USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 126 THR OG1 : rot 180:sc= -0.0857 USER MOD Set 1.2: A 170 NDP O2D : rot 30:sc= -1.31! USER MOD Set 2.1: A 116 THR OG1 : rot -115:sc= 0.263 USER MOD Set 2.2: A 155 TYR OH : rot -104:sc= 0.42 USER MOD Set 3.1: A 89 HIS : no HD1:sc= -0.33 K(o=-1.5,f=-3.2) USER MOD Set 3.2: A 92 GLN : amide:sc= -1.19 K(o=-1.5,f=-3.2!) USER MOD Set 4.1: A 63 THR OG1 : rot -172:sc= -0.938 USER MOD Set 4.2: A 65 GLN :FLIP amide:sc= 0.00556 F(o=-1.8,f=-0.93) USER MOD Single : A 1 THR N :NH3+ -146:sc= -0.0312 (180deg=-0.343) USER MOD Single : A 1 THR OG1 : rot 41:sc= 0.485 USER MOD Single : A 7 GLN :FLIP amide:sc= -3.39 F(o=-6.1,f=-3.4) USER MOD Single : A 15 LYS NZ :NH3+ 150:sc=-0.00123 (180deg=-0.356) USER MOD Single : A 18 HIS :FLIP no HD1:sc= -0.628 F(o=-2.2,f=-0.63) USER MOD Single : A 22 HIS : no HD1:sc= -0.0263 X(o=-0.026,f=-0.17) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot -74:sc= -0.13 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 150:sc= -0.397 (180deg=-1.49!) USER MOD Single : A 45 THR OG1 : rot -90:sc= -0.116 USER MOD Single : A 46 TYR OH : rot 105:sc= 0.966 USER MOD Single : A 48 SER OG : rot 81:sc= 1.17 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 83:sc= 0.28 USER MOD Single : A 59 ASN :FLIP amide:sc= 0.0161 F(o=-2.7,f=0.016) USER MOD Single : A 64 HIS : no HD1:sc= -4.55! X(o=-4.5!,f=-4.2) USER MOD Single : A 68 TYR OH : rot 83:sc= 2.21 USER MOD Single : A 69 GLN :FLIP amide:sc= -0.386 F(o=-1.6,f=-0.39) USER MOD Single : A 71 GLN : amide:sc= -0.966 K(o=-0.97,f=-1.7) USER MOD Single : A 77 HIS : no HE2:sc= -3.34 K(o=-3.3,f=-6.3!) USER MOD Single : A 85 TYR OH : rot -155:sc= -6.24! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.435 X(o=-0.44,f=-0.41) USER MOD Single : A 101 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 104 THR OG1 : rot -160:sc= -2.07! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= -0.678 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -165:sc= -3.33! (180deg=-3.65) USER MOD Single : A 132 ASN : amide:sc= -0.405 X(o=-0.4,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -164:sc= 0.551 (180deg=0.419) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= -0.402 USER MOD Single : A 143 THR OG1 : rot 180:sc=-0.00238 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0881 USER MOD Single : A 148 ASN : amide:sc= -0.155 K(o=-0.16,f=-0.84) USER MOD Single : A 152 THR OG1 : rot 91:sc= 0.794 USER MOD Single : A 153 HIS : no HE2:sc= -6.69! C(o=-6.7!,f=-8.5!) USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 159 GLN :FLIP amide:sc= 1.53 F(o=-0.085,f=1.5) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O3B : rot 156:sc= -1.57 USER MOD Single : A 170 NDP O3D : rot -41:sc= 0.0107 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.148 8.888 5.352 1.00 0.00 N ATOM 2 CA THR A 1 -4.621 8.404 4.048 1.00 0.00 C ATOM 3 C THR A 1 -3.109 8.217 4.101 1.00 0.00 C ATOM 4 O THR A 1 -2.353 9.189 4.097 1.00 0.00 O ATOM 5 CB THR A 1 -4.990 9.420 2.966 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.438 10.691 3.263 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.484 9.597 2.795 1.00 0.00 C ATOM 0 H1 THR A 1 -6.094 8.487 5.515 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.509 8.590 6.117 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.210 9.926 5.338 1.00 0.00 H new ATOM 0 HA THR A 1 -5.064 7.435 3.820 1.00 0.00 H new ATOM 0 HB THR A 1 -4.580 9.017 2.040 1.00 0.00 H new ATOM 0 HG1 THR A 1 -3.525 10.580 3.602 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.676 10.331 2.012 1.00 0.00 H new ATOM 0 HG22 THR A 1 -6.934 8.644 2.517 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.919 9.944 3.732 1.00 0.00 H new ATOM 17 N ALA A 2 -2.673 6.963 4.151 1.00 0.00 N ATOM 18 CA ALA A 2 -1.251 6.650 4.206 1.00 0.00 C ATOM 19 C ALA A 2 -0.887 5.560 3.203 1.00 0.00 C ATOM 20 O ALA A 2 -1.673 4.649 2.946 1.00 0.00 O ATOM 21 CB ALA A 2 -0.859 6.225 5.613 1.00 0.00 C ATOM 0 H ALA A 2 -3.285 6.147 4.155 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.697 7.550 3.941 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.206 5.994 5.640 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.072 7.035 6.310 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.429 5.341 5.898 1.00 0.00 H new ATOM 27 N PHE A 3 0.312 5.661 2.640 1.00 0.00 N ATOM 28 CA PHE A 3 0.788 4.685 1.665 1.00 0.00 C ATOM 29 C PHE A 3 1.808 3.746 2.300 1.00 0.00 C ATOM 30 O PHE A 3 2.739 4.194 2.966 1.00 0.00 O ATOM 31 CB PHE A 3 1.422 5.396 0.469 1.00 0.00 C ATOM 32 CG PHE A 3 0.430 5.906 -0.540 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.779 6.451 -0.136 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.713 5.844 -1.895 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.686 6.924 -1.066 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.191 6.314 -2.828 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.391 6.855 -2.413 1.00 0.00 C ATOM 0 H PHE A 3 0.974 6.410 2.842 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.067 4.101 1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.018 6.234 0.832 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.107 4.709 -0.027 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.015 6.507 0.916 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.651 5.423 -2.226 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.624 7.347 -0.739 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.041 6.258 -3.881 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.098 7.224 -3.141 1.00 0.00 H new ATOM 47 N LEU A 4 1.632 2.446 2.094 1.00 0.00 N ATOM 48 CA LEU A 4 2.548 1.461 2.654 1.00 0.00 C ATOM 49 C LEU A 4 2.761 0.297 1.692 1.00 0.00 C ATOM 50 O LEU A 4 1.836 -0.465 1.410 1.00 0.00 O ATOM 51 CB LEU A 4 2.011 0.945 3.990 1.00 0.00 C ATOM 52 CG LEU A 4 2.768 -0.245 4.580 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.158 0.176 5.034 1.00 0.00 C ATOM 54 CD2 LEU A 4 1.982 -0.846 5.733 1.00 0.00 C ATOM 0 H LEU A 4 0.867 2.051 1.546 1.00 0.00 H new ATOM 0 HA LEU A 4 3.510 1.947 2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 4 2.031 1.762 4.711 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.967 0.662 3.859 1.00 0.00 H new ATOM 0 HG LEU A 4 2.882 -1.005 3.807 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.681 -0.685 5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.717 0.563 4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.073 0.952 5.795 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.531 -1.693 6.145 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.840 -0.093 6.508 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.010 -1.184 5.374 1.00 0.00 H new ATOM 66 N TRP A 5 3.988 0.160 1.196 1.00 0.00 N ATOM 67 CA TRP A 5 4.317 -0.921 0.272 1.00 0.00 C ATOM 68 C TRP A 5 5.823 -1.180 0.239 1.00 0.00 C ATOM 69 O TRP A 5 6.619 -0.316 0.609 1.00 0.00 O ATOM 70 CB TRP A 5 3.798 -0.600 -1.135 1.00 0.00 C ATOM 71 CG TRP A 5 4.724 0.261 -1.939 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.736 -0.160 -2.751 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.725 1.689 -2.004 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.368 0.920 -3.316 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.765 2.067 -2.873 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.946 2.685 -1.411 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.046 3.398 -3.162 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.224 4.008 -1.700 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.267 4.354 -2.569 1.00 0.00 C ATOM 0 H TRP A 5 4.767 0.780 1.417 1.00 0.00 H new ATOM 0 HA TRP A 5 3.827 -1.828 0.627 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.628 -1.534 -1.671 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.833 -0.100 -1.051 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.001 -1.192 -2.924 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.157 0.875 -3.960 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.141 2.426 -0.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.850 3.667 -3.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.628 4.787 -1.249 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.460 5.396 -2.775 1.00 0.00 H new ATOM 90 N ALA A 6 6.206 -2.371 -0.213 1.00 0.00 N ATOM 91 CA ALA A 6 7.616 -2.740 -0.302 1.00 0.00 C ATOM 92 C ALA A 6 8.121 -2.600 -1.735 1.00 0.00 C ATOM 93 O ALA A 6 7.383 -2.854 -2.686 1.00 0.00 O ATOM 94 CB ALA A 6 7.824 -4.162 0.197 1.00 0.00 C ATOM 0 H ALA A 6 5.560 -3.097 -0.523 1.00 0.00 H new ATOM 0 HA ALA A 6 8.188 -2.061 0.330 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.880 -4.422 0.124 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.503 -4.233 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.238 -4.851 -0.412 1.00 0.00 H new ATOM 100 N GLN A 7 9.378 -2.190 -1.889 1.00 0.00 N ATOM 101 CA GLN A 7 9.954 -2.014 -3.220 1.00 0.00 C ATOM 102 C GLN A 7 11.441 -2.357 -3.247 1.00 0.00 C ATOM 103 O GLN A 7 12.105 -2.379 -2.212 1.00 0.00 O ATOM 104 CB GLN A 7 9.749 -0.574 -3.694 1.00 0.00 C ATOM 105 CG GLN A 7 10.159 0.468 -2.666 1.00 0.00 C ATOM 106 CD GLN A 7 9.008 1.366 -2.255 1.00 0.00 C ATOM 107 OE1 GLN A 7 8.191 0.891 -1.322 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.855 2.474 -2.769 1.00 0.00 N flip ATOM 0 H GLN A 7 10.011 -1.976 -1.118 1.00 0.00 H new ATOM 0 HA GLN A 7 9.440 -2.701 -3.892 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.322 -0.416 -4.608 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.699 -0.429 -3.947 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.556 -0.034 -1.784 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.964 1.079 -3.075 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.507 2.800 -3.483 1.00 0.00 H new ATOM 0 HE22 GLN A 7 8.076 3.067 -2.481 1.00 0.00 H new ATOM 117 N ASP A 8 11.955 -2.614 -4.449 1.00 0.00 N ATOM 118 CA ASP A 8 13.365 -2.947 -4.634 1.00 0.00 C ATOM 119 C ASP A 8 14.154 -1.714 -5.074 1.00 0.00 C ATOM 120 O ASP A 8 13.658 -0.590 -4.985 1.00 0.00 O ATOM 121 CB ASP A 8 13.516 -4.074 -5.661 1.00 0.00 C ATOM 122 CG ASP A 8 13.088 -3.661 -7.057 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.775 -2.469 -7.257 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.068 -4.532 -7.951 1.00 0.00 O ATOM 0 H ASP A 8 11.412 -2.598 -5.312 1.00 0.00 H new ATOM 0 HA ASP A 8 13.767 -3.290 -3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.556 -4.399 -5.686 1.00 0.00 H new ATOM 0 HB3 ASP A 8 12.922 -4.931 -5.343 1.00 0.00 H new ATOM 129 N ARG A 9 15.378 -1.923 -5.552 1.00 0.00 N ATOM 130 CA ARG A 9 16.218 -0.817 -6.007 1.00 0.00 C ATOM 131 C ARG A 9 15.589 -0.115 -7.209 1.00 0.00 C ATOM 132 O ARG A 9 15.709 1.100 -7.367 1.00 0.00 O ATOM 133 CB ARG A 9 17.614 -1.325 -6.371 1.00 0.00 C ATOM 134 CG ARG A 9 18.338 -1.996 -5.214 1.00 0.00 C ATOM 135 CD ARG A 9 19.793 -1.563 -5.139 1.00 0.00 C ATOM 136 NE ARG A 9 19.959 -0.331 -4.371 1.00 0.00 N ATOM 137 CZ ARG A 9 21.121 0.077 -3.865 1.00 0.00 C ATOM 138 NH1 ARG A 9 22.220 -0.645 -4.044 1.00 0.00 N ATOM 139 NH2 ARG A 9 21.184 1.210 -3.180 1.00 0.00 N ATOM 0 H ARG A 9 15.809 -2.844 -5.634 1.00 0.00 H new ATOM 0 HA ARG A 9 16.302 -0.098 -5.192 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.530 -2.033 -7.196 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.214 -0.488 -6.728 1.00 0.00 H new ATOM 0 HG2 ARG A 9 17.836 -1.751 -4.278 1.00 0.00 H new ATOM 0 HG3 ARG A 9 18.285 -3.079 -5.330 1.00 0.00 H new ATOM 0 HD2 ARG A 9 20.384 -2.357 -4.683 1.00 0.00 H new ATOM 0 HD3 ARG A 9 20.180 -1.416 -6.147 1.00 0.00 H new ATOM 0 HE ARG A 9 19.136 0.251 -4.213 1.00 0.00 H new ATOM 0 HH11 ARG A 9 22.177 -1.517 -4.571 1.00 0.00 H new ATOM 0 HH12 ARG A 9 23.108 -0.328 -3.654 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.342 1.769 -3.041 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.074 1.523 -2.792 1.00 0.00 H new ATOM 153 N ASP A 10 14.912 -0.893 -8.049 1.00 0.00 N ATOM 154 CA ASP A 10 14.250 -0.363 -9.240 1.00 0.00 C ATOM 155 C ASP A 10 12.881 0.231 -8.895 1.00 0.00 C ATOM 156 O ASP A 10 12.148 0.676 -9.778 1.00 0.00 O ATOM 157 CB ASP A 10 14.093 -1.463 -10.292 1.00 0.00 C ATOM 158 CG ASP A 10 15.114 -1.347 -11.406 1.00 0.00 C ATOM 159 OD1 ASP A 10 15.216 -0.257 -12.007 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.813 -2.346 -11.678 1.00 0.00 O ATOM 0 H ASP A 10 14.806 -1.900 -7.926 1.00 0.00 H new ATOM 0 HA ASP A 10 14.874 0.434 -9.645 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.191 -2.437 -9.813 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.090 -1.416 -10.716 1.00 0.00 H new ATOM 165 N GLY A 11 12.545 0.229 -7.609 1.00 0.00 N ATOM 166 CA GLY A 11 11.269 0.763 -7.174 1.00 0.00 C ATOM 167 C GLY A 11 10.131 -0.221 -7.368 1.00 0.00 C ATOM 168 O GLY A 11 8.964 0.122 -7.175 1.00 0.00 O ATOM 0 H GLY A 11 13.135 -0.134 -6.860 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.333 1.036 -6.121 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.053 1.677 -7.728 1.00 0.00 H new ATOM 172 N LEU A 12 10.472 -1.453 -7.744 1.00 0.00 N ATOM 173 CA LEU A 12 9.479 -2.501 -7.959 1.00 0.00 C ATOM 174 C LEU A 12 8.517 -2.579 -6.779 1.00 0.00 C ATOM 175 O LEU A 12 8.700 -1.899 -5.773 1.00 0.00 O ATOM 176 CB LEU A 12 10.185 -3.849 -8.140 1.00 0.00 C ATOM 177 CG LEU A 12 9.428 -4.901 -8.958 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.928 -4.310 -10.269 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.327 -6.100 -9.218 1.00 0.00 C ATOM 0 H LEU A 12 11.434 -1.749 -7.906 1.00 0.00 H new ATOM 0 HA LEU A 12 8.909 -2.263 -8.857 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.148 -3.671 -8.618 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.391 -4.264 -7.153 1.00 0.00 H new ATOM 0 HG LEU A 12 8.560 -5.229 -8.386 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.394 -5.075 -10.833 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.256 -3.478 -10.060 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.776 -3.954 -10.854 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.782 -6.844 -9.800 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.209 -5.780 -9.773 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.635 -6.537 -8.268 1.00 0.00 H new ATOM 191 N ILE A 13 7.517 -3.438 -6.894 1.00 0.00 N ATOM 192 CA ILE A 13 6.554 -3.639 -5.822 1.00 0.00 C ATOM 193 C ILE A 13 5.970 -5.044 -5.903 1.00 0.00 C ATOM 194 O ILE A 13 5.728 -5.690 -4.886 1.00 0.00 O ATOM 195 CB ILE A 13 5.423 -2.581 -5.830 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.454 -2.782 -7.002 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.018 -1.182 -5.875 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.017 -2.465 -6.645 1.00 0.00 C ATOM 0 H ILE A 13 7.350 -4.010 -7.722 1.00 0.00 H new ATOM 0 HA ILE A 13 7.089 -3.520 -4.880 1.00 0.00 H new ATOM 0 HB ILE A 13 4.852 -2.704 -4.910 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.763 -2.150 -7.834 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.518 -3.815 -7.345 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.215 -0.445 -5.880 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.648 -1.026 -4.999 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.618 -1.071 -6.778 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.382 -2.627 -7.516 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.692 -3.115 -5.833 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.942 -1.424 -6.329 1.00 0.00 H new ATOM 210 N GLY A 14 5.752 -5.511 -7.127 1.00 0.00 N ATOM 211 CA GLY A 14 5.201 -6.834 -7.325 1.00 0.00 C ATOM 212 C GLY A 14 5.698 -7.488 -8.597 1.00 0.00 C ATOM 213 O GLY A 14 6.451 -6.887 -9.365 1.00 0.00 O ATOM 0 H GLY A 14 5.948 -4.995 -7.985 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.460 -7.462 -6.473 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.113 -6.770 -7.355 1.00 0.00 H new ATOM 217 N LYS A 15 5.263 -8.718 -8.820 1.00 0.00 N ATOM 218 CA LYS A 15 5.643 -9.471 -10.007 1.00 0.00 C ATOM 219 C LYS A 15 4.412 -10.120 -10.630 1.00 0.00 C ATOM 220 O LYS A 15 4.356 -11.338 -10.803 1.00 0.00 O ATOM 221 CB LYS A 15 6.679 -10.540 -9.651 1.00 0.00 C ATOM 222 CG LYS A 15 6.244 -11.452 -8.514 1.00 0.00 C ATOM 223 CD LYS A 15 6.126 -12.899 -8.969 1.00 0.00 C ATOM 224 CE LYS A 15 5.240 -13.708 -8.034 1.00 0.00 C ATOM 225 NZ LYS A 15 6.004 -14.774 -7.329 1.00 0.00 N ATOM 0 H LYS A 15 4.640 -9.221 -8.188 1.00 0.00 H new ATOM 0 HA LYS A 15 6.085 -8.785 -10.729 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.883 -11.145 -10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.614 -10.051 -9.377 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.963 -11.384 -7.698 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.285 -11.114 -8.123 1.00 0.00 H new ATOM 0 HD2 LYS A 15 5.716 -12.932 -9.979 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.118 -13.350 -9.013 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.784 -13.043 -7.301 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.428 -14.160 -8.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 5.573 -14.953 -6.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 5.983 -15.647 -7.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 6.990 -14.468 -7.201 1.00 0.00 H new ATOM 239 N ASP A 16 3.419 -9.293 -10.951 1.00 0.00 N ATOM 240 CA ASP A 16 2.170 -9.770 -11.542 1.00 0.00 C ATOM 241 C ASP A 16 1.271 -10.380 -10.470 1.00 0.00 C ATOM 242 O ASP A 16 0.483 -11.285 -10.744 1.00 0.00 O ATOM 243 CB ASP A 16 2.445 -10.796 -12.647 1.00 0.00 C ATOM 244 CG ASP A 16 1.603 -10.551 -13.884 1.00 0.00 C ATOM 245 OD1 ASP A 16 0.390 -10.292 -13.736 1.00 0.00 O ATOM 246 OD2 ASP A 16 2.157 -10.617 -15.002 1.00 0.00 O ATOM 0 H ASP A 16 3.456 -8.283 -10.811 1.00 0.00 H new ATOM 0 HA ASP A 16 1.658 -8.916 -11.986 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.501 -10.762 -12.916 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.245 -11.798 -12.267 1.00 0.00 H new ATOM 251 N GLY A 17 1.399 -9.873 -9.247 1.00 0.00 N ATOM 252 CA GLY A 17 0.600 -10.368 -8.142 1.00 0.00 C ATOM 253 C GLY A 17 0.862 -9.604 -6.857 1.00 0.00 C ATOM 254 O GLY A 17 -0.036 -8.961 -6.314 1.00 0.00 O ATOM 0 H GLY A 17 2.046 -9.124 -9.002 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.457 -10.293 -8.398 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.816 -11.425 -7.985 1.00 0.00 H new ATOM 258 N HIS A 18 2.099 -9.676 -6.372 1.00 0.00 N ATOM 259 CA HIS A 18 2.487 -8.989 -5.146 1.00 0.00 C ATOM 260 C HIS A 18 3.987 -9.124 -4.904 1.00 0.00 C ATOM 261 O HIS A 18 4.720 -9.612 -5.764 1.00 0.00 O ATOM 262 CB HIS A 18 1.707 -9.556 -3.961 1.00 0.00 C ATOM 263 CG HIS A 18 1.964 -11.010 -3.709 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.123 -11.710 -3.646 1.00 0.00 N flip ATOM 265 CD2 HIS A 18 0.955 -11.924 -3.487 1.00 0.00 C flip ATOM 266 CE1 HIS A 18 2.794 -13.018 -3.389 1.00 0.00 C flip ATOM 267 NE2 HIS A 18 1.481 -13.121 -3.297 1.00 0.00 N flip ATOM 0 H HIS A 18 2.851 -10.206 -6.812 1.00 0.00 H new ATOM 0 HA HIS A 18 2.252 -7.930 -5.252 1.00 0.00 H new ATOM 0 HB2 HIS A 18 1.963 -8.991 -3.065 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.641 -9.410 -4.136 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.101 -11.697 -3.471 1.00 0.00 H new ATOM 0 HE1 HIS A 18 3.496 -13.831 -3.280 1.00 0.00 H new ATOM 0 HE2 HIS A 18 0.961 -13.979 -3.111 1.00 0.00 H new ATOM 276 N LEU A 19 4.442 -8.692 -3.731 1.00 0.00 N ATOM 277 CA LEU A 19 5.858 -8.772 -3.390 1.00 0.00 C ATOM 278 C LEU A 19 6.302 -10.232 -3.267 1.00 0.00 C ATOM 279 O LEU A 19 5.841 -10.954 -2.383 1.00 0.00 O ATOM 280 CB LEU A 19 6.143 -8.026 -2.084 1.00 0.00 C ATOM 281 CG LEU A 19 5.258 -8.413 -0.897 1.00 0.00 C ATOM 282 CD1 LEU A 19 5.912 -9.516 -0.077 1.00 0.00 C ATOM 283 CD2 LEU A 19 4.979 -7.195 -0.028 1.00 0.00 C ATOM 0 H LEU A 19 3.853 -8.285 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 19 6.425 -8.300 -4.192 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.184 -8.195 -1.809 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.031 -6.957 -2.265 1.00 0.00 H new ATOM 0 HG LEU A 19 4.310 -8.790 -1.281 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.267 -9.777 0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.064 -10.394 -0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.874 -9.168 0.299 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.348 -7.485 0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.920 -6.792 0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.468 -6.435 -0.620 1.00 0.00 H new ATOM 295 N PRO A 20 7.198 -10.692 -4.161 1.00 0.00 N ATOM 296 CA PRO A 20 7.687 -12.074 -4.147 1.00 0.00 C ATOM 297 C PRO A 20 8.774 -12.314 -3.102 1.00 0.00 C ATOM 298 O PRO A 20 9.043 -13.455 -2.727 1.00 0.00 O ATOM 299 CB PRO A 20 8.258 -12.244 -5.552 1.00 0.00 C ATOM 300 CG PRO A 20 8.737 -10.884 -5.924 1.00 0.00 C ATOM 301 CD PRO A 20 7.796 -9.910 -5.262 1.00 0.00 C ATOM 0 HA PRO A 20 6.898 -12.781 -3.889 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.072 -12.969 -5.565 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.500 -12.603 -6.248 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.761 -10.726 -5.586 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.735 -10.753 -7.006 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.325 -9.033 -4.889 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.037 -9.552 -5.957 1.00 0.00 H new ATOM 309 N TRP A 21 9.402 -11.238 -2.639 1.00 0.00 N ATOM 310 CA TRP A 21 10.463 -11.345 -1.643 1.00 0.00 C ATOM 311 C TRP A 21 9.888 -11.592 -0.252 1.00 0.00 C ATOM 312 O TRP A 21 8.767 -11.184 0.049 1.00 0.00 O ATOM 313 CB TRP A 21 11.314 -10.075 -1.636 1.00 0.00 C ATOM 314 CG TRP A 21 10.499 -8.820 -1.585 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.619 -8.456 -0.608 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.483 -7.767 -2.555 1.00 0.00 C ATOM 317 NE1 TRP A 21 9.058 -7.239 -0.908 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.572 -6.796 -2.099 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.151 -7.551 -3.763 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.313 -5.628 -2.810 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.892 -6.390 -4.468 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.980 -5.441 -3.990 1.00 0.00 C ATOM 0 H TRP A 21 9.196 -10.284 -2.936 1.00 0.00 H new ATOM 0 HA TRP A 21 11.090 -12.195 -1.911 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.985 -10.100 -0.778 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.939 -10.059 -2.529 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.396 -9.040 0.273 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.371 -6.745 -0.338 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.856 -8.277 -4.139 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.610 -4.895 -2.