 C ATOM 1753 CG LYS A 112 1.185 6.253 -16.366 1.00 0.00 C ATOM 1754 CD LYS A 112 2.528 6.348 -17.071 1.00 0.00 C ATOM 1755 CE LYS A 112 3.093 7.759 -17.004 1.00 0.00 C ATOM 1756 NZ LYS A 112 4.168 7.973 -18.012 1.00 0.00 N ATOM 0 H LYS A 112 -0.395 7.561 -14.878 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.048 7.227 -17.200 1.00 0.00 H new ATOM 0 HB2 LYS A 112 0.054 6.344 -18.179 1.00 0.00 H new ATOM 0 HB3 LYS A 112 0.285 7.896 -17.397 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.236 6.776 -15.411 1.00 0.00 H new ATOM 0 HG3 LYS A 112 0.962 5.209 -16.146 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.231 5.651 -16.614 1.00 0.00 H new ATOM 0 HD3 LYS A 112 2.415 6.049 -18.113 1.00 0.00 H new ATOM 0 HE2 LYS A 112 2.292 8.479 -17.169 1.00 0.00 H new ATOM 0 HE3 LYS A 112 3.489 7.945 -16.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 4.528 8.946 -17.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 4.944 7.302 -17.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 3.784 7.820 -18.966 1.00 0.00 H new ATOM 1770 N ASN A 113 -1.117 4.571 -15.470 1.00 0.00 N ATOM 1771 CA ASN A 113 -1.406 3.160 -15.247 1.00 0.00 C ATOM 1772 C ASN A 113 -1.673 2.886 -13.770 1.00 0.00 C ATOM 1773 O ASN A 113 -1.036 2.026 -13.163 1.00 0.00 O ATOM 1774 CB ASN A 113 -0.241 2.296 -15.735 1.00 0.00 C ATOM 1775 CG ASN A 113 -0.686 0.907 -16.151 1.00 0.00 C ATOM 1776 OD1 ASN A 113 -1.859 0.683 -16.452 1.00 0.00 O ATOM 1777 ND2 ASN A 113 0.251 -0.033 -16.170 1.00 0.00 N ATOM 0 H ASN A 113 -0.437 4.970 -14.823 1.00 0.00 H new ATOM 0 HA ASN A 113 -2.302 2.904 -15.813 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.244 2.787 -16.579 1.00 0.00 H new ATOM 0 HB3 ASN A 113 0.504 2.214 -14.943 1.00 0.00 H new ATOM 0 HD21 ASN A 113 0.011 -0.986 -16.442 1.00 0.00 H new ATOM 0 HD22 ASN A 113 1.211 0.198 -15.913 1.00 0.00 H new ATOM 1784 N MET A 114 -2.619 3.624 -13.198 1.00 0.00 N ATOM 1785 CA MET A 114 -2.971 3.459 -11.793 1.00 0.00 C ATOM 1786 C MET A 114 -3.849 2.228 -11.593 1.00 0.00 C ATOM 1787 O MET A 114 -4.277 1.934 -10.477 1.00 0.00 O ATOM 1788 CB MET A 114 -3.695 4.704 -11.277 1.00 0.00 C ATOM 1789 CG MET A 114 -5.173 4.739 -11.631 1.00 0.00 C ATOM 1790 SD MET A 114 -6.207 3.961 -10.376 1.00 0.00 S ATOM 1791 CE MET A 114 -5.640 4.804 -8.901 1.00 0.00 C ATOM 0 H MET A 114 -3.155 4.342 -13.686 1.00 0.00 H new ATOM 0 HA MET A 114 -2.049 3.322 -11.228 1.00 0.00 H new ATOM 0 HB2 MET A 114 -3.588 4.753 -10.193 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.211 5.591 -11.686 1.00 0.00 H new ATOM 0 HG2 MET A 114 -5.486 5.775 -11.763 1.00 0.00 H new ATOM 0 HG3 MET A 114 -5.326 4.235 -12.585 1.00 0.00 H new ATOM 0 HE1 MET A 114 -6.487 4.992 -8.241 1.00 0.00 H new ATOM 0 HE2 MET A 114 -4.909 4.182 -8.384 1.00 0.00 H new ATOM 0 HE3 MET A 114 -5.178 5.752 -9.178 1.00 0.00 H new ATOM 1801 N ALA A 115 -4.112 1.511 -12.681 1.00 0.00 N ATOM 1802 CA ALA A 115 -4.937 0.311 -12.624 1.00 0.00 C ATOM 1803 C ALA A 115 -4.210 -0.822 -11.908 1.00 0.00 C ATOM 1804 O ALA A 115 -4.805 -1.853 -11.592 1.00 0.00 O ATOM 1805 CB ALA A 115 -5.339 -0.121 -14.026 1.00 0.00 C ATOM 0 H ALA A 115 -3.765 1.741 -13.612 1.00 0.00 H new ATOM 0 HA ALA A 115 -5.837 0.546 -12.056 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -5.955 -1.018 -13.968 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.906 0.678 -14.504 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -4.445 -0.332 -14.612 1.00 0.00 H new ATOM 1811 N CYS A 116 -2.921 -0.624 -11.655 1.00 0.00 N ATOM 1812 CA CYS A 116 -2.111 -1.630 -10.977 1.00 0.00 C ATOM 1813 C CYS A 116 -2.113 -1.403 -9.469 1.00 0.00 C ATOM 1814 O CYS A 116 -2.329 -2.333 -8.691 1.00 0.00 O ATOM 1815 CB CYS A 116 -0.677 -1.603 -11.507 1.00 0.00 C ATOM 1816 SG CYS A 116 -0.435 -2.548 -13.030 1.00 0.00 S ATOM 0 H CYS A 116 -2.414 0.224 -11.909 1.00 0.00 H new ATOM 0 HA CYS A 116 -2.547 -2.608 -11.180 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -0.386 -0.568 -11.684 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -0.010 -1.995 -10.739 1.00 0.00 H new ATOM 0 HG CYS A 116 0.808 -2.463 -13.401 1.00 0.00 H new ATOM 1822 N VAL A 117 -1.868 -0.162 -9.062 1.00 0.00 N ATOM 1823 CA VAL A 117 -1.840 0.187 -7.647 1.00 0.00 C ATOM 1824 C VAL A 117 -3.086 -0.321 -6.931 1.00 0.00 C ATOM 1825 O VAL A 117 -3.021 -0.746 -5.777 1.00 0.00 O ATOM 1826 CB VAL A 117 -1.732 1.711 -7.447 1.00 0.00 C ATOM 1827 CG1 VAL A 117 -2.724 2.439 -8.341 1.00 0.00 C ATOM 1828 CG2 VAL A 117 -1.953 2.073 -5.986 1.00 0.00 C ATOM 0 H VAL A 117 -1.686 0.619 -9.693 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.959 -0.292 -7.220 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.727 2.027 -7.728 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -2.633 3.514 -8.186 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -2.514 2.204 -9.384 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -3.737 