USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 798 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 21 ASN : amide:sc= -0.0017 K(o=-0.84,f=-3.9) USER MOD Set 1.2: C 49 LYS NZ :NH3+ -165:sc= 1.19 (180deg=0) USER MOD Set 1.3: C 52 ASN : amide:sc= -2.03! K(o=-0.84!,f=-3.9) USER MOD Set 2.1: C 39 SER OG : rot 180:sc= 0 USER MOD Set 2.2: C 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: B 23 ASN : amide:sc=-0.00936 K(o=-0.035,f=-0.59) USER MOD Set 3.2: B 55 GLN : amide:sc= -0.0261 X(o=-0.035,f=-0.24) USER MOD Set 4.1: A 18 HIS : no HE2:sc= -0.0228 X(o=-2.9,f=-3.4) USER MOD Set 4.2: A 22 ASN : amide:sc= -2.93! C(o=-2.9!,f=-9.9!) USER MOD Set 5.1: A 14 ASN : amide:sc= -2.28! C(o=-3.7!,f=-5.8!) USER MOD Set 5.2: A 28 SER OG : rot -110:sc= -1.37 USER MOD Single : A 10 GLN :FLIP amide:sc= 0.333 F(o=-1.4,f=0.33) USER MOD Single : A 19 SER OG : rot 80:sc= 0.821 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 83:sc= 0.0548 USER MOD Single : A 30 THR OG1 : rot 45:sc= 0.0746 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= -2.06! K(o=-2.1!,f=-3.1) USER MOD Single : B 26 GLN : amide:sc= 0.807 K(o=0.81,f=-5.2!) USER MOD Single : B 32 HIS : no HD1:sc= -0.352 X(o=-0.35,f=0) USER MOD Single : B 33 SER OG : rot 87:sc= 1.27 USER MOD Single : B 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN :FLIP amide:sc= 0 F(o=-1.8!,f=0) USER MOD Single : B 41 SER OG : rot -74:sc= 1.19 USER MOD Single : B 43 ASN : amide:sc= -0.0476 X(o=-0.048,f=0) USER MOD Single : B 49 LYS NZ :NH3+ -135:sc= -0.427 (180deg=-2.32!) USER MOD Single : B 50 LYS NZ :NH3+ 167:sc= 1.13 (180deg=0.882) USER MOD Single : B 52 ASN : amide:sc= -0.817 K(o=-0.82,f=-1.7) USER MOD Single : C 18 TYR OH : rot 180:sc= 0 USER MOD Single : C 23 ASN : amide:sc= -1.82 K(o=-1.8,f=-3.3!) USER MOD Single : C 26 GLN : amide:sc= -0.188 K(o=-0.19,f=-0.78) USER MOD Single : C 32 HIS : no HD1:sc= 0.996 K(o=1,f=-5.1!) USER MOD Single : C 33 SER OG : rot 71:sc= 1.32 USER MOD Single : C 35 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : C 41 SER OG : rot 180:sc= 0 USER MOD Single : C 43 ASN : amide:sc= -0.0288 X(o=-0.029,f=0) USER MOD Single : C 50 LYS NZ :NH3+ -179:sc= 0.415 (180deg=0.378) USER MOD Single : C 55 GLN : amide:sc= -0.072 K(o=-0.072,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 10 15.793 -11.414 -0.024 1.00 0.00 N ATOM 2 CA GLN A 10 15.132 -10.157 -0.432 1.00 0.00 C ATOM 3 C GLN A 10 14.414 -9.531 0.744 1.00 0.00 C ATOM 4 O GLN A 10 14.394 -10.077 1.848 1.00 0.00 O ATOM 5 CB GLN A 10 14.114 -10.388 -1.558 1.00 0.00 C ATOM 6 CG GLN A 10 14.705 -10.489 -2.960 1.00 0.00 C ATOM 7 CD GLN A 10 15.386 -11.817 -3.256 1.00 0.00 C ATOM 8 OE1 GLN A 10 15.350 -12.225 -4.512 1.00 0.00 O flip ATOM 9 NE2 GLN A 10 15.934 -12.473 -2.373 1.00 0.00 N flip ATOM 0 HA GLN A 10 15.915 -9.491 -0.795 1.00 0.00 H new ATOM 0 HB2 GLN A 10 13.565 -11.305 -1.346 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.391 -9.573 -1.544 1.00 0.00 H new ATOM 0 HG2 GLN A 10 13.911 -10.331 -3.689 1.00 0.00 H new ATOM 0 HG3 GLN A 10 15.428 -9.685 -3.096 1.00 0.00 H new ATOM 0 HE21 GLN A 10 15.943 -12.128 -1.413 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.379 -13.362 -2.600 1.00 0.00 H new ATOM 18 N ARG A 11 13.826 -8.383 0.484 1.00 0.00 N ATOM 19 CA ARG A 11 13.022 -7.678 1.457 1.00 0.00 C ATOM 20 C ARG A 11 11.797 -7.105 0.760 1.00 0.00 C ATOM 21 O ARG A 11 11.889 -6.581 -0.349 1.00 0.00 O ATOM 22 CB ARG A 11 13.836 -6.569 2.103 1.00 0.00 C ATOM 23 CG ARG A 11 14.219 -5.504 1.117 1.00 0.00 C ATOM 24 CD ARG A 11 14.951 -4.349 1.775 1.00 0.00 C ATOM 25 NE ARG A 11 16.163 -4.794 2.462 1.00 0.00 N ATOM 26 CZ ARG A 11 17.394 -4.382 2.156 1.00 0.00 C ATOM 27 NH1 ARG A 11 17.596 -3.558 1.134 1.00 0.00 N ATOM 28 NH2 ARG A 11 18.431 -4.809 2.864 1.00 0.00 N ATOM 0 H ARG A 11 13.894 -7.909 -0.417 1.00 0.00 H new ATOM 0 HA ARG A 11 12.704 -8.365 2.241 1.00 0.00 H new ATOM 0 HB2 ARG A 11 13.260 -6.122 2.914 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.737 -6.992 2.547 1.00 0.00 H new ATOM 0 HG2 ARG A 11 14.851 -5.939 0.343 1.00 0.00 H new ATOM 0 HG3 ARG A 11 13.322 -5.129 0.623 1.00 0.00 H new ATOM 0 HD2 ARG A 11 15.213 -3.607 1.020 1.00 0.00 H new ATOM 0 HD3 ARG A 11 14.289 -3.858 2.488 1.00 0.00 H new ATOM 0 HE ARG A 11 16.060 -5.463 3.225 1.00 0.00 H new ATOM 0 HH11 ARG A 11 16.806 -3.235 0.576 1.00 0.00 H new ATOM 0 HH12 ARG A 11 18.541 -3.248 0.908 1.00 0.00 H new ATOM 0 HH21 ARG A 11 18.287 -5.452 3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 11 19.373 -4.494 2.630 1.00 0.00 H new ATOM 42 N LEU A 12 10.653 -7.230 1.392 1.00 0.00 N ATOM 43 CA LEU A 12 9.406 -6.791 0.805 1.00 0.00 C ATOM 44 C LEU A 12 8.630 -5.952 1.791 1.00 0.00 C ATOM 45 O LEU A 12 8.948 -5.919 2.980 1.00 0.00 O ATOM 46 CB LEU A 12 8.537 -7.982 0.353 1.00 0.00 C ATOM 47 CG LEU A 12 9.063 -8.817 -0.825 1.00 0.00 C ATOM 48 CD1 LEU A 12 9.570 -7.917 -1.935 1.00 0.00 C ATOM 49 CD2 LEU A 12 10.147 -9.792 -0.379 1.00 0.00 C ATOM 0 H LEU A 12 10.559 -7.637 2.323 1.00 0.00 H new ATOM 0 HA LEU A 12 9.653 -6.195 -0.073 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.401 -8.646 1.206 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.551 -7.601 0.086 1.00 0.00 H new ATOM 0 HG LEU A 12 8.231 -9.406 -1.212 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.938 -8.528 -2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.758 -7.282 -2.288 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.380 -7.293 -1.556 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.496 -10.366 -1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.981 -9.237 0.050 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.740 -10.471 0.370 1.00 0.00 H new ATOM 61 N ALA A 13 7.617 -5.272 1.291 1.00 0.00 N ATOM 62 CA ALA A 13 6.785 -4.451 2.132 1.00 0.00 C ATOM 63 C ALA A 13 5.384 -5.011 2.217 1.00 0.00 C ATOM 64 O ALA A 13 4.669 -5.120 1.220 1.00 0.00 O ATOM 65 CB ALA A 13 6.768 -3.015 1.649 1.00 0.00 C ATOM 0 H ALA A 13 7.354 -5.275 0.305 1.00 0.00 H new ATOM 0 HA ALA A 13 7.212 -4.459 3.135 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.132 -2.419 2.303 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.781 -2.614 1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 13 6.378 -2.978 0.632 1.00 0.00 H new ATOM 71 N ASN A 14 5.030 -5.386 3.420 1.00 0.00 N ATOM 72 CA ASN A 14 3.700 -5.826 3.753 1.00 0.00 C ATOM 73 C ASN A 14 2.781 -4.617 3.695 1.00 0.00 C ATOM 74 O ASN A 14 3.157 -3.530 4.138 1.00 0.00 O ATOM 75 CB ASN A 14 3.742 -6.413 5.161 1.00 0.00 C ATOM 76 CG ASN A 14 2.743 -7.483 5.421 1.00 0.00 C ATOM 77 OD1 ASN A 14 1.620 -7.463 4.921 1.00 0.00 O ATOM 78 ND2 ASN A 14 3.163 -8.425 6.228 1.00 0.00 N ATOM 0 H ASN A 14 5.673 -5.394 4.212 1.00 0.00 H new ATOM 0 HA ASN A 14 3.333 -6.584 3.061 1.00 0.00 H new ATOM 0 HB2 ASN A 14 4.739 -6.815 5.342 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.587 -5.608 5.880 1.00 0.00 H new ATOM 0 HD21 ASN A 14 2.546 -9.199 6.474 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.108 -8.385 6.611 1.00 0.00 H new ATOM 85 N PHE A 15 1.599 -4.778 3.145 1.00 0.00 N ATOM 86 CA PHE A 15 0.720 -3.642 2.969 1.00 0.00 C ATOM 87 C PHE A 15 -0.414 -3.705 3.969 1.00 0.00 C ATOM 88 O PHE A 15 -1.293 -4.557 3.878 1.00 0.00 O ATOM 89 CB PHE A 15 0.170 -3.591 1.541 1.00 0.00 C ATOM 90 CG PHE A 15 -0.514 -2.293 1.217 1.00 0.00 C ATOM 91 CD1 PHE A 15 0.198 -1.241 0.661 1.00 0.00 C ATOM 92 CD2 PHE A 15 -1.865 -2.120 1.475 1.00 0.00 C ATOM 93 CE1 PHE A 15 -0.425 -0.044 0.369 1.00 0.00 C ATOM 94 CE2 PHE A 15 -2.492 -0.924 1.185 1.00 0.00 C ATOM 95 CZ PHE A 15 -1.771 0.115 0.631 1.00 0.00 C ATOM 0 H PHE A 15 1.227 -5.669 2.816 1.00 0.00 H new ATOM 0 HA PHE A 15 1.295 -2.732 3.141 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.988 -3.749 0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.535 -4.411 1.400 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.251 -1.359 0.454 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.434 -2.930 1.908 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.141 0.768 -0.064 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.545 -0.802 1.391 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.259 