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.402 -6.212 -5.403 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.800 -4.544 -4.564 1.00 0.00 H new ATOM 333 N HIS A 22 10.667 -12.261 0.592 1.00 0.00 N ATOM 334 CA HIS A 22 10.240 -12.562 1.953 1.00 0.00 C ATOM 335 C HIS A 22 10.653 -11.444 2.906 1.00 0.00 C ATOM 336 O HIS A 22 11.822 -11.329 3.273 1.00 0.00 O ATOM 337 CB HIS A 22 10.839 -13.892 2.415 1.00 0.00 C ATOM 338 CG HIS A 22 9.863 -14.772 3.133 1.00 0.00 C ATOM 339 ND1 HIS A 22 8.882 -14.282 3.970 1.00 0.00 N ATOM 340 CD2 HIS A 22 9.719 -16.118 3.135 1.00 0.00 C ATOM 341 CE1 HIS A 22 8.179 -15.289 4.456 1.00 0.00 C ATOM 342 NE2 HIS A 22 8.666 -16.413 3.965 1.00 0.00 N ATOM 0 H HIS A 22 11.598 -12.605 0.357 1.00 0.00 H new ATOM 0 HA HIS A 22 9.153 -12.642 1.961 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.228 -14.426 1.548 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.686 -13.691 3.072 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.320 -16.828 2.586 1.00 0.00 H new ATOM 0 HE1 HIS A 22 7.347 -15.207 5.139 1.00 0.00 H new ATOM 0 HE2 HIS A 22 8.317 -17.349 4.169 1.00 0.00 H new ATOM 351 N LEU A 23 9.687 -10.617 3.294 1.00 0.00 N ATOM 352 CA LEU A 23 9.949 -9.503 4.196 1.00 0.00 C ATOM 353 C LEU A 23 9.245 -9.699 5.540 1.00 0.00 C ATOM 354 O LEU A 23 8.140 -9.198 5.747 1.00 0.00 O ATOM 355 CB LEU A 23 9.495 -8.193 3.551 1.00 0.00 C ATOM 356 CG LEU A 23 10.629 -7.269 3.112 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.388 -7.872 1.938 1.00 0.00 C ATOM 358 CD2 LEU A 23 10.090 -5.889 2.757 1.00 0.00 C ATOM 0 H LEU A 23 8.715 -10.698 2.997 1.00 0.00 H new ATOM 0 HA LEU A 23 11.022 -9.462 4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 23 8.878 -8.426 2.683 1.00 0.00 H new ATOM 0 HB3 LEU A 23 8.861 -7.657 4.257 1.00 0.00 H new ATOM 0 HG LEU A 23 11.324 -7.158 3.945 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.192 -7.199 1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 23 11.810 -8.833 2.232 1.00 0.00 H new ATOM 0 HD13 LEU A 23 10.706 -8.017 1.100 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.913 -5.246 2.447 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.372 -5.978 1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.599 -5.455 3.628 1.00 0.00 H new ATOM 370 N PRO A 24 9.881 -10.427 6.475 1.00 0.00 N ATOM 371 CA PRO A 24 9.309 -10.680 7.803 1.00 0.00 C ATOM 372 C PRO A 24 9.006 -9.389 8.556 1.00 0.00 C ATOM 373 O PRO A 24 7.978 -9.272 9.223 1.00 0.00 O ATOM 374 CB PRO A 24 10.402 -11.473 8.527 1.00 0.00 C ATOM 375 CG PRO A 24 11.246 -12.048 7.443 1.00 0.00 C ATOM 376 CD PRO A 24 11.202 -11.057 6.316 1.00 0.00 C ATOM 0 HA PRO A 24 8.357 -11.208 7.738 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.988 -10.829 9.183 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.973 -12.257 9.151 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.269 -12.204 7.786 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.865 -13.018 7.125 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.008 -10.327 6.390 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.302 -11.545 5.346 1.00 0.00 H new ATOM 384 N ASP A 25 9.913 -8.423 8.449 1.00 0.00 N ATOM 385 CA ASP A 25 9.756 -7.145 9.117 1.00 0.00 C ATOM 386 C ASP A 25 8.553 -6.379 8.573 1.00 0.00 C ATOM 387 O ASP A 25 7.844 -5.708 9.322 1.00 0.00 O ATOM 388 CB ASP A 25 11.028 -6.322 8.939 1.00 0.00 C ATOM 389 CG ASP A 25 11.296 -5.973 7.488 1.00 0.00 C ATOM 390 OD1 ASP A 25 10.825 -6.716 6.602 1.00 0.00 O ATOM 391 OD2 ASP A 25 11.977 -4.956 7.239 1.00 0.00 O ATOM 0 H ASP A 25 10.769 -8.507 7.901 1.00 0.00 H new ATOM 0 HA ASP A 25 9.581 -7.327 10.177 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.947 -5.404 9.521 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.876 -6.879 9.338 1.00 0.00 H new ATOM 396 N ASP A 26 8.330 -6.481 7.267 1.00 0.00 N ATOM 397 CA ASP A 26 7.213 -5.794 6.629 1.00 0.00 C ATOM 398 C ASP A 26 5.881 -6.357 7.111 1.00 0.00 C ATOM 399 O ASP A 26 5.048 -5.629 7.651 1.00 0.00 O ATOM 400 CB ASP A 26 7.313 -5.912 5.107 1.00 0.00 C ATOM 401 CG ASP A 26 6.547 -4.817 4.391 1.00 0.00 C ATOM 402 OD1 ASP A 26 7.074 -3.689 4.295 1.00 0.00 O ATOM 403 OD2 ASP A 26 5.419 -5.088 3.926 1.00 0.00 O ATOM 0 H ASP A 26 8.907 -7.032 6.631 1.00 0.00 H new ATOM 0 HA ASP A 26 7.262 -4.741 6.906 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.361 -5.872 4.810 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.930 -6.884 4.795 1.00 0.00 H new ATOM 408 N LEU A 27 5.687 -7.658 6.916 1.00 0.00 N ATOM 409 CA LEU A 27 4.462 -8.319 7.331 1.00 0.00 C ATOM 410 C LEU A 27 4.206 -8.109 8.821 1.00 0.00 C ATOM 411 O LEU A 27 3.096 -7.767 9.227 1.00 0.00 O ATOM 412 CB LEU A 27 4.547 -9.812 7.016 1.00 0.00 C ATOM 413 CG LEU A 27 5.875 -10.485 7.379 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.753 -11.224 8.703 1.00 0.00 C ATOM 415 CD2 LEU A 27 6.314 -11.436 6.273 1.00 0.00 C ATOM 0 H LEU A 27 6.367 -8.274 6.471 1.00 0.00 H new ATOM 0 HA LEU A 27 3.630 -7.882 6.780 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.743 -10.324 7.545 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.367 -9.952 5.950 1.00 0.00 H new ATOM 0 HG LEU A 27 6.635 -9.711 7.486 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.705 -11.696 8.945 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.487 -10.519 9.490 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.979 -11.988 8.623 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.259 -11.904 6.549 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.555 -12.206 6.133 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.443 -10.880 5.345 1.00 0.00 H new ATOM 427 N HIS A 28 5.242 -8.312 9.630 1.00 0.00 N ATOM 428 CA HIS A 28 5.129 -8.140 11.074 1.00 0.00 C ATOM 429 C HIS A 28 4.691 -6.719 11.415 1.00 0.00 C ATOM 430 O HIS A 28 3.778 -6.514 12.214 1.00 0.00 O ATOM 431 CB HIS A 28 6.464 -8.452 11.751 1.00 0.00 C ATOM 432 CG HIS A 28 6.327 -8.862 13.185 1.00 0.00 C ATOM 433 ND1 HIS A 28 5.952 -7.990 14.185 1.00 0.00 N ATOM 434 CD2 HIS A 28 6.517 -10.061 13.786 1.00 0.00 C ATOM 435 CE1 HIS A 28 5.918 -8.634 15.338 1.00 0.00 C ATOM 436 NE2 HIS A 28 6.256 -9.891 15.123 1.00 0.00 N ATOM 0 H HIS A 28 6.168 -8.595 9.310 1.00 0.00 H new ATOM 0 HA HIS A 28 4.374 -8.834 11.443 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.964 -9.249 11.200 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.106 -7.573 11.693 1.00 0.00 H new ATOM 0 HD2 HIS A 28 6.818 -10.979 13.303 1.00 0.00 H new ATOM 0 HE1 HIS A 28 5.658 -8.204 16.294 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.314 -10.619 15.835 1.00 0.00 H new ATOM 445 N TYR A 29 5.348 -5.742 10.799 1.00 0.00 N ATOM 446 CA TYR A 29 5.027 -4.338 11.031 1.00 0.00 C ATOM 447 C TYR A 29 3.655 -3.996 10.458 1.00 0.00 C ATOM 448 O TYR A 29 2.962 -3.113 10.963 1.00 0.00 O ATOM 449 CB TYR A 29 6.094 -3.442 10.399 1.00 0.00 C ATOM 450 CG TYR A 29 6.219 -2.086 11.057 1.00 0.00 C ATOM 451 CD1 TYR A 29 6.383 -1.972 12.432 1.00 0.00 C ATOM 452 CD2 TYR A 29 6.174 -0.921 10.302 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.499 -0.734 13.035 1.00 0.00 C ATOM 454 CE2 TYR A 29 6.289 0.321 10.899 1.00 0.00 C ATOM 455 CZ TYR A 29 6.451 0.408 12.265 1.00 0.00 C ATOM 456 OH TYR A 29 6.567 1.642 12.862 1.00 0.00 O ATOM 0 H TYR A 29 6.107 -5.897 10.135 1.00 0.00 H new ATOM 0 HA TYR A 29 5.006 -4.165 12.107 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.057 -3.950 10.448 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.860 -3.303 9.343 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.420 -2.865 13.039 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.047 -0.986 9.231 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.627 -0.662 14.105 1.00 0.00 H new ATOM 0 HE2 TYR A 29 6.252 1.218 10.298 1.00 0.00 H new ATOM 0 HH TYR A 29 6.514 2.342 12.179 1.00 0.00 H new ATOM 466 N PHE A 30 3.270 -4.703 9.400 1.00 0.00 N ATOM 467 CA PHE A 30 1.982 -4.478 8.756 1.00 0.00 C ATOM 468 C PHE A 30 0.833 -4.791 9.709 1.00 0.00 C ATOM 469 O PHE A 30 0.040 -3.914 10.051 1.00 0.00 O ATOM 470 CB PHE A 30 1.865 -5.340 7.496 1.00 0.00 C ATOM 471 CG PHE A 30 1.315 -4.600 6.309 1.00 0.00 C ATOM 472 CD1 PHE A 30 0.017 -4.118 6.318 1.00 0.00 C ATOM 473 CD2 PHE A 30 2.097 -4.390 5.185 1.00 0.00 C ATOM 474 CE1 PHE A 30 -0.492 -3.438 5.228 1.00 0.00 C ATOM 475 CE2 PHE A 30 1.594 -3.711 4.091 1.00 0.00 C ATOM 476 CZ PHE A 30 0.297 -3.235 4.113 1.00 0.00 C ATOM 0 H PHE A 30 3.833 -5.437 8.971 1.00 0.00 H new ATOM 0 HA PHE A 30 1.920 -3.426 8.478 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.849 -5.735 7.243 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.224 -6.195 7.709 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.605 -4.275 7.187 1.00 0.00 H new ATOM 0 HD2 PHE A 30 3.111 -4.761 5.163 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.506 -3.066 5.248 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.214 -3.553 3.221 1.00 0.00 H new ATOM 0 HZ PHE A 30 -0.099 -2.705 3.259 1.00 0.00 H new ATOM 486 N ARG A 31 0.747 -6.049 10.130 1.00 0.00 N ATOM 487 CA ARG A 31 -0.307 -6.485 11.041 1.00 0.00 C ATOM 488 C ARG A 31 -0.297 -5.670 12.334 1.00 0.00 C ATOM 489 O ARG A 31 -1.315 -5.564 13.018 1.00 0.00 O ATOM 490 CB ARG A 31 -0.144 -7.973 11.360 1.00 0.00 C ATOM 491 CG ARG A 31 -1.361 -8.809 11.000 1.00 0.00 C ATOM 492 CD ARG A 31 -1.101 -10.291 11.213 1.00 0.00 C ATOM 493 NE ARG A 31 -0.675 -10.955 9.983 1.00 0.00 N ATOM 494 CZ ARG A 31 -0.043 -12.126 9.953 1.00 0.00 C ATOM 495 NH1 ARG A 31 0.237 -12.767 11.081 1.00 0.00 N ATOM 496 NH2 ARG A 31 0.309 -12.659 8.791 1.00 0.00 N ATOM 0 H ARG A 31 1.396 -6.786 9.854 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.265 -6.324 10.547 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.723 -8.358 10.823 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.063 -8.087 12.424 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.211 -8.497 11.607 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.631 -8.632 9.959 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.335 -10.418 11.978 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.007 -10.768 11.587 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.874 -10.494 9.095 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.032 -12.363 11.978 1.00 0.00 H new ATOM 0 HH12 ARG A 31 0.722 -13.664 11.051 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.095 -12.172 7.921 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.793 -13.556 8.767 1.00 0.00 H new ATOM 510 N ALA A 32 0.859 -5.103 12.667 1.00 0.00 N ATOM 511 CA ALA A 32 0.997 -4.307 13.881 1.00 0.00 C ATOM 512 C ALA A 32 0.284 -2.964 13.755 1.00 0.00 C ATOM 513 O ALA A 32 -0.182 -2.404 14.748 1.00 0.00 O ATOM 514 CB ALA A 32 2.468 -4.095 14.205 1.00 0.00 C ATOM 0 H ALA A 32 1.712 -5.180 12.114 1.00 0.00 H new ATOM 0 HA ALA A 32 0.527 -4.857 14.696 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.558 -3.499 15.113 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.950 -5.061 14.355 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.951 -3.573 13.379 1.00 0.00 H new ATOM 520 N GLN A 33 0.209 -2.445 12.534 1.00 0.00 N ATOM 521 CA GLN A 33 -0.440 -1.161 12.290 1.00 0.00 C ATOM 522 C GLN A 33 -1.849 -1.344 11.729 1.00 0.00 C ATOM 523 O GLN A 33 -2.711 -0.484 11.905 1.00 0.00 O ATOM 524 CB GLN A 33 0.400 -0.321 11.325 1.00 0.00 C ATOM 525 CG GLN A 33 1.163 0.805 12.004 1.00 0.00 C ATOM 526 CD GLN A 33 0.524 2.162 11.777 1.00 0.00 C ATOM 527 OE1 GLN A 33 -0.329 2.596 12.551 1.00 0.00 O ATOM 528 NE2 GLN A 33 0.935 2.839 10.711 1.00 0.00 N ATOM 0 H GLN A 33 0.588 -2.892 11.699 1.00 0.00 H new ATOM 0 HA GLN A 33 -0.522 -0.642 13.245 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.109 -0.972 10.813 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -0.253 0.102 10.562 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.218 0.608 13.075 1.00 0.00 H new ATOM 0 HG3 GLN A 33 2.187 0.822 11.630 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.645 2.441 10.096 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.541 3.757 10.507 1.00 0.00 H new ATOM 537 N THR A 34 -2.077 -2.461 11.047 1.00 0.00 N ATOM 538 CA THR A 34 -3.383 -2.738 10.454 1.00 0.00 C ATOM 539 C THR A 34 -4.314 -3.450 11.432 1.00 0.00 C ATOM 540 O THR A 34 -5.219 -4.175 11.019 1.00 0.00 O ATOM 541 CB THR A 34 -3.220 -3.587 9.193 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.536 -4.792 9.484 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.463 -2.881 8.089 1.00 0.00 C ATOM 0 H THR A 34 -1.378 -3.188 10.891 1.00 0.00 H new ATOM 0 HA THR A 34 -3.833 -1.779 10.198 1.00 0.00 H new ATOM 0 HB THR A 34 -4.234 -3.784 8.845 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.584 -4.603 9.622 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.383 -3.539 7.224 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.995 -1.973 7.806 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.464 -2.622 8.441 1.00 0.00 H new ATOM 551 N VAL A 35 -4.102 -3.236 12.726 1.00 0.00 N ATOM 552 CA VAL A 35 -4.944 -3.865 13.741 1.00 0.00 C ATOM 553 C VAL A 35 -6.129 -2.972 14.088 1.00 0.00 C ATOM 554 O VAL A 35 -6.014 -2.055 14.902 1.00 0.00 O ATOM 555 CB VAL A 35 -4.168 -4.209 15.038 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.061 -5.718 15.205 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.785 -3.571 15.051 1.00 0.00 C ATOM 0 H VAL A 35 -3.363 -2.638 13.096 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.296 -4.800 13.306 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.727 -3.799 15.879 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.514 -5.945 16.120 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.060 -6.149 15.264 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.532 -6.142 14.351 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.271 -3.835 15.976 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.209 -3.934 14.200 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.884 -2.487 14.987 1.00 0.00 H new ATOM 567 N GLY A 36 -7.267 -3.246 13.460 1.00 0.00 N ATOM 568 CA GLY A 36 -8.460 -2.460 13.708 1.00 0.00 C ATOM 569 C GLY A 36 -8.545 -1.240 12.813 1.00 0.00 C ATOM 570 O GLY A 36 -9.201 -0.256 13.156 1.00 0.00 O ATOM 0 H GLY A 36 -7.384 -4.000 12.783 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.341 -3.083 13.553 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.473 -2.144 14.751 1.00 0.00 H new ATOM 574 N LYS A 37 -7.877 -1.300 11.663 1.00 0.00 N ATOM 575 CA LYS A 37 -7.881 -0.187 10.720 1.00 0.00 C ATOM 576 C LYS A 37 -8.515 -0.595 9.394 1.00 0.00 C ATOM 577 O LYS A 37 -9.027 -1.706 9.254 1.00 0.00 O ATOM 578 CB LYS A 37 -6.455 0.312 10.485 1.00 0.00 C ATOM 579 CG LYS A 37 -5.730 0.704 11.763 1.00 0.00 C ATOM 580 CD LYS A 37 -5.083 2.077 11.647 1.00 0.00 C ATOM 581 CE LYS A 37 -5.339 2.923 12.884 1.00 0.00 C ATOM 582 NZ LYS A 37 -4.086 3.538 13.405 1.00 0.00 N ATOM 0 H LYS A 37 -7.328 -2.106 11.363 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.476 0.619 11.151 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.885 -0.467 9.978 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.485 1.172 9.816 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.434 0.703 12.595 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.966 -0.040 11.991 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -4.009 1.962 11.500 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -5.472 2.590 10.768 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -6.057 3.708 12.645 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.790 2.304 13.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -4.303 4.107 14.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -3.410 2.789 13.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -3.669 4.149 12.674 1.00 0.00 H new ATOM 596 N ILE A 38 -8.476 0.312 8.423 1.00 0.00 N ATOM 597 CA ILE A 38 -9.046 0.051 7.104 1.00 0.00 C ATOM 598 C ILE A 38 -7.995 0.254 6.015 1.00 0.00 C ATOM 599 O ILE A 38 -7.409 1.330 5.899 1.00 0.00 O ATOM 600 CB ILE A 38 -10.274 0.951 6.795 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.625 1.869 7.976 1.00 0.00 C ATOM 602 CG2 ILE A 38 -11.475 0.092 6.424 1.00 0.00 C ATOM 603 CD1 ILE A 38 -10.513 3.342 7.647 1.00 0.00 C ATOM 0 H ILE A 38 -8.055 1.236 8.524 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.381 -0.986 7.114 1.00 0.00 H new ATOM 0 HB ILE A 38 -10.009 1.588 5.951 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.642 1.654 8.304 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.965 1.640 8.813 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -12.329 0.734 6.210 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -11.238 -0.503 5.542 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.719 -0.571 7.254 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -10.775 3.932 8.525 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -9.490 3.571 7.348 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.193 3.585 6.831 1.00 0.00 H new ATOM 615 N MET A 39 -7.756 -0.789 5.225 1.00 0.00 N ATOM 616 CA MET A 39 -6.767 -0.723 4.151 1.00 0.00 C ATOM 617 C MET A 39 -7.435 -0.693 2.780 1.00 0.00 C ATOM 618 O MET A 39 -8.303 -1.513 2.482 1.00 0.00 O ATOM 619 CB MET A 39 -5.814 -1.918 4.238 1.00 0.00 C ATOM 620 CG MET A 39 -4.808 -1.991 3.099 1.00 0.00 C ATOM 621 SD MET A 39 -3.999 -3.599 2.990 1.00 0.00 S ATOM 622 CE MET A 39 -5.414 -4.677 2.783 1.00 0.00 C ATOM 0 H MET A 39 -8.231 -1.688 5.307 1.00 0.00 H new ATOM 0 HA MET A 39 -6.203 0.201 4.274 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.274 -1.871 5.184 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.400 -2.837 4.251 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.315 -1.779 2.158 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.053 -1.217 3.236 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.125 -5.549 2.196 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.771 -5.000 3.761 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.209 -4.139 2.266 1.00 0.00 H new ATOM 632 N VAL A 40 -7.009 0.250 1.945 1.00 0.00 N ATOM 633 CA VAL A 40 -7.549 0.384 0.597 1.00 0.00 C ATOM 634 C VAL A 40 -6.776 -0.496 -0.377 1.00 0.00 C ATOM 635 O VAL A 40 -5.591 -0.272 -0.625 1.00 0.00 O ATOM 636 CB VAL A 40 -7.495 1.844 0.109 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.257 1.999 -1.198 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.046 2.783 1.172 1.00 0.00 C ATOM 0 H VAL A 40 -6.290 0.934 2.179 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.591 0.066 0.633 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.453 2.109 -0.072 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.208 3.037 -1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.812 1.356 -1.957 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.299 1.715 -1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.000 3.810 0.810 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.082 