2.121 -8.094 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.873 3.153 -5.863 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.945 1.745 -5.676 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -1.199 1.581 -5.371 1.00 0.00 H new ATOM 1838 N GLN A 118 -4.220 -0.276 -7.623 1.00 0.00 N ATOM 1839 CA GLN A 118 -5.481 -0.732 -7.052 1.00 0.00 C ATOM 1840 C GLN A 118 -5.357 -2.159 -6.527 1.00 0.00 C ATOM 1841 O GLN A 118 -6.055 -2.549 -5.591 1.00 0.00 O ATOM 1842 CB GLN A 118 -6.595 -0.656 -8.098 1.00 0.00 C ATOM 1843 CG GLN A 118 -7.126 0.751 -8.320 1.00 0.00 C ATOM 1844 CD GLN A 118 -7.721 1.355 -7.064 1.00 0.00 C ATOM 1845 OE1 GLN A 118 -8.710 0.678 -6.491 1.00 0.00 O flip ATOM 1846 NE2 GLN A 118 -7.297 2.420 -6.612 1.00 0.00 N flip ATOM 0 H GLN A 118 -4.291 0.072 -8.579 1.00 0.00 H new ATOM 0 HA GLN A 118 -5.730 -0.078 -6.217 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -6.221 -1.048 -9.044 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -7.417 -1.301 -7.789 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -6.317 1.388 -8.677 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -7.884 0.730 -9.103 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -6.535 2.907 -7.084 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -7.708 2.814 -5.766 1.00 0.00 H new ATOM 1855 N ARG A 119 -4.464 -2.932 -7.136 1.00 0.00 N ATOM 1856 CA ARG A 119 -4.249 -4.316 -6.730 1.00 0.00 C ATOM 1857 C ARG A 119 -3.152 -4.409 -5.674 1.00 0.00 C ATOM 1858 O ARG A 119 -3.293 -5.118 -4.677 1.00 0.00 O ATOM 1859 CB ARG A 119 -3.880 -5.173 -7.942 1.00 0.00 C ATOM 1860 CG ARG A 119 -3.713 -6.648 -7.616 1.00 0.00 C ATOM 1861 CD ARG A 119 -5.052 -7.367 -7.583 1.00 0.00 C ATOM 1862 NE ARG A 119 -4.897 -8.818 -7.625 1.00 0.00 N ATOM 1863 CZ ARG A 119 -5.845 -9.647 -8.048 1.00 0.00 C ATOM 1864 NH1 ARG A 119 -7.010 -9.170 -8.462 1.00 0.00 N ATOM 1865 NH2 ARG A 119 -5.627 -10.956 -8.057 1.00 0.00 N ATOM 0 H ARG A 119 -3.878 -2.624 -7.912 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.177 -4.690 -6.298 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -4.653 -5.063 -8.703 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -2.952 -4.797 -8.373 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -3.067 -7.115 -8.359 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -3.218 -6.754 -6.651 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -5.591 -7.086 -6.678 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -5.658 -7.043 -8.429 1.00 0.00 H new ATOM 0 HE ARG A 119 -4.012 -9.217 -7.312 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -7.180 -8.164 -8.456 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -7.736 -9.809 -8.786 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -4.731 -11.326 -7.739 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -6.355 -11.592 -8.382 1.00 0.00 H new ATOM 1879 N THR A 120 -2.058 -3.688 -5.899 1.00 0.00 N ATOM 1880 CA THR A 120 -0.936 -3.691 -4.969 1.00 0.00 C ATOM 1881 C THR A 120 -1.401 -3.404 -3.546 1.00 0.00 C ATOM 1882 O THR A 120 -0.860 -3.950 -2.583 1.00 0.00 O ATOM 1883 CB THR A 120 0.127 -2.651 -5.369 1.00 0.00 C ATOM 1884 OG1 THR A 120 0.763 -3.044 -6.591 1.00 0.00 O ATOM 1885 CG2 THR A 120 1.173 -2.497 -4.275 1.00 0.00 C ATOM 0 H THR A 120 -1.925 -3.094 -6.718 1.00 0.00 H new ATOM 0 HA THR A 120 -0.494 -4.686 -5.010 1.00 0.00 H new ATOM 0 HB THR A 120 -0.372 -1.692 -5.511 1.00 0.00 H new ATOM 0 HG1 THR A 120 0.760 -2.291 -7.218 1.00 0.00 H new ATOM 0 HG21 THR A 120 1.913 -1.757 -4.581 1.00 0.00 H new ATOM 0 HG22 THR A 120 0.691 -2.169 -3.354 1.00 0.00 H new ATOM 0 HG23 THR A 120 1.666 -3.454 -4.105 1.00 0.00 H new ATOM 1893 N LEU A 121 -2.407 -2.545 -3.419 1.00 0.00 N ATOM 1894 CA LEU A 121 -2.946 -2.187 -2.112 1.00 0.00 C ATOM 1895 C LEU A 121 -3.634 -3.381 -1.460 1.00 0.00 C ATOM 1896 O LEU A 121 -3.253 -3.812 -0.372 1.00 0.00 O ATOM 1897 CB LEU A 121 -3.933 -1.026 -2.247 1.00 0.00 C ATOM 1898 CG LEU A 121 -3.332 0.325 -2.635 1.00 0.00 C ATOM 1899 CD1 LEU A 121 -4.229 1.462 -2.172 1.00 0.00 C ATOM 1900 CD2 LEU A 121 -1.935 0.475 -2.050 1.00 0.00 C ATOM 0 H LEU A 121 -2.865 -2.084 -4.205 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.116 -1.879 -1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.681 -1.296 -2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.457 -0.909 -1.298 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.257 0.368 -3.722 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -3.784 2.415 -2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -5.209 1.365 -2.638 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -4.337 1.422 -1.088 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.523 1.442 -2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.987 0.410 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -1.294 -0.320 -2.431 1.00 0.00 H new ATOM 1912 