1.051 0.403 1.00 0.00 H new ATOM 105 N LEU A 16 -0.381 -2.806 4.930 1.00 0.00 N ATOM 106 CA LEU A 16 -1.406 -2.758 5.949 1.00 0.00 C ATOM 107 C LEU A 16 -2.199 -1.481 5.806 1.00 0.00 C ATOM 108 O LEU A 16 -1.749 -0.518 5.187 1.00 0.00 O ATOM 109 CB LEU A 16 -0.816 -2.867 7.365 1.00 0.00 C ATOM 110 CG LEU A 16 -0.211 -1.589 7.963 1.00 0.00 C ATOM 111 CD1 LEU A 16 0.448 -1.898 9.296 1.00 0.00 C ATOM 112 CD2 LEU A 16 0.784 -0.958 7.021 1.00 0.00 C ATOM 0 H LEU A 16 0.346 -2.098 5.026 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.063 -3.617 5.808 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.602 -3.216 8.035 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.043 -3.635 7.353 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.019 -0.875 8.121 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.874 -0.985 9.712 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.295 -2.298 9.985 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.239 -2.633 9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.193 -0.056 7.475 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.592 -1.662 6.820 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.287 -0.700 6.086 1.00 0.00 H new ATOM 124 N VAL A 17 -3.376 -1.479 6.365 1.00 0.00 N ATOM 125 CA VAL A 17 -4.235 -0.330 6.274 1.00 0.00 C ATOM 126 C VAL A 17 -5.150 -0.204 7.481 1.00 0.00 C ATOM 127 O VAL A 17 -5.840 -1.149 7.866 1.00 0.00 O ATOM 128 CB VAL A 17 -5.066 -0.367 4.975 1.00 0.00 C ATOM 129 CG1 VAL A 17 -5.652 -1.737 4.727 1.00 0.00 C ATOM 130 CG2 VAL A 17 -6.166 0.665 5.021 1.00 0.00 C ATOM 0 H VAL A 17 -3.765 -2.262 6.890 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.590 0.549 6.256 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.393 -0.135 4.150 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.230 -1.724 3.803 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.847 -2.467 4.640 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -6.302 -2.011 5.558 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.742 0.624 4.096 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.822 0.460 5.867 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.729 1.657 5.133 1.00 0.00 H new ATOM 140 N HIS A 18 -5.127 0.972 8.080 1.00 0.00 N ATOM 141 CA HIS A 18 -6.069 1.318 9.123 1.00 0.00 C ATOM 142 C HIS A 18 -7.399 1.660 8.455 1.00 0.00 C ATOM 143 O HIS A 18 -7.531 2.709 7.829 1.00 0.00 O ATOM 144 CB HIS A 18 -5.540 2.494 9.947 1.00 0.00 C ATOM 145 CG HIS A 18 -6.416 2.874 11.098 1.00 0.00 C ATOM 146 ND1 HIS A 18 -7.126 4.050 11.144 1.00 0.00 N ATOM 147 CD2 HIS A 18 -6.685 2.231 12.257 1.00 0.00 C ATOM 148 CE1 HIS A 18 -7.794 4.116 12.279 1.00 0.00 C ATOM 149 NE2 HIS A 18 -7.544 3.023 12.973 1.00 0.00 N ATOM 0 H HIS A 18 -4.458 1.709 7.858 1.00 0.00 H new ATOM 0 HA HIS A 18 -6.208 0.483 9.810 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -4.549 2.242 10.325 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -5.422 3.358 9.293 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -7.135 4.762 10.413 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -6.295 1.271 12.562 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -8.437 4.927 12.588 1.00 0.00 H new ATOM 158 N SER A 19 -8.364 0.759 8.610 1.00 0.00 N ATOM 159 CA SER A 19 -9.591 0.719 7.798 1.00 0.00 C ATOM 160 C SER A 19 -10.252 2.079 7.529 1.00 0.00 C ATOM 161 O SER A 19 -10.826 2.275 6.458 1.00 0.00 O ATOM 162 CB SER A 19 -10.615 -0.205 8.460 1.00 0.00 C ATOM 163 OG SER A 19 -10.098 -1.516 8.627 1.00 0.00 O ATOM 0 H SER A 19 -8.322 0.021 9.313 1.00 0.00 H new ATOM 0 HA SER A 19 -9.271 0.348 6.824 1.00 0.00 H new ATOM 0 HB2 SER A 19 -10.900 0.202 9.430 1.00 0.00 H new ATOM 0 HB3 SER A 19 -11.519 -0.243 7.852 1.00 0.00 H new ATOM 0 HG SER A 19 -9.518 -1.541 9.416 1.00 0.00 H new ATOM 169 N SER A 20 -10.185 3.009 8.472 1.00 0.00 N ATOM 170 CA SER A 20 -11.004 4.207 8.377 1.00 0.00 C ATOM 171 C SER A 20 -10.562 5.150 7.247 1.00 0.00 C ATOM 172 O SER A 20 -11.367 5.478 6.374 1.00 0.00 O ATOM 173 CB SER A 20 -10.981 4.943 9.715 1.00 0.00 C ATOM 174 OG SER A 20 -11.283 4.057 10.782 1.00 0.00 O ATOM 0 H SER A 20 -9.585 2.959 9.295 1.00 0.00 H new ATOM 0 HA SER A 20 -12.018 3.889 8.136 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.999 5.389 9.873 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.703 5.759 9.699 1.00 0.00 H new ATOM 0 HG SER A 20 -11.261 4.547 11.630 1.00 0.00 H new ATOM 180 N ASN A 21 -9.303 5.584 7.241 1.00 0.00 N ATOM 181 CA ASN A 21 -8.874 6.546 6.223 1.00 0.00 C ATOM 182 C ASN A 21 -7.505 6.241 5.610 1.00 0.00 C ATOM 183 O ASN A 21 -7.276 6.516 4.431 1.00 0.00 O ATOM 184 CB ASN A 21 -8.879 7.961 6.813 1.00 0.00 C ATOM 185 CG ASN A 21 -8.499 9.028 5.802 1.00 0.00 C ATOM 186 OD1 ASN A 21 -7.338 9.432 5.712 1.00 0.00 O ATOM 187 ND2 ASN A 21 -9.476 9.494 5.036 1.00 0.00 N ATOM 0 H ASN A 21 -8.582 5.298 7.904 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.592 6.466 5.407 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -9.871 8.180 7.208 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.185 8.001 7.653 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -9.280 10.214 4.340 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -10.424 9.133 5.142 1.00 0.00 H new ATOM 194 N ASN A 22 -6.600 5.666 6.386 1.00 0.00 N ATOM 195 CA ASN A 22 -5.192 5.651 5.998 1.00 0.00 C ATOM 196 C ASN A 22 -4.654 4.252 5.703 1.00 0.00 C ATOM 197 O ASN A 22 -4.702 3.354 6.542 1.00 0.00 O ATOM 198 CB ASN A 22 -4.331 6.340 7.071 1.00 0.00 C ATOM 199 CG ASN A 22 -4.489 5.747 8.464 1.00 0.00 C ATOM 200 OD1 ASN A 22 -5.547 5.234 8.825 1.00 0.00 O ATOM 201 ND2 ASN A 22 -3.439 5.834 9.267 1.00 0.00 N ATOM 0 H ASN A 22 -6.806 5.210 7.275 1.00 0.00 H new ATOM 0 HA ASN A 22 -5.129 6.207 5.063 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -3.283 6.278 6.777 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -4.590 7.398 7.106 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -3.493 5.469 10.218 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -2.577 6.266 8.934 1.00 0.00 H new ATOM 208 N PHE A 23 -4.144 4.089 4.486 1.00 0.00 N ATOM 209 CA PHE A 23 -3.429 2.894 4.080 1.00 0.00 C ATOM 210 C PHE A 23 -1.930 3.136 4.196 1.00 0.00 C ATOM 211 O PHE A 23 -1.460 4.250 3.948 1.00 0.00 O ATOM 212 CB PHE A 23 -3.797 2.530 2.637 1.00 0.00 C ATOM 213 CG PHE A 23 -4.002 3.719 1.728 1.00 0.00 C ATOM 214 CD1 PHE A 23 -5.240 4.341 1.665 1.00 0.00 C ATOM 215 CD2 PHE A 23 -2.966 4.219 0.939 1.00 0.00 C ATOM 216 CE1 PHE A 23 -5.445 5.430 0.845 1.00 0.00 C ATOM 217 CE2 PHE A 23 -3.173 5.310 0.118 1.00 0.00 C ATOM 218 CZ PHE A 23 -4.412 5.916 0.071 1.00 0.00 C ATOM 0 H PHE A 23 -4.219 4.792 3.751 1.00 0.00 H new ATOM 0 HA PHE A 23 -3.708 2.065 4.731 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.009 1.901 2.221 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.709 1.933 2.647 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -6.055 3.967 2.267 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.994 3.749 0.970 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -6.415 5.903 0.809 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -2.364 5.690 -0.488 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.573 6.770 -0.571 1.00 0.00 H new ATOM 228 N GLY A 24 -1.175 2.119 4.586 1.00 0.00 N ATOM 229 CA GLY A 24 0.247 2.307 4.744 1.00 0.00 C ATOM 230 C GLY A 24 1.053 1.113 4.299 1.00 0.00 C ATOM 231 O GLY A 24 0.567 0.261 3.559 1.00 0.00 O ATOM 0 H GLY A 24 -1.518 1.181 4.793 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.558 3.182 4.172 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.466 2.516 5.791 1.00 0.00 H new ATOM 235 N ALA A 25 2.284 1.049 4.768 1.00 0.00 N ATOM 236 CA ALA A 25 3.180 -0.028 4.428 1.00 0.00 C ATOM 237 C ALA A 25 3.995 -0.409 5.638 1.00 0.00 C ATOM 238 O ALA A 25 3.982 0.285 6.647 1.00 0.00 O ATOM 239 CB ALA A 25 4.081 0.359 3.260 1.00 0.00 C ATOM 0 H ALA A 25 2.687 1.745 5.396 1.00 0.00 H new ATOM 0 HA ALA A 25 2.592 -0.891 4.114 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.747 -0.471 3.024 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.468 0.592 2.389 1.00 0.00 H new ATOM 0 HB3 ALA