2.521 1.388 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.452 2.692 2.081 1.00 0.00 H new ATOM 648 N VAL A 41 -7.449 -1.504 -0.920 1.00 0.00 N ATOM 649 CA VAL A 41 -6.817 -2.422 -1.858 1.00 0.00 C ATOM 650 C VAL A 41 -7.427 -2.296 -3.255 1.00 0.00 C ATOM 651 O VAL A 41 -8.634 -2.104 -3.401 1.00 0.00 O ATOM 652 CB VAL A 41 -6.918 -3.883 -1.352 1.00 0.00 C ATOM 653 CG1 VAL A 41 -8.088 -4.624 -1.988 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.611 -4.622 -1.596 1.00 0.00 C ATOM 0 H VAL A 41 -8.430 -1.705 -0.727 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.763 -2.152 -1.925 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.104 -3.848 -0.279 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.123 -5.644 -1.606 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.019 -4.113 -1.743 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.960 -4.646 -3.070 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.699 -5.647 -1.235 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.392 -4.631 -2.664 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.804 -4.118 -1.065 1.00 0.00 H new ATOM 664 N GLY A 42 -6.580 -2.398 -4.275 1.00 0.00 N ATOM 665 CA GLY A 42 -7.047 -2.288 -5.646 1.00 0.00 C ATOM 666 C GLY A 42 -7.696 -3.562 -6.146 1.00 0.00 C ATOM 667 O GLY A 42 -7.723 -4.571 -5.441 1.00 0.00 O ATOM 0 H GLY A 42 -5.577 -2.555 -4.176 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.762 -1.468 -5.717 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.207 -2.035 -6.293 1.00 0.00 H new ATOM 671 N ARG A 43 -8.226 -3.515 -7.364 1.00 0.00 N ATOM 672 CA ARG A 43 -8.884 -4.674 -7.954 1.00 0.00 C ATOM 673 C ARG A 43 -7.923 -5.855 -8.069 1.00 0.00 C ATOM 674 O ARG A 43 -8.143 -6.912 -7.476 1.00 0.00 O ATOM 675 CB ARG A 43 -9.441 -4.325 -9.335 1.00 0.00 C ATOM 676 CG ARG A 43 -10.200 -5.469 -9.987 1.00 0.00 C ATOM 677 CD ARG A 43 -10.014 -5.475 -11.496 1.00 0.00 C ATOM 678 NE ARG A 43 -10.440 -4.217 -12.104 1.00 0.00 N ATOM 679 CZ ARG A 43 -10.783 -4.090 -13.384 1.00 0.00 C ATOM 680 NH1 ARG A 43 -10.746 -5.139 -14.197 1.00 0.00 N ATOM 681 NH2 ARG A 43 -11.162 -2.910 -13.852 1.00 0.00 N ATOM 0 H ARG A 43 -8.212 -2.688 -7.961 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.705 -4.960 -7.297 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.104 -3.464 -9.244 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -8.619 -4.027 -9.985 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.856 -6.417 -9.574 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -11.261 -5.384 -9.751 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.965 -5.655 -11.731 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.583 -6.298 -11.928 1.00 0.00 H new ATOM 0 HE ARG A 43 -10.477 -3.387 -11.513 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.453 -6.049 -13.842 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -11.010 -5.035 -15.177 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.191 -2.101 -13.232 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.425 -2.811 -14.832 1.00 0.00 H new ATOM 695 N ARG A 44 -6.856 -5.668 -8.838 1.00 0.00 N ATOM 696 CA ARG A 44 -5.862 -6.717 -9.036 1.00 0.00 C ATOM 697 C ARG A 44 -5.270 -7.180 -7.708 1.00 0.00 C ATOM 698 O ARG A 44 -4.717 -8.276 -7.617 1.00 0.00 O ATOM 699 CB ARG A 44 -4.747 -6.219 -9.959 1.00 0.00 C ATOM 700 CG ARG A 44 -4.536 -7.092 -11.187 1.00 0.00 C ATOM 701 CD ARG A 44 -5.795 -7.178 -12.037 1.00 0.00 C ATOM 702 NE ARG A 44 -5.931 -6.032 -12.931 1.00 0.00 N ATOM 703 CZ ARG A 44 -5.144 -5.813 -13.982 1.00 0.00 C ATOM 704 NH1 ARG A 44 -4.162 -6.658 -14.272 1.00 0.00 N ATOM 705 NH2 ARG A 44 -5.339 -4.747 -14.746 1.00 0.00 N ATOM 0 H ARG A 44 -6.657 -4.800 -9.335 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.361 -7.568 -9.499 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.980 -5.204 -10.281 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.816 -6.169 -9.395 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.719 -6.688 -11.785 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.238 -8.093 -10.875 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.774 -8.096 -12.625 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.668 -7.236 -11.387 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.673 -5.359 -12.739 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.008 -7.480 -13.688 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.562 -6.485 -15.079 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.092 -4.095 -14.528 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.736 -4.579 -15.551 1.00 0.00 H new ATOM 719 N THR A 45 -5.376 -6.341 -6.682 1.00 0.00 N ATOM 720 CA THR A 45 -4.835 -6.676 -5.371 1.00 0.00 C ATOM 721 C THR A 45 -5.725 -7.675 -4.634 1.00 0.00 C ATOM 722 O THR A 45 -5.257 -8.734 -4.218 1.00 0.00 O ATOM 723 CB THR A 45 -4.648 -5.414 -4.531 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.348 -4.303 -5.357 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.536 -5.539 -3.512 1.00 0.00 C ATOM 0 H THR A 45 -5.829 -5.429 -6.733 1.00 0.00 H new ATOM 0 HA THR A 45 -3.864 -7.146 -5.526 1.00 0.00 H new ATOM 0 HB THR A 45 -5.592 -5.271 -4.005 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.377 -4.231 -5.468 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.454 -4.610 -2.948 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.758 -6.360 -2.830 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.594 -5.737 -4.024 1.00 0.00 H new ATOM 733 N TYR A 46 -7.008 -7.343 -4.467 1.00 0.00 N ATOM 734 CA TYR A 46 -7.936 -8.235 -3.770 1.00 0.00 C ATOM 735 C TYR A 46 -7.819 -9.660 -4.305 1.00 0.00 C ATOM 736 O TYR A 46 -7.914 -10.629 -3.552 1.00 0.00 O ATOM 737 CB TYR A 46 -9.387 -7.730 -3.889 1.00 0.00 C ATOM 738 CG TYR A 46 -10.024 -7.933 -5.253 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.231 -9.208 -5.768 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.418 -6.847 -6.025 1.00 0.00 C ATOM 741 CE1 TYR A 46 -10.803 -9.395 -7.009 1.00 0.00 C ATOM 742 CE2 TYR A 46 -10.994 -7.028 -7.269 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.182 -8.303 -7.757 1.00 0.00 C ATOM 744 OH TYR A 46 -11.754 -8.486 -8.995 1.00 0.00 O ATOM 0 H TYR A 46 -7.424 -6.473 -4.801 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.666 -8.239 -2.714 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -9.996 -8.237 -3.141 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.407 -6.667 -3.649 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.938 -10.069 -5.185 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.272 -5.846 -5.647 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.953 -10.394 -7.392 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.295 -6.173 -7.856 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.719 -8.323 -8.937 1.00 0.00 H new ATOM 754 N GLU A 47 -7.611 -9.774 -5.613 1.00 0.00 N ATOM 755 CA GLU A 47 -7.479 -11.078 -6.262 1.00 0.00 C ATOM 756 C GLU A 47 -6.052 -11.595 -6.144 1.00 0.00 C ATOM 757 O GLU A 47 -5.809 -12.802 -6.162 1.00 0.00 O ATOM 758 CB GLU A 47 -7.871 -11.003 -7.743 1.00 0.00 C ATOM 759 CG GLU A 47 -7.742 -9.619 -8.362 1.00 0.00 C ATOM 760 CD GLU A 47 -7.707 -9.659 -9.877 1.00 0.00 C ATOM 761 OE1 GLU A 47 -8.790 -9.743 -10.494 1.00 0.00 O ATOM 762 OE2 GLU A 47 -6.597 -9.607 -10.447 1.00 0.00 O ATOM 0 H GLU A 47 -7.530 -8.979 -6.247 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.156 -11.765 -5.754 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.248 -11.698 -8.306 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.902 -11.340 -7.850 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.579 -9.001 -8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.833 -9.144 -7.994 1.00 0.00 H new ATOM 769 N SER A 48 -5.117 -10.667 -6.022 1.00 0.00 N ATOM 770 CA SER A 48 -3.704 -11.012 -5.896 1.00 0.00 C ATOM 771 C SER A 48 -3.240 -10.926 -4.443 1.00 0.00 C ATOM 772 O SER A 48 -2.052 -10.755 -4.173 1.00 0.00 O ATOM 773 CB SER A 48 -2.852 -10.089 -6.768 1.00 0.00 C ATOM 774 OG SER A 48 -3.220 -10.192 -8.133 1.00 0.00 O ATOM 0 H SER A 48 -5.308 -9.665 -6.007 1.00 0.00 H new ATOM 0 HA SER A 48 -3.581 -12.041 -6.234 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.969 -9.058 -6.434 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.799 -10.344 -6.652 1.00 0.00 H new ATOM 0 HG SER A 48 -4.017 -9.646 -8.299 1.00 0.00 H new ATOM 780 N PHE A 49 -4.181 -11.047 -3.509 1.00 0.00 N ATOM 781 CA PHE A 49 -3.857 -10.984 -2.088 1.00 0.00 C ATOM 782 C PHE A 49 -3.941 -12.370 -1.447 1.00 0.00 C ATOM 783 O PHE A 49 -4.848 -13.146 -1.747 1.00 0.00 O ATOM 784 CB PHE A 49 -4.802 -10.019 -1.370 1.00 0.00 C ATOM 785 CG PHE A 49 -4.130 -9.204 -0.301 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.322 -8.127 -0.634 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.305 -9.517 1.037 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.704 -7.378 0.349 1.00 0.00 C ATOM 789 CE2 PHE A 49 -3.688 -8.772 2.024 1.00 0.00 C ATOM 790 CZ PHE A 49 -2.887 -7.701 1.679 1.00 0.00 C ATOM 0 H PHE A 49 -5.171 -11.189 -3.711 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.834 -10.620 -1.990 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.246 -9.346 -2.103 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.618 -10.587 -0.923 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.174 -7.871 -1.673 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.931 -10.353 1.312 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.078 -6.541 0.077 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.832 -9.027 3.064 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.404 -7.117 2.449 1.00 0.00 H new ATOM 800 N PRO A 50 -2.988 -12.702 -0.556 1.00 0.00 N ATOM 801 CA PRO A 50 -2.956 -14.000 0.120 1.00 0.00 C ATOM 802 C PRO A 50 -3.894 -14.068 1.323 1.00 0.00 C ATOM 803 O PRO A 50 -4.271 -15.153 1.764 1.00 0.00 O ATOM 804 CB PRO A 50 -1.502 -14.106 0.571 1.00 0.00 C ATOM 805 CG PRO A 50 -1.089 -12.698 0.830 1.00 0.00 C ATOM 806 CD PRO A 50 -1.862 -11.841 -0.142 1.00 0.00 C ATOM 0 HA PRO A 50 -3.288 -14.809 -0.531 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.408 -14.719 1.468 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.881 -14.567 -0.197 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.308 -12.412 1.859 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.015 -12.576 0.687 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.213 -10.922 0.327 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.248 -11.549 -0.994 1.00 0.00 H new ATOM 814 N LYS A 51 -4.263 -12.906 1.855 1.00 0.00 N ATOM 815 CA LYS A 51 -5.153 -12.845 3.010 1.00 0.00 C ATOM 816 C LYS A 51 -6.287 -11.850 2.778 1.00 0.00 C ATOM 817 O LYS A 51 -6.232 -10.711 3.242 1.00 0.00 O ATOM 818 CB LYS A 51 -4.366 -12.460 4.264 1.00 0.00 C ATOM 819 CG LYS A 51 -4.788 -13.226 5.507 1.00 0.00 C ATOM 820 CD LYS A 51 -4.228 -14.639 5.508 1.00 0.00 C ATOM 821 CE LYS A 51 -2.720 -14.641 5.705 1.00 0.00 C ATOM 822 NZ LYS A 51 -2.041 -15.595 4.784 1.00 0.00 N ATOM 0 H LYS A 51 -3.960 -11.997 1.506 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.590 -13.833 3.152 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.305 -12.633 4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.489 -11.392 4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.444 -12.697 6.396 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.876 -13.265 5.560 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.700 -15.218 6.302 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -4.474 -15.129 4.566 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.331 -13.637 5.539 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.489 -14.906 6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -1.015 -15.567 4.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.394 -16.558 4.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.240 -15.328 3.799 1.00 0.00 H new ATOM 836 N ARG A 52 -7.314 -12.289 2.057 1.00 0.00 N ATOM 837 CA ARG A 52 -8.461 -11.437 1.763 1.00 0.00 C ATOM 838 C ARG A 52 -9.757 -12.057 2.293 1.00 0.00 C ATOM 839 O ARG A 52 -10.255 -13.029 1.726 1.00 0.00 O ATOM 840 CB ARG A 52 -8.576 -11.214 0.254 1.00 0.00 C ATOM 841 CG ARG A 52 -8.415 -12.486 -0.563 1.00 0.00 C ATOM 842 CD ARG A 52 -9.169 -12.403 -1.881 1.00 0.00 C ATOM 843 NE ARG A 52 -10.393 -13.200 -1.864 1.00 0.00 N ATOM 844 CZ ARG A 52 -11.032 -13.602 -2.960 1.00 0.00 C ATOM 845 NH1 ARG A 52 -10.568 -13.284 -4.162 1.00 0.00 N ATOM 846 NH2 ARG A 52 -12.139 -14.324 -2.854 1.00 0.00 N ATOM 0 H ARG A 52 -7.375 -13.229 1.666 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.307 -10.480 2.261 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.547 -10.771 0.034 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.819 -10.494 -0.057 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.357 -12.662 -0.759 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.779 -13.337 0.012 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -9.417 -11.363 -2.092 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.524 -12.747 -2.690 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.781 -13.464 -0.958 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -9.717 -12.728 -4.250 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -11.062 -13.595 -4.998 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.500 -14.571 -1.933 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -12.629 -14.632 -3.694 1.00 0.00 H new ATOM 860 N PRO A 53 -10.330 -11.512 3.388 1.00 0.00 N ATOM 861 CA PRO A 53 -9.790 -10.359 4.107 1.00 0.00 C ATOM 862 C PRO A 53 -8.779 -10.760 5.178 1.00 0.00 C ATOM 863 O PRO A 53 -8.589 -11.944 5.454 1.00 0.00 O ATOM 864 CB PRO A 53 -11.035 -9.750 4.744 1.00 0.00 C ATOM 865 CG PRO A 53 -11.959 -10.901 4.978 1.00 0.00 C ATOM 866 CD PRO A 53 -11.575 -11.995 4.008 1.00 0.00 C ATOM 0 HA PRO A 53 -9.244 -9.679 3.453 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.792 -9.244 5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.489 -9.007 4.088 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.879 -11.254 6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.995 -10.599 4.825 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.422 -12.945 4.520 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.354 -12.157 3.263 1.00 0.00 H new ATOM 874 N LEU A 54 -8.132 -9.764 5.774 1.00 0.00 N ATOM 875 CA LEU A 54 -7.136 -10.007 6.813 1.00 0.00 C ATOM 876 C LEU A 54 -7.797 -10.187 8.178 1.00 0.00 C ATOM 877 O LEU A 54 -8.901 -9.694 8.418 1.00 0.00 O ATOM 878 CB LEU A 54 -6.137 -8.854 6.866 1.00 0.00 C ATOM 879 CG LEU A 54 -5.084 -8.855 5.754 1.00 0.00 C ATOM 880 CD1 LEU A 54 -4.924 -7.460 5.167 1.00 0.00 C ATOM 881 CD2 LEU A 54 -3.752 -9.370 6.280 1.00 0.00 C ATOM 0 H LEU A 54 -8.280 -8.779 5.555 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.608 -10.928 6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.688 -7.914 6.823 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.626 -8.880 7.829 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.422 -9.523 4.962 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.172 -7.481 4.379 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.876 -7.129 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.610 -6.770 5.950 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.016 -9.364 5.476 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.409 -8.728 7.091 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.876 -10.388 6.650 1.00 0.00 H new ATOM 893 N PRO A 55 -7.129 -10.912 9.091 1.00 0.00 N ATOM 894 CA PRO A 55 -7.655 -11.178 10.431 1.00 0.00 C ATOM 895 C PRO A 55 -7.506 -10.004 11.397 1.00 0.00 C ATOM 896 O PRO A 55 -6.445 -9.388 11.497 1.00 0.00 O ATOM 897 CB PRO A 55 -6.808 -12.358 10.901 1.00 0.00 C ATOM 898 CG PRO A 55 -5.501 -12.177 10.212 1.00 0.00 C ATOM 899 CD PRO A 55 -5.812 -11.547 8.879 1.00 0.00 C ATOM 0 HA PRO A 55 -8.728 -11.366 10.405 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.689 -12.355 11.985 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.269 -13.309 10.634 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.837 -11.541 10.798 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -4.994 -13.133 10.082 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.056 -10.815 8.596 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.850 -12.291 8.083 1.00 0.00 H new ATOM 907 N GLU A 56 -8.584 -9.733 12.126 1.00 0.00 N ATOM 908 CA GLU A 56 -8.620 -8.670 13.128 1.00 0.00 C ATOM 909 C GLU A 56 -8.440 -7.271 12.536 1.00 0.00 C ATOM 910 O GLU A 56 -7.970 -6.366 13.227 1.00 0.00 O ATOM 911 CB GLU A 56 -7.547 -8.916 14.190 1.00 0.00 C ATOM 912 CG GLU A 56 -7.859 -10.085 15.109 1.00 0.00 C ATOM 913 CD GLU A 56 -6.842 -10.237 16.224 1.00 0.00 C ATOM 914 OE1 GLU A 56 -5.630 -10.136 15.940 1.00 0.00 O ATOM 915 OE2 GLU A 56 -7.258 -10.457 17.381 1.00 0.00 O ATOM 0 H GLU A 56 -9.461 -10.246 12.039 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.614 -8.701 13.574 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.593 -9.098 13.695 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.428 -8.014 14.790 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.850 -9.948 15.542 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.891 -11.004 14.524 1.00 0.00 H new ATOM 922 N ARG A 57 -8.827 -7.075 11.279 1.00 0.00 N ATOM 923 CA ARG A 57 -8.708 -5.763 10.662 1.00 0.00 C ATOM 924 C ARG A 57 -9.818 -5.540 9.636 1.00 0.00 C ATOM 925 O ARG A 57 -10.636 -6.427 9.393 1.00 0.00 O ATOM 926 CB ARG A 57 -7.337 -5.616 10.013 1.00 0.00 C ATOM 927 CG ARG A 57 -7.174 -6.448 8.753 1.00 0.00 C ATOM 928 CD ARG A 57 -6.446 -5.683 7.666 1.00 0.00 C ATOM 929 NE ARG A 57 -6.813 -4.268 7.630 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.013 -3.304 7.180 1.00 0.00 C ATOM 931 NH1 ARG A 57 -4.822 -3.601 6.671 1.00 0.00 N ATOM 932 NH2 ARG A 57 -6.412 -2.039 7.224 1.00 0.00 N ATOM 0 H ARG A 57 -9.220 -7.798 10.677 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.813 -5.004 11.437 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.168 -4.567 9.771 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.570 -5.905 10.732 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.624 -7.359 8.987 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.155 -6.753 8.389 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.371 -5.772 7.823 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.666 -6.136 6.699 1.00 0.00 H new ATOM 0 HE ARG A 57 -7.738 -4.004 7.970 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.516 -4.573 6.623 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.214 -2.857 6.328 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -7.330 -1.807 7.602 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.800 -1.299 6.880 1.00 0.00 H new ATOM 946 N THR A 58 -9.842 -4.353 9.038 1.00 0.00 N ATOM 947 CA THR A 58 -10.853 -4.023 8.040 1.00 0.00 C ATOM 948 C THR A 58 -10.234 -3.932 6.650 1.00 0.00 C ATOM 949 O THR A 58 -9.133 -3.406 6.483 1.00 0.00 O ATOM 950 CB THR A 58 -11.538 -2.703 8.395 1.00 0.00 C ATOM 951 OG1 THR A 58 -11.682 -2.574 9.798 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.913 -2.558 7.777 1.00 0.00 C ATOM 0 H THR A 58 -9.174 -3.605 9.227 1.00 0.00 H new ATOM 0 HA THR A 58 -11.597 -4.819 8.035 1.00 0.00 H new ATOM 0 HB THR A 58 -10.891 -1.924 7.991 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.848 -2.232 10.182 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.344 -1.600 8.068 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.830 -2.604 6.691 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.556 -3.366 8.126 1.00 0.00 H new ATOM 960 N ASN A 59 -10.944 -4.455 5.654 1.00 0.00 N ATOM 961 CA ASN A 59 -10.457 -4.439 4.280 1.00 0.00 C ATOM 962 C ASN A 59 -11.326 -3.559 3.388 1.00 0.00 C ATOM 963 O ASN A 59 -12.518 -3.380 3.639 1.00 0.00 O ATOM 964 CB ASN A 59 -10.419 -5.859 3.716 1.00 0.00 C ATOM 965 CG ASN A 59 -9.108 -6.561 4.008 1.00 0.00 C ATOM 966 OD1 ASN A 59 -8.700 -6.545 5.271 1.00 0.00 O flip ATOM 967 ND2 ASN A 59 -8.471 -7.110 3.111 1.00 0.00 N flip ATOM 0 H ASN A 59 -11.857 -4.894 5.773 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.450 -4.023 4.293 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.240 -6.437 4.139 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -10.577 -5.823 2.638 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.823 -7.097 2.154 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.590 -7.578 3.324 1.00 0.00 H new ATOM 974 N VAL A 60 -10.715 -3.024 2.337 1.00 0.00 N ATOM 975 CA VAL A 60 -11.415 -2.172 1.385 1.00 0.00 C ATOM 976 C VAL A 60 -10.993 -2.521 -0.039 1.00 0.00 C ATOM 977 O VAL A 60 -9.803 -2.607 -0.339 1.00 0.00 O ATOM 978 CB VAL A 60 -11.141 -0.678 1.659 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.773 0.199 0.585 