N MET A 122 -4.649 -3.914 -2.134 1.00 0.00 N ATOM 1913 CA MET A 122 -5.388 -5.061 -1.622 1.00 0.00 C ATOM 1914 C MET A 122 -4.439 -6.103 -1.037 1.00 0.00 C ATOM 1915 O MET A 122 -4.775 -6.793 -0.077 1.00 0.00 O ATOM 1916 CB MET A 122 -6.231 -5.689 -2.733 1.00 0.00 C ATOM 1917 CG MET A 122 -7.502 -4.915 -3.042 1.00 0.00 C ATOM 1918 SD MET A 122 -8.546 -4.685 -1.590 1.00 0.00 S ATOM 1919 CE MET A 122 -9.151 -6.353 -1.340 1.00 0.00 C ATOM 0 H MET A 122 -4.978 -3.569 -3.036 1.00 0.00 H new ATOM 0 HA MET A 122 -6.048 -4.711 -0.829 1.00 0.00 H new ATOM 0 HB2 MET A 122 -5.629 -5.760 -3.639 1.00 0.00 H new ATOM 0 HB3 MET A 122 -6.496 -6.707 -2.446 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.238 -3.941 -3.453 1.00 0.00 H new ATOM 0 HG3 MET A 122 -8.066 -5.443 -3.811 1.00 0.00 H new ATOM 0 HE1 MET A 122 -10.209 -6.399 -1.600 1.00 0.00 H new ATOM 0 HE2 MET A 122 -8.591 -7.042 -1.973 1.00 0.00 H new ATOM 0 HE3 MET A 122 -9.022 -6.634 -0.295 1.00 0.00 H new ATOM 1929 N ASN A 123 -3.251 -6.210 -1.625 1.00 0.00 N ATOM 1930 CA ASN A 123 -2.253 -7.168 -1.162 1.00 0.00 C ATOM 1931 C ASN A 123 -1.775 -6.819 0.244 1.00 0.00 C ATOM 1932 O ASN A 123 -1.817 -7.652 1.150 1.00 0.00 O ATOM 1933 CB ASN A 123 -1.064 -7.201 -2.124 1.00 0.00 C ATOM 1934 CG ASN A 123 -1.314 -8.098 -3.322 1.00 0.00 C ATOM 1935 OD1 ASN A 123 -1.831 -9.206 -3.184 1.00 0.00 O ATOM 1936 ND2 ASN A 123 -0.946 -7.620 -4.505 1.00 0.00 N ATOM 0 H ASN A 123 -2.956 -5.646 -2.422 1.00 0.00 H new ATOM 0 HA ASN A 123 -2.717 -8.154 -1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -0.851 -6.189 -2.469 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -0.179 -7.549 -1.592 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -1.089 -8.178 -5.347 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -0.521 -6.695 -4.572 1.00 0.00 H new ATOM 1943 N LEU A 124 -1.321 -5.583 0.419 1.00 0.00 N ATOM 1944 CA LEU A 124 -0.835 -5.123 1.715 1.00 0.00 C ATOM 1945 C LEU A 124 -1.772 -5.563 2.835 1.00 0.00 C ATOM 1946 O LEU A 124 -1.325 -5.982 3.903 1.00 0.00 O ATOM 1947 CB LEU A 124 -0.698 -3.599 1.719 1.00 0.00 C ATOM 1948 CG LEU A 124 0.164 -3.006 2.834 1.00 0.00 C ATOM 1949 CD1 LEU A 124 1.638 -3.264 2.563 1.00 0.00 C ATOM 1950 CD2 LEU A 124 -0.101 -1.514 2.975 1.00 0.00 C ATOM 0 H LEU A 124 -1.279 -4.881 -0.320 1.00 0.00 H new ATOM 0 HA LEU A 124 0.144 -5.570 1.888 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -0.281 -3.289 0.761 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.695 -3.165 1.788 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.102 -3.493 3.772 1.00 0.00 H new ATOM 0 HD11 LEU A 124 2.236 -2.835 3.367 1.00 0.00 H new ATOM 0 HD12 LEU A 124 1.816 -4.338 2.512 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.920 -2.804 1.616 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.521 -1.108 3.773 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.138 -1.012 2.038 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -1.152 -1.352 3.216 1.00 0.00 H new ATOM 1962 N GLY A 125 -3.074 -5.468 2.584 1.00 0.00 N ATOM 1963 CA GLY A 125 -4.053 -5.862 3.580 1.00 0.00 C ATOM 1964 C GLY A 125 -4.117 -7.365 3.766 1.00 0.00 C ATOM 1965 O GLY A 125 -3.941 -7.868 4.875 1.00 0.00 O ATOM 0 H GLY A 125 -3.468 -5.125 1.708 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -3.808 -5.391 4.532 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -5.035 -5.493 3.285 1.00 0.00 H new ATOM 1969 N GLY A 126 -4.373 -8.084 2.678 1.00 0.00 N ATOM 1970 CA GLY A 126 -4.458 -9.531 2.748 1.00 0.00 C ATOM 1971 C GLY A 126 -3.278 -10.147 3.473 1.00 0.00 C ATOM 1972 O GLY A 126 -3.450 -11.009 4.336 1.00 0.00 O ATOM 0 H GLY A 126 -4.523 -7.690 1.749 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -5.380 -9.813 3.256 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -4.513 -9.938 1.738 1.00 0.00 H new ATOM 1976 N LEU A 127 -2.075 -9.706 3.123 1.00 0.00 N ATOM 1977 CA LEU A 127 -0.860 -10.220 3.746 1.00 0.00 C ATOM 1978 C LEU A 127 -0.868 -9.963 5.249 1.00 0.00 C ATOM 1979 O LEU A 127 -0.629 -10.870 6.045 1.00 0.00 O ATOM 1980 CB LEU A 127 0.374 -9.574 3.113 1.00 0.00 C ATOM 1981 CG LEU A 127 0.810 -10.141 1.762 1.00 0.00 C ATOM 1982 CD1 LEU A 127 1.496 -9.069 0.929 1.00 0.00 C ATOM 1983 CD2 LEU A 127 1.731 -11.337 1.957 1.00 0.00 C ATOM 0 H LEU A 127 -1.915 -8.993 2.411 1.00 0.00 H new ATOM 0 HA LEU A 127 -0.824 -11.297 3.581 1.00 0.00 H new ATOM 0 HB2 LEU A 127 0.179 -8.508 2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.207 -9.669 3.810 1.00 0.00 H new ATOM 0 HG LEU A 127 -0.079 -10.475 1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.799 -9.491 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 127 0.806 -8.243 0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 127 2.376 -8.704 1.459 1.00 0.00 H new ATOM 0 HD21 LEU A 127 2.031 -11.727 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 127 2.616 -11.028 2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 127 1.206 -12.114 2.513 1.00 0.00 H new ATOM 1995 N ALA A 128 -1.146 -8.720 5.630 1.00 0.00 N ATOM 1996 CA ALA A 128 -1.189 -8.345 7.038 1.00 0.00 C ATOM 1997 C ALA A 128 -2.033 -9.328 7.843 1.00 0.00 C ATOM 1998 O ALA A 128 -1.607 -9.816 8.890 1.00 0.00 O ATOM 1999 CB ALA A 128 -1.732 -6.932 7.191 1.00 0.00 C ATOM 0 H ALA A 128 -1.345 -7.956 4.984 1.00 0.00 H new ATOM 0 HA ALA A 128 -0.172 -8.376 7.428 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.759 -6.665 8.247 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.087 -6.235 6.657 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -2.740 -6.883 6.779 1.00 0.00 H new ATOM 2005 N VAL A 129 -3.233 -9.615 7.347 1.00 0.00 N ATOM 2006 CA VAL A 129 -4.137 -10.540 8.020 1.00 0.00 C ATOM 2007 C VAL A 129 -3.490 -11.909 8.198 1.00 0.00 C ATOM 2008 O VAL A 129 -3.870 -12.676 9.082 1.00 0.00 O ATOM 2009 CB VAL A 129 -5.454 -10.705 7.239 1.00 0.00 C ATOM 2010 CG1 VAL A 129 -6.480 -11.456 8.074 1.00 0.00 C ATOM 2011 CG2 VAL A 129 -5.993 -9.349 6.810 1.00 0.00 C ATOM 0 H VAL A 129 -3.601 -9.220 6.482 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.355 -10.114 8.999 1.00 0.00 H new ATOM 0 HB VAL A 129 -5.253 -11.290 6.342 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -7.404 -11.563 7.506 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -6.092 -12.443 8.325 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -6.680 -10.901 8.990 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -6.924 -9.485 6.259 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -6.179 -8.736 7.692 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -5.263 -8.853 6.171 1.00 0.00 H new ATOM 2021 N ALA A 130 -2.509 -12.208 7.353 1.00 0.00 N ATOM 2022 CA ALA A 130 -1.806 -13.483 7.418 1.00 0.00 C ATOM 2023 C ALA A 130 -0.601 -13.399 8.349 1.00 0.00 C ATOM 2024 O ALA A 130 0.298 -14.238 8.293 1.00 0.00 O ATOM 2025 CB ALA A 130 -1.372 -13.919 6.027 1.00 0.00 C ATOM 0 H ALA A 130 -2.183 -11.584 6.615 1.00 0.00 H new ATOM 0 HA ALA A 130 -2.492 -14.227 7.822 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.848 -14.873 6.092 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -2.250 -14.029 5.390 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.707 -13.168 5.601 1.00 0.00 H new ATOM 2031 N ARG A 131 -0.589 -12.381 9.203 1.00 0.00 N ATOM 2032 CA ARG A 131 0.507 -12.186 10.144 1.00 0.00 C ATOM 2033 C ARG A 131 0.037 -12.407 11.579 1.00 0.00 C ATOM 2034 O ARG A 131 -1.128 -12.724 11.820 1.00 0.00 O ATOM 2035 CB ARG A 131 1.090 -10.779 9.997 1.00 0.00 C ATOM 2036 CG ARG A 131 1.316 -10.361 8.554 1.00 0.00 C ATOM 2037 CD ARG A 131 2.656 -10.856 8.034 1.00 0.00 C ATOM 2038 NE ARG A 131 3.777 -10.177 8.677 1.00 0.00 N ATOM 2039 CZ ARG A 131 5.050 -10.432 8.395 1.00 0.00 C ATOM 2040 NH1 ARG A 131 5.362 -11.345 7.486 1.00 0.00 N ATOM 2041 NH2 ARG A 131 6.015 -9.772 9.023 1.00 0.00 N ATOM 0 H ARG A 131 -1.326 -11.678 9.263 1.00 0.00 H new ATOM 0 HA ARG A 131 1.282 -12.918 9.917 1.00 0.00 H new ATOM 0 HB2 ARG A 131 0.417 -10.065 10.472 1.00 0.00 H new ATOM 0 HB3 ARG A 131 2.038 -10.730 10.533 1.00 0.00 H new ATOM 0 HG2 ARG A 131 0.514 -10.756 7.930 1.00 0.00 H new ATOM 0 HG3 ARG A 131 1.274 -9.274 8.478 1.00 0.00 H new ATOM 0 HD2 ARG A 131 2.737 -11.930 8.204 1.00 0.00 H new ATOM 0 HD3 ARG A 131 2.707 -10.699 6.957 1.00 0.00 H new ATOM 0 HE ARG A 131 3.572 -9.468 9.381 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.624 -11.854 7.000 1.00 0.00 H new ATOM 0 HH12 ARG A 131 6.340 -11.538 7.272 1.00 0.00 H new ATOM 0 HH21 ARG A 131 5.780 -9.068 9.723 1.00 0.00 H new ATOM 0 HH22 ARG A 131 6.992 -9.968 8.806 1.00 0.00 H new ATOM 2055 N ASP A 132 0.951 -12.236 12.528 1.00 0.00 N ATOM 2056 CA ASP A 132 0.631 -12.416 13.939 1.00 0.00 C ATOM 2057 C ASP A 132 0.977 -11.164 14.739 1.00 0.00 C ATOM 2058 O ASP A 132 0.908 -11.161 15.968 1.00 0.00 O ATOM 2059 CB ASP A 132 1.382 -13.622 14.505 1.00 0.00 C ATOM 2060 CG ASP A 132 0.974 -14.922 13.841 1.00 0.00 C ATOM 2061 OD1 ASP A 132 1.576 -15.274 12.806 1.00 0.00 O ATOM 2062 OD2 ASP A 132 0.053 -15.588 14.358 1.00 0.00 O ATOM 0 H ASP A 132 1.919 -11.973 12.346 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.441 -12.594 14.023 1.00 0.00 H new ATOM 0 HB2 ASP A 132 2.454 -13.472 14.376 1.00 0.00 H new ATOM 0 HB3 ASP A 132 1.197 -13.691 15.577 1.00 0.00 H new ATOM 2067 N ASP A 133 1.351 -10.102 14.033 1.00 0.00 N ATOM 2068 CA ASP A 133 1.708 -8.843 14.677 1.00 0.00 C ATOM 2069 C ASP A 133 0.575 -8.350 15.572 1.00 0.00 C ATOM 2070 O ASP A 133 0.814 -7.770 16.630 1.00 0.00 O ATOM 2071 CB ASP A 133 2.042 -7.785 13.625 1.00 0.00 C ATOM 2072 CG ASP A 133 3.237 -8.170 12.775 1.00 0.00 C ATOM 2073 OD1 ASP A 133 4.378 -7.864 13.181 1.00 0.00 O ATOM 2074 OD2 ASP A 133 3.032 -8.778 11.704 1.00 0.00 O ATOM 0 H ASP A 133 1.415 -10.088 13.015 