A 25 4.673 1.233 3.531 1.00 0.00 H new ATOM 245 N ILE A 26 4.642 -1.540 5.553 1.00 0.00 N ATOM 246 CA ILE A 26 5.497 -2.022 6.609 1.00 0.00 C ATOM 247 C ILE A 26 6.416 -3.078 6.033 1.00 0.00 C ATOM 248 O ILE A 26 5.978 -3.922 5.273 1.00 0.00 O ATOM 249 CB ILE A 26 4.664 -2.575 7.776 1.00 0.00 C ATOM 250 CG1 ILE A 26 5.570 -3.127 8.867 1.00 0.00 C ATOM 251 CG2 ILE A 26 3.690 -3.641 7.308 1.00 0.00 C ATOM 252 CD1 ILE A 26 4.804 -3.542 10.084 1.00 0.00 C ATOM 0 H ILE A 26 4.592 -2.159 4.744 1.00 0.00 H new ATOM 0 HA ILE A 26 6.095 -1.203 7.009 1.00 0.00 H new ATOM 0 HB ILE A 26 4.083 -1.749 8.187 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.123 -3.982 8.479 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.305 -2.371 9.143 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.118 -4.010 8.159 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.010 -3.214 6.571 1.00 0.00 H new ATOM 0 HG23 ILE A 26 4.242 -4.466 6.857 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.494 -3.929 10.834 1.00 0.00 H new ATOM 0 HD12 ILE A 26 4.272 -2.682 10.490 1.00 0.00 H new ATOM 0 HD13 ILE A 26 4.087 -4.318 9.816 1.00 0.00 H new ATOM 264 N LEU A 27 7.681 -3.041 6.366 1.00 0.00 N ATOM 265 CA LEU A 27 8.613 -3.954 5.744 1.00 0.00 C ATOM 266 C LEU A 27 8.640 -5.276 6.464 1.00 0.00 C ATOM 267 O LEU A 27 8.371 -5.365 7.659 1.00 0.00 O ATOM 268 CB LEU A 27 10.011 -3.369 5.679 1.00 0.00 C ATOM 269 CG LEU A 27 10.207 -2.256 4.655 1.00 0.00 C ATOM 270 CD1 LEU A 27 11.647 -1.851 4.631 1.00 0.00 C ATOM 271 CD2 LEU A 27 9.802 -2.694 3.261 1.00 0.00 C ATOM 0 H LEU A 27 8.086 -2.403 7.051 1.00 0.00 H new ATOM 0 HA LEU A 27 8.266 -4.118 4.724 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.271 -2.983 6.665 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.713 -4.173 5.456 1.00 0.00 H new ATOM 0 HG LEU A 27 9.573 -1.420 4.950 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.789 -1.055 3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.941 -1.493 5.618 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.262 -2.709 4.358 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.957 -1.872 2.562 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.408 -3.548 2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.749 -2.977 3.260 1.00 0.00 H new ATOM 283 N SER A 28 8.950 -6.302 5.711 1.00 0.00 N ATOM 284 CA SER A 28 8.853 -7.660 6.192 1.00 0.00 C ATOM 285 C SER A 28 9.936 -8.523 5.557 1.00 0.00 C ATOM 286 O SER A 28 10.083 -8.564 4.333 1.00 0.00 O ATOM 287 CB SER A 28 7.453 -8.214 5.894 1.00 0.00 C ATOM 288 OG SER A 28 6.452 -7.431 6.525 1.00 0.00 O ATOM 0 H SER A 28 9.277 -6.221 4.748 1.00 0.00 H new ATOM 0 HA SER A 28 9.006 -7.675 7.271 1.00 0.00 H new ATOM 0 HB2 SER A 28 7.285 -8.227 4.817 1.00 0.00 H new ATOM 0 HB3 SER A 28 7.385 -9.245 6.240 1.00 0.00 H new ATOM 0 HG SER A 28 6.047 -7.945 7.255 1.00 0.00 H new ATOM 294 N SER A 29 10.713 -9.174 6.405 1.00 0.00 N ATOM 295 CA SER A 29 11.796 -10.032 5.964 1.00 0.00 C ATOM 296 C SER A 29 12.024 -11.115 7.008 1.00 0.00 C ATOM 297 O SER A 29 12.067 -12.308 6.701 1.00 0.00 O ATOM 298 CB SER A 29 13.067 -9.202 5.771 1.00 0.00 C ATOM 299 OG SER A 29 14.018 -9.878 4.962 1.00 0.00 O ATOM 0 H SER A 29 10.610 -9.122 7.418 1.00 0.00 H new ATOM 0 HA SER A 29 11.539 -10.497 5.012 1.00 0.00 H new ATOM 0 HB2 SER A 29 12.812 -8.247 5.312 1.00 0.00 H new ATOM 0 HB3 SER A 29 13.508 -8.980 6.743 1.00 0.00 H new ATOM 0 HG SER A 29 13.801 -9.738 4.017 1.00 0.00 H new ATOM 305 N THR A 30 12.158 -10.681 8.250 1.00 0.00 N ATOM 306 CA THR A 30 12.288 -11.586 9.373 1.00 0.00 C ATOM 307 C THR A 30 10.915 -12.089 9.812 1.00 0.00 C ATOM 308 O THR A 30 10.116 -11.274 10.322 1.00 0.00 O ATOM 309 CB THR A 30 13.011 -10.899 10.548 1.00 0.00 C ATOM 310 OG1 THR A 30 12.616 -9.519 10.625 1.00 0.00 O ATOM 311 CG2 THR A 30 14.521 -10.992 10.383 1.00 0.00 C ATOM 0 H THR A 30 12.179 -9.694 8.505 1.00 0.00 H new ATOM 0 HA THR A 30 12.887 -12.440 9.057 1.00 0.00 H new ATOM 0 HB THR A 30 12.731 -11.410 11.469 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.643 -9.451 10.530 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.010 -10.500 11.224 1.00 0.00 H new ATOM 0 HG22 THR A 30 14.820 -12.040 10.352 1.00 0.00 H new ATOM 0 HG23 THR A 30 14.816 -10.503 9.455 1.00 0.00 H new TER 319 THR A 30 ATOM 320 N GLY B 13 -12.803 2.187 16.480 1.00 0.00 N ATOM 321 CA GLY B 13 -13.258 1.684 15.164 1.00 0.00 C ATOM 322 C GLY B 13 -12.170 1.766 14.119 1.00 0.00 C ATOM 323 O GLY B 13 -11.404 2.733 14.085 1.00 0.00 O ATOM 0 HA2 GLY B 13 -13.586 0.649 15.265 1.00 0.00 H new ATOM 0 HA3 GLY B 13 -14.122 2.261 14.834 1.00 0.00 H new ATOM 327 N GLY B 14 -12.091 0.753 13.271 1.00 0.00 N ATOM 328 CA GLY B 14 -11.103 0.747 12.216 1.00 0.00 C ATOM 329 C GLY B 14 -9.920 -0.136 12.545 1.00 0.00 C ATOM 330 O GLY B 14 -9.011 0.273 13.268 1.00 0.00 O ATOM 0 H GLY B 14 -12.696 -0.068 13.296 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -11.565 0.403 11.290 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.756 1.765 12.040 1.00 0.00 H new ATOM 334 N GLU B 15 -9.930 -1.347 12.013 1.00 0.00 N ATOM 335 CA GLU B 15 -8.852 -2.296 12.240 1.00 0.00 C ATOM 336 C GLU B 15 -7.723 -2.044 11.246 1.00 0.00 C ATOM 337 O GLU B 15 -7.927 -1.393 10.221 1.00 0.00 O ATOM 338 CB GLU B 15 -9.387 -3.722 12.094 1.00 0.00 C ATOM 339 CG GLU B 15 -9.930 -4.018 10.706 1.00 0.00 C ATOM 340 CD GLU B 15 -10.675 -5.333 10.627 1.00 0.00 C ATOM 341 OE1 GLU B 15 -10.076 -6.388 10.923 1.00 0.00 O ATOM 342 OE2 GLU B 15 -11.863 -5.316 10.252 1.00 0.00 O ATOM 0 H GLU B 15 -10.679 -1.698 11.416 1.00 0.00 H new ATOM 0 HA GLU B 15 -8.460 -2.169 13.249 1.00 0.00 H new ATOM 0 HB2 GLU B 15 -8.589 -4.428 12.323 1.00 0.00 H new ATOM 0 HB3 GLU B 15 -10.176 -3.884 12.828 1.00 0.00 H new ATOM 0 HG2 GLU B 15 -10.597 -3.211 10.404 1.00 0.00 H new ATOM 0 HG3 GLU B 15 -9.104 -4.032 9.995 1.00 0.00 H new ATOM 349 N ILE B 16 -6.534 -2.531 11.552 1.00 0.00 N ATOM 350 CA ILE B 16 -5.404 -2.382 10.651 1.00 0.00 C ATOM 351 C ILE B 16 -5.100 -3.704 9.969 1.00 0.00 C ATOM 352 O ILE B 16 -4.462 -4.582 10.548 1.00 0.00 O ATOM 353 CB ILE B 16 -4.158 -1.881 11.397 1.00 0.00 C ATOM 354 CG1 ILE B 16 -4.493 -0.582 12.125 1.00 0.00 C ATOM 355 CG2 ILE B 16 -2.999 -1.673 10.428 1.00 0.00 C ATOM 356 CD1 ILE B 16 -3.415 -0.122 13.070 1.00 0.00 C ATOM 0 H ILE B 16 -6.325 -3.032 12.416 1.00 0.00 H new ATOM 0 HA ILE B 16 -5.672 -1.640 9.898 1.00 0.00 H new ATOM 0 HB ILE B 16 -3.851 -2.630 12.127 1.00 0.00 H new ATOM 0 HG12 ILE B 16 -4.676 0.200 11.388 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -5.420 -0.717 12.683 1.00 0.00 H new ATOM 0 HG21 ILE B 16 -2.126 -1.318 10.976 1.00 0.00 H new ATOM 0 HG22 ILE B 16 -2.761 -2.617 9.938 1.00 0.00 H new ATOM 0 HG23 ILE B 16 -3.281 -0.935 9.677 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -3.724 0.806 13.550 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -3.247 -0.885 13.830 1.00 0.00 H new ATOM 0 HD13 ILE B 16 -2.492 0.046 12.515 1.00 0.00 H new ATOM 368 N VAL B 17 -5.562 -3.840 8.740 1.00 0.00 N ATOM 369 CA VAL B 17 -5.441 -5.096 8.022 1.00 0.00 C ATOM 370 C VAL B 17 -4.184 -5.153 7.172 1.00 0.00 C ATOM 371 O VAL B 17 -3.913 -4.260 6.375 1.00 0.00 O ATOM 372 CB VAL B 17 -6.674 -5.396 7.141 1.00 0.00 C ATOM 373 CG1 VAL B 17 -7.752 -6.075 7.965 1.00 0.00 C ATOM 374 CG2 VAL B 17 -7.228 -4.140 6.494 1.00 0.00 C ATOM 0 H VAL B 17 -6.025 -3.096 8.218 1.00 0.00 H new ATOM 0 HA VAL B 17 -5.376 -5.864 8.793 1.00 0.00 H new ATOM 0 HB VAL B 17 -6.351 -6.064 6.342 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.616 -6.282 7.334 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -7.366 -7.011 8.369 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -8.049 -5.421 8.785 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -8.094 -4.397 5.884 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -7.527 -3.433 7.268 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -6.462 -3.687 5.865 1.00 0.00 H new ATOM 384 N TYR B 18 -3.413 -6.205 7.384 1.00 0.00 N ATOM 385 CA TYR B 18 -2.234 -6.492 6.579 1.00 0.00 C ATOM 386 C TYR B 18 -2.618 -7.397 5.413 1.00 0.00 C ATOM 387 O TYR B 18 -3.013 -8.546 5.616 1.00 0.00 O ATOM 