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.644 -0.288 3.043 1.00 0.00 C ATOM 0 H VAL A 60 -9.728 -3.167 2.122 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.484 -2.349 1.502 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.063 -0.519 1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.565 1.247 0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.356 -0.060 -0.388 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.851 0.038 0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.442 0.769 3.219 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.717 -0.468 3.104 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.133 -0.886 3.798 1.00 0.00 H new ATOM 990 N VAL A 61 -11.974 -2.732 -0.911 1.00 0.00 N ATOM 991 CA VAL A 61 -11.698 -3.085 -2.299 1.00 0.00 C ATOM 992 C VAL A 61 -12.049 -1.943 -3.248 1.00 0.00 C ATOM 993 O VAL A 61 -13.090 -1.300 -3.109 1.00 0.00 O ATOM 994 CB VAL A 61 -12.476 -4.354 -2.714 1.00 0.00 C ATOM 995 CG1 VAL A 61 -12.301 -4.645 -4.199 1.00 0.00 C ATOM 996 CG2 VAL A 61 -12.031 -5.544 -1.876 1.00 0.00 C ATOM 0 H VAL A 61 -12.966 -2.665 -0.681 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.628 -3.281 -2.370 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.536 -4.177 -2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.860 -5.543 -4.462 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.674 -3.802 -4.781 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.244 -4.798 -4.418 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.587 -6.431 -2.179 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.965 -5.716 -2.025 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.221 -5.339 -0.823 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.172 -1.705 -4.219 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.381 -0.652 -5.204 1.00 0.00 C ATOM 1008 C LEU A 62 -11.292 -1.215 -6.619 1.00 0.00 C ATOM 1009 O LEU A 62 -10.200 -1.386 -7.163 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.352 0.467 -5.023 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.745 1.811 -5.640 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.864 2.457 -4.842 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.543 2.738 -5.716 1.00 0.00 C ATOM 0 H LEU A 62 -10.307 -2.230 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.379 -0.240 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.177 0.611 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.407 0.146 -5.461 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.103 1.630 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.130 3.412 -5.296 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.735 1.801 -4.840 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.531 2.622 -3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.844 3.688 -6.158 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.153 2.911 -4.713 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.769 2.280 -6.332 1.00 0.00 H new ATOM 1025 N THR A 63 -12.448 -1.492 -7.212 1.00 0.00 N ATOM 1026 CA THR A 63 -12.509 -2.024 -8.567 1.00 0.00 C ATOM 1027 C THR A 63 -13.505 -1.229 -9.407 1.00 0.00 C ATOM 1028 O THR A 63 -14.539 -0.790 -8.905 1.00 0.00 O ATOM 1029 CB THR A 63 -12.905 -3.501 -8.541 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.027 -4.010 -9.857 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.214 -3.756 -7.827 1.00 0.00 C ATOM 0 H THR A 63 -13.359 -1.356 -6.773 1.00 0.00 H new ATOM 0 HA THR A 63 -11.521 -1.933 -9.018 1.00 0.00 H new ATOM 0 HB THR A 63 -12.108 -4.005 -7.995 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.394 -4.918 -9.824 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.436 -4.823 -7.845 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.136 -3.419 -6.793 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.014 -3.210 -8.328 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.192 -1.047 -10.686 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.069 -0.303 -11.584 1.00 0.00 C ATOM 1041 C HIS A 64 -15.413 -1.008 -11.739 1.00 0.00 C ATOM 1042 O HIS A 64 -16.441 -0.366 -11.957 1.00 0.00 O ATOM 1043 CB HIS A 64 -13.411 -0.132 -12.955 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.539 1.083 -13.063 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -12.713 2.212 -12.288 1.00 0.00 N ATOM 1046 CD2 HIS A 64 -11.479 1.342 -13.865 1.00 0.00 C ATOM 1047 CE1 HIS A 64 -11.798 3.109 -12.611 1.00 0.00 C ATOM 1048 NE2 HIS A 64 -11.038 2.605 -13.564 1.00 0.00 N ATOM 0 H HIS A 64 -12.342 -1.403 -11.123 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.241 0.681 -11.147 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -12.813 -1.017 -13.173 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.189 -0.078 -13.716 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.059 0.677 -14.605 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -11.691 4.089 -12.169 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -10.250 3.078 -14.006 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.397 -2.335 -11.633 1.00 0.00 N ATOM 1058 CA GLN A 65 -16.611 -3.132 -11.769 1.00 0.00 C ATOM 1059 C GLN A 65 -17.721 -2.602 -10.868 1.00 0.00 C ATOM 1060 O GLN A 65 -17.525 -2.413 -9.668 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.322 -4.597 -11.435 1.00 0.00 C ATOM 1062 CG GLN A 65 -15.799 -5.398 -12.617 1.00 0.00 C ATOM 1063 CD GLN A 65 -14.629 -6.287 -12.246 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -13.472 -5.677 -12.014 1.00 0.00 O flip ATOM 1065 NE2 GLN A 65 -14.762 -7.509 -12.169 1.00 0.00 N flip ATOM 0 H GLN A 65 -14.554 -2.881 -11.453 1.00 0.00 H new ATOM 0 HA GLN A 65 -16.947 -3.059 -12.803 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.592 -4.640 -10.626 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.235 -5.064 -11.066 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.604 -6.013 -13.020 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.494 -4.714 -13.409 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -15.669 -7.936 -12.356 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.965 -8.094 -11.919 1.00 0.00 H new ATOM 1074 N GLU A 66 -18.889 -2.376 -11.457 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.037 -1.880 -10.710 1.00 0.00 C ATOM 1076 C GLU A 66 -20.753 -3.028 -10.009 1.00 0.00 C ATOM 1077 O GLU A 66 -21.299 -2.862 -8.918 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.005 -1.151 -11.643 1.00 0.00 C ATOM 1079 CG GLU A 66 -20.349 -0.048 -12.459 1.00 0.00 C ATOM 1080 CD GLU A 66 -21.104 1.265 -12.380 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -21.228 1.812 -11.264 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -21.571 1.746 -13.434 1.00 0.00 O ATOM 0 H GLU A 66 -19.066 -2.529 -12.450 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.679 -1.178 -9.956 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.456 -1.874 -12.322 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -21.813 -0.722 -11.051 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -19.329 0.102 -12.106 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -20.283 -0.362 -13.501 1.00 0.00 H new ATOM 1089 N ASP A 67 -20.754 -4.190 -10.654 1.00 0.00 N ATOM 1090 CA ASP A 67 -21.411 -5.369 -10.105 1.00 0.00 C ATOM 1091 C ASP A 67 -20.433 -6.255 -9.336 1.00 0.00 C ATOM 1092 O ASP A 67 -20.702 -7.436 -9.117 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.068 -6.176 -11.227 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.504 -5.758 -11.474 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.194 -5.394 -10.498 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -23.940 -5.794 -12.644 1.00 0.00 O ATOM 0 H ASP A 67 -20.307 -4.340 -11.558 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.174 -5.025 -9.406 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.493 -6.052 -12.145 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.039 -7.236 -10.974 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.304 -5.688 -8.915 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.316 -6.451 -8.160 1.00 0.00 C ATOM 1103 C TYR A 68 -18.783 -6.652 -6.722 1.00 0.00 C ATOM 1104 O TYR A 68 -19.365 -5.750 -6.119 1.00 0.00 O ATOM 1105 CB TYR A 68 -16.961 -5.742 -8.175 1.00 0.00 C ATOM 1106 CG TYR A 68 -15.877 -6.507 -7.451 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.273 -7.614 -8.034 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.459 -6.125 -6.182 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.285 -8.319 -7.374 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.471 -6.823 -5.516 1.00 0.00 C ATOM 1111 CZ TYR A 68 -13.887 -7.920 -6.116 1.00 0.00 C ATOM 1112 OH TYR A 68 -12.904 -8.621 -5.454 1.00 0.00 O ATOM 0 H TYR A 68 -19.053 -4.713 -9.082 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.205 -7.426 -8.634 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -16.654 -5.582 -9.209 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.069 -4.758 -7.718 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.581 -7.929 -9.020 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -15.915 -5.268 -5.709 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.827 -9.178 -7.841 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.157 -6.512 -4.531 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.024 -8.322 -5.764 1.00 0.00 H new ATOM 1122 N GLN A 69 -18.534 -7.839 -6.178 1.00 0.00 N ATOM 1123 CA GLN A 69 -18.941 -8.149 -4.811 1.00 0.00 C ATOM 1124 C GLN A 69 -17.773 -8.687 -3.990 1.00 0.00 C ATOM 1125 O GLN A 69 -17.313 -9.808 -4.206 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.083 -9.167 -4.818 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.238 -8.779 -5.726 1.00 0.00 C ATOM 1128 CD GLN A 69 -21.926 -7.503 -5.282 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -21.869 -6.476 -6.123 1.00 0.00 O flip ATOM 1130 NE2 GLN A 69 -22.502 -7.440 -4.196 1.00 0.00 N flip ATOM 0 H GLN A 69 -18.054 -8.599 -6.660 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.283 -7.223 -4.348 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.694 -10.135 -5.133 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.456 -9.289 -3.801 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -20.869 -8.653 -6.744 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.965 -9.590 -5.749 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.521 -8.253 -3.581 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -22.960 -6.574 -3.911 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.306 -7.881 -3.042 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.198 -8.274 -2.179 1.00 0.00 C ATOM 1141 C ALA A 70 -16.694 -8.603 -0.776 1.00 0.00 C ATOM 1142 O ALA A 70 -16.877 -7.713 0.055 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.149 -7.172 -2.126 1.00 0.00 C ATOM 0 H ALA A 70 -17.678 -6.951 -2.852 1.00 0.00 H new ATOM 0 HA ALA A 70 -15.741 -9.170 -2.598 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.329 -7.481 -1.478 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.767 -6.984 -3.130 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.599 -6.260 -1.733 1.00 0.00 H new ATOM 1149 N GLN A 71 -16.912 -9.887 -0.520 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.391 -10.337 0.780 1.00 0.00 C ATOM 1151 C GLN A 71 -16.298 -10.214 1.834 1.00 0.00 C ATOM 1152 O GLN A 71 -15.195 -10.733 1.664 1.00 0.00 O ATOM 1153 CB GLN A 71 -17.872 -11.787 0.695 1.00 0.00 C ATOM 1154 CG GLN A 71 -19.120 -11.965 -0.153 1.00 0.00 C ATOM 1155 CD GLN A 71 -18.833 -11.873 -1.639 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -19.232 -10.916 -2.302 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -18.137 -12.871 -2.170 1.00 0.00 N ATOM 0 H GLN A 71 -16.764 -10.636 -1.197 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.226 -9.700 1.072 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.072 -12.403 0.283 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -18.071 -12.155 1.702 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -19.569 -12.933 0.067 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -19.852 -11.205 0.120 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -17.826 -13.645 -1.583 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -17.913 -12.864 -3.165 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.613 -9.525 2.925 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.648 -9.348 3.991 1.00 0.00 C ATOM 1168 C GLY A 72 -15.028 -7.965 3.998 1.00 0.00 C ATOM 1169 O GLY A 72 -14.598 -7.481 5.045 1.00 0.00 O ATOM 0 H GLY A 72 -17.519 -9.087 3.089 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.135 -9.528 4.949 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.860 -10.094 3.889 1.00 0.00 H new ATOM 1173 N ALA A 73 -14.975 -7.325 2.832 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.396 -5.990 2.722 1.00 0.00 C ATOM 1175 C ALA A 73 -15.373 -5.017 2.066 1.00 0.00 C ATOM 1176 O ALA A 73 -16.410 -5.423 1.542 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.094 -6.044 1.936 1.00 0.00 C ATOM 0 H ALA A 73 -15.325 -7.708 1.954 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.187 -5.628 3.729 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.672 -5.042 1.861 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.387 -6.698 2.447 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.289 -6.431 0.936 1.00 0.00 H new ATOM 1183 N VAL A 74 -15.038 -3.729 2.103 1.00 0.00 N ATOM 1184 CA VAL A 74 -15.891 -2.699 1.516 1.00 0.00 C ATOM 1185 C VAL A 74 -15.655 -2.586 0.014 1.00 0.00 C ATOM 1186 O VAL A 74 -14.529 -2.733 -0.459 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.647 -1.323 2.167 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -16.739 -0.343 1.768 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.560 -1.451 3.682 1.00 0.00 C ATOM 0 H VAL A 74 -14.183 -3.375 2.533 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.922 -3.000 1.701 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.694 -0.937 1.806 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.550 0.623 2.237 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.744 -0.225 0.684 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.706 -0.723 2.096 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.388 -0.468 4.121 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.494 -1.861 4.067 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.736 -2.115 3.944 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.727 -2.342 -0.735 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.632 -2.232 -2.186 1.00 0.00 C ATOM 1201 C VAL A 75 -16.981 -0.832 -2.685 1.00 0.00 C ATOM 1202 O VAL A 75 -17.998 -0.255 -2.301 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.553 -3.251 -2.883 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.357 -3.210 -4.392 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -17.301 -4.651 -2.344 1.00 0.00 C ATOM 0 H VAL A 75 -17.668 -2.217 -0.362 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.592 -2.442 -2.437 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.587 -2.982 -2.669 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.017 -3.937 -4.865 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.592 -2.212 -4.762 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.321 -3.451 -4.631 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.960 -5.359 -2.847 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.263 -4.929 -2.526 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.499 -4.669 -1.272 1.00 0.00 H new ATOM 1215 N VAL A 76 -16.130 -0.310 -3.564 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.325 1.008 -4.158 1.00 0.00 C ATOM 1217 C VAL A 76 -15.532 1.113 -5.459 1.00 0.00 C ATOM 1218 O VAL A 76 -14.607 0.334 -5.688 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.903 2.142 -3.201 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -16.684 2.064 -1.899 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.407 2.098 -2.935 1.00 0.00 C ATOM 0 H VAL A 76 -15.288 -0.788 -3.884 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.390 1.123 -4.360 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.133 3.093 -3.681 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.371 2.872 -1.238 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.750 2.158 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.492 1.106 -1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.134 2.907 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.146 1.142 -2.482 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.867 2.213 -3.875 1.00 0.00 H new ATOM 1231 N HIS A 77 -15.903 2.056 -6.319 1.00 0.00 N ATOM 1232 CA HIS A 77 -15.216 2.215 -7.600 1.00 0.00 C ATOM 1233 C HIS A 77 -14.739 3.647 -7.833 1.00 0.00 C ATOM 1234 O HIS A 77 -13.969 3.900 -8.758 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.128 1.780 -8.754 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.229 0.849 -8.341 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.001 -0.339 -7.679 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -18.572 0.941 -8.495 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.155 -0.938 -7.444 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.123 -0.182 -7.928 1.00 0.00 N ATOM 0 H HIS A 77 -16.665 2.715 -6.158 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.334 1.575 -7.566 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -16.568 2.667 -9.211 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -15.523 1.294 -9.519 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.085 -0.699 -7.412 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.109 1.747 -8.974 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.284 -1.885 -6.941 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.201 4.587 -7.016 1.00 0.00 N ATOM 1250 CA ASP A 78 -14.809 5.979 -7.180 1.00 0.00 C ATOM 1251 C ASP A 78 -13.919 6.449 -6.036 1.00 0.00 C ATOM 1252 O ASP A 78 -13.936 5.881 -4.944 1.00 0.00 O ATOM 1253 CB ASP A 78 -16.048 6.871 -7.276 1.00 0.00 C ATOM 1254 CG ASP A 78 -16.623 6.914 -8.678 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -16.944 5.836 -9.221 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -16.753 8.025 -9.233 1.00 0.00 O ATOM 0 H ASP A 78 -15.841 4.412 -6.241 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.237 6.054 -8.105 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -16.809 6.507 -6.585 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.790 7.882 -6.961 1.00 0.00 H new ATOM 1261 N VAL A 79 -13.146 7.496 -6.300 1.00 0.00 N ATOM 1262 CA VAL A 79 -12.246 8.061 -5.302 1.00 0.00 C ATOM 1263 C VAL A 79 -13.026 8.843 -4.255 1.00 0.00 C ATOM 1264 O VAL A 79 -12.748 8.754 -3.059 1.00 0.00 O ATOM 1265 CB VAL A 79 -11.200 8.990 -5.946 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -10.177 9.439 -4.915 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -10.520 8.298 -7.118 1.00 0.00 C ATOM 0 H VAL A 79 -13.125 7.973 -7.201 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.730 7.226 -4.827 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.711 9.875 -6.324 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.446 10.095 -5.389 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.681 9.978 -4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.669 8.567 -4.503 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.784 8.970 -7.560 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.022 7.394 -6.768 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.266 8.033 -7.867 1.00 0.00 H new ATOM 1277 N ALA A 80 -14.014 9.596 -4.716 1.00 0.00 N ATOM 1278 CA ALA A 80 -14.855 10.382 -3.827 1.00 0.00 C ATOM 1279 C ALA A 80 -15.744 9.461 -3.007 1.00 0.00 C ATOM 1280 O ALA A 80 -16.018 9.720 -1.835 1.00 0.00 O ATOM 1281 CB ALA A 80 -15.696 11.369 -4.623 1.00 0.00 C ATOM 0 H ALA A 80 -14.253 9.679 -5.704 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.217 10.949 -3.149 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.319 11.949 -3.942 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.041 12.042 -5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.331 10.825 -5.322 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.180 8.371 -3.634 1.00 0.00 N ATOM 1288 CA ALA A 81 -17.027 7.393 -2.964 1.00 0.00 C ATOM 1289 C ALA A 81 -16.333 6.867 -1.716 1.00 0.00 C ATOM 1290 O ALA A 81 -16.734 7.175 -0.593 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.367 6.250 -3.909 1.00 0.00 C ATOM 0 H ALA A 81 -15.960 8.145 -4.604 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.956 7.879 -2.666 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.000 5.528 -3.394 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.896 6.641 -4.778 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.449 5.761 -4.233 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.278 6.083 -1.920 