1.00 0.00 H new ATOM 0 HA ASP A 133 2.587 -9.017 15.298 1.00 0.00 H new ATOM 0 HB2 ASP A 133 1.176 -7.631 12.981 1.00 0.00 H new ATOM 0 HB3 ASP A 133 2.243 -6.835 14.120 1.00 0.00 H new ATOM 2079 N GLY A 134 -0.660 -8.583 15.138 1.00 0.00 N ATOM 2080 CA GLY A 134 -1.811 -8.154 15.910 1.00 0.00 C ATOM 2081 C GLY A 134 -1.988 -6.649 15.901 1.00 0.00 C ATOM 2082 O GLY A 134 -2.374 -6.055 16.909 1.00 0.00 O ATOM 0 H GLY A 134 -0.884 -9.061 14.265 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -2.709 -8.625 15.509 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -1.703 -8.498 16.939 1.00 0.00 H new ATOM 2086 N LEU A 135 -1.703 -6.029 14.761 1.00 0.00 N ATOM 2087 CA LEU A 135 -1.832 -4.582 14.624 1.00 0.00 C ATOM 2088 C LEU A 135 -2.859 -4.225 13.555 1.00 0.00 C ATOM 2089 O LEU A 135 -3.669 -3.316 13.736 1.00 0.00 O ATOM 2090 CB LEU A 135 -0.478 -3.961 14.275 1.00 0.00 C ATOM 2091 CG LEU A 135 0.686 -4.327 15.196 1.00 0.00 C ATOM 2092 CD1 LEU A 135 2.008 -3.887 14.586 1.00 0.00 C ATOM 2093 CD2 LEU A 135 0.496 -3.702 16.570 1.00 0.00 C ATOM 0 H LEU A 135 -1.381 -6.505 13.918 1.00 0.00 H new ATOM 0 HA LEU A 135 -2.174 -4.181 15.578 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -0.217 -4.255 13.258 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -0.588 -2.877 14.275 1.00 0.00 H new ATOM 0 HG LEU A 135 0.706 -5.411 15.312 1.00 0.00 H new ATOM 0 HD11 LEU A 135 2.825 -4.156 15.256 1.00 0.00 H new ATOM 0 HD12 LEU A 135 2.148 -4.382 13.625 1.00 0.00 H new ATOM 0 HD13 LEU A 135 1.999 -2.807 14.439 1.00 0.00 H new ATOM 0 HD21 LEU A 135 1.334 -3.973 17.212 1.00 0.00 H new ATOM 0 HD22 LEU A 135 0.449 -2.617 16.473 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -0.432 -4.067 17.011 1.00 0.00 H new ATOM 2105 N PHE A 136 -2.822 -4.948 12.441 1.00 0.00 N ATOM 2106 CA PHE A 136 -3.751 -4.709 11.342 1.00 0.00 C ATOM 2107 C PHE A 136 -5.129 -4.322 11.870 1.00 0.00 C ATOM 2108 O PHE A 136 -5.629 -4.917 12.825 1.00 0.00 O ATOM 2109 CB PHE A 136 -3.861 -5.954 10.459 1.00 0.00 C ATOM 2110 CG PHE A 136 -5.129 -6.008 9.655 1.00 0.00 C ATOM 2111 CD1 PHE A 136 -6.309 -6.452 10.228 1.00 0.00 C ATOM 2112 CD2 PHE A 136 -5.139 -5.614 8.327 1.00 0.00 C ATOM 2113 CE1 PHE A 136 -7.477 -6.503 9.490 1.00 0.00 C ATOM 2114 CE2 PHE A 136 -6.304 -5.662 7.584 1.00 0.00 C ATOM 2115 CZ PHE A 136 -7.474 -6.107 8.167 1.00 0.00 C ATOM 0 H PHE A 136 -2.159 -5.705 12.275 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.365 -3.883 10.745 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -3.008 -5.985 9.781 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -3.801 -6.842 11.088 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -6.317 -6.762 11.263 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -4.226 -5.265 7.867 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -8.391 -6.852 9.948 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -6.299 -5.352 6.549 1.00 0.00 H new ATOM 0 HZ PHE A 136 -8.386 -6.145 7.589 1.00 0.00 H new ATOM 2125 N SER A 137 -5.737 -3.321 11.242 1.00 0.00 N ATOM 2126 CA SER A 137 -7.056 -2.851 11.650 1.00 0.00 C ATOM 2127 C SER A 137 -8.047 -2.942 10.494 1.00 0.00 C ATOM 2128 O SER A 137 -7.659 -3.135 9.343 1.00 0.00 O ATOM 2129 CB SER A 137 -6.973 -1.408 12.153 1.00 0.00 C ATOM 2130 OG SER A 137 -6.714 -1.368 13.546 1.00 0.00 O ATOM 0 H SER A 137 -5.337 -2.820 10.449 1.00 0.00 H new ATOM 0 HA SER A 137 -7.408 -3.491 12.459 1.00 0.00 H new ATOM 0 HB2 SER A 137 -6.185 -0.878 11.618 1.00 0.00 H new ATOM 0 HB3 SER A 137 -7.908 -0.890 11.939 1.00 0.00 H new ATOM 0 HG SER A 137 -6.664 -0.435 13.843 1.00 0.00 H new ATOM 2136 N GLY A 138 -9.331 -2.801 10.810 1.00 0.00 N ATOM 2137 CA GLY A 138 -10.359 -2.871 9.788 1.00 0.00 C ATOM 2138 C GLY A 138 -10.858 -4.284 9.563 1.00 0.00 C ATOM 2139 O GLY A 138 -10.112 -5.248 9.738 1.00 0.00 O ATOM 0 H GLY A 138 -9.677 -2.640 11.756 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -11.196 -2.235 10.075 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -9.964 -2.475 8.852 1.00 0.00 H new ATOM 2143 N ASP A 139 -12.122 -4.408 9.176 1.00 0.00 N ATOM 2144 CA ASP A 139 -12.721 -5.715 8.927 1.00 0.00 C ATOM 2145 C ASP A 139 -11.725 -6.647 8.244 1.00 0.00 C ATOM 2146 O ASP A 139 -11.247 -6.383 7.141 1.00 0.00 O ATOM 2147 CB ASP A 139 -13.976 -5.569 8.066 1.00 0.00 C ATOM 2148 CG ASP A 139 -14.940 -6.725 8.247 1.00 0.00 C ATOM 2149 OD1 ASP A 139 -14.872 -7.394 9.299 1.00 0.00 O ATOM 2150 OD2 ASP A 139 -15.762 -6.960 7.337 1.00 0.00 O ATOM 0 H ASP A 139 -12.752 -3.620 9.028 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.998 -6.150 9.887 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -14.480 -4.636 8.319 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -13.688 -5.501 7.017 1.00 0.00 H new ATOM 2155 N PRO A 140 -11.405 -7.764 8.913 1.00 0.00 N ATOM 2156 CA PRO A 140 -10.463 -8.758 8.389 1.00 0.00 C ATOM 2157 