388 CB TYR B 18 -1.155 -7.202 7.411 1.00 0.00 C ATOM 389 CG TYR B 18 -0.681 -6.453 8.640 1.00 0.00 C ATOM 390 CD1 TYR B 18 -1.418 -6.474 9.818 1.00 0.00 C ATOM 391 CD2 TYR B 18 0.519 -5.748 8.632 1.00 0.00 C ATOM 392 CE1 TYR B 18 -0.976 -5.815 10.948 1.00 0.00 C ATOM 393 CE2 TYR B 18 0.964 -5.088 9.756 1.00 0.00 C ATOM 394 CZ TYR B 18 0.215 -5.124 10.911 1.00 0.00 C ATOM 395 OH TYR B 18 0.659 -4.460 12.032 1.00 0.00 O ATOM 0 H TYR B 18 -3.586 -6.888 8.122 1.00 0.00 H new ATOM 0 HA TYR B 18 -1.837 -5.544 6.215 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -1.542 -8.171 7.725 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -0.295 -7.395 6.770 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -2.352 -7.015 9.850 1.00 0.00 H new ATOM 0 HD2 TYR B 18 1.111 -5.718 7.729 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -1.561 -5.841 11.856 1.00 0.00 H new ATOM 0 HE2 TYR B 18 1.897 -4.544 9.732 1.00 0.00 H new ATOM 0 HH TYR B 18 1.515 -4.025 11.837 1.00 0.00 H new ATOM 405 N LEU B 19 -2.525 -6.882 4.203 1.00 0.00 N ATOM 406 CA LEU B 19 -2.780 -7.687 3.014 1.00 0.00 C ATOM 407 C LEU B 19 -1.563 -7.670 2.083 1.00 0.00 C ATOM 408 O LEU B 19 -1.478 -6.866 1.159 1.00 0.00 O ATOM 409 CB LEU B 19 -4.044 -7.187 2.287 1.00 0.00 C ATOM 410 CG LEU B 19 -4.282 -5.685 2.334 1.00 0.00 C ATOM 411 CD1 LEU B 19 -4.978 -5.272 1.070 1.00 0.00 C ATOM 412 CD2 LEU B 19 -5.125 -5.304 3.543 1.00 0.00 C ATOM 0 H LEU B 19 -2.275 -5.912 4.012 1.00 0.00 H new ATOM 0 HA LEU B 19 -2.953 -8.719 3.321 1.00 0.00 H new ATOM 0 HB2 LEU B 19 -3.986 -7.494 1.243 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -4.911 -7.687 2.719 1.00 0.00 H new ATOM 0 HG LEU B 19 -3.325 -5.172 2.422 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -5.156 -4.197 1.087 1.00 0.00 H new ATOM 0 HD12 LEU B 19 -4.354 -5.522 0.212 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -5.930 -5.796 0.991 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -5.280 -4.225 3.553 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -6.089 -5.809 3.488 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -4.610 -5.605 4.455 1.00 0.00 H new ATOM 424 N PRO B 20 -0.605 -8.588 2.315 1.00 0.00 N ATOM 425 CA PRO B 20 0.634 -8.675 1.537 1.00 0.00 C ATOM 426 C PRO B 20 0.521 -9.605 0.336 1.00 0.00 C ATOM 427 O PRO B 20 1.435 -9.695 -0.485 1.00 0.00 O ATOM 428 CB PRO B 20 1.601 -9.272 2.549 1.00 0.00 C ATOM 429 CG PRO B 20 0.755 -10.200 3.357 1.00 0.00 C ATOM 430 CD PRO B 20 -0.633 -9.601 3.390 1.00 0.00 C ATOM 0 HA PRO B 20 0.924 -7.710 1.121 1.00 0.00 H new ATOM 0 HB2 PRO B 20 2.416 -9.802 2.057 1.00 0.00 H new ATOM 0 HB3 PRO B 20 2.053 -8.500 3.172 1.00 0.00 H new ATOM 0 HG2 PRO B 20 0.737 -11.195 2.912 1.00 0.00 H new ATOM 0 HG3 PRO B 20 1.154 -10.309 4.365 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -1.399 -10.355 3.209 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -0.852 -9.151 4.358 1.00 0.00 H new ATOM 438 N ASN B 21 -0.602 -10.294 0.241 1.00 0.00 N ATOM 439 CA ASN B 21 -0.767 -11.344 -0.755 1.00 0.00 C ATOM 440 C ASN B 21 -1.406 -10.787 -2.014 1.00 0.00 C ATOM 441 O ASN B 21 -1.794 -11.535 -2.908 1.00 0.00 O ATOM 442 CB ASN B 21 -1.624 -12.486 -0.200 1.00 0.00 C ATOM 443 CG ASN B 21 -1.107 -13.023 1.121 1.00 0.00 C ATOM 444 OD1 ASN B 21 -1.469 -12.523 2.186 1.00 0.00 O ATOM 445 ND2 ASN B 21 -0.275 -14.049 1.067 1.00 0.00 N ATOM 0 H ASN B 21 -1.415 -10.147 0.840 1.00 0.00 H new ATOM 0 HA ASN B 21 0.221 -11.734 -1.002 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -2.647 -12.135 -0.068 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -1.656 -13.296 -0.928 1.00 0.00 H new ATOM 0 HD21 ASN B 21 0.091 -14.455 1.928 1.00 0.00 H new ATOM 0 HD22 ASN B 21 0.001 -14.435 0.164 1.00 0.00 H new ATOM 452 N LEU B 22 -1.508 -9.471 -2.079 1.00 0.00 N ATOM 453 CA LEU B 22 -2.107 -8.816 -3.226 1.00 0.00 C ATOM 454 C LEU B 22 -1.121 -8.696 -4.362 1.00 0.00 C ATOM 455 O LEU B 22 0.094 -8.755 -4.166 1.00 0.00 O ATOM 456 CB LEU B 22 -2.598 -7.416 -2.873 1.00 0.00 C ATOM 457 CG LEU B 22 -3.774 -7.347 -1.914 1.00 0.00 C ATOM 458 CD1 LEU B 22 -4.425 -5.987 -2.002 1.00 0.00 C ATOM 459 CD2 LEU B 22 -4.782 -8.428 -2.206 1.00 0.00 C ATOM 0 H LEU B 22 -1.183 -8.836 -1.350 1.00 0.00 H new ATOM 0 HA LEU B 22 -2.951 -9.435 -3.531 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -1.767 -6.859 -2.439 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -2.876 -6.906 -3.795 1.00 0.00 H new ATOM 0 HG LEU B 22 -3.401 -7.505 -0.902 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -5.268 -5.942 -1.313 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -3.699 -5.218 -1.738 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -4.779 -5.818 -3.019 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -5.611 -8.352 -1.503 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -5.157 -8.311 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -4.308 -9.404 -2.104 1.00 0.00 H new ATOM 471 N ASN B 23 -1.661 -8.519 -5.547 1.00 0.00 N ATOM 472 CA ASN B 23 -0.845 -8.232 -6.712 1.00 0.00 C ATOM 473 C ASN B 23 -0.533 -6.744 -6.750 1.00 0.00 C ATOM 474 O ASN B 23 -1.367 -5.936 -6.335 1.00 0.00 O ATOM 475 CB ASN B 23 -1.559 -8.633 -8.007 1.00 0.00 C ATOM 476 CG ASN B 23 -1.866 -10.113 -8.086 1.00 0.00 C ATOM 477 OD1 ASN B 23 -1.143 -10.942 -7.535 1.00 0.00 O ATOM 478 ND2 ASN B 23 -2.939 -10.454 -8.780 1.00 0.00 N ATOM 0 H ASN B 23 -2.663 -8.568 -5.732 1.00 0.00 H new ATOM 0 HA ASN B 23 0.075 -8.812 -6.637 1.00 0.00 H new ATOM 0 HB2 ASN B 23 -2.489 -8.071 -8.090 1.00 0.00 H new ATOM 0 HB3 ASN B 23 -0.939 -8.351 -8.858 1.00 0.00 H new ATOM 0 HD21 ASN B 23 -3.194 -11.437 -8.874 1.00 0.00 H new ATOM 0 HD22 ASN B 23 -3.511 -9.734 -9.221 1.00 0.00 H new ATOM 485 N PRO B 24 0.663 -6.353 -7.210 1.00 0.00 N ATOM 486 CA PRO B 24 1.018 -4.941 -7.382 1.00 0.00 C ATOM 487 C PRO B 24 -0.095 -4.140 -8.059 1.00 0.00 C ATOM 488 O PRO B 24 -0.449 -3.042 -7.617 1.00 0.00 O ATOM 489 CB PRO B 24 2.253 -5.007 -8.276 1.00 0.00 C ATOM 490 CG PRO B 24 2.896 -6.307 -7.933 1.00 0.00 C ATOM 491 CD PRO B 24 1.779 -7.251 -7.562 1.00 0.00 C ATOM 0 HA PRO B 24 1.186 -4.437 -6.430 1.00 0.00 H new ATOM 0 HB2 PRO B 24 1.982 -4.965 -9.331 1.00 0.00 H new ATOM 0 HB3 PRO B 24 2.925 -4.170 -8.086 1.00 0.00 H new ATOM 0 HG2 PRO B 24 3.466 -6.693 -8.778 1.00 0.00 H new ATOM 0 HG3 PRO B 24 3.595 -6.188 -7.105 1.00 0.00 H new ATOM 0 HD2 PRO B 24 1.518 -7.908 -8.392 1.00 0.00 H new ATOM 0 HD3 PRO B 24 2.057 -7.891 -6.725 1.00 0.00 H new ATOM 499 N ASP B 25 -0.660 -4.711 -9.119 1.00 0.00 N ATOM 500 CA ASP B 25 -1.736 -4.061 -9.864 1.00 0.00 C ATOM 501 C ASP B 25 -3.014 -3.982 -9.030 1.00 0.00 C ATOM 502 O ASP B 25 -3.777 -3.021 -9.144 1.00 0.00 O ATOM 503 CB ASP B 25 -2.023 -4.800 -11.173 1.00 0.00 C ATOM 504 CG ASP B 25 -0.815 -4.879 -12.086 1.00 0.00 C ATOM 505 OD1 ASP B 25 -0.181 -3.835 -12.340 1.00 0.00 O ATOM 506 OD2 ASP B 25 -0.493 -5.992 -12.552 1.00 0.00 O ATOM 0 H ASP B 25 -0.390 -5.625 -9.483 1.00 0.00 H new ATOM 0 HA ASP B 25 -1.404 -3.049 -10.095 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -2.367 -5.809 -10.946 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -2.835 -4.297 -11.697 1.00 0.00 H new ATOM 511 N GLN B 26 -3.242 -4.991 -8.189 1.00 0.00 N ATOM 512 CA GLN B 26 -4.399 -5.001 -7.300 1.00 0.00 C ATOM 513 C GLN B 26 -4.337 -3.848 -6.310 1.00 0.00 C ATOM 514 O GLN B 26 -5.336 -3.174 -6.084 1.00 0.00 O ATOM 515 CB GLN B 26 -4.512 -6.328 -6.547 1.00 0.00 C ATOM 516 CG GLN B 26 -5.152 -7.439 -7.360 1.00 0.00 C ATOM 517 CD GLN B 26 -5.296 -8.724 -6.569 1.00 0.00 C ATOM 518 OE1 GLN B 26 -4.476 -9.026 -5.703 1.00 0.00 O ATOM 519 NE2 GLN B 26 -6.345 -9.479 -6.851 1.00 0.00 N ATOM 0 H GLN B 26 -2.640 -5.810 -8.106 1.00 0.00 H new ATOM 0 HA GLN B 26 -5.286 -4.881 -7.923 1.00 0.00 H new ATOM 0 HB2 GLN B 26 -3.517 -6.645 -6.236 1.00 0.00 H new ATOM 0 HB3 GLN B 26 -5.095 -6.172 -5.639 1.00 0.00 H new ATOM 0 HG2 GLN B 26 -6.134 -7.115 -7.703 1.00 0.00 H new ATOM 0 HG3 GLN B 26 -4.550 -7.628 -8.249 1.00 0.00 H new ATOM 0 HE21 GLN B 26 -7.001 -9.191 -7.577 1.00 0.00 H new ATOM 0 HE22 GLN B 26 -6.498 -10.350 -6.342 1.00 0.00 H new ATOM 528 N LEU B 27 -3.166 -3.619 -5.719 1.00 0.00 N ATOM 