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.510 5.525 -0.814 1.00 0.00 C ATOM 1299 C VAL A 82 -14.123 6.622 0.177 1.00 0.00 C ATOM 1300 O VAL A 82 -13.954 6.373 1.370 1.00 0.00 O ATOM 1301 CB VAL A 82 -13.238 4.815 -1.334 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -12.135 5.818 -1.635 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.755 3.771 -0.342 1.00 0.00 C ATOM 0 H VAL A 82 -14.936 5.820 -2.844 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.136 4.793 -0.304 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.497 4.308 -2.264 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.253 5.291 -1.999 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.478 6.519 -2.396 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.882 6.364 -0.726 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.860 3.286 -0.731 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.523 4.252 0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.535 3.025 -0.191 1.00 0.00 H new ATOM 1313 N PHE A 83 -13.989 7.842 -0.332 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.628 8.980 0.500 1.00 0.00 C ATOM 1315 C PHE A 83 -14.701 9.240 1.549 1.00 0.00 C ATOM 1316 O PHE A 83 -14.394 9.455 2.721 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.423 10.225 -0.373 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.000 10.712 -0.435 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -10.935 9.842 -0.248 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.730 12.048 -0.682 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -9.632 10.297 -0.305 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.429 12.509 -0.739 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.379 11.633 -0.550 1.00 0.00 C ATOM 0 H PHE A 83 -14.125 8.066 -1.318 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.695 8.752 1.015 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.763 10.005 -1.385 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -14.053 11.029 0.008 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.127 8.797 -0.056 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.547 12.738 -0.832 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.812 9.609 -0.158 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.234 13.554 -0.931 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.361 11.991 -0.594 1.00 0.00 H new ATOM 1333 N ALA A 84 -15.962 9.204 1.129 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.067 9.422 2.053 1.00 0.00 C ATOM 1335 C ALA A 84 -17.038 8.370 3.148 1.00 0.00 C ATOM 1336 O ALA A 84 -17.288 8.663 4.317 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.398 9.401 1.317 1.00 0.00 C ATOM 0 H ALA A 84 -16.241 9.028 0.164 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.955 10.406 2.509 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.209 9.566 2.027 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.410 10.189 0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.531 8.434 0.833 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.694 7.147 2.763 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.592 6.064 3.722 1.00 0.00 C ATOM 1345 C TYR A 85 -15.489 6.410 4.717 1.00 0.00 C ATOM 1346 O TYR A 85 -15.739 6.532 5.915 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.334 4.726 3.005 1.00 0.00 C ATOM 1348 CG TYR A 85 -15.046 4.027 3.389 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.863 3.506 4.664 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -14.018 3.889 2.470 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.688 2.866 5.009 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.840 3.251 2.807 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.680 2.742 4.077 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.508 2.107 4.413 1.00 0.00 O ATOM 0 H TYR A 85 -16.483 6.886 1.800 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.530 5.944 4.265 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.168 4.055 3.211 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.326 4.904 1.930 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.651 3.603 5.396 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.140 4.287 1.473 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.560 2.465 6.004 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.049 3.152 2.079 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.784 2.432 3.838 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.265 6.565 4.209 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.121 6.899 5.050 1.00 0.00 C ATOM 1366 C ALA A 86 -13.474 7.976 6.070 1.00 0.00 C ATOM 1367 O ALA A 86 -13.033 7.919 7.218 1.00 0.00 O ATOM 1368 CB ALA A 86 -11.945 7.344 4.192 1.00 0.00 C ATOM 0 H ALA A 86 -14.043 6.464 3.218 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.837 6.001 5.600 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.099 7.590 4.834 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.664 6.538 3.514 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.229 8.223 3.613 1.00 0.00 H new ATOM 1374 N LYS A 87 -14.291 8.942 5.661 1.00 0.00 N ATOM 1375 CA LYS A 87 -14.710 9.999 6.570 1.00 0.00 C ATOM 1376 C LYS A 87 -15.652 9.417 7.616 1.00 0.00 C ATOM 1377 O LYS A 87 -15.540 9.703 8.808 1.00 0.00 O ATOM 1378 CB LYS A 87 -15.403 11.125 5.801 1.00 0.00 C ATOM 1379 CG LYS A 87 -15.055 12.515 6.311 1.00 0.00 C ATOM 1380 CD LYS A 87 -13.704 12.980 5.788 1.00 0.00 C ATOM 1381 CE LYS A 87 -13.824 14.273 4.996 1.00 0.00 C ATOM 1382 NZ LYS A 87 -12.969 14.260 3.777 1.00 0.00 N ATOM 0 H LYS A 87 -14.671 9.013 4.717 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.832 10.416 7.064 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.131 11.055 4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -16.482 10.984 5.862 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.827 13.220 6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.042 12.511 7.401 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.021 13.127 6.624 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.272 12.204 5.156 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.864 14.427 4.708 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.541 15.114 5.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.080 15.159 3.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.974 14.139 4.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.256 13.473 3.160 1.00 0.00 H new ATOM 1396 N GLN A 88 -16.581 8.596 7.143 1.00 0.00 N ATOM 1397 CA GLN A 88 -17.561 7.953 8.009 1.00 0.00 C ATOM 1398 C GLN A 88 -16.879 7.083 9.062 1.00 0.00 C ATOM 1399 O GLN A 88 -17.474 6.759 10.090 1.00 0.00 O ATOM 1400 CB GLN A 88 -18.526 7.104 7.178 1.00 0.00 C ATOM 1401 CG GLN A 88 -19.892 6.931 7.821 1.00 0.00 C ATOM 1402 CD GLN A 88 -20.556 8.256 8.144 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -20.969 8.496 9.278 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -20.662 9.124 7.145 1.00 0.00 N ATOM 0 H GLN A 88 -16.676 8.358 6.156 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.121 8.736 8.521 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -18.651 7.565 6.198 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.084 6.121 7.014 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.535 6.360 7.151 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.788 6.348 8.736 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -20.306 8.883 6.220 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.100 10.032 7.302 1.00 0.00 H new ATOM 1413 N HIS A 89 -15.630 6.705 8.802 1.00 0.00 N ATOM 1414 CA HIS A 89 -14.877 5.872 9.732 1.00 0.00 C ATOM 1415 C HIS A 89 -13.749 6.663 10.395 1.00 0.00 C ATOM 1416 O HIS A 89 -12.578 6.494 10.055 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.302 4.658 9.000 1.00 0.00 C ATOM 1418 CG HIS A 89 -15.179 3.447 9.070 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.797 3.031 10.231 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.541 2.559 8.114 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -16.501 1.940 9.985 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -16.362 1.633 8.709 1.00 0.00 N ATOM 0 H HIS A 89 -15.120 6.962 7.957 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.559 5.535 10.512 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.139 4.918 7.954 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.328 4.416 9.424 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.240 2.576 7.077 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -17.090 1.393 10.706 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.794 0.837 8.241 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.087 7.540 11.358 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.098 8.354 12.069 1.00 0.00 C ATOM 1433 C PRO A 90 -12.358 7.569 13.151 1.00 0.00 C ATOM 1434 O PRO A 90 -11.454 8.095 13.800 1.00 0.00 O ATOM 1435 CB PRO A 90 -13.951 9.452 12.699 1.00 0.00 C ATOM 1436 CG PRO A 90 -15.266 8.799 12.949 1.00 0.00 C ATOM 1437 CD PRO A 90 -15.461 7.808 11.831 1.00 0.00 C ATOM 0 HA PRO A 90 -12.315 8.720 11.405 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.507 9.819 13.624 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.053 10.308 12.033 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.275 8.300 13.918 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.070 9.535 12.962 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.948 6.898 12.182 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.085 8.218 11.037 1.00 0.00 H new ATOM 1445 N ASP A 91 -12.747 6.311 13.343 1.00 0.00 N ATOM 1446 CA ASP A 91 -12.119 5.463 14.350 1.00 0.00 C ATOM 1447 C ASP A 91 -10.984 4.630 13.751 1.00 0.00 C ATOM 1448 O ASP A 91 -10.399 3.789 14.433 1.00 0.00 O ATOM 1449 CB ASP A 91 -13.161 4.542 14.988 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.525 4.969 16.396 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -12.601 5.226 17.196 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -14.734 5.047 16.699 1.00 0.00 O ATOM 0 H ASP A 91 -13.493 5.858 12.815 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.694 6.113 15.115 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.059 4.532 14.371 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.777 3.522 15.008 1.00 0.00 H new ATOM 1457 N GLN A 92 -10.676 4.866 12.478 1.00 0.00 N ATOM 1458 CA GLN A 92 -9.612 4.132 11.804 1.00 0.00 C ATOM 1459 C GLN A 92 -8.902 5.015 10.783 1.00 0.00 C ATOM 1460 O GLN A 92 -9.335 6.134 10.506 1.00 0.00 O ATOM 1461 CB GLN A 92 -10.178 2.890 11.113 1.00 0.00 C ATOM 1462 CG GLN A 92 -10.753 1.866 12.077 1.00 0.00 C ATOM 1463 CD GLN A 92 -12.262 1.959 12.194 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -12.803 2.116 13.288 1.00 0.00 O ATOM 1465 NE2 GLN A 92 -12.950 1.861 11.062 1.00 0.00 N ATOM 0 H GLN A 92 -11.147 5.558 11.895 1.00 0.00 H new ATOM 0 HA GLN A 92 -8.887 3.823 12.557 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -10.957 3.196 10.415 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.389 2.420 10.525 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.479 0.865 11.744 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.306 2.008 13.061 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -12.460 1.731 10.177 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.968 1.915 11.078 1.00 0.00 H new ATOM 1474 N GLU A 93 -7.809 4.503 10.227 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.037 5.242 9.235 1.00 0.00 C ATOM 1476 C GLU A 93 -7.043 4.516 7.893 1.00 0.00 C ATOM 1477 O GLU A 93 -7.332 3.321 7.825 1.00 0.00 O ATOM 1478 CB GLU A 93 -5.598 5.438 9.720 1.00 0.00 C ATOM 1479 CG GLU A 93 -5.237 6.892 9.979 1.00 0.00 C ATOM 1480 CD GLU A 93 -5.807 7.410 11.285 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -5.818 6.646 12.273 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -6.242 8.581 11.319 1.00 0.00 O ATOM 0 H GLU A 93 -7.438 3.579 10.447 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.502 6.219 9.101 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.451 4.867 10.637 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.914 5.029 8.977 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.152 6.996 9.994 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.605 7.506 9.157 1.00 0.00 H new ATOM 1489 N LEU A 94 -6.721 5.244 6.829 1.00 0.00 N ATOM 1490 CA LEU A 94 -6.689 4.666 5.491 1.00 0.00 C ATOM 1491 C LEU A 94 -5.257 4.360 5.067 1.00 0.00 C ATOM 1492 O LEU A 94 -4.411 5.252 5.011 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.343 5.620 4.486 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.629 5.098 3.844 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -9.728 4.964 4.885 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -9.071 6.017 2.715 1.00 0.00 C ATOM 0 H LEU A 94 -6.479 6.234 6.867 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.249 3.731 5.510 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.562 6.561 4.990 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.624 5.841 3.697 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.430 4.111 3.426 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.636 4.591 4.410 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.412 4.266 5.660 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.926 5.938 5.332 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.988 5.631 2.269 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.253 7.017 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.290 6.063 1.956 1.00 0.00 H new ATOM 1508 N VAL A 95 -4.991 3.092 4.772 1.00 0.00 N ATOM 1509 CA VAL A 95 -3.661 2.667 4.356 1.00 0.00 C ATOM 1510 C VAL A 95 -3.699 2.002 2.985 1.00 0.00 C ATOM 1511 O VAL A 95 -4.295 0.938 2.817 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.040 1.689 5.372 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.597 1.377 5.002 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.125 2.254 6.782 1.00 0.00 C ATOM 0 H VAL A 95 -5.680 2.341 4.814 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.045 3.565 4.304 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.608 0.759 5.344 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.176 0.685 5.731 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.565 0.924 4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.015 2.299 4.998 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.681 1.548 7.484 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.585 3.200 6.828 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.170 2.419 7.045 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.057 2.633 2.007 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.014 2.098 0.652 1.00 0.00 C ATOM 1526 C ILE A 96 -1.898 1.069 0.512 1.00 0.00 C ATOM 1527 O ILE A 96 -0.717 1.405 0.608 1.00 0.00 O ATOM 1528 CB ILE A 96 -2.806 3.212 -0.395 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -3.619 4.455 -0.026 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.191 2.715 -1.780 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.099 4.185 0.134 1.00 0.00 C ATOM 0 H ILE A 96 -2.560 3.515 2.128 1.00 0.00 H new ATOM 0 HA ILE A 96 -3.977 1.622 0.469 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.750 3.484 -0.405 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.231 4.870 0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.478 5.213 -0.796 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.039 3.512 -2.508 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.571 1.859 -2.045 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.240 2.418 -1.781 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.612 5.111 0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.502 3.799 -0.802 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.251 3.450 0.925 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.277 -0.185 0.293 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.305 -1.262 0.150 1.00 0.00 C ATOM 1545 C ALA A 97 -1.087 -1.629 -1.314 1.00 0.00 C ATOM 1546 O ALA A 97 -0.029 -2.138 -1.682 1.00 0.00 O ATOM 1547 CB ALA A 97 -1.753 -2.483 0.939 1.00 0.00 C ATOM 0 H ALA A 97 -3.250 -0.481 0.211 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.354 -0.908 0.549 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.019 -3.280 0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.843 -2.222 1.993 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.719 -2.823 0.566 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.092 -1.375 -2.146 1.00 0.00 N ATOM 1554 CA GLY A 98 -1.981 -1.695 -3.558 1.00 0.00 C ATOM 1555 C GLY A 98 -3.310 -1.586 -4.286 1.00 0.00 C ATOM 1556 O GLY A 98 -4.325 -1.274 -3.663 1.00 0.00 O ATOM 0 H GLY A 98 -2.979 -0.954 -1.869 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.259 -1.024 -4.024 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.592 -2.707 -3.668 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.288 -1.676 -5.622 1.00 0.00 N ATOM 1561 CA GLY A 99 -2.045 -1.872 -6.354 1.00 0.00 C ATOM 1562 C GLY A 99 -1.399 -0.563 -6.767 1.00 0.00 C ATOM 1563 O GLY A 99 -1.590 0.465 -6.117 1.00 0.00 O ATOM 0 H GLY A 99 -4.119 -1.616 -6.211 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.348 -2.437 -5.735 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -2.242 -2.472 -7.242 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.631 -0.604 -7.851 1.00 0.00 N ATOM 1568 CA ALA A 100 0.049 0.584 -8.354 1.00 0.00 C ATOM 1569 C ALA A 100 -0.949 1.624 -8.848 1.00 0.00 C ATOM 1570 O ALA A 100 -0.759 2.824 -8.647 1.00 0.00 O ATOM 1571 CB ALA A 100 1.013 0.206 -9.468 1.00 0.00 C ATOM 0 H ALA A 100 -0.464 -1.448 -8.398 1.00 0.00 H new ATOM 0 HA ALA A 100 0.612 1.024 -7.531 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.514 1.102 -9.835 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.755 -0.494 -9.085 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.461 -0.261 -10.284 1.00 0.00 H new ATOM 1577 N GLN A 101 -2.013 1.160 -9.494 1.00 0.00 N ATOM 1578 CA GLN A 101 -3.038 2.056 -10.014 1.00 0.00 C ATOM 1579 C GLN A 101 -3.759 2.767 -8.874 1.00 0.00 C ATOM 1580 O GLN A 101 -4.242 3.889 -9.035 1.00 0.00 O ATOM 1581 CB GLN A 101 -4.040 1.281 -10.873 1.00 0.00 C ATOM 1582 CG GLN A 101 -4.181 1.830 -12.283 1.00 0.00 C ATOM 1583 CD GLN A 101 -4.811 3.209 -12.312 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -6.122 3.265 -12.107 1.00 0.00 O flip ATOM 1585 NE2 GLN A 101 -4.128 4.212 -12.515 1.00 0.00 N flip ATOM 0 H GLN A 101 -2.188 0.171 -9.670 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.552 2.807 -10.637 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.730 0.238 -10.927 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.015 1.299 -10.385 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.198 1.874 -12.752 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.787 1.145 -12.877 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.123 4.123 -12.668 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.566 5.133 -12.531 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.823 2.111 -7.720 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.478 2.684 -6.553 1.00 0.00 C ATOM 1596 C ILE A 102 -3.636 3.807 -5.962 1.00 0.00 C ATOM 1597 O ILE A 102 -4.163 4.834 -5.534 1.00 0.00 O ATOM 1598 CB ILE A 102 -4.732 1.619 -5.470 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.408 0.392 -6.081 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.582 2.195 -4.348 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -6.783 0.678 -6.643 1.00 0.00 C ATOM 0 H ILE A 102 -3.429 1.182 -7.569 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.437 3.082 -6.885 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.773 1.312 -5.051 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.775 -0.004 -6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.489 -0.385 -5.321 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.752 1.430 -3.591 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.065 3.042 -3.898 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.539 2.527 -4.750 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.203 -0.237 -7.060 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.432 1.046 -5.848 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.706 1.432 -7.426 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.322 3.607 -5.951 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.403 4.607 -5.423 1.00 0.00 C ATOM 1615 C PHE A 103 -1.499 5.896 -6.229 1.00 0.00 C ATOM 1616 O PHE A 103 -1.482 6.993 -5.671 1.00 0.00 O ATOM 1617 CB PHE A 103 0.035 4.084 -5.462 1.00 0.00 C ATOM 1618 CG PHE A 103 0.264 2.864 -4.615 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.331 2.744 -3.369 1.00 0.00 C ATOM 1620 CD2 PHE A 103 1.079 1.838 -5.066 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -0.117 1.623 -2.589 1.00 0.00 C ATOM 1622 CE2 PHE A 103 