C PRO A 140 -11.028 -9.519 7.195 1.00 0.00 C ATOM 2158 O PRO A 140 -10.346 -10.351 6.598 1.00 0.00 O ATOM 2159 CB PRO A 140 -10.251 -9.704 9.574 1.00 0.00 C ATOM 2160 CG PRO A 140 -11.488 -9.569 10.393 1.00 0.00 C ATOM 2161 CD PRO A 140 -11.937 -8.144 10.233 1.00 0.00 C ATOM 0 HA PRO A 140 -9.545 -8.297 8.024 1.00 0.00 H new ATOM 0 HB2 PRO A 140 -10.108 -10.732 9.240 1.00 0.00 H new ATOM 0 HB3 PRO A 140 -9.365 -9.429 10.147 1.00 0.00 H new ATOM 0 HG2 PRO A 140 -12.258 -10.261 10.053 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -11.290 -9.801 11.440 1.00 0.00 H new ATOM 0 HD2 PRO A 140 -13.023 -8.059 10.268 1.00 0.00 H new ATOM 0 HD3 PRO A 140 -11.541 -7.507 11.024 1.00 0.00 H new ATOM 2169 N ASN A 141 -12.279 -9.228 6.851 1.00 0.00 N ATOM 2170 CA ASN A 141 -12.935 -9.885 5.727 1.00 0.00 C ATOM 2171 C ASN A 141 -12.515 -9.251 4.405 1.00 0.00 C ATOM 2172 O ASN A 141 -12.174 -9.949 3.450 1.00 0.00 O ATOM 2173 CB ASN A 141 -14.455 -9.809 5.882 1.00 0.00 C ATOM 2174 CG ASN A 141 -14.967 -10.695 7.002 1.00 0.00 C ATOM 2175 OD1 ASN A 141 -15.091 -11.909 6.841 1.00 0.00 O ATOM 2176 ND2 ASN A 141 -15.268 -10.089 8.145 1.00 0.00 N ATOM 0 H ASN A 141 -12.858 -8.542 7.335 1.00 0.00 H new ATOM 0 HA ASN A 141 -12.629 -10.931 5.721 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -14.746 -8.777 6.077 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -14.928 -10.103 4.945 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -15.618 -10.633 8.934 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -15.150 -9.080 8.234 1.00 0.00 H new ATOM 2183 N TRP A 142 -12.542 -7.924 4.357 1.00 0.00 N ATOM 2184 CA TRP A 142 -12.164 -7.195 3.152 1.00 0.00 C ATOM 2185 C TRP A 142 -11.027 -7.902 2.422 1.00 0.00 C ATOM 2186 O TRP A 142 -11.014 -7.971 1.193 1.00 0.00 O ATOM 2187 CB TRP A 142 -11.748 -5.766 3.505 1.00 0.00 C ATOM 2188 CG TRP A 142 -12.881 -4.926 4.014 1.00 0.00 C ATOM 2189 CD1 TRP A 142 -14.201 -5.043 3.683 1.00 0.00 C ATOM 2190 CD2 TRP A 142 -12.793 -3.841 4.944 1.00 0.00 C ATOM 2191 NE1 TRP A 142 -14.938 -4.095 4.351 1.00 0.00 N ATOM 2192 CE2 TRP A 142 -14.098 -3.346 5.131 1.00 0.00 C ATOM 2193 CE3 TRP A 142 -11.739 -3.241 5.638 1.00 0.00 C ATOM 2194 CZ2 TRP A 142 -14.374 -2.279 5.982 1.00 0.00 C ATOM 2195 CZ3 TRP A 142 -12.015 -2.182 6.482 1.00 0.00 C ATOM 2196 CH2 TRP A 142 -13.323 -1.710 6.649 1.00 0.00 C ATOM 0 H TRP A 142 -12.822 -7.331 5.138 1.00 0.00 H new ATOM 0 HA TRP A 142 -13.030 -7.162 2.491 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -10.963 -5.800 4.260 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -11.321 -5.291 2.622 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -14.606 -5.773 2.997 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -15.948 -3.970 4.278 1.00 0.00 H new ATOM 0 HE3 TRP A 142 -10.727 -3.598 5.517 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -15.382 -1.913 6.111 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 -11.208 -1.710 7.022 1.00 0.00 H new ATOM 0 HH2 TRP A 142 -13.506 -0.881 7.317 1.00 0.00 H new ATOM 2207 N PHE A 143 -10.075 -8.426 3.186 1.00 0.00 N ATOM 2208 CA PHE A 143 -8.933 -9.128 2.611 1.00 0.00 C ATOM 2209 C PHE A 143 -8.892 -10.578 3.084 1.00 0.00 C ATOM 2210 O PHE A 143 -8.847 -10.867 4.280 1.00 0.00 O ATOM 2211 CB PHE A 143 -7.630 -8.420 2.987 1.00 0.00 C ATOM 2212 CG PHE A 143 -7.718 -6.922 2.910 1.00 0.00 C ATOM 2213 CD1 PHE A 143 -8.122 -6.182 4.009 1.00 0.00 C ATOM 2214 CD2 PHE A 143 -7.397 -6.255 1.739 1.00 0.00 C ATOM 2215 CE1 PHE A 143 -8.204 -4.804 3.942 1.00 0.00 C ATOM 2216 CE2 PHE A 143 -7.476 -4.878 1.666 1.00 0.00 C ATOM 2217 CZ PHE A 143 -7.882 -4.151 2.768 1.00 0.00 C ATOM 0 H PHE A 143 -10.071 -8.378 4.205 1.00 0.00 H new ATOM 0 HA PHE A 143 -9.042 -9.121 1.527 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -7.349 -8.708 4.000 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -6.835 -8.764 2.325 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -8.376 -6.688 4.929 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -7.081 -6.818 0.873 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -8.519 -4.238 4.806 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -7.220 -4.370 0.748 1.00 0.00 H new ATOM 0 HZ PHE A 143 -7.948 -3.074 2.712 1.00 0.00 H new ATOM 2227 N PRO A 144 -8.908 -11.514 2.123 1.00 0.00 N ATOM 2228 CA PRO A 144 -8.873 -12.950 2.416 1.00 0.00 C ATOM 2229 C PRO A 144 -7.522 -13.397 2.965 1.00 0.00 C ATOM 2230 O PRO A 144 -6.525 -12.685 2.845 1.00 0.00 O ATOM 2231 CB PRO A 144 -9.136 -13.597 1.054 1.00 0.00 C ATOM 2232 CG PRO A 144 -8.680 -12.585 0.060 1.00 0.00 C ATOM 2233 CD PRO A 144 -8.961 -11.243 0.677 1.00 0.00 C ATOM 0 HA PRO A 144 -9.597 -13.227 3.182 1.00 0.00 H new ATOM 0 HB2 PRO A 144 -8.587 -14.532 0.947 1.00 0.00 H new ATOM 0 HB3 PRO A 144 -10.193 -13.831 0.924 1.00 0.00 H new ATOM 0 HG2 PRO A 144 -7.618 -12.701 -0.156 1.00 0.00 H