529 CA LEU B 27 -2.979 -2.473 -4.833 1.00 0.00 C ATOM 530 C LEU B 27 -3.265 -1.184 -5.582 1.00 0.00 C ATOM 531 O LEU B 27 -3.962 -0.305 -5.082 1.00 0.00 O ATOM 532 CB LEU B 27 -1.556 -2.431 -4.272 1.00 0.00 C ATOM 533 CG LEU B 27 -1.181 -3.573 -3.339 1.00 0.00 C ATOM 534 CD1 LEU B 27 0.303 -3.534 -3.038 1.00 0.00 C ATOM 535 CD2 LEU B 27 -1.983 -3.483 -2.056 1.00 0.00 C ATOM 0 H LEU B 27 -2.340 -4.206 -5.836 1.00 0.00 H new ATOM 0 HA LEU B 27 -3.675 -2.577 -4.001 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -0.856 -2.424 -5.107 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -1.424 -1.491 -3.737 1.00 0.00 H new ATOM 0 HG LEU B 27 -1.412 -4.519 -3.828 1.00 0.00 H new ATOM 0 HD11 LEU B 27 0.560 -4.356 -2.370 1.00 0.00 H new ATOM 0 HD12 LEU B 27 0.865 -3.632 -3.967 1.00 0.00 H new ATOM 0 HD13 LEU B 27 0.553 -2.586 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -1.707 -4.305 -1.396 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -1.773 -2.534 -1.562 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -3.047 -3.545 -2.287 1.00 0.00 H new ATOM 547 N CYS B 28 -2.734 -1.095 -6.794 1.00 0.00 N ATOM 548 CA CYS B 28 -2.951 0.061 -7.652 1.00 0.00 C ATOM 549 C CYS B 28 -4.446 0.314 -7.842 1.00 0.00 C ATOM 550 O CYS B 28 -4.910 1.451 -7.762 1.00 0.00 O ATOM 551 CB CYS B 28 -2.275 -0.168 -9.005 1.00 0.00 C ATOM 552 SG CYS B 28 -2.277 1.283 -10.108 1.00 0.00 S ATOM 0 H CYS B 28 -2.144 -1.817 -7.208 1.00 0.00 H new ATOM 0 HA CYS B 28 -2.514 0.940 -7.178 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -1.244 -0.477 -8.834 1.00 0.00 H new ATOM 0 HB3 CYS B 28 -2.775 -0.994 -9.511 1.00 0.00 H new ATOM 557 N ALA B 29 -5.194 -0.762 -8.065 1.00 0.00 N ATOM 558 CA ALA B 29 -6.634 -0.676 -8.262 1.00 0.00 C ATOM 559 C ALA B 29 -7.349 -0.339 -6.958 1.00 0.00 C ATOM 560 O ALA B 29 -8.184 0.565 -6.911 1.00 0.00 O ATOM 561 CB ALA B 29 -7.165 -1.987 -8.825 1.00 0.00 C ATOM 0 H ALA B 29 -4.821 -1.710 -8.114 1.00 0.00 H new ATOM 0 HA ALA B 29 -6.830 0.126 -8.974 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -8.243 -1.911 -8.968 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.685 -2.193 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -6.948 -2.797 -8.128 1.00 0.00 H new ATOM 567 N PHE B 30 -6.998 -1.058 -5.899 1.00 0.00 N ATOM 568 CA PHE B 30 -7.644 -0.906 -4.608 1.00 0.00 C ATOM 569 C PHE B 30 -7.447 0.501 -4.051 1.00 0.00 C ATOM 570 O PHE B 30 -8.406 1.150 -3.637 1.00 0.00 O ATOM 571 CB PHE B 30 -7.097 -1.970 -3.648 1.00 0.00 C ATOM 572 CG PHE B 30 -7.164 -1.596 -2.199 1.00 0.00 C ATOM 573 CD1 PHE B 30 -6.019 -1.198 -1.538 1.00 0.00 C ATOM 574 CD2 PHE B 30 -8.358 -1.638 -1.505 1.00 0.00 C ATOM 575 CE1 PHE B 30 -6.059 -0.846 -0.204 1.00 0.00 C ATOM 576 CE2 PHE B 30 -8.407 -1.288 -0.170 1.00 0.00 C ATOM 577 CZ PHE B 30 -7.256 -0.891 0.482 1.00 0.00 C ATOM 0 H PHE B 30 -6.259 -1.761 -5.914 1.00 0.00 H new ATOM 0 HA PHE B 30 -8.718 -1.049 -4.725 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -7.653 -2.895 -3.797 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -6.059 -2.177 -3.909 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -5.081 -1.162 -2.071 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -9.261 -1.947 -2.011 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -5.156 -0.536 0.302 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -9.345 -1.325 0.364 1.00 0.00 H new ATOM 0 HZ PHE B 30 -7.292 -0.616 1.526 1.00 0.00 H new ATOM 587 N ILE B 31 -6.210 0.979 -4.070 1.00 0.00 N ATOM 588 CA ILE B 31 -5.893 2.293 -3.531 1.00 0.00 C ATOM 589 C ILE B 31 -6.547 3.393 -4.354 1.00 0.00 C ATOM 590 O ILE B 31 -7.042 4.385 -3.813 1.00 0.00 O ATOM 591 CB ILE B 31 -4.373 2.519 -3.469 1.00 0.00 C ATOM 592 CG1 ILE B 31 -3.727 1.477 -2.555 1.00 0.00 C ATOM 593 CG2 ILE B 31 -4.065 3.924 -2.975 1.00 0.00 C ATOM 594 CD1 ILE B 31 -2.221 1.447 -2.647 1.00 0.00 C ATOM 0 H ILE B 31 -5.410 0.476 -4.453 1.00 0.00 H new ATOM 0 HA ILE B 31 -6.290 2.332 -2.517 1.00 0.00 H new ATOM 0 HB ILE B 31 -3.960 2.410 -4.472 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -4.016 1.680 -1.524 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -4.118 0.491 -2.807 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -2.985 4.068 -2.937 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -4.504 4.653 -3.655 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -4.484 4.059 -1.978 1.00 0.00 H new ATOM 0 HD11 ILE B 31 -1.830 0.685 -1.972 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -1.924 1.213 -3.669 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -1.820 2.421 -2.366 1.00 0.00 H new ATOM 606 N HIS B 32 -6.568 3.196 -5.660 1.00 0.00 N ATOM 607 CA HIS B 32 -7.209 4.143 -6.560 1.00 0.00 C ATOM 608 C HIS B 32 -8.692 4.224 -6.235 1.00 0.00 C ATOM 609 O HIS B 32 -9.295 5.289 -6.307 1.00 0.00 O ATOM 610 CB HIS B 32 -7.010 3.735 -8.024 1.00 0.00 C ATOM 611 CG HIS B 32 -7.409 4.798 -9.007 1.00 0.00 C ATOM 612 ND1 HIS B 32 -8.551 4.733 -9.775 1.00 0.00 N ATOM 613 CD2 HIS B 32 -6.804 5.963 -9.340 1.00 0.00 C ATOM 614 CE1 HIS B 32 -8.628 5.809 -10.536 1.00 0.00 C ATOM 615 NE2 HIS B 32 -7.581 6.572 -10.291 1.00 0.00 N ATOM 0 H HIS B 32 -6.149 2.389 -6.123 1.00 0.00 H new ATOM 0 HA HIS B 32 -6.750 5.122 -6.421 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -5.962 3.482 -8.182 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -7.589 2.833 -8.223 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -5.879 6.343 -8.931 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -9.416 6.028 -11.241 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -7.382 7.468 -10.736 1.00 0.00 H new ATOM 624 N SER B 33 -9.257 3.091 -5.842 1.00 0.00 N ATOM 625 CA SER B 33 -10.669 3.010 -5.505 1.00 0.00 C ATOM 626 C SER B 33 -10.956 3.642 -4.143 1.00 0.00 C ATOM 627 O SER B 33 -12.081 4.042 -3.873 1.00 0.00 O ATOM 628 CB SER B 33 -11.124 1.551 -5.518 1.00 0.00 C ATOM 629 OG SER B 33 -10.808 0.932 -6.756 1.00 0.00 O ATOM 0 H SER B 33 -8.753 2.209 -5.749 1.00 0.00 H new ATOM 0 HA SER B 33 -11.229 3.569 -6.255 1.00 0.00 H new ATOM 0 HB2 SER B 33 -10.644 1.009 -4.703 1.00 0.00 H new ATOM 0 HB3 SER B 33 -12.199 1.500 -5.345 1.00 0.00 H new ATOM 0 HG SER B 33 -9.899 0.568 -6.717 1.00 0.00 H new ATOM 635 N ILE B 34 -9.943 3.737 -3.288 1.00 0.00 N ATOM 636 CA ILE B 34 -10.120 4.363 -1.980 1.00 0.00 C ATOM 637 C ILE B 34 -10.224 5.871 -2.117 1.00 0.00 C ATOM 638 O ILE B 34 -11.115 6.496 -1.557 1.00 0.00 O ATOM 639 CB ILE B 34 -8.960 4.049 -1.013 1.00 0.00 C ATOM 640 CG1 ILE B 34 -8.850 2.541 -0.774 1.00 0.00 C ATOM 641 CG2 ILE B 34 -9.161 4.788 0.310 1.00 0.00 C ATOM 642 CD1 ILE B 34 -10.059 1.944 -0.083 1.00 0.00 C ATOM 0 H ILE B 34 -9.001 3.393 -3.473 1.00 0.00 H new ATOM 0 HA ILE B 34 -11.041 3.949 -1.569 1.00 0.00 H new ATOM 0 HB ILE B 34 -8.029 4.391 -1.466 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -8.705 2.040 -1.731 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -7.963 2.341 -0.172 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -8.336 4.558 0.984 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -9.191 5.862 0.126 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -10.100 4.471 0.765 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -9.909 0.873 0.052 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -10.193 2.417 0.890 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -10.946 2.112 -0.693 1.00 0.00 H new ATOM 654 N HIS B 35 -9.299 6.454 -2.858 1.00 0.00 N ATOM 655 CA HIS B 35 -9.265 7.898 -3.015 1.00 0.00 C ATOM 656 C HIS B 35 -10.382 8.354 -3.943 1.00 0.00 C ATOM 657 O HIS B 35 -10.922 9.450 -3.794 1.00 0.00 O ATOM 658 CB HIS B 35 -7.906 8.332 -3.557 1.00 0.00 C ATOM 659 CG HIS B 35 -7.657 9.811 -3.460 1.00 0.00 C ATOM 660 ND1 HIS B 35 -7.587 10.638 -4.561 1.00 0.00 N ATOM 661 CD2 HIS B 35 -7.445 10.607 -2.384 1.00 0.00 C ATOM 662 CE1 HIS B 35 -7.340 11.874 -4.166 1.00 0.00 C ATOM 663 NE2 HIS B 35 -7.251 11.881 -2.852 1.00 0.00 N ATOM 0 H HIS B 35 -8.565 5.953 -3.358 1.00 0.00 H new ATOM 0 HA HIS B 35 -9.416 8.364 -2.041 1.00 0.00 H new ATOM 0 HB2 HIS B 35 -7.123 7.805 -3.012 1.00 0.00 H new ATOM 0 HB3 HIS B 35 -7.828 8.028 -4.601 1.00 0.00 H new ATOM 0 HD2 HIS B 35 -7.431 10.296 -1.350 1.00 0.00 H new ATOM 0 HE1 HIS B 35 -7.230 12.733 -4.811 1.00 0.00 H new ATOM 0 HE2 HIS B 35 -7.067 12.702 -2.275 1.00 0.00 H new ATOM 672 N ASP B 36 -10.724 7.498 -4.893 1.00 0.00 N ATOM 673 CA ASP B 36 -11.787 7.798 -5.844 1.00 0.00 C ATOM 674 C ASP B 36 -13.158 7.537 -5.222 1.00 0.00 C ATOM 675 O ASP B 36 -14.085 8.326 -5.403 1.00 0.00 O ATOM 676 CB ASP B 36 -11.611 6.969 -7.118 1.00 0.00 C ATOM 677 CG ASP B 36 -12.468 7.461 -8.269 1.00 0.00 C ATOM 678 OD1 ASP B 36 -12.146 8.524 -8.843 1.00 0.00 O ATOM 679 OD2 ASP B 36 -13.441 6.774 -8.630 1.00 0.00 O ATOM 0 H ASP B 36 -10.282 6.589 -5.027 1.00 0.00 H new ATOM 0 HA ASP B 36 -11.726 8.855 -6.105 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -10.563 6.991 -7.417 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -11.860 5.929 -6.906 1.00 0.00 H new ATOM 684 N ASP B 37 -13.290 6.435 -4.486 1.00 0.00 N ATOM 685 CA ASP B 37 -14.512 6.119 -3.781 1.00 0.00 C ATOM 686 C ASP B 37 -14.267 5.995 -2.277 1.00 0.00 C ATOM 687 O ASP B 37 -14.361 4.899 -1.721 1.00 0.00 O ATOM 688 CB ASP B 37 -15.069 4.802 -4.303 1.00 0.00 C ATOM 689 CG ASP B 37 -15.778 4.940 -5.629 1.00 0.00 C ATOM 690 OD1 ASP B 37 -15.252 4.444 -6.645 1.00 0.00 O ATOM 691 OD2 ASP B 37 -16.874 5.537 -5.662 1.00 0.00 O ATOM 0 H ASP B 37 -12.550 5.743 -4.367 1.00 0.00 H new ATOM 0 HA ASP B 37 -15.223 6.928 -3.951 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -14.254 4.086 -4.407 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -15.762 4.392 -3.569 1.00 0.00 H new ATOM 696 N PRO B 38 -13.971 7.107 -1.582 1.00 0.00 N ATOM 697 CA PRO B 38 -13.650 7.069 -0.153 1.00 0.00 C ATOM 698 C PRO B 38 -14.846 6.661 0.699 1.00 0.00 C ATOM 699 O PRO B 38 -14.686 6.102 1.783 1.00 0.00 O ATOM 700 CB PRO B 38 -13.217 8.501 0.156 1.00 0.00 C ATOM 701 CG PRO B 38 -13.901 9.328 -0.877 1.00 0.00 C ATOM 702 CD PRO B 38 -13.919 8.481 -2.117 1.00 0.00 C ATOM 0 HA PRO B 38 -12.883 6.329 0.075 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.514 8.797 1.162 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -12.134 8.610 0.098 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -14.912 9.589 -0.565 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -13.368 10.263 -1.048 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -14.783 8.702 -2.744 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.031 8.642 -2.728 1.00 0.00 H new ATOM 710 N SER B 39 -16.045 6.923 0.198 1.00 0.00 N ATOM 711 CA SER B 39 -17.261 6.522 0.893 1.00 0.00 C ATOM 712 C SER B 39 -17.426 5.004 0.854 1.00 0.00 C ATOM 713 O SER B 39 -18.028 4.409 1.749 1.00 0.00 O ATOM 714 CB SER B 39 -18.479 7.204 0.270 1.00 0.00 C ATOM 715 OG SER B 39 -18.337 8.615 0.294 1.00 0.00 O ATOM 0 H SER B 39 -16.202 7.410 -0.684 1.00 0.00 H new ATOM 0 HA SER B 39 -17.181 6.834 1.934 1.00 0.00 H new ATOM 0 HB2 SER B 39 -18.604 6.865 -0.758 1.00 0.00 H new ATOM 0 HB3 SER B 39 -19.379 6.916 0.813 1.00 0.00 H new ATOM 0 HG SER B 39 -19.127 9.030 -0.111 1.00 0.00 H new ATOM 721 N GLN B 40 -16.885 4.379 -0.187 1.00 0.00 N ATOM 722 CA GLN B 40 -16.946 2.939 -0.335 1.00 0.00 C ATOM 723 C GLN B 40 -15.746 2.249 0.300 1.00 0.00 C ATOM 724 O GLN B 40 -15.694 1.026 0.306 1.00 0.00 O ATOM 725 CB GLN B 40 -17.023 2.545 -1.807 1.00 0.00 C ATOM 726 CG GLN B 40 -18.180 3.174 -2.544 1.00 0.00 C ATOM 727 CD GLN B 40 -18.582 2.391 -3.779 1.00 0.00 C ATOM 728 OE1 GLN B 40 -18.054 2.778 -4.928 1.00 0.00 O flip ATOM 729 NE2 GLN B 40 -19.383 1.458 -3.703 1.00 0.00 N flip ATOM 0 H GLN B 40 -16.396 4.857 -0.944 1.00 0.00 H new ATOM 0 HA GLN B 40 -17.849 2.612 0.181 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -16.093 2.829 -2.299 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -17.104 1.460 -1.880 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -19.035 3.250 -1.872 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -17.912 4.190 -2.834 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -19.768 1.189 -2.798 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -19.661 0.954 -4.545 1.00 0.00 H new ATOM 738 N SER B 41 -14.774 3.029 0.787 1.00 0.00 N ATOM 739 CA SER B 41 -13.503 2.491 1.300 1.00 0.00 C ATOM 740 C SER B 41 -13.691 1.222 2.140 1.00 0.00 C ATOM 741 O SER B 41 -12.954 0.250 1.969 1.00 0.00 O ATOM 742 CB SER B 41 -12.771 3.559 2.119 1.00 0.00 C ATOM 743 OG SER B 41 -13.597 4.071 3.151 1.00 0.00 O ATOM 0 H SER B 41 -14.843 4.045 0.838 1.00 0.00 H new ATOM 0 HA SER B 41 -12.903 2.214 0.433 1.00 0.00 H new ATOM 0 HB2 SER B 41 -11.866 3.132 2.552 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.458 4.372 1.464 1.00 0.00 H new ATOM 0 HG SER B 41 -14.278 4.660 2.763 1.00 0.00 H new ATOM 749 N ALA B 42 -14.694 1.235 3.020 1.00 0.00 N ATOM 750 CA ALA B 42 -15.028 0.079 3.857 1.00 0.00 C ATOM 751 C ALA B 42 -15.212 -1.187 3.025 1.00 0.00 C ATOM 752 O ALA B 42 -14.789 -2.273 3.411 1.00 0.00 O ATOM 753 CB ALA B 42 -16.302 0.360 4.625 1.00 0.00 C ATOM 0 H ALA B 42 -15.296 2.044 3.173 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.198 -0.084 4.545 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.549 -0.500 5.247 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.160 1.236 5.258 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -17.116 0.547 3.924 1.00 0.00 H new ATOM 759 N ASN B 43 -15.848 -1.025 1.883 1.00 0.00 N ATOM 760 CA ASN B 43 -16.115 -2.130 0.974 1.00 0.00 C ATOM 761 C ASN B 43 -14.876 -2.469 0.156 1.00 0.00 C ATOM 762 O ASN B 43 -14.601 -3.636 -0.109 1.00 0.00 O ATOM 763 CB ASN B 43 -17.278 -1.779 0.040 1.00 0.00 C ATOM 764 CG ASN B 43 -17.549 -2.856 -0.996 1.00 0.00 C ATOM 765 OD1 ASN B 43 -18.281 -3.809 -0.736 1.00 0.00 O ATOM 766 ND2 ASN B 43 -16.982 -2.705 -2.185 1.00 0.00 N ATOM 0 H ASN B 43 -16.196 -0.124 1.555 1.00 0.00 H new ATOM 0 HA ASN B 43 -16.386 -3.002 1.569 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -18.178 -1.618 0.633 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -17.059 -0.840 -0.468 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -17.148 -3.393 -2.920 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -16.380 -1.901 -2.365 1.00 0.00 H new ATOM 773 N LEU B 44 -14.123 -1.447 -0.234 1.00 0.00 N ATOM 774 CA LEU B 44 -12.934 -1.658 -1.049 1.00 0.00 C ATOM 775 C LEU B 44 -11.878 -2.466 -0.301 1.00 0.00 C ATOM 776 O LEU B 44 -11.237 -3.336 -0.889 1.00 0.00 O ATOM 777 CB LEU B 44 -12.333 -0.336 -1.548 1.00 0.00 C ATOM 778 CG LEU B 44 -13.016 0.293 -2.775 1.00 0.00 C ATOM 779 CD1 LEU B 44 -13.497 -0.779 -3.736 1.00 0.00 C ATOM 780 CD2 LEU B 44 -14.165 1.194 -2.370 1.00 0.00 C ATOM 0 H LEU B 44 -14.313 -0.472 -0.001 1.00 0.00 H new ATOM 0 HA LEU B 44 -13.255 -2.230 -1.920 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -12.362 0.385 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.283 -0.504 -1.787 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.272 0.906 -3.284 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.976 -0.309 -4.595 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.647 -1.372 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -14.213 -1.426 -3.230 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.624 1.621 -3.262 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -14.907 0.613 -1.822 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -13.791 1.997 -1.734 1.00 0.00 H new ATOM 792 N LEU B 45 -11.698 -2.214 0.994 1.00 0.00 N ATOM 793 CA LEU B 45 -10.694 -2.961 1.733 1.00 0.00 C ATOM 794 C LEU B 45 -11.295 -4.264 2.246 1.00 0.00 C ATOM 795 O LEU B 45 -10.575 -5.198 2.589 1.00 0.00 O ATOM 796 CB LEU B 45 -10.071 -2.135 2.870 1.00 0.00 C ATOM 797 CG LEU B 45 -10.714 -2.274 4.247 1.00 0.00 C ATOM 798 CD1 LEU B 45 -9.722 -1.876 5.322 1.00 0.00 C ATOM 799 CD2 LEU B 45 -11.961 -1.421 4.360 1.00 0.00 C ATOM 0 H LEU B 45 -12.217 -1.522 1.535 1.00 0.00 H new ATOM 0 HA LEU B 45 -9.877 -3.197 1.051 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -9.020 -2.411 2.955 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -10.102 -1.084 2.584 1.00 0.00 H new ATOM 0 HG LEU B 45 -11.001 -3.317 4.382 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -10.188 -1.978 6.302 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -8.847 -2.523 5.267 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -9.417 -0.840 5.171 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -12.396 -1.542 5.352 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -11.701 -0.374 4.203 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -12.684 -1.732 3.607 1.00 0.00 H new ATOM 811 N ALA B 46 -12.625 -4.323 2.272 1.00 0.00 N ATOM 812 CA ALA B 46 -13.333 -5.567 2.548 1.00 0.00 C ATOM 813 C ALA B 46 -12.945 -6.606 1.513 1.00 0.00 C ATOM 814 O ALA B 46 -12.659 -7.763 1.833 1.00 0.00 O ATOM 815 CB ALA B 46 -14.834 -5.343 2.507 1.00 0.00 C ATOM 0 H ALA B 46 -13.233 -3.521 2.105 1.00 0.00 H new ATOM 0 HA ALA B 46 -13.059 -5.917 3.543 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -15.348 -6.282 2.715 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -15.112 -4.603 3.257 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.121 -4.983 1.519 1.00 0.00 H new ATOM 821 N GLU B 47 -12.938 -6.161 0.266 1.00 0.00 N ATOM 822 CA GLU B 47 -12.502 -6.980 -0.848 1.00 0.00 C ATOM 823 C GLU B 47 -11.056 -7.363 -0.674 1.00 0.00 C ATOM 824 O GLU B 47 -10.707 -8.528 -0.766 1.00 0.00 O ATOM 825 CB GLU B 47 -12.663 -6.215 -2.153 1.00 0.00 C ATOM 826 CG GLU B 47 -14.085 -5.802 -2.416 1.00 0.00 C ATOM 827 CD GLU B 47 -15.015 -6.984 -2.610 1.00 0.00 C ATOM 828 OE1 GLU B 47 -15.641 -7.423 -1.626 1.00 0.00 O ATOM 829 OE2 GLU B 47 -15.132 -7.475 -3.754 1.00 0.00 O ATOM 0 H GLU B 47 -13.235 -5.222 0.001 1.00 0.00 H new ATOM 0 HA GLU B 47 -13.115 -7.881 -0.877 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -12.031 -5.328 -2.129 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -12.311 -6.835 -2.978 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -14.443 -5.197 -1.583 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -14.117 -5.171 -3.304 1.00 0.00 H new ATOM 836 N ALA B 48 -10.227 -6.365 -0.411 1.00 0.00 N ATOM 837 CA ALA B 48 -8.795 -6.575 -0.227 1.00 0.00 C ATOM 838 C ALA B 48 -8.506 -7.658 0.809 1.00 0.00 C ATOM 839 O ALA B 48 -7.574 -8.445 0.646 1.00 0.00 O ATOM 840 CB ALA B 48 -8.113 -5.289 0.176 1.00 0.00 C ATOM 0 H ALA B 48 -10.522 -5.393 -0.319 1.00 0.00 H new ATOM 0 HA ALA B 48 -8.397 -6.909 -1.185 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -7.046 -5.469 0.308 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -8.261 -4.539 -0.601 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -8.539 -4.929 1.113 1.00 0.00 H new ATOM 846 N LYS B 49 -9.312 -7.693 1.867 1.00 0.00 N ATOM 847 CA LYS B 49 -9.165 -8.698 2.913 1.00 0.00 C ATOM 848 C LYS B 49 -9.441 -10.096 2.369 1.00 0.00 C ATOM 849 O LYS B 49 -8.808 -11.067 2.780 1.00 0.00 O ATOM 850 CB LYS B 49 -10.098 -8.390 4.088 1.00 0.00 C ATOM 851 CG LYS B 49 -9.736 -7.115 4.826 1.00 0.00 C ATOM 852 CD LYS B 49 -10.819 -6.670 5.806 1.00 0.00 C ATOM 853 CE LYS B 49 -10.911 -7.561 7.043 1.00 0.00 C ATOM 854 NZ LYS B 49 -11.603 -8.851 6.781 1.00 0.00 N ATOM 0 H LYS B 49 -10.075 -7.034 2.022 1.00 0.00 H new ATOM 0 HA LYS B 49 -8.135 -8.668 3.268 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -11.121 -8.310 3.719 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -10.076 -9.225 4.788 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -8.803 -7.267 5.368 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.559 -6.320 4.102 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.619 -5.645 6.118 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -11.782 -6.666 5.296 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -9.906 -7.763 7.414 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -11.440 -7.025 7.831 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -12.279 -9.044 7.547 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -12.112 -8.794 5.876 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -10.902 -9.618 6.737 1.00 0.00 H new ATOM 868 N LYS B 50 -10.382 -10.197 1.441 1.00 0.00 N ATOM 869 CA LYS B 50 -10.672 -11.470 0.803 1.00 0.00 C ATOM 870 C LYS B 50 -9.675 -11.717 -0.326 1.00 0.00 C ATOM 871 O LYS B 50 -9.364 -12.859 -0.663 1.00 0.00 O ATOM 872 CB LYS B 50 -12.100 -11.486 0.256 1.00 0.00 C ATOM 873 CG LYS B 50 -12.523 -12.843 -0.283 1.00 0.00 C ATOM 874 CD LYS B 50 -12.658 -13.867 0.834 1.00 0.00 C ATOM 875 CE LYS B 50 -12.764 -15.281 0.289 1.00 0.00 C ATOM 876 NZ LYS B 50 -11.485 -15.734 -0.321 1.00 0.00 N ATOM 0 H LYS B 50 -10.954 -9.417 1.116 1.00 0.00 H new ATOM 0 HA LYS B 50 -10.581 -12.263 1.545 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -12.788 -11.187 1.047 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -12.186 -10.745 -0.538 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -13.474 -12.747 -0.808 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -11.791 -13.191 -1.011 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -11.797 -13.797 1.499 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -13.541 -13.640 1.431 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -13.044 -15.961 1.094 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -13.558 -15.325 -0.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -11.521 -16.761 -0.481 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -11.342 -15.247 -1.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -10.697 -15.511 0.320 1.00 0.00 H new ATOM 890 N LEU B 51 -9.181 -10.627 -0.895 1.00 0.00 N ATOM 891 CA LEU B 51 -8.196 -10.669 -1.958 1.00 0.00 C ATOM 892 C LEU B 51 -6.907 -11.323 -1.467 1.00 0.00 C ATOM 893 O LEU B 51 -6.497 -12.358 -1.997 1.00 0.00 O ATOM 894 CB LEU B 51 -7.910 -9.251 -2.453 1.00 0.00 C ATOM 895 CG LEU B 51 -8.450 -8.882 -3.833 1.00 0.00 C ATOM 896 CD1 LEU B 51 -9.976 -8.841 -3.842 1.00 0.00 C ATOM 897 CD2 LEU B 51 -7.883 -7.544 -4.291 1.00 0.00 C ATOM 0 H LEU B 51 -9.457 -9.682 -0.627 1.00 0.00 H new ATOM 0 HA LEU B 51 -8.592 -11.263 -2.781 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -8.321 -8.549 -1.728 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.830 -9.105 -2.461 1.00 0.00 H new ATOM 0 HG LEU B 51 -8.130 -9.656 -4.530 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -10.327 -8.575 -4.839 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -10.368 -9.821 -3.568 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -10.324 -8.098 -3.125 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -8.280 -7.299 -5.276 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -8.167 -6.767 -3.582 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.796 -7.608 -4.343 1.00 0.00 H new ATOM 909 N ASN B 52 -6.261 -10.730 -0.451 1.00 0.00 N ATOM 910 CA ASN B 52 -5.057 -11.337 0.120 1.00 0.00 C ATOM 911 C ASN B 52 -5.353 -12.734 0.665 1.00 0.00 C ATOM 912 O ASN B 52 -4.478 -13.592 0.686 1.00 0.00 O ATOM 913 CB ASN B 52 -4.445 -10.463 1.226 1.00 0.00 C ATOM 914 CG ASN B 52 -5.186 -10.535 2.555 1.00 0.00 C ATOM 915 OD1 ASN B 52 -6.102 -9.759 2.812 1.00 0.00 O ATOM 916 ND2 ASN B 52 -4.780 -11.456 3.418 1.00 0.00 N ATOM 0 H ASN B 52 -6.546 -9.851 -0.019 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.330 -11.419 -0.688 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -3.410 -10.765 1.382 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -4.427 -9.427 0.888 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -5.232 -11.536 4.329 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -4.016 -12.085 3.171 1.00 0.00 H new ATOM 923 N ASP B 53 -6.589 -12.953 1.095 1.00 0.00 N ATOM 924 CA ASP B 53 -7.010 -14.254 1.614 1.00 0.00 C ATOM 925 C ASP B 53 -7.004 -15.309 0.514 1.00 0.00 C ATOM 926 O ASP B 53 -6.607 -16.453 0.733 1.00 0.00 O ATOM 927 CB ASP B 53 -8.411 -14.145 2.226 1.00 0.00 C ATOM 928 CG ASP B 53 -9.008 -15.491 2.588 1.00 0.00 C ATOM 929 OD1 ASP B 53 -9.791 -16.037 1.777 1.00 0.00 O ATOM 930 OD2 ASP B 53 -8.709 -16.004 3.686 1.00 0.00 O ATOM 0 H ASP B 53 -7.323 -12.245 1.096 1.00 0.00 H new ATOM 0 HA ASP B 53 -6.302 -14.559 2.384 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -8.363 -13.523 3.120 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -9.071 -13.639 1.521 1.00 0.00 H new ATOM 935 N ALA B 54 -7.429 -14.909 -0.674 1.00 0.00 N ATOM 936 CA ALA B 54 -7.532 -15.822 -1.800 1.00 0.00 C ATOM 937 C ALA B 54 -6.159 -16.196 -2.342 