1.296 0.715 -4.291 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.698 0.608 -3.051 1.00 0.00 C ATOM 0 H PHE A 103 -1.871 2.762 -6.302 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.680 4.812 -4.389 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.299 3.852 -6.494 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.708 4.875 -5.131 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.969 3.535 -3.003 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.550 1.917 -6.035 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.586 1.541 -1.620 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.933 -0.078 -4.655 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.867 -0.268 -2.443 1.00 0.00 H new ATOM 1633 N THR A 104 -1.594 5.751 -7.547 1.00 0.00 N ATOM 1634 CA THR A 104 -1.686 6.896 -8.443 1.00 0.00 C ATOM 1635 C THR A 104 -2.893 7.769 -8.114 1.00 0.00 C ATOM 1636 O THR A 104 -2.772 8.988 -8.000 1.00 0.00 O ATOM 1637 CB THR A 104 -1.768 6.426 -9.896 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.656 5.612 -10.224 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.814 7.565 -10.892 1.00 0.00 C ATOM 0 H THR A 104 -1.609 4.847 -8.019 1.00 0.00 H new ATOM 0 HA THR A 104 -0.786 7.496 -8.306 1.00 0.00 H new ATOM 0 HB THR A 104 -2.701 5.866 -9.966 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.548 5.583 -11.198 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.872 7.162 -11.903 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.690 8.183 -10.697 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.913 8.171 -10.794 1.00 0.00 H new ATOM 1647 N ALA A 105 -4.059 7.146 -7.973 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.279 7.886 -7.670 1.00 0.00 C ATOM 1649 C ALA A 105 -5.126 8.707 -6.401 1.00 0.00 C ATOM 1650 O ALA A 105 -5.268 9.930 -6.428 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.460 6.934 -7.548 1.00 0.00 C ATOM 0 H ALA A 105 -4.185 6.138 -8.063 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.466 8.575 -8.493 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.363 7.501 -7.322 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.594 6.398 -8.488 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.270 6.220 -6.747 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.840 8.045 -5.288 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.676 8.737 -4.021 1.00 0.00 C ATOM 1659 C PHE A 106 -3.376 9.537 -3.989 1.00 0.00 C ATOM 1660 O PHE A 106 -3.185 10.374 -3.113 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.714 7.736 -2.865 1.00 0.00 C ATOM 1662 CG PHE A 106 -6.069 7.122 -2.652 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.533 6.124 -3.495 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.880 7.545 -1.611 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.780 5.559 -3.303 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -8.129 6.984 -1.415 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.579 5.990 -2.262 1.00 0.00 C ATOM 0 H PHE A 106 -4.718 7.034 -5.239 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.502 9.439 -3.911 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.990 6.944 -3.056 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.403 8.238 -1.949 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.913 5.784 -4.311 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.533 8.321 -0.945 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.129 4.781 -3.966 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.752 7.323 -0.600 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.554 5.551 -2.111 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.480 9.280 -4.944 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.203 9.993 -5.003 1.00 0.00 C ATOM 1679 C LYS A 107 -1.408 11.491 -4.776 1.00 0.00 C ATOM 1680 O LYS A 107 -0.598 12.151 -4.125 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.512 9.746 -6.354 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.817 10.798 -7.414 1.00 0.00 C ATOM 1683 CD LYS A 107 -0.326 10.366 -8.786 1.00 0.00 C ATOM 1684 CE LYS A 107 -0.868 11.269 -9.883 1.00 0.00 C ATOM 1685 NZ LYS A 107 0.180 11.622 -10.880 1.00 0.00 N ATOM 0 H LYS A 107 -2.614 8.589 -5.682 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.562 9.611 -4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.566 9.707 -6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.814 8.769 -6.731 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.891 10.978 -7.451 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.345 11.741 -7.138 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.764 10.383 -8.805 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.633 9.337 -8.976 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.696 10.771 -10.387 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.268 12.180 -9.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.230 12.238 -11.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.959 12.120 -10.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.544 10.754 -11.323 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.508 12.010 -5.310 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.843 13.420 -5.163 1.00 0.00 C ATOM 1701 C ASP A 108 -3.646 13.653 -3.887 1.00 0.00 C ATOM 1702 O ASP A 108 -3.451 14.648 -3.189 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.637 13.907 -6.376 1.00 0.00 C ATOM 1704 CG ASP A 108 -2.744 14.474 -7.462 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -2.069 15.493 -7.204 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -2.719 13.899 -8.570 1.00 0.00 O ATOM 0 H ASP A 108 -3.185 11.472 -5.851 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.914 13.986 -5.097 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.218 13.079 -6.783 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.348 14.670 -6.059 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.559 12.729 -3.597 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.408 12.831 -2.411 1.00 0.00 C ATOM 1713 C ASP A 109 -4.738 12.227 -1.172 1.00 0.00 C ATOM 1714 O ASP A 109 -5.375 12.078 -0.129 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.749 12.140 -2.667 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.899 13.125 -2.760 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.809 14.204 -2.137 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.889 12.817 -3.456 1.00 0.00 O ATOM 0 H ASP A 109 -4.730 11.901 -4.167 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.572 13.891 -2.214 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.689 11.568 -3.593 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.947 11.429 -1.865 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.464 11.867 -1.293 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.730 11.265 -0.184 1.00 0.00 C ATOM 1725 C VAL A 110 -2.122 12.325 0.730 1.00 0.00 C ATOM 1726 O VAL A 110 -1.931 13.473 0.329 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.609 10.339 -0.697 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.596 11.124 -1.518 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.927 9.624 0.461 1.00 0.00 C ATOM 0 H VAL A 110 -2.918 11.981 -2.147 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.450 10.679 0.387 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.060 9.585 -1.343 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.186 10.452 -1.870 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.095 11.579 -2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.152 11.904 -0.899 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.140 8.976 0.076 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.493 10.360 1.138 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.660 9.023 1.000 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.823 11.928 1.965 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.239 12.837 2.944 1.00 0.00 C ATOM 1741 C ASP A 111 0.065 12.275 3.510 1.00 0.00 C ATOM 1742 O ASP A 111 1.027 13.013 3.724 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.231 13.102 4.079 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.451 14.582 4.321 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.596 15.209 4.981 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -3.479 15.114 3.852 1.00 0.00 O ATOM 0 H ASP A 111 -1.977 10.981 2.310 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.014 13.776 2.438 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.184 12.630 3.842 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.864 12.638 4.994 1.00 0.00 H new ATOM 1751 N THR A 112 0.091 10.966 3.754 1.00 0.00 N ATOM 1752 CA THR A 112 1.279 10.315 4.299 1.00 0.00 C ATOM 1753 C THR A 112 1.858 9.310 3.307 1.00 0.00 C ATOM 1754 O THR A 112 1.157 8.822 2.422 1.00 0.00 O ATOM 1755 CB THR A 112 0.945 9.612 5.616 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.259 10.488 6.492 1.00 0.00 O ATOM 1757 CG2 THR A 112 2.167 9.096 6.347 1.00 0.00 C ATOM 0 H THR A 112 -0.694 10.338 3.583 1.00 0.00 H new ATOM 0 HA THR A 112 2.027 11.086 4.485 1.00 0.00 H new ATOM 0 HB THR A 112 0.322 8.762 5.339 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.053 10.020 7.328 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.859 8.609 7.272 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.692 8.379 5.716 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.831 9.929 6.579 1.00 0.00 H new ATOM 1765 N LEU A 113 3.145 9.007 3.464 1.00 0.00 N ATOM 1766 CA LEU A 113 3.828 8.065 2.588 1.00 0.00 C ATOM 1767 C LEU A 113 4.793 7.182 3.378 1.00 0.00 C ATOM 1768 O LEU A 113 5.608 7.677 4.157 1.00 0.00 O ATOM 1769 CB LEU A 113 4.595 8.832 1.513 1.00 0.00 C ATOM 1770 CG LEU A 113 4.396 8.348 0.077 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.917 8.276 -0.277 1.00 0.00 C ATOM 1772 CD2 LEU A 113 5.130 9.274 -0.876 1.00 0.00 C ATOM 0 H LEU A 113 3.736 9.404 4.194 1.00 0.00 H new ATOM 0 HA LEU A 113 3.081 7.423 2.122 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.305 9.881 1.566 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.658 8.783 1.748 1.00 0.00 H new ATOM 0 HG LEU A 113 4.805 7.342 -0.014 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.805 7.929 -1.304 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.415 7.582 0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.471 9.265 -0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.988 8.929 -1.900 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.736 10.285 -0.776 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.193 9.273 -0.637 1.00 0.00 H new ATOM 1784 N LEU A 114 4.702 5.874 3.161 1.00 0.00 N ATOM 1785 CA LEU A 114 5.572 4.916 3.838 1.00 0.00 C ATOM 1786 C LEU A 114 6.069 3.872 2.845 1.00 0.00 C ATOM 1787 O LEU A 114 5.285 3.086 2.310 1.00 0.00 O ATOM 1788 CB LEU A 114 4.833 4.238 4.994 1.00 0.00 C ATOM 1789 CG LEU A 114 4.135 5.191 5.964 1.00 0.00 C ATOM 1790 CD1 LEU A 114 2.895 4.538 6.556 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.091 5.621 7.067 1.00 0.00 C ATOM 0 H LEU A 114 4.032 5.451 2.519 1.00 0.00 H new ATOM 0 HA LEU A 114 6.428 5.453 4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 114 4.090 3.557 4.580 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.545 3.631 5.554 1.00 0.00 H new ATOM 0 HG LEU A 114 3.824 6.078 5.412 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.412 5.232 7.244 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.202 4.280 5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.181 3.634 7.094 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.578 6.299 7.749 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.431 4.743 7.616 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.949 6.129 6.627 1.00 0.00 H new ATOM 1803 N VAL A 115 7.371 3.877 2.583 1.00 0.00 N ATOM 1804 CA VAL A 115 7.949 2.938 1.630 1.00 0.00 C ATOM 1805 C VAL A 115 9.145 2.187 2.202 1.00 0.00 C ATOM 1806 O VAL A 115 9.958 2.748 2.936 1.00 0.00 O ATOM 1807 CB VAL A 115 8.389 3.660 0.343 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.196 4.309 -0.337 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.462 4.693 0.648 1.00 0.00 C ATOM 0 H VAL A 115 8.041 4.515 3.013 1.00 0.00 H new ATOM 0 HA VAL A 115 7.164 2.216 1.405 1.00 0.00 H new ATOM 0 HB VAL A 115 8.812 2.922 -0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.525 4.815 -1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.463 3.544 -0.593 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.743 5.035 0.338 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.759 5.192 -0.274 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.069 5.430 1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.328 4.199 1.089 1.00 0.00 H new ATOM 1819 N THR A 116 9.251 0.914 1.833 1.00 0.00 N ATOM 1820 CA THR A 116 10.352 0.068 2.274 1.00 0.00 C ATOM 1821 C THR A 116 11.256 -0.259 1.089 1.00 0.00 C ATOM 1822 O THR A 116 10.950 -1.144 0.290 1.00 0.00 O ATOM 1823 CB THR A 116 9.811 -1.222 2.900 1.00 0.00 C ATOM 1824 OG1 THR A 116 9.151 -0.948 4.123 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.883 -2.255 3.179 1.00 0.00 C ATOM 0 H THR A 116 8.581 0.444 1.224 1.00 0.00 H new ATOM 0 HA THR A 116 10.932 0.602 3.027 1.00 0.00 H new ATOM 0 HB THR A 116 9.123 -1.631 2.160 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.645 -1.362 4.861 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.428 -3.141 3.621 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.377 -2.528 2.246 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.617 -1.840 3.870 1.00 0.00 H new ATOM 1833 N ARG A 117 12.361 0.470 0.969 1.00 0.00 N ATOM 1834 CA ARG A 117 13.292 0.262 -0.135 1.00 0.00 C ATOM 1835 C ARG A 117 14.257 -0.883 0.154 1.00 0.00 C ATOM 1836 O ARG A 117 15.186 -0.743 0.950 1.00 0.00 O ATOM 1837 CB ARG A 117 14.075 1.548 -0.412 1.00 0.00 C ATOM 1838 CG ARG A 117 14.040 1.978 -1.870 1.00 0.00 C ATOM 1839 CD ARG A 117 13.220 3.244 -2.061 1.00 0.00 C ATOM 1840 NE ARG A 117 12.875 3.467 -3.463 1.00 0.00 N ATOM 1841 CZ ARG A 117 12.148 4.496 -3.893 1.00 0.00 C ATOM 1842 NH1 ARG A 117 11.687 5.396 -3.033 1.00 0.00 N ATOM 1843 NH2 ARG A 117 11.880 4.624 -5.185 1.00 0.00 N ATOM 0 H ARG A 117 12.633 1.207 1.619 1.00 0.00 H new ATOM 0 HA ARG A 117 12.709 -0.005 -1.016 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.670 2.350 0.205 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.112 1.405 -0.109 1.00 0.00 H new ATOM 0 HG2 ARG A 117 15.057 2.146 -2.225 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.619 1.176 -2.476 1.00 0.00 H new ATOM 0 HD2 ARG A 117 12.307 3.177 -1.469 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.781 4.100 -1.685 1.00 0.00 H new ATOM 0 HE ARG A 117 13.211 2.795 -4.153 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.889 5.301 -2.038 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.130 6.183 -3.367 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.231 3.934 -5.849 1.00 0.00 H new ATOM 0 HH22 ARG A 117 11.323 5.412 -5.515 1.00 0.00 H new ATOM 1857 N LEU A 118 14.032 -2.014 -0.507 1.00 0.00 N ATOM 1858 CA LEU A 118 14.879 -3.188 -0.334 1.00 0.00 C ATOM 1859 C LEU A 118 16.252 -2.959 -0.959 1.00 0.00 C ATOM 1860 O LEU A 118 16.446 -2.015 -1.725 1.00 0.00 O ATOM 1861 CB LEU A 118 14.217 -4.415 -0.969 1.00 0.00 C ATOM 1862 CG LEU A 118 13.536 -5.369 0.013 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.409 -4.664 0.750 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.012 -6.597 -0.717 1.00 0.00 C ATOM 0 H LEU A 118 13.267 -2.142 -1.170 1.00 0.00 H new ATOM 0 HA LEU A 118 15.007 -3.363 0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.476 -4.075 -1.693 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.974 -4.970 -1.524 1.00 0.00 H new ATOM 0 HG LEU A 118 14.274 -5.692 0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.937 -5.360 1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.811 -3.816 1.304 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.670 -4.311 0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.530 -7.266 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.289 -6.290 -1.473 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.841 -7.116 -1.198 1.00 0.00 H new ATOM 1876 N ALA A 119 17.198 -3.833 -0.634 1.00 0.00 N ATOM 1877 CA ALA A 119 18.549 -3.729 -1.170 1.00 0.00 C ATOM 1878 C ALA A 119 18.663 -4.474 -2.493 1.00 0.00 C ATOM 1879 O ALA A 119 19.239 -3.970 -3.457 1.00 0.00 O ATOM 1880 CB ALA A 119 19.559 -4.273 -0.172 1.00 0.00 C ATOM 0 H ALA A 119 17.054 -4.621 -0.002 1.00 0.00 H new ATOM 0 HA ALA A 119 18.765 -2.676 -1.348 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.563 -4.188 -0.588 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.500 -3.701 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.339 -5.321 0.034 1.00 0.00 H new ATOM 1886 N GLY A 120 18.112 -5.682 -2.529 1.00 0.00 N ATOM 1887 CA GLY A 120 18.162 -6.485 -3.734 1.00 0.00 C ATOM 1888 C GLY A 120 17.452 -5.833 -4.903 1.00 0.00 C ATOM 1889 O GLY A 120 16.501 -5.071 -4.719 1.00 0.00 O ATOM 0 H GLY A 120 17.631 -6.119 -1.743 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.203 -6.666 -4.002 1.00 0.00 H new ATOM 0 HA3 GLY A 120 17.710 -7.457 -3.537 1.00 0.00 H new ATOM 1893 N SER A 121 17.915 -6.137 -6.109 1.00 0.00 N ATOM 1894 CA SER A 121 17.321 -5.585 -7.320 1.00 0.00 C ATOM 1895 C SER A 121 16.478 -6.637 -8.034 1.00 0.00 C ATOM 1896 O SER A 121 17.003 -7.627 -8.543 1.00 0.00 O ATOM 1897 CB SER A 121 18.412 -5.065 -8.258 1.00 0.00 C ATOM 1898 OG SER A 121 18.858 -3.780 -7.860 1.00 0.00 O ATOM 0 H SER A 121 18.702 -6.764 -6.275 1.00 0.00 H new ATOM 0 HA SER A 121 16.674 -4.755 -7.035 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.252 -5.759 -8.264 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.029 -5.021 -9.277 1.00 0.00 H new ATOM 0 HG SER A 121 19.556 -3.471 -8.475 1.00 0.00 H new ATOM 1904 N PHE A 122 15.167 -6.418 -8.064 1.00 0.00 N ATOM 1905 CA PHE A 122 14.250 -7.350 -8.712 1.00 0.00 C ATOM 1906 C PHE A 122 13.625 -6.727 -9.956 1.00 0.00 C ATOM 1907 O PHE A 122 13.665 -5.511 -10.142 1.00 0.00 O ATOM 1908 CB PHE A 122 13.153 -7.778 -7.737 1.00 0.00 C ATOM 1909 CG PHE A 122 13.672 -8.514 -6.534 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.436 -7.859 -5.581 1.00 0.00 C ATOM 1911 CD2 PHE A 122 13.396 -9.860 -6.357 1.00 0.00 C ATOM 1912 CE1 PHE A 122 14.915 -8.533 -4.474 1.00 0.00 C ATOM 1913 CE2 PHE A 122 13.872 -10.539 -5.251 1.00 0.00 C ATOM 1914 CZ PHE A 122 14.633 -9.875 -4.309 1.00 0.00 C ATOM 0 H PHE A 122 14.716 -5.604 -7.647 1.00 0.00 H new ATOM 0 HA PHE A 122 14.821 -8.227 -9.016 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.608 -6.894 -7.405 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.440 -8.414 -8.262 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.660 -6.810 -5.705 1.00 0.00 H new ATOM 0 HD2 PHE A 122 12.802 -10.385 -7.091 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.509 -8.011 -3.739 1.00 0.00 H new ATOM 0 HE2 PHE A 122 13.649 -11.588 -5.124 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.007 -10.404 -3.445 1.00 0.00 H new ATOM 1924 N GLU A 123 13.046 -7.570 -10.805 1.00 0.00 N ATOM 1925 CA GLU A 123 12.410 -7.103 -12.031 1.00 0.00 C ATOM 1926 C GLU A 123 11.001 -7.673 -12.163 1.00 0.00 C ATOM 1927 O GLU A 123 10.777 -8.861 -11.931 1.00 0.00 O ATOM 1928 CB GLU A 123 13.249 -7.498 -13.248 1.00 0.00 C ATOM 1929 CG GLU A 123 13.355 -9.001 -13.450 1.00 0.00 C ATOM 1930 CD GLU A 123 14.783 -9.461 -13.673 1.00 0.00 C ATOM 1931 OE1 GLU A 123 15.632 -9.208 -12.793 1.00 0.00 O ATOM 1932 OE2 GLU A 123 15.052 -10.074 -14.727 1.00 0.00 O ATOM 0 H GLU A 123 13.004 -8.580 -10.666 1.00 0.00 H new ATOM 0 HA GLU A 123 12.340 -6.016 -11.984 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.813 -7.049 -14.141 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.251 -7.083 -13.139 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.945 -9.511 -12.578 1.00 0.00 H new ATOM 0 HG3 GLU A 123 12.746 -9.293 -14.305 1.00 0.00 H new ATOM 1939 N GLY A 124 10.055 -6.817 -12.535 1.00 0.00 N ATOM 1940 CA GLY A 124 8.680 -7.254 -12.690 1.00 0.00 C ATOM 1941 C GLY A 124 7.906 -6.398 -13.674 1.00 0.00 C ATOM 1942 O GLY A 124 8.398 -6.092 -14.760 1.00 0.00 O ATOM 0 H GLY A 124 10.216 -5.829 -12.732 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.667 -8.291 -13.027 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.182 -7.228 -11.721 1.00 0.00 H new ATOM 1946 N ASP A 125 6.693 -6.012 -13.293 1.00 0.00 N ATOM 1947 CA ASP A 125 5.850 -5.188 -14.151 1.00 0.00 C ATOM 1948 C ASP A 125 5.041 -4.189 -13.328 1.00 0.00 C ATOM 1949 O ASP A 125 3.959 -3.767 -13.737 1.00 0.00 O ATOM 1950 CB ASP A 125 4.911 -6.070 -14.977 1.00 0.00 C ATOM 1951 CG ASP A 125 5.399 -6.260 -16.400 1.00 0.00 C ATOM 1952 OD1 ASP A 125 6.628 -6.223 -16.616 1.00 0.00 O ATOM 1953 OD2 ASP A 125 4.551 -6.445 -17.298 1.00 0.00 O ATOM 0 H ASP A 125 6.272 -6.256 -12.397 1.00 0.00 H new ATOM 0 HA ASP A 125 6.499 -4.629 -14.826 1.00 0.00 H new ATOM 0 HB2 ASP A 125 4.814 -7.043 -14.496 1.00 0.00 H new ATOM 0 HB3 ASP A 125 3.917 -5.622 -14.993 1.00 0.00 H new ATOM 1958 N THR A 126 5.570 -3.813 -12.168 1.00 0.00 N ATOM 1959 CA THR A 126 4.893 -2.861 -11.295 1.00 0.00 C ATOM 1960 C THR A 126 5.900 -2.019 -10.520 1.00 0.00 C ATOM 1961 O THR A 126 6.527 -2.497 -9.571 1.00 0.00 O ATOM 1962 CB THR A 126 3.968 -3.595 -10.324 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.546 -4.832 -10.870 1.00 0.00 O ATOM 1964 CG2 THR A 126 2.730 -2.802 -9.969 1.00 0.00 C ATOM 0 H THR A 126 6.463 -4.152 -11.811 1.00 0.00 H new ATOM 0 HA THR A 126 4.297 -2.196 -11.920 1.00 0.00 H new ATOM 0 HB THR A 126 4.557 -3.746 -9.419 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.956 -5.287 -10.233 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.115 -3.378 -9.277 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.022 -1.862 -9.500 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.159 -2.594 -10.874 1.00 0.00 H new ATOM 1972 N LYS A 127 6.047 -0.762 -10.935 1.00 0.00 N ATOM 1973 CA LYS A 127 6.978 0.161 -10.294 1.00 0.00 C ATOM 1974 C LYS A 127 6.255 1.419 -9.812 1.00 0.00 C ATOM 1975 O LYS A 127 5.174 1.751 -10.299 1.00 0.00 O ATOM 1976 CB LYS A 127 8.093 0.538 -11.274 1.00 0.00 C ATOM 1977 CG LYS A 127 9.253 1.285 -10.635 1.00 0.00 C ATOM 1978 CD LYS A 127 9.244 2.757 -11.015 1.00 0.00 C ATOM 1979 CE LYS A 127 10.382 3.514 -10.349 1.00 0.00 C ATOM 1980 NZ LYS A 127 10.605 4.845 -10.977 1.00 0.00 N ATOM 0 H LYS A 127 5.530 -0.359 -11.716 1.00 0.00 H new ATOM 0 HA LYS A 127 7.413 -0.335 -9.426 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.473 -0.370 -11.742 1.00 0.00 H new ATOM 0 HB3 LYS A 127 7.671 1.154 -12.068 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.197 1.188 -9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 127 10.194 0.833 -10.947 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.326 2.854 -12.098 1.00 0.00 H new ATOM 0 HD3 LYS A 127 8.292 3.202 -10.726 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.160 3.645 -9.290 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.297 2.925 -10.