new ATOM 0 HG3 PRO A 144 -9.211 -12.699 -0.885 1.00 0.00 H new ATOM 0 HD2 PRO A 144 -8.220 -10.501 0.380 1.00 0.00 H new ATOM 0 HD3 PRO A 144 -9.935 -10.858 0.376 1.00 0.00 H new ATOM 2241 N LYS A 145 -7.496 -14.581 3.568 1.00 0.00 N ATOM 2242 CA LYS A 145 -6.267 -15.124 4.134 1.00 0.00 C ATOM 2243 C LYS A 145 -5.755 -16.295 3.301 1.00 0.00 C ATOM 2244 O LYS A 145 -5.112 -17.207 3.821 1.00 0.00 O ATOM 2245 CB LYS A 145 -6.503 -15.577 5.577 1.00 0.00 C ATOM 2246 CG LYS A 145 -6.869 -14.442 6.518 1.00 0.00 C ATOM 2247 CD LYS A 145 -7.648 -14.945 7.722 1.00 0.00 C ATOM 2248 CE LYS A 145 -6.732 -15.604 8.742 1.00 0.00 C ATOM 2249 NZ LYS A 145 -7.461 -15.963 9.991 1.00 0.00 N ATOM 0 H LYS A 145 -8.312 -15.183 3.677 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.513 -14.337 4.124 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -7.300 -16.320 5.590 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -5.603 -16.069 5.947 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -5.962 -13.940 6.854 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -7.463 -13.701 5.983 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -8.176 -14.113 8.189 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -8.404 -15.659 7.395 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -6.291 -16.501 8.308 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.910 -14.929 8.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -6.803 -16.410 10.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -7.861 -15.103 10.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -8.229 -16.627 9.766 1.00 0.00 H new ATOM 2263 N LYS A 146 -6.043 -16.262 2.004 1.00 0.00 N ATOM 2264 CA LYS A 146 -5.609 -17.319 1.097 1.00 0.00 C ATOM 2265 C LYS A 146 -6.089 -18.683 1.582 1.00 0.00 C ATOM 2266 O LYS A 146 -5.374 -19.678 1.471 1.00 0.00 O ATOM 2267 CB LYS A 146 -4.084 -17.317 0.972 1.00 0.00 C ATOM 2268 CG LYS A 146 -3.539 -16.132 0.194 1.00 0.00 C ATOM 2269 CD LYS A 146 -2.044 -16.261 -0.044 1.00 0.00 C ATOM 2270 CE LYS A 146 -1.738 -17.285 -1.126 1.00 0.00 C ATOM 2271 NZ LYS A 146 -2.156 -16.809 -2.474 1.00 0.00 N ATOM 0 H LYS A 146 -6.575 -15.515 1.557 1.00 0.00 H new ATOM 0 HA LYS A 146 -6.048 -17.127 0.118 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.646 -17.318 1.970 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.767 -18.238 0.484 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -4.055 -16.055 -0.763 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -3.743 -15.212 0.741 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -1.636 -15.292 -0.332 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -1.551 -16.552 0.883 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -0.669 -17.499 -1.132 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.249 -18.220 -0.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -1.713 -17.402 -3.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -3.191 -16.871 -2.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -1.857 -15.821 -2.602 1.00 0.00 H new ATOM 2285 N SER A 147 -7.305 -18.722 2.119 1.00 0.00 N ATOM 2286 CA SER A 147 -7.879 -19.964 2.623 1.00 0.00 C ATOM 2287 C SER A 147 -9.301 -20.155 2.104 1.00 0.00 C ATOM 2288 O SER A 147 -9.644 -21.210 1.571 1.00 0.00 O ATOM 2289 CB SER A 147 -7.877 -19.968 4.152 1.00 0.00 C ATOM 2290 OG SER A 147 -6.574 -20.197 4.660 1.00 0.00 O ATOM 0 H SER A 147 -7.911 -17.908 2.216 1.00 0.00 H new ATOM 0 HA SER A 147 -7.266 -20.791 2.264 1.00 0.00 H new ATOM 0 HB2 SER A 147 -8.252 -19.014 4.522 1.00 0.00 H new ATOM 0 HB3 SER A 147 -8.554 -20.740 4.518 1.00 0.00 H new ATOM 0 HG SER A 147 -6.599 -20.193 5.640 1.00 0.00 H new ATOM 2296 N LYS A 148 -10.125 -19.125 2.265 1.00 0.00 N ATOM 2297 CA LYS A 148 -11.511 -19.176 1.813 1.00 0.00 C ATOM 2298 C LYS A 148 -12.161 -20.501 2.199 1.00 0.00 C ATOM 2299 O LYS A 148 -12.726 -21.195 1.355 1.00 0.00 O ATOM 2300 CB LYS A 148 -11.581 -18.985 0.296 1.00 0.00 C ATOM 2301 CG LYS A 148 -13.000 -18.915 -0.243 1.00 0.00 C ATOM 2302 CD LYS A 148 -13.082 -18.045 -1.486 1.00 0.00 C ATOM 2303 CE LYS A 148 -13.363 -16.593 -1.133 1.00 0.00 C ATOM 2304 NZ LYS A 148 -14.799 -16.370 -0.807 1.00 0.00 N ATOM 0 H LYS A 148 -9.857 -18.245 2.705 1.00 0.00 H new ATOM 0 HA LYS A 148 -12.056 -18.368 2.301 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -11.054 -18.069 0.029 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -11.057 -19.808 -0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -13.351 -19.920 -0.477 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -13.663 -18.517 0.525 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -12.146 -18.111 -2.040 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -13.868 -18.420 -2.142 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -12.748 -16.300 -0.282 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -13.077 -15.954 -1.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -14.960 -15.359 -0.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -15.388 -16.673 -1.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -15.053 -16.922 0.037 1.00 0.00 H new ATOM 2318 N GLU A 149 -12.077 -20.844 3.481 1.00 0.00 N ATOM 2319 CA GLU A 149 -12.659 -22.085 3.978 1.00 0.00 C ATOM 2320 C GLU A 149 -13.723 -21.803 5.035 1.00 0.00 C ATOM 2321 O GLU A 149 -14.786 -22.423 5.041 1.00 0.00 O ATOM 2322 CB GLU A 149 -11.569 -22.986 4.563 1.00 0.00 C ATOM 2323 CG GLU A 149 -12.034 -24.408 4.830 1.00 0.00 C ATOM 2324 CD GLU A 149 -12.047 -25.263 3.578 1.00 0.00 C ATOM 2325 OE1 GLU A 149 -11.077 -25.185 2.796 1.00 0.00 O ATOM 2326 OE2 GLU A 149 -13.028 -26.010 3.380 1.00 0.00 O ATOM 0 H GLU A 149 -11.612 -20.281 4.193 1.00 0.00 H new ATOM 0 HA GLU A 149 -13.132 -22.596 3.139 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -10.723 -23.012 3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -11.209 -22.549 5.495 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -11.380 -24.867 5.572 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -13.036 -24.384 5.259 1.00 0.00 H new ATOM 2333 N SER A 150 -13.427 -20.864 5.928 1.00 0.00 N ATOM 2334 CA SER A 150 -14.355 -20.502 6.992 1.00 0.00 C ATOM 2335 C SER A 150 -15.525 -19.692 6.441 1.00 0.00 C ATOM 2336 O SER A 150 -15.333 -18.732 5.696 1.00 0.00 O ATOM 2337 CB SER A 150 -13.633 -19.702 8.078 1.00 0.00 C ATOM 2338 OG SER A 150 -14.451 -19.543 9.224 1.00 0.00 O ATOM 0 H SER A 150 -12.552 -20.340 5.935 1.00 0.00 H new ATOM 0 HA SER A 150 -14.745 -21.422 7.427 1.00 0.00 H new ATOM 0 HB2 SER A 150 -12.709 -20.210 8.355 1.00 0.00 H new ATOM 0 HB3 SER A 150 -13.354 -18.723 7.688 1.00 0.00 H new ATOM 0 HG SER A 150 -13.966 -19.030 9.904 1.00 0.00 H new ATOM 2344 N GLY A 151 -16.738 -20.087 6.814 1.00 0.00 N ATOM 2345 CA GLY A 151 -17.922 -19.388 6.348 1.00 0.00 C ATOM 2346 C GLY A 151 -18.738 -18.808 7.487 1.00 0.00 C ATOM 2347 O GLY A 151 -18.348 -18.869 8.653 1.00 0.00 O ATOM 0 H GLY A 151 -16.922 -20.878 7.430 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -17.625 -18.586 5.673 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -18.543 -20.075 5.773 1.00 0.00 H new ATOM 2351 N PRO A 152 -19.901 -18.229 7.151 1.00 0.00 N ATOM 2352 CA PRO A 152 -20.798 -17.624 8.140 1.00 0.00 C ATOM 2353 C PRO A 152 -21.462 -18.665 9.034 1.00 0.00 C ATOM 2354 O PRO A 152 -22.145 -19.568 8.550 1.00 0.00 O ATOM 2355 CB PRO A 152 -21.845 -16.912 7.280 1.00 0.00 C ATOM 2356 CG PRO A 152 -21.843 -17.655 5.989 1.00 0.00 C ATOM 2357 CD PRO A 152 -20.429 -18.121 5.781 1.00 0.00 C ATOM 0 HA PRO A 152 -20.265 -16.962 8.823 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -22.828 -16.938 7.750 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -21.590 -15.863 7.133 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -22.531 -18.500 6.024 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -22.167 -17.014 5.169 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -20.394 -19.078 5.260 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -19.856 -17.412 5.184 1.00 0.00 H new ATOM 2365 N SER A 153 -21.258 -18.533 10.341 1.00 0.00 N ATOM 2366 CA SER A 153 -21.835 -19.464 11.303 1.00 0.00 C ATOM 2367 C SER A 153 -23.359 -19.450 11.226 1.00 0.00 C ATOM 2368 O SER A 153 -23.974 -18.394 11.086 1.00 0.00 O ATOM 2369 CB SER A 153 -21.381 -19.113 12.721 1.00 0.00 C ATOM 2370 OG SER A 153 -21.912 -20.024 13.667 1.00 0.00 O ATOM 0 H SER A 153 -20.697 -17.790 10.758 1.00 0.00 H new ATOM 0 HA SER A 153 -21.485 -20.466 11.056 1.00 0.00 H new ATOM 0 HB2 SER A 153 -20.292 -19.125 12.771 1.00 0.00 H new ATOM 0 HB3 SER A 153 -21.700 -18.100 12.968 1.00 0.00 H new ATOM 0 HG SER A 153 -21.606 -19.779 14.565 1.00 0.00 H new ATOM 2376 N SER A 154 -23.960 -20.632 11.320 1.00 0.00 N ATOM 2377 CA SER A 154 -25.412 -20.757 11.258 1.00 0.00 C ATOM 2378 C SER A 154 -25.997 -20.993 12.647 1.00 0.00 C ATOM 2379 O SER A 154 -25.268 -21.248 13.605 1.00 0.00 O ATOM 2380 CB SER A 154 -25.806 -21.904 10.325 1.00 0.00 C ATOM 2381 OG SER A 154 -27.080 -21.676 9.747 1.00 0.00 O ATOM 0 H SER A 154 -23.465 -21.516 11.439 1.00 0.00 H new ATOM 0 HA SER A 154 -25.816 -19.823 10.867 1.00 0.00 H new ATOM 0 HB2 SER A 154 -25.060 -22.009 9.538 1.00 0.00 H new ATOM 0 HB3 SER A 154 -25.818 -22.842 10.881 1.00 0.00 H new ATOM 0 HG SER A 154 -27.308 -22.422 9.154 1.00 0.00 H new ATOM 2387 N GLY A 155 -27.320 -20.907 12.748 1.00 0.00 N ATOM 2388 CA GLY A 155 -27.982 -21.113 14.023 1.00 0.00 C ATOM 2389 C GLY A 155 -27.443 -20.204 15.109 1.00 0.00 C ATOM 2390 O GLY A 155 -28.156 -19.334 15.610 1.00 0.00 O ATOM 0 H GLY A 155 -27.945 -20.698 11.970 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -29.052 -20.939 13.906 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -27.859 -22.152 14.329 1.00 0.00 H new TER 2394 GLY A 155