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 11.389 5.329 -10.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.842 4.719 -11.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.741 5.417 -10.894 1.00 0.00 H new ATOM 1994 N MET A 128 6.860 2.113 -8.850 1.00 0.00 N ATOM 1995 CA MET A 128 6.283 3.336 -8.291 1.00 0.00 C ATOM 1996 C MET A 128 5.832 4.295 -9.393 1.00 0.00 C ATOM 1997 O MET A 128 6.458 4.391 -10.448 1.00 0.00 O ATOM 1998 CB MET A 128 7.307 4.019 -7.369 1.00 0.00 C ATOM 1999 CG MET A 128 6.987 5.471 -7.017 1.00 0.00 C ATOM 2000 SD MET A 128 6.217 5.647 -5.396 1.00 0.00 S ATOM 2001 CE MET A 128 4.601 4.938 -5.701 1.00 0.00 C ATOM 0 H MET A 128 7.755 1.848 -8.439 1.00 0.00 H new ATOM 0 HA MET A 128 5.401 3.064 -7.711 1.00 0.00 H new ATOM 0 HB2 MET A 128 7.383 3.445 -6.446 1.00 0.00 H new ATOM 0 HB3 MET A 128 8.286 3.984 -7.848 1.00 0.00 H new ATOM 0 HG2 MET A 128 7.906 6.057 -7.043 1.00 0.00 H new ATOM 0 HG3 MET A 128 6.323 5.886 -7.776 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.925 5.210 -4.890 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.208 5.319 -6.644 1.00 0.00 H new ATOM 0 HE3 MET A 128 4.684 3.853 -5.755 1.00 0.00 H new ATOM 2011 N ILE A 129 4.744 5.012 -9.126 1.00 0.00 N ATOM 2012 CA ILE A 129 4.203 5.978 -10.075 1.00 0.00 C ATOM 2013 C ILE A 129 4.660 7.395 -9.723 1.00 0.00 C ATOM 2014 O ILE A 129 5.152 7.636 -8.622 1.00 0.00 O ATOM 2015 CB ILE A 129 2.662 5.932 -10.111 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.080 6.252 -8.732 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.184 4.569 -10.587 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.768 7.718 -8.533 1.00 0.00 C ATOM 0 H ILE A 129 4.218 4.941 -8.255 1.00 0.00 H new ATOM 0 HA ILE A 129 4.582 5.709 -11.061 1.00 0.00 H new ATOM 0 HB ILE A 129 2.312 6.688 -10.814 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.168 5.672 -8.588 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.786 5.932 -7.966 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.094 4.552 -10.607 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.568 4.378 -11.589 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.546 3.798 -9.907 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.359 7.871 -7.534 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.681 8.303 -8.645 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.038 8.039 -9.277 1.00 0.00 H new ATOM 2030 N PRO A 130 4.513 8.351 -10.658 1.00 0.00 N ATOM 2031 CA PRO A 130 4.923 9.747 -10.439 1.00 0.00 C ATOM 2032 C PRO A 130 4.188 10.404 -9.272 1.00 0.00 C ATOM 2033 O PRO A 130 2.978 10.245 -9.120 1.00 0.00 O ATOM 2034 CB PRO A 130 4.558 10.444 -11.756 1.00 0.00 C ATOM 2035 CG PRO A 130 4.449 9.347 -12.758 1.00 0.00 C ATOM 2036 CD PRO A 130 3.948 8.151 -12.002 1.00 0.00 C ATOM 0 HA PRO A 130 5.980 9.815 -10.181 1.00 0.00 H new ATOM 0 HB2 PRO A 130 3.619 10.990 -11.666 1.00 0.00 H new ATOM 0 HB3 PRO A 130 5.321 11.167 -12.044 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.763 9.617 -13.561 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.415 9.141 -13.219 1.00 0.00 H new ATOM 0 HD2 PRO A 130 2.859 8.114 -11.981 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.290 7.218 -12.449 1.00 0.00 H new ATOM 2044 N LEU A 131 4.930 11.149 -8.454 1.00 0.00 N ATOM 2045 CA LEU A 131 4.349 11.837 -7.302 1.00 0.00 C ATOM 2046 C LEU A 131 5.006 13.199 -7.093 1.00 0.00 C ATOM 2047 O LEU A 131 6.168 13.399 -7.446 1.00 0.00 O ATOM 2048 CB LEU A 131 4.505 11.002 -6.022 1.00 0.00 C ATOM 2049 CG LEU A 131 4.688 9.492 -6.219 1.00 0.00 C ATOM 2050 CD1 LEU A 131 5.760 8.954 -5.282 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.371 8.764 -5.995 1.00 0.00 C ATOM 0 H LEU A 131 5.934 11.292 -8.567 1.00 0.00 H new ATOM 0 HA LEU A 131 3.288 11.976 -7.510 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.363 11.382 -5.467 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.625 11.162 -5.398 1.00 0.00 H new ATOM 0 HG LEU A 131 5.011 9.316 -7.245 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.874 7.881 -5.438 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.707 9.453 -5.487 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.468 9.142 -4.249 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.518 7.694 -6.139 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.021 8.949 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.629 9.127 -6.706 1.00 0.00 H new ATOM 2063 N ASN A 132 4.260 14.127 -6.500 1.00 0.00 N ATOM 2064 CA ASN A 132 4.780 15.462 -6.225 1.00 0.00 C ATOM 2065 C ASN A 132 5.697 15.422 -5.008 1.00 0.00 C ATOM 2066 O ASN A 132 5.322 15.850 -3.916 1.00 0.00 O ATOM 2067 CB ASN A 132 3.631 16.445 -5.990 1.00 0.00 C ATOM 2068 CG ASN A 132 3.918 17.818 -6.565 1.00 0.00 C ATOM 2069 OD1 ASN A 132 3.075 18.411 -7.238 1.00 0.00 O ATOM 2070 ND2 ASN A 132 5.114 18.331 -6.303 1.00 0.00 N ATOM 0 H ASN A 132 3.296 13.979 -6.202 1.00 0.00 H new ATOM 0 HA ASN A 132 5.352 15.800 -7.089 1.00 0.00 H new ATOM 0 HB2 ASN A 132 2.720 16.049 -6.439 1.00 0.00 H new ATOM 0 HB3 ASN A 132 3.446 16.534 -4.920 1.00 0.00 H new ATOM 0 HD21 ASN A 132 5.364 19.252 -6.664 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.783 17.805 -5.741 1.00 0.00 H new ATOM 2077 N TRP A 133 6.896 14.884 -5.204 1.00 0.00 N ATOM 2078 CA TRP A 133 7.872 14.756 -4.128 1.00 0.00 C ATOM 2079 C TRP A 133 8.146 16.090 -3.440 1.00 0.00 C ATOM 2080 O TRP A 133 8.237 16.149 -2.214 1.00 0.00 O ATOM 2081 CB TRP A 133 9.172 14.160 -4.667 1.00 0.00 C ATOM 2082 CG TRP A 133 9.006 12.756 -5.166 1.00 0.00 C ATOM 2083 CD1 TRP A 133 8.608 12.373 -6.414 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.224 11.550 -4.425 1.00 0.00 C ATOM 2085 NE1 TRP A 133 8.565 11.002 -6.495 1.00 0.00 N ATOM 2086 CE2 TRP A 133 8.941 10.474 -5.287 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.633 11.275 -3.117 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 9.053 9.146 -4.883 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 9.745 9.957 -2.717 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.456 8.907 -3.597 1.00 0.00 C ATOM 0 H TRP A 133 7.217 14.527 -6.104 1.00 0.00 H new ATOM 0 HA TRP A 133 7.449 14.086 -3.379 1.00 0.00 H new ATOM 0 HB2 TRP A 133 9.545 14.787 -5.477 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.926 14.174 -3.880 1.00 0.00 H new ATOM 0 HD1 TRP A 133 8.363 13.049 -7.220 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.297 10.465 -7.320 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.858 12.078 -2.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.830 8.334 -5.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.061 9.733 -1.709 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.553 7.888 -3.254 1.00 0.00 H new ATOM 2101 N ASP A 134 8.279 17.162 -4.218 1.00 0.00 N ATOM 2102 CA ASP A 134 8.544 18.481 -3.650 1.00 0.00 C ATOM 2103 C ASP A 134 7.481 18.857 -2.623 1.00 0.00 C ATOM 2104 O ASP A 134 7.791 19.401 -1.563 1.00 0.00 O ATOM 2105 CB ASP A 134 8.595 19.535 -4.759 1.00 0.00 C ATOM 2106 CG ASP A 134 9.776 20.474 -4.610 1.00 0.00 C ATOM 2107 OD1 ASP A 134 10.928 19.997 -4.685 1.00 0.00 O ATOM 2108 OD2 ASP A 134 9.549 21.687 -4.417 1.00 0.00 O ATOM 0 H ASP A 134 8.208 17.144 -5.235 1.00 0.00 H new ATOM 0 HA ASP A 134 9.510 18.445 -3.147 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.650 19.037 -5.727 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.671 20.113 -4.750 1.00 0.00 H new ATOM 2113 N ASP A 135 6.225 18.569 -2.949 1.00 0.00 N ATOM 2114 CA ASP A 135 5.111 18.883 -2.059 1.00 0.00 C ATOM 2115 C ASP A 135 5.073 17.945 -0.851 1.00 0.00 C ATOM 2116 O ASP A 135 4.215 18.084 0.020 1.00 0.00 O ATOM 2117 CB ASP A 135 3.788 18.799 -2.821 1.00 0.00 C ATOM 2118 CG ASP A 135 3.413 20.115 -3.475 1.00 0.00 C ATOM 2119 OD1 ASP A 135 4.256 20.676 -4.205 1.00 0.00 O ATOM 2120 OD2 ASP A 135 2.276 20.583 -3.257 1.00 0.00 O ATOM 0 H ASP A 135 5.952 18.119 -3.823 1.00 0.00 H new ATOM 0 HA ASP A 135 5.257 19.899 -1.693 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.860 18.025 -3.585 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.996 18.498 -2.136 1.00 0.00 H new ATOM 2125 N PHE A 136 6.004 16.993 -0.797 1.00 0.00 N ATOM 2126 CA PHE A 136 6.059 16.050 0.312 1.00 0.00 C ATOM 2127 C PHE A 136 7.427 16.082 0.987 1.00 0.00 C ATOM 2128 O PHE A 136 8.463 16.063 0.321 1.00 0.00 O ATOM 2129 CB PHE A 136 5.751 14.635 -0.179 1.00 0.00 C ATOM 2130 CG PHE A 136 4.303 14.422 -0.513 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.337 14.464 0.480 1.00 0.00 C ATOM 2132 CD2 PHE A 136 3.908 14.182 -1.819 1.00 0.00 C ATOM 2133 CE1 PHE A 136 2.004 14.270 0.176 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.575 13.987 -2.129 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.622 14.031 -1.130 1.00 0.00 C ATOM 0 H PHE A 136 6.725 16.857 -1.505 1.00 0.00 H new ATOM 0 HA PHE A 136 5.307 16.344 1.044 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.355 14.425 -1.062 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.048 13.920 0.588 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.630 14.650 1.503 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.650 14.147 -2.603 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.261 14.305 0.959 1.00 0.00 H new ATOM 0 HE2 PHE A 136 2.279 13.801 -3.151 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.580 13.879 -1.370 1.00 0.00 H new ATOM 2145 N THR A 137 7.417 16.142 2.314 1.00 0.00 N ATOM 2146 CA THR A 137 8.652 16.190 3.089 1.00 0.00 C ATOM 2147 C THR A 137 8.815 14.931 3.933 1.00 0.00 C ATOM 2148 O THR A 137 7.836 14.368 4.423 1.00 0.00 O ATOM 2149 CB THR A 137 8.663 17.429 3.989 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.638 18.612 3.211 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.871 17.502 4.898 1.00 0.00 C ATOM 0 H THR A 137 6.566 16.159 2.876 1.00 0.00 H new ATOM 0 HA THR A 137 9.488 16.247 2.392 1.00 0.00 H new ATOM 0 HB THR A 137 7.770 17.343 4.608 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.644 19.393 3.803 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.814 18.404 5.507 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.891 16.627 5.547 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.779 17.528 4.295 1.00 0.00 H new ATOM 2159 N LYS A 138 10.060 14.493 4.093 1.00 0.00 N ATOM 2160 CA LYS A 138 10.355 13.298 4.870 1.00 0.00 C ATOM 2161 C LYS A 138 10.087 13.525 6.352 1.00 0.00 C ATOM 2162 O LYS A 138 10.714 14.374 6.985 1.00 0.00 O ATOM 2163 CB LYS A 138 11.807 12.873 4.664 1.00 0.00 C ATOM 2164 CG LYS A 138 12.090 11.460 5.144 1.00 0.00 C ATOM 2165 CD LYS A 138 12.777 10.630 4.072 1.00 0.00 C ATOM 2166 CE LYS A 138 14.287 10.805 4.113 1.00 0.00 C ATOM 2167 NZ LYS A 138 14.924 10.432 2.820 1.00 0.00 N ATOM 0 H LYS A 138 10.880 14.949 3.694 1.00 0.00 H new ATOM 0 HA LYS A 138 9.697 12.503 4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 138 12.054 12.946 3.605 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.461 13.567 5.192 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.718 11.497 6.034 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.155 10.980 5.433 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.528 9.578 4.210 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.403 10.920 3.090 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.526 11.842 4.350 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.702 10.191 4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.946 10.302 2.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 14.507 9.545 2.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.764 11.188 2.124 1.00 0.00 H new ATOM 2181 N VAL A 139 9.155 12.754 6.899 1.00 0.00 N ATOM 2182 CA VAL A 139 8.808 12.863 8.310 1.00 0.00 C ATOM 2183 C VAL A 139 9.740 12.009 9.158 1.00 0.00 C ATOM 2184 O VAL A 139 10.025 12.338 10.309 1.00 0.00 O ATOM 2185 CB VAL A 139 7.353 12.429 8.588 1.00 0.00 C ATOM 2186 CG1 VAL A 139 6.794 13.179 9.787 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.476 12.643 7.364 1.00 0.00 C ATOM 0 H VAL A 139 8.627 12.047 6.387 1.00 0.00 H new ATOM 0 HA VAL A 139 8.914 13.915 8.575 1.00 0.00 H new ATOM 0 HB VAL A 139 7.355 11.363 8.817 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.767 12.861 9.969 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.402 12.964 10.666 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.812 14.250 9.587 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.456 12.329 7.588 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.480 13.699 7.094 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.863 12.054 6.532 1.00 0.00 H new ATOM 2197 N SER A 140 10.211 10.907 8.582 1.00 0.00 N ATOM 2198 CA SER A 140 11.112 10.009 9.296 1.00 0.00 C ATOM 2199 C SER A 140 11.816 9.053 8.339 1.00 0.00 C ATOM 2200 O SER A 140 11.432 8.924 7.177 1.00 0.00 O ATOM 2201 CB SER A 140 10.338 9.216 10.353 1.00 0.00 C ATOM 2202 OG SER A 140 10.854 9.457 11.650 1.00 0.00 O ATOM 0 H SER A 140 9.986 10.616 7.631 1.00 0.00 H new ATOM 0 HA SER A 140 11.872 10.617 9.786 1.00 0.00 H new ATOM 0 HB2 SER A 140 9.284 9.493 10.320 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.395 8.151 10.127 1.00 0.00 H new ATOM 0 HG SER A 140 10.342 8.941 12.307 1.00 0.00 H new ATOM 2208 N SER A 141 12.851 8.386 8.840 1.00 0.00 N ATOM 2209 CA SER A 141 13.614 7.439 8.036 1.00 0.00 C ATOM 2210 C SER A 141 14.403 6.485 8.928 1.00 0.00 C ATOM 2211 O SER A 141 15.193 6.915 9.769 1.00 0.00 O ATOM 2212 CB SER A 141 14.565 8.184 7.098 1.00 0.00 C ATOM 2213 OG SER A 141 15.152 7.300 6.158 1.00 0.00 O ATOM 0 H SER A 141 13.181 8.484 9.800 1.00 0.00 H new ATOM 0 HA SER A 141 12.912 6.856 7.440 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.021 8.969 6.573 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.347 8.672 7.680 1.00 0.00 H new ATOM 0 HG SER A 141 15.754 7.801 5.569 1.00 0.00 H new ATOM 2219 N ARG A 142 14.184 5.188 8.738 1.00 0.00 N ATOM 2220 CA ARG A 142 14.875 4.171 9.523 1.00 0.00 C ATOM 2221 C ARG A 142 15.395 3.055 8.625 1.00 0.00 C ATOM 2222 O ARG A 142 14.636 2.450 7.868 1.00 0.00 O ATOM 2223 CB ARG A 142 13.939 3.593 10.586 1.00 0.00 C ATOM 2224 CG ARG A 142 14.665 2.844 11.693 1.00 0.00 C ATOM 2225 CD ARG A 142 14.202 3.292 13.070 1.00 0.00 C ATOM 2226 NE ARG A 142 14.402 4.724 13.276 1.00 0.00 N ATOM 2227 CZ ARG A 142 14.423 5.306 14.473 1.00 0.00 C ATOM 2228 NH1 ARG A 142 14.257 4.583 15.574 1.00 0.00 N ATOM 2229 NH2 ARG A 142 14.611 6.615 14.570 1.00 0.00 N ATOM 0 H ARG A 142 13.533 4.816 8.047 1.00 0.00 H new ATOM 0 HA ARG A 142 15.725 4.642 10.017 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.359 4.404 11.027 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.230 2.918 10.106 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.493 1.773 11.582 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.739 3.006 11.599 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.146 3.052 13.193 1.00 0.00 H new ATOM 0 HD3 ARG A 142 14.746 2.736 13.834 1.00 0.00 H new ATOM 0 HE ARG A 142 14.533 5.313 12.454 1.00 0.00 H new ATOM 0 HH11 ARG A 142 14.112 3.576 15.506 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.274 5.035 16.488 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.739 7.176 13.728 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.627 7.061 15.487 1.00 0.00 H new ATOM 2243 N THR A 143 16.694 2.789 8.710 1.00 0.00 N ATOM 2244 CA THR A 143 17.314 1.748 7.899 1.00 0.00 C ATOM 2245 C THR A 143 17.387 0.427 8.658 1.00 0.00 C ATOM 2246 O THR A 143 18.222 0.255 9.546 1.00 0.00 O ATOM 2247 CB THR A 143 18.716 2.177 7.466 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.689 3.469 6.888 1.00 0.00 O ATOM 2249 CG2 THR A 143 19.344 1.236 6.460 1.00 0.00 C ATOM 0 H THR A 143 17.337 3.279 9.332 1.00 0.00 H new ATOM 0 HA THR A 143 16.694 1.600 7.014 1.00 0.00 H new ATOM 0 HB THR A 143 19.317 2.165 8.376 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.596 3.726 6.619 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.337 1.598 6.194 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.425 0.240 6.895 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.723 1.192 5.565 1.00 0.00 H new ATOM 2257 N VAL A 144 16.512 -0.505 8.295 1.00 0.00 N ATOM 2258 CA VAL A 144 16.481 -1.815 8.933 1.00 0.00 C ATOM 2259 C VAL A 144 17.163 -2.856 8.053 1.00 0.00 C ATOM 2260 O VAL A 144 16.860 -2.971 6.866 1.00 0.00 O ATOM 2261 CB VAL A 144 15.037 -2.268 9.222 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.032 -3.542 10.051 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.262 -1.163 9.923 1.00 0.00 C ATOM 0 H VAL A 144 15.815 -0.377 7.562 1.00 0.00 H new ATOM 0 HA VAL A 144 17.016 -1.726 9.878 1.00 0.00 H new ATOM 0 HB VAL A 144 14.545 -2.479 8.273 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.003 -3.846 10.245 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.548 -4.333 9.506 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.542 -3.362 10.998 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.244 -1.500 10.119 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.751 -0.917 10.866 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.234 -0.278 9.287 1.00 0.00 H new ATOM 2273 N GLU A 145 18.089 -3.610 8.635 1.00 0.00 N ATOM 2274 CA GLU A 145 18.810 -4.634 7.889 1.00 0.00 C ATOM 2275 C GLU A 145 18.678 -5.999 8.554 1.00 0.00 C ATOM 2276 O GLU A 145 18.631 -6.107 9.779 1.00 0.00 O ATOM 2277 CB GLU A 145 20.287 -4.257 7.760 1.00 0.00 C ATOM 2278 CG GLU A 145 20.954 -3.945 9.087 1.00 0.00 C ATOM 2279 CD GLU A 145 22.095 -4.892 9.407 1.00 0.00 C ATOM 2280 OE1 GLU A 145 22.916 -5.158 8.504 1.00 0.00 O ATOM 2281 OE2 GLU A 145 22.166 -5.368 10.559 1.00 0.00 O ATOM 0 H GLU A 145 18.357 -3.532 9.616 1.00 0.00 H new ATOM 0 HA GLU A 145 18.368 -4.695 6.895 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.821 -5.076 7.278 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.376 -3.390 7.106 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.331 -2.922 9.068 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.211 -3.996 9.883 1.00 0.00 H new ATOM 2288 N ASP A 146 18.622 -7.039 7.730 1.00 0.00 N ATOM 2289 CA ASP A 146 18.499 -8.405 8.221 1.00 0.00 C ATOM 2290 C ASP A 146 19.811 -9.160 8.036 1.00 0.00 C ATOM 2291 O ASP A 146 20.797 -8.599 7.559 1.00 0.00 O ATOM 2292 CB ASP A 146 17.372 -9.129 7.482 1.00 0.00 C ATOM 2293 CG ASP A 146 16.029 -8.955 8.163 1.00 0.00 C ATOM 2294 OD1 ASP A 146 15.806 -7.888 8.772 1.00 0.00 O ATOM 2295 OD2 ASP A 146 15.199 -9.885 8.086 1.00 0.00 O ATOM 0 H ASP A 146 18.660 -6.960 6.714 1.00 0.00 H new ATOM 0 HA ASP A 146 18.264 -8.370 9.285 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.310 -8.752 6.461 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.608 -10.191 7.416 1.00 0.00 H new ATOM 2300 N THR A 147 19.817 -10.437 8.408 1.00 0.00 N ATOM 2301 CA THR A 147 21.014 -11.259 8.269 1.00 0.00 C ATOM 2302 C THR A 147 21.448 -11.320 6.809 1.00 0.00 C ATOM 2303 O THR A 147 22.630 -11.187 6.494 1.00 0.00 O ATOM 2304 CB THR A 147 20.759 -12.672 8.800 1.00 0.00 C ATOM 2305 OG1 THR A 147 19.392 -13.025 8.657 1.00 0.00 O ATOM 2306 CG2 THR A 147 21.133 -12.840 10.258 1.00 0.00 C ATOM 0 H THR A 147 19.012 -10.922 8.805 1.00 0.00 H new ATOM 0 HA THR A 147 21.813 -10.805 8.855 1.00 0.00 H new ATOM 0 HB THR A 147 21.396 -13.325 8.203 1.00 0.00 H new ATOM 0 HG1 THR A 147 19.251 -13.932 9.001 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.927 -13.864 10.571 1.00 0.00 H new ATOM 0 HG22 THR A 147 22.194 -12.627 10.388 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.547 -12.150 10.866 1.00 0.00 H new ATOM 2314 N ASN A 148 20.477 -11.517 5.923 1.00 0.00 N ATOM 2315 CA ASN A 148 20.750 -11.589 4.493 1.00 0.00 C ATOM 2316 C ASN A 148 21.009 -10.193 3.925 1.00 0.00 C ATOM 2317 O ASN A 148 20.241 -9.264 4.176 1.00 0.00 O ATOM 2318 CB ASN A 148 19.575 -12.240 3.761 1.00 0.00 C ATOM 2319 CG ASN A 148 19.652 -13.754 3.775 1.00 0.00 C ATOM 2320 OD1 ASN A 148 20.727 -14.334 3.621 1.00 0.00 O ATOM 2321 ND2 ASN A 148 18.508 -14.403 3.961 1.00 0.00 N ATOM 0 H ASN A 148 19.494 -11.630 6.171 1.00 0.00 H new ATOM 0 HA ASN A 148 21.642 -12.198 4.344 1.00 0.00 H new ATOM 0 HB2 ASN A 148 18.641 -11.922 4.224 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.554 -11.890 2.729 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.498 -15.423 3.980 1.00 0.00 H new ATOM 0 HD22 ASN A 148 17.640 -13.882 4.084 1.00 0.00 H new ATOM 2328 N PRO A 149 22.095 -10.023 3.150 1.00 0.00 N ATOM 2329 CA PRO A 149 22.439 -8.727 2.553 1.00 0.00 C ATOM 2330 C PRO A 149 21.307 -8.173 1.699 1.00 0.00 C ATOM 2331 O PRO A 149 21.074 -6.965 1.661 1.00 0.00 O ATOM 2332 CB PRO A 149 23.656 -9.042 1.678 1.00 0.00 C ATOM 2333 CG PRO A 149 24.231 -10.287 2.255 1.00 0.00 C ATOM 2334 CD PRO A 149 23.069 -11.070 2.793 1.00 0.00 C ATOM 0 HA PRO A 149 22.631 -7.969 3.312 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.367 -9.186 0.637 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.379 -8.227 1.699 1.00 0.00 H new ATOM 0 HG2 PRO A 149 24.767 -10.857 1.496 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.946 -10.057 3.045 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.667 -11.757 2.048 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.353 -11.668 3.659 1.00 0.00 H new ATOM 2342 N ALA A 150 20.610 -9.069 1.012 1.00 0.00 N ATOM 2343 CA ALA A 150 19.500 -8.680 0.150 1.00 0.00 C ATOM 2344 C ALA A 150 18.240 -8.371 0.957 1.00 0.00 C ATOM 2345 O ALA A 150 17.295 -7.777 0.437 1.00 0.00 O ATOM 2346 CB ALA A 150 19.217 -9.775 -0.867 1.00 0.00 C ATOM 0 H ALA A 150 20.794 -10.072 1.035 1.00 0.00 H new ATOM 0 HA ALA A 150 19.790 -7.769 -0.373 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.386 -9.473 -1.505 1.00 0.00 H new ATOM 0 HB2 ALA A 150 20.103 -9.941 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.958 -10.697 -0.346 1.00 0.00 H new ATOM 2352 N LEU A 151 18.226 -8.777 2.226 1.00 0.00 N ATOM 2353 CA LEU A 151 17.072 -8.540 3.088 1.00 0.00 C ATOM 2354 C LEU A 151 17.175 -7.198 3.814 1.00 0.00 C ATOM 2355 O LEU A 151 16.450 -6.949 4.777 1.00 0.00 O ATOM 2356 CB LEU A 151 16.924 -9.674 4.106 1.00 0.00 C ATOM 2357 CG LEU A 151 16.376 -10.989 3.544 1.00 0.00 C ATOM 2358 CD1 LEU A 151 16.017 -11.941 4.674 1.00 0.00 C ATOM 2359 CD2 LEU A 151 15.165 -10.733 2.658 1.00 0.00 C ATOM 0 H LEU A 151 18.997 -9.269 2.677 1.00 0.00 H new ATOM 0 HA LEU A 151 16.188 -8.510 2.451 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.899 -9.867 4.554 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.266 -9.338 4.907 1.00 0.00 H new ATOM 0 HG LEU A 151 17.153 -11.451 2.935 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.629 -12.871 4.257 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.906 -12.153 5.268 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.258 -11.483 5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.792 -11.680 2.269 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.383 -10.247 3.242 1.00 0.00 H new ATOM 0 HD23 LEU A 151 15.452 -10.088 1.827 1.00 0.00 H new ATOM 2371 N THR A 152 18.073 -6.336 3.350 1.00 0.00 N ATOM 2372 CA THR A 152 18.254 -5.023 3.957 1.00 0.00 C ATOM 2373 C THR A 152 17.328 -4.000 3.304 1.00 0.00 C ATOM 2374 O THR A 152 17.394 -3.774 2.095 1.00 0.00 O ATOM 2375 CB THR A 152 19.709 -4.571 3.827 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.593 -5.626 4.163 1.00 0.00 O ATOM 2377 CG2 THR A 152 20.051 -3.389 4.708 1.00 0.00 C ATOM 0 H THR A 152 18.686 -6.523 2.557 1.00 0.00 H new ATOM 0 HA THR A 152 18.003 -5.097 5.015 1.00 0.00 H new ATOM 0 HB THR A 152 19.826 -4.272 2.785 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.810 -6.140 3.357 1.00 0.00 H new ATOM 0 HG21 THR A 152 21.098 -3.121 4.566 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.420 -2.541 4.441 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.882 -3.652 5.752 1.00 0.00 H new ATOM 2385 N HIS A 153 16.462 -3.389 4.106 1.00 0.00 N ATOM 2386 CA HIS A 153 15.520 -2.395 3.597 1.00 0.00 C ATOM 2387 C HIS A 153 15.602 -1.100 4.400 1.00 0.00 C ATOM 2388 O HIS A 153 16.192 -1.061 5.479 1.00 0.00 O ATOM 2389 CB HIS A 153 14.081 -2.932 3.630 1.00 0.00 C ATOM 2390 CG HIS A 153 13.976 -4.397 3.925 1.00 0.00 C ATOM 2391 ND1 HIS A 153 13.247 -4.901 4.982 1.00 0.00 N ATOM 2392 CD2 HIS A 153 14.504 -5.471 3.291 1.00 0.00 C ATOM 2393 CE1 HIS A 153 13.332 -6.219 4.986 1.00 0.00 C ATOM 2394 NE2 HIS A 153 14.088 -6.589 3.970 1.00 0.00 N ATOM 0 H HIS A 153 16.392 -3.563 5.109 1.00 0.00 H new ATOM 0 HA HIS A 153 15.795 -2.186 2.563 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.517 -2.381 4.382 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.609 -2.732 2.668 1.00 0.00 H new ATOM 0 HD1 HIS A 153 12.723 -4.342 5.656 1.00 0.00 H new ATOM 0 HD2 HIS A 153 15.135 -5.451 2.415 1.00 0.00 H new ATOM 0 HE1 HIS A 153 12.863 -6.881 5.699 1.00 0.00 H new ATOM 2403 N THR A 154 15.002 -0.043 3.864 1.00 0.00 N ATOM 2404 CA THR A 154 15.002 1.254 4.529 1.00 0.00 C ATOM 2405 C THR A 154 13.595 1.842 4.573 1.00 0.00 C ATOM 2406 O THR A 154 12.953 2.020 3.538 1.00 0.00 O ATOM 2407 CB THR A 154 15.947 2.219 3.812 1.00 0.00 C ATOM 2408 OG1 THR A 154 17.231 1.641 3.656 1.00 0.00 O ATOM 2409 CG2 THR A 154 16.121 3.536 4.538 1.00 0.00 C ATOM 0 H THR A 154 14.510 -0.059 2.971 1.00 0.00 H new ATOM 0 HA THR A 154 15.349 1.109 5.552 1.00 0.00 H new ATOM 0 HB THR A 154 15.482 2.414 2.846 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.820 2.273 3.194 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.803 4.174 3.976 1.00 0.00 H new ATOM 0 HG22 THR A 154 15.154 4.031 4.630 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.531 3.353 5.531 1.00 0.00 H new ATOM 2417 N TYR A 155 13.122 2.142 5.778 1.00 0.00 N ATOM 2418 CA TYR A 155 11.792 2.712 5.958 1.00 0.00 C ATOM 2419 C TYR A 155 11.859 4.235 5.960 1.00 0.00 C ATOM 2420 O TYR A 155 12.746 4.824 6.577 1.00 0.00 O ATOM 2421 CB TYR A 155 11.174 2.216 7.267 1.00 0.00 C ATOM 2422 CG TYR A 155 10.339 0.966 7.110 1.00 0.00 C ATOM 2423 CD1 TYR A 155 10.912 -0.294 7.232 1.00 0.00 C ATOM 2424 CD2 TYR A 155 8.979 1.045 6.840 1.00 0.00 C ATOM 2425 CE1 TYR A 155 10.152 -1.440 7.089 1.00 0.00 C ATOM 2426 CE2 TYR A 155 8.212 -0.095 6.697 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.803 -1.335 6.822 1.00 0.00 C ATOM 2428 OH TYR A 155 8.043 -2.473 6.681 1.00 0.00 O ATOM 0 H TYR A 155 13.640 2.000 6.645 1.00 0.00 H new ATOM 0 HA TYR A 155 11.166 2.390 5.126 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.972 2.022 7.984 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.553 3.007 7.688 1.00 0.00 H new ATOM 0 HD1 TYR A 155 11.968 -0.379 7.442 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.513 2.014 6.740 1.00 0.00 H new ATOM 0 HE1 TYR A 155 10.612 -2.412 7.186 1.00 0.00 H new ATOM 0 HE2 TYR A 155 7.155 -0.016 6.488 1.00 0.00 H new ATOM 0 HH TYR A 155 7.855 -2.625 5.731 1.00 0.00 H new ATOM 2438 N GLU A 156 10.921 4.869 5.264 1.00 0.00 N ATOM 2439 CA GLU A 156 10.887 6.325 5.189 1.00 0.00 C ATOM 2440 C GLU A 156 9.461 6.854 5.295 1.00 0.00 C ATOM 2441 O GLU A 156 8.526 6.269 4.744 1.00 0.00 O ATOM 2442 CB GLU A 156 11.522 6.801 3.881 1.00 0.00 C ATOM 2443 CG GLU A 156 12.965 6.357 3.709 1.00 0.00 C ATOM 2444 CD GLU A 156 13.503 6.649 2.321 1.00 0.00 C ATOM 2445 OE1 GLU A 156 13.606 7.841 1.963 1.00 0.00 O ATOM 2446 OE2 GLU A 156 13.820 5.685 1.593 1.00 0.00 O ATOM 0 H GLU A 156 10.178 4.400 4.746 1.00 0.00 H new ATOM 0 HA GLU A 156 11.457 6.716 6.032 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.933 6.427 3.044 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.478 7.889 3.840 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.587 6.860 4.449 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.038 5.287 3.906 1.00 0.00 H new ATOM 2453 N VAL A 157 9.307 7.971 6.000 1.00 0.00 N ATOM 2454 CA VAL A 157 8.002 8.597 6.178 1.00 0.00 C ATOM 2455 C VAL A 157 7.941 9.928 5.436 1.00 0.00 C ATOM 2456 O VAL A 157 8.943 10.636 5.335 1.00 0.00 O ATOM 2457 CB VAL A 157 7.675 8.833 7.665 1.00 0.00 C ATOM 2458 CG1 VAL A 157 6.198 9.157 7.841 1.00 0.00 C ATOM 2459 CG2 VAL A 157 8.065 7.622 8.500 1.00 0.00 C ATOM 0 H VAL A 157 10.074 8.463 6.459 1.00 0.00 H new ATOM 0 HA VAL A 157 7.262 7.910 5.767 1.00 0.00 H new ATOM 0 HB VAL A 157 8.257 9.686 8.014 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.985 9.321 8.897 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.953 10.057 7.278 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.597 8.325 7.474 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.826 7.809 9.547 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.514 6.748 8.153 1.00 0.00 H new ATOM 0 HG23 VAL A 157 9.135 7.440 8.399 1.00 0.00 H new ATOM 2469 N TRP A 158 6.754 10.262 4.938 1.00 0.00 N ATOM 2470 CA TRP A 158 6.551 11.513 4.210 1.00 0.00 C ATOM 2471 C TRP A 158 5.168 12.098 4.475 1.00 0.00 C ATOM 2472 O TRP A 158 4.169 11.382 4.472 1.00 0.00 O ATOM 2473 CB TRP A 158 6.732 11.298 2.705 1.00 0.00 C ATOM 2474 CG TRP A 158 8.071 10.741 2.328 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.535 9.480 2.571 1.00 0.00 C ATOM 2476 CD2 TRP A 158 9.118 11.427 1.631 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.808 9.341 2.072 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.187 10.522 1.489 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.255 12.718 1.114 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.376 10.869 0.851 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.435 13.061 0.481 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.481 12.139 0.354 1.00 0.00 C ATOM 0 H TRP A 158 5.918 9.685 5.025 1.00 0.00 H new ATOM 0 HA TRP A 158 7.300 12.219 4.569 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.955 10.622 2.348 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.587 12.249 2.192 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.982 8.705 3.081 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.378 8.497 2.127 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.453 13.435 1.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.185 10.161 0.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.552 14.056 0.078 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.390 12.437 -0.147 1.00 0.00 H new ATOM 2493 N GLN A 159 5.122 13.410 4.693 1.00 0.00 N ATOM 2494 CA GLN A 159 3.864 14.104 4.949 1.00 0.00 C ATOM 2495 C GLN A 159 3.837 15.444 4.221 1.00 0.00 C ATOM 2496 O GLN A 159 4.794 16.215 4.289 1.00 0.00 O ATOM 2497 CB GLN A 159 3.665 14.322 6.451 1.00 0.00 C ATOM 2498 CG GLN A 159 2.663 13.365 7.076 1.00 0.00 C ATOM 2499 CD GLN A 159 1.282 13.975 7.212 1.00 0.00 C ATOM 2500 OE1 GLN A 159 0.878 14.258 8.445 1.00 0.00 O flip ATOM 2501 NE2 GLN A 159 0.586 14.191 6.220 1.00 0.00 N flip ATOM 0 H GLN A 159 5.944 14.014 4.697 1.00 0.00 H new ATOM 0 HA GLN A 159 3.050 13.483 4.575 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.625 14.212 6.956 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.332 15.346 6.620 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.599 12.463 6.468 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.021 13.062 8.060 1.00 0.00 H new ATOM 0 HE21 GLN A 159 0.936 13.958 5.291 1.00 0.00 H new ATOM 0 HE22 GLN A 159 -0.341 14.603 6.327 1.00 0.00 H new ATOM 2510 N LYS A 160 2.741 15.716 3.519 1.00 0.00 N ATOM 2511 CA LYS A 160 2.602 16.962 2.775 1.00 0.00 C ATOM 2512 C LYS A 160 2.737 18.169 3.697 1.00 0.00 C ATOM 2513 O LYS A 160 2.220 18.173 4.815 1.00 0.00 O ATOM 2514 CB LYS A 160 1.251 17.004 2.059 1.00 0.00 C ATOM 2515 CG LYS A 160 1.306 17.670 0.694 1.00 0.00 C ATOM 2516 CD LYS A 160 -0.086 17.883 0.122 1.00 0.00 C ATOM 2517 CE LYS A 160 -0.111 17.653 -1.381 1.00 0.00 C ATOM 2518 NZ LYS A 160 -1.409 17.080 -1.833 1.00 0.00 N ATOM 0 H LYS A 160 1.938 15.091 3.450 1.00 0.00 H new ATOM 0 HA LYS A 160 3.402 17.003 2.035 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.879 15.986 1.943 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.534 17.536 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.817 18.629 0.776 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.891 17.054 0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.788 17.204 0.607 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.420 18.897 0.342 1.00 0.00 H new ATOM 0 HE2 LYS A 160 0.068 18.597 -1.896 1.00 0.00 H new ATOM 0 HE3 LYS A 160 0.700 16.979 -1.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -1.386 16.938 -2.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.569 16.167 -1.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.180 17.734 -1.591 1.00 0.00 H new ATOM 2532 N LYS A 161 3.436 19.193 3.218 1.00 0.00 N ATOM 2533 CA LYS A 161 3.644 20.410 3.995 1.00 0.00 C ATOM 2534 C LYS A 161 2.312 21.042 4.386 1.00 0.00 C ATOM 2535 O LYS A 161 1.399 21.147 3.567 1.00 0.00 O ATOM 2536 CB LYS A 161 4.481 21.411 3.196 1.00 0.00 C ATOM 2537 CG LYS A 161 5.901 20.940 2.928 1.00 0.00 C ATOM 2538 CD LYS A 161 6.741 22.035 2.289 1.00 0.00 C ATOM 2539 CE LYS A 161 6.853 23.253 3.192 1.00 0.00 C ATOM 2540 NZ LYS A 161 6.222 24.456 2.583 1.00 0.00 N ATOM 0 H LYS A 161 3.869 19.204 2.294 1.00 0.00 H new ATOM 0 HA LYS A 161 4.179 20.143 4.906 1.00 0.00 H new ATOM 0 HB2 LYS A 161 3.987 21.607 2.245 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.517 22.356 3.738 1.00 0.00 H new ATOM 0 HG2 LYS A 161 6.363 20.625 3.863 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.879 20.069 2.274 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.737 21.650 2.071 1.00 0.00 H new ATOM 0 HD3 LYS A 161 6.297 22.327 1.337 1.00 0.00 H new ATOM 0 HE2 LYS A 161 6.378 23.040 4.150 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.904 23.458 3.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 6.320 25.264 3.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 6.691 24.675 1.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 5.213 24.270 2.412 1.00 0.00 H new ATOM 2554 N ALA A 162 2.209 21.462 5.643 1.00 0.00 N ATOM 2555 CA ALA A 162 0.990 22.084 6.143 1.00 0.00 C ATOM 2556 C ALA A 162 -0.200 21.138 6.019 1.00 0.00 C ATOM 2557 O ALA A 162 -0.896 21.198 4.984 1.00 0.00 O ATOM 2558 CB ALA A 162 0.716 23.381 5.397 1.00 0.00 C ATOM 2559 OXT ALA A 162 -0.425 20.345 6.957 1.00 0.00 O ATOM 0 H ALA A 162 2.956 21.382 6.333 1.00 0.00 H new ATOM 0 HA ALA A 162 1.133 22.309 7.200 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.198 23.835 5.780 1.00 0.00 H new ATOM 0 HB2 ALA A 162 1.551 24.067 5.541 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.598 23.171 4.334 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -4.560 -3.050 -11.836 1.00 0.00 P HETATM 2567 O1A NDP A 170 -5.868 -3.690 -11.599 1.00 0.00 O HETATM 2568 O2A NDP A 170 -4.233 -2.656 -13.220 1.00 0.00 O HETATM 2569 O5B NDP A 170 -4.303 -1.854 -10.814 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.370 -1.334 -9.995 1.00 0.00 C HETATM 2571 C4B NDP A 170 -6.644 -1.230 -10.799 1.00 0.00 C HETATM 2572 O4B NDP A 170 -7.740 -0.864 -9.920 1.00 0.00 O HETATM 2573 C3B NDP A 170 -6.649 -0.167 -11.885 1.00 0.00 C HETATM 2574 O3B NDP A 170 -6.071 -0.669 -13.093 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.137 0.118 -12.040 1.00 0.00 C HETATM 2576 O2B NDP A 170 -8.816 -0.841 -12.828 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.606 0.039 -10.586 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.533 1.321 -9.887 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.424 1.889 -9.311 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.656 3.052 -8.751 1.00 0.00 N HETATM 2581 C5A NDP A 170 -9.010 3.263 -8.973 1.00 0.00 C HETATM 2582 C6A NDP A 170 -9.875 4.318 -8.624 1.00 0.00 C HETATM 2583 N6A NDP A 170 -9.486 5.404 -7.952 1.00 0.00 N HETATM 2584 N1A NDP A 170 -11.172 4.218 -8.996 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.563 3.128 -9.672 1.00 0.00 C HETATM 2586 N3A NDP A 170 -10.845 2.073 -10.057 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.563 2.204 -9.672 1.00 0.00 C HETATM 2588 O3 NDP A 170 -3.381 -4.068 -11.294 1.00 0.00 O HETATM 2589 PN NDP A 170 -1.759 -3.946 -11.028 1.00 0.00 P HETATM 2590 O1N NDP A 170 -1.064 -4.844 -11.972 1.00 0.00 O HETATM 2591 O2N NDP A 170 -1.391 -2.517 -11.049 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.738 -4.531 -9.546 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.810 -4.030 -8.567 1.00 0.00 C HETATM 2594 C4D NDP A 170 0.380 -4.952 -8.457 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.351 -4.383 -7.539 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.093 -6.334 -7.894 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.355 -7.223 -8.922 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.457 -6.748 -7.356 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.336 -7.251 -8.362 1.00 0.00 O HETATM 2600 C1D NDP A 170 1.984 -5.420 -6.809 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.697 -5.218 -5.389 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.524 -5.054 -4.364 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.199 -4.851 -3.127 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.382 -4.697 -2.328 1.00 0.00 C HETATM 2605 O7N NDP A 170 2.924 -4.394 -1.132 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.694 -4.762 -2.663 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.734 -4.797 -2.790 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.218 -4.968 -3.857 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.172 -5.181 -5.170 1.00 0.00 C HETATM 2610 P2B NDP A 170 -8.505 -1.286 -14.409 1.00 0.00 P HETATM 2611 O1X NDP A 170 -7.548 -0.086 -14.781 1.00 0.00 O HETATM 2612 O2X NDP A 170 -7.675 -2.549 -14.182 1.00 0.00 O HETATM 2613 O3X NDP A 170 -9.877 -1.053 -15.037 1.00 0.00 O HETATM 0 HO3N NDP A 170 -0.975 -6.751 -9.516 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -6.411 -0.157 -13.856 1.00 0.00 H new HETATM 0 HO2N NDP A 170 2.129 -6.826 -9.220 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.410 -4.624 -1.950 1.00 0.00 H new HETATM 0 H71N NDP A 170 4.965 -4.948 -3.628 1.00 0.00 H new HETATM 0 H62A NDP A 170 -10.162 6.135 -7.729 1.00 0.00 H new HETATM 0 H61A NDP A 170 -8.513 5.503 -7.662 1.00 0.00 H new HETATM 0 H52N NDP A 170 -0.480 -3.030 -8.847 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.527 -1.984 -9.134 1.00 0.00 H new HETATM 0 H51N NDP A 170 -1.303 -3.944 -7.599 1.00 0.00 H new HETATM 0 H51A NDP A 170 -5.095 -0.353 -9.607 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.536 -5.565 -2.042 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.536 -3.834 -2.319 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.441 1.417 -9.318 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.543 -5.312 -5.983 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.282 -4.929 -3.624 1.00 0.00 H new HETATM 0 H4D NDP A 170 0.722 -5.055 -9.487 1.00 0.00 H new HETATM 0 H4B NDP A 170 -6.739 -2.209 -11.268 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.695 -6.351 -7.142 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.063 0.721 -11.647 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.590 -5.094 -4.587 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.390 -7.561 -6.633 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.333 1.061 -12.550 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.618 3.101 -9.946 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.069 -5.422 -6.917 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.650 -0.275 -10.583 1.00 0.00 H new