1.00 0.00 C ATOM 938 O ALA B 54 -5.968 -17.289 -2.873 1.00 0.00 O ATOM 939 CB ALA B 54 -8.381 -15.202 -2.895 1.00 0.00 C ATOM 0 H ALA B 54 -7.710 -13.951 -0.883 1.00 0.00 H new ATOM 0 HA ALA B 54 -8.010 -16.737 -1.450 1.00 0.00 H new ATOM 0 HB1 ALA B 54 -8.453 -15.893 -3.735 1.00 0.00 H new ATOM 0 HB2 ALA B 54 -9.379 -14.995 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA B 54 -7.922 -14.272 -3.229 1.00 0.00 H new ATOM 945 N GLN B 55 -5.200 -15.294 -2.201 1.00 0.00 N ATOM 946 CA GLN B 55 -3.863 -15.534 -2.721 1.00 0.00 C ATOM 947 C GLN B 55 -2.867 -15.749 -1.588 1.00 0.00 C ATOM 948 O GLN B 55 -1.672 -15.496 -1.747 1.00 0.00 O ATOM 949 CB GLN B 55 -3.411 -14.371 -3.604 1.00 0.00 C ATOM 950 CG GLN B 55 -4.402 -14.018 -4.700 1.00 0.00 C ATOM 951 CD GLN B 55 -3.821 -13.076 -5.734 1.00 0.00 C ATOM 952 OE1 GLN B 55 -2.628 -13.118 -6.033 1.00 0.00 O ATOM 953 NE2 GLN B 55 -4.659 -12.217 -6.287 1.00 0.00 N ATOM 0 H GLN B 55 -5.321 -14.395 -1.734 1.00 0.00 H new ATOM 0 HA GLN B 55 -3.898 -16.440 -3.325 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -3.246 -13.494 -2.978 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -2.453 -14.622 -4.059 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -4.733 -14.932 -5.193 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -5.284 -13.560 -4.253 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -5.641 -12.214 -6.012 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -4.324 -11.557 -6.989 1.00 0.00 H new ATOM 962 N ALA B 56 -3.365 -16.200 -0.444 1.00 0.00 N ATOM 963 CA ALA B 56 -2.524 -16.491 0.700 1.00 0.00 C ATOM 964 C ALA B 56 -1.923 -17.888 0.582 1.00 0.00 C ATOM 965 O ALA B 56 -2.626 -18.867 0.910 1.00 0.00 O ATOM 966 CB ALA B 56 -3.351 -16.372 1.963 1.00 0.00 C ATOM 0 H ALA B 56 -4.358 -16.372 -0.288 1.00 0.00 H new ATOM 0 HA ALA B 56 -1.702 -15.776 0.737 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.726 -16.589 2.829 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.746 -15.359 2.045 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.178 -17.082 1.925 1.00 0.00 H new TER 972 ALA B 56 ATOM 973 N GLY C 13 13.685 -3.556 8.180 1.00 0.00 N ATOM 974 CA GLY C 13 12.919 -4.822 8.221 1.00 0.00 C ATOM 975 C GLY C 13 11.982 -4.888 9.408 1.00 0.00 C ATOM 976 O GLY C 13 12.374 -5.322 10.492 1.00 0.00 O ATOM 0 HA2 GLY C 13 12.344 -4.926 7.301 1.00 0.00 H new ATOM 0 HA3 GLY C 13 13.612 -5.662 8.261 1.00 0.00 H new ATOM 980 N GLY C 14 10.749 -4.440 9.213 1.00 0.00 N ATOM 981 CA GLY C 14 9.752 -4.541 10.261 1.00 0.00 C ATOM 982 C GLY C 14 9.202 -3.197 10.686 1.00 0.00 C ATOM 983 O GLY C 14 8.281 -3.132 11.501 1.00 0.00 O ATOM 0 H GLY C 14 10.421 -4.009 8.349 1.00 0.00 H new ATOM 0 HA2 GLY C 14 8.932 -5.170 9.915 1.00 0.00 H new ATOM 0 HA3 GLY C 14 10.191 -5.038 11.126 1.00 0.00 H new ATOM 987 N GLU C 15 9.755 -2.123 10.140 1.00 0.00 N ATOM 988 CA GLU C 15 9.268 -0.792 10.451 1.00 0.00 C ATOM 989 C GLU C 15 8.005 -0.490 9.677 1.00 0.00 C ATOM 990 O GLU C 15 7.797 -0.996 8.571 1.00 0.00 O ATOM 991 CB GLU C 15 10.314 0.288 10.165 1.00 0.00 C ATOM 992 CG GLU C 15 10.905 0.267 8.765 1.00 0.00 C ATOM 993 CD GLU C 15 11.931 -0.830 8.555 1.00 0.00 C ATOM 994 OE1 GLU C 15 11.549 -1.941 8.139 1.00 0.00 O ATOM 995 OE2 GLU C 15 13.129 -0.588 8.808 1.00 0.00 O ATOM 0 H GLU C 15 10.536 -2.149 9.484 1.00 0.00 H new ATOM 0 HA GLU C 15 9.053 -0.778 11.520 1.00 0.00 H new ATOM 0 HB2 GLU C 15 9.860 1.264 10.335 1.00 0.00 H new ATOM 0 HB3 GLU C 15 11.125 0.184 10.885 1.00 0.00 H new ATOM 0 HG2 GLU C 15 10.099 0.143 8.041 1.00 0.00 H new ATOM 0 HG3 GLU C 15 11.370 1.232 8.562 1.00 0.00 H new ATOM 1002 N ILE C 16 7.179 0.352 10.259 1.00 0.00 N ATOM 1003 CA ILE C 16 5.909 0.707 9.651 1.00 0.00 C ATOM 1004 C ILE C 16 6.064 1.987 8.852 1.00 0.00 C ATOM 1005 O ILE C 16 6.495 3.015 9.378 1.00 0.00 O ATOM 1006 CB ILE C 16 4.779 0.886 10.688 1.00 0.00 C ATOM 1007 CG1 ILE C 16 4.654 -0.366 11.561 1.00 0.00 C ATOM 1008 CG2 ILE C 16 3.465 1.176 9.979 1.00 0.00 C ATOM 1009 CD1 ILE C 16 3.367 -0.437 12.359 1.00 0.00 C ATOM 0 H ILE C 16 7.362 0.806 11.154 1.00 0.00 H new ATOM 0 HA ILE C 16 5.626 -0.120 9.000 1.00 0.00 H new ATOM 0 HB ILE C 16 5.022 1.730 11.333 1.00 0.00 H new ATOM 0 HG12 ILE C 16 4.724 -1.248 10.925 1.00 0.00 H new ATOM 0 HG13 ILE C 16 5.498 -0.402 12.249 1.00 0.00 H new ATOM 0 HG21 ILE C 16 2.673 1.301 10.717 1.00 0.00 H new ATOM 0 HG22 ILE C 16 3.562 2.090 9.393 1.00 0.00 H new ATOM 0 HG23 ILE C 16 3.217 0.345 9.318 1.00 0.00 H new ATOM 0 HD11 ILE C 16 3.356 -1.352 12.950 1.00 0.00 H new ATOM 0 HD12 ILE C 16 3.303 0.425 13.023 1.00 0.00 H new ATOM 0 HD13 ILE C 16 2.516 -0.435 11.678 1.00 0.00 H new ATOM 1021 N VAL C 17 5.709 1.926 7.582 1.00 0.00 N ATOM 1022 CA VAL C 17 5.929 3.035 6.686 1.00 0.00 C ATOM 1023 C VAL C 17 4.611 3.421 6.014 1.00 0.00 C ATOM 1024 O VAL C 17 4.278 2.931 4.944 1.00 0.00 O ATOM 1025 CB VAL C 17 6.989 2.653 5.627 1.00 0.00 C ATOM 1026 CG1 VAL C 17 7.306 3.811 4.714 1.00 0.00 C ATOM 1027 CG2 VAL C 17 8.256 2.154 6.283 1.00 0.00 C ATOM 0 H VAL C 17 5.266 1.115 7.151 1.00 0.00 H new ATOM 0 HA VAL C 17 6.298 3.891 7.251 1.00 0.00 H new ATOM 0 HB VAL C 17 6.563 1.850 5.025 1.00 0.00 H new ATOM 0 HG11 VAL C 17 8.055 3.504 3.984 1.00 0.00 H new ATOM 0 HG12 VAL C 17 6.400 4.124 4.195 1.00 0.00 H new ATOM 0 HG13 VAL C 17 7.693 4.643 5.302 1.00 0.00 H new ATOM 0 HG21 VAL C 17 8.984 1.892 5.515 1.00 0.00 H new ATOM 0 HG22 VAL C 17 8.667 2.936 6.922 1.00 0.00 H new ATOM 0 HG23 VAL C 17 8.032 1.274 6.885 1.00 0.00 H new ATOM 1037 N TYR C 18 3.858 4.298 6.662 1.00 0.00 N ATOM 1038 CA TYR C 18 2.557 4.725 6.154 1.00 0.00 C ATOM 1039 C TYR C 18 2.707 5.828 5.118 1.00 0.00 C ATOM 1040 O TYR C 18 3.409 6.812 5.352 1.00 0.00 O ATOM 1041 CB TYR C 18 1.670 5.219 7.301 1.00 0.00 C ATOM 1042 CG TYR C 18 0.618 4.226 7.736 1.00 0.00 C ATOM 1043 CD1 TYR C 18 -0.706 4.380 7.347 1.00 0.00 C ATOM 1044 CD2 TYR C 18 0.944 3.137 8.531 1.00 0.00 C ATOM 1045 CE1 TYR C 18 -1.674 3.477 7.739 1.00 0.00 C ATOM 1046 CE2 TYR C 18 -0.018 2.229 8.927 1.00 0.00 C ATOM 1047 CZ TYR C 18 -1.325 2.403 8.527 1.00 0.00 C ATOM 1048 OH TYR C 18 -2.286 1.503 8.922 1.00 0.00 O ATOM 0 H TYR C 18 4.125 4.731 7.546 1.00 0.00 H new ATOM 0 HA TYR C 18 2.089 3.863 5.680 1.00 0.00 H new ATOM 0 HB2 TYR C 18 2.301 5.462 8.156 1.00 0.00 H new ATOM 0 HB3 TYR C 18 1.179 6.143 6.995 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -0.983 5.220 6.728 1.00 0.00 H new ATOM 0 HD2 TYR C 18 1.968 2.997 8.846 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -2.700 3.612 7.429 1.00 0.00 H new ATOM 0 HE2 TYR C 18 0.253 1.387 9.547 1.00 0.00 H new ATOM 0 HH TYR C 18 -1.874 0.805 9.472 1.00 0.00 H new ATOM 1058 N LEU C 19 2.056 5.656 3.971 1.00 0.00 N ATOM 1059 CA LEU C 19 2.041 6.684 2.939 1.00 0.00 C ATOM 1060 C LEU C 19 0.636 6.886 2.369 1.00 0.00 C ATOM 1061 O LEU C 19 0.410 6.670 1.182 1.00 0.00 O ATOM 1062 CB LEU C 19 3.009 6.337 1.803 1.00 0.00 C ATOM 1063 CG LEU C 19 4.478 6.330 2.181 1.00 0.00 C ATOM 1064 CD1 LEU C 19 4.909 4.970 2.662 1.00 0.00 C ATOM 1065 CD2 LEU C 19 5.308 6.743 1.005 1.00 0.00 C ATOM 0 H LEU C 19 1.532 4.813 3.734 1.00 0.00 H new ATOM 0 HA LEU C 19 2.362 7.613 3.410 1.00 0.00 H new ATOM 0 HB2 LEU C 19 2.747 5.354 1.412 1.00 0.00 H new ATOM 0 HB3 LEU C 19 2.863 7.051 0.993 1.00 0.00 H new ATOM 0 HG LEU C 19 4.624 7.040 2.995 1.00 0.00 H new ATOM 0 HD11 LEU C 19 5.966 4.996 2.926 1.00 0.00 H new ATOM 0 HD12 LEU C 19 4.323 4.691 3.538 1.00 0.00 H new ATOM 0 HD13 LEU C 19 4.750 4.237 1.871 1.00 0.00 H new ATOM 0 HD21 LEU C 19 6.362 6.736 1.283 1.00 0.00 H new ATOM 0 HD22 LEU C 19 5.145 6.047 0.182 1.00 0.00 H new ATOM 0 HD23 LEU C 19 5.022 7.747 0.693 1.00 0.00 H new ATOM 1077 N PRO C 20 -0.327 7.327 3.198 1.00 0.00 N ATOM 1078 CA PRO C 20 -1.695 7.570 2.742 1.00 0.00 C ATOM 1079 C PRO C 20 -1.833 8.931 2.069 1.00 0.00 C ATOM 1080 O PRO C 20 -2.872 9.256 1.496 1.00 0.00 O ATOM 1081 CB PRO C 20 -2.497 7.522 4.037 1.00 0.00 C ATOM 1082 CG PRO C 20 -1.557 8.029 5.077 1.00 0.00 C ATOM 1083 CD PRO C 20 -0.174 7.619 4.639 1.00 0.00 C ATOM 0 HA PRO C 20 -2.026 6.849 1.995 1.00 0.00 H new ATOM 0 HB2 PRO C 20 -3.391 8.142 3.974 1.00 0.00 H new ATOM 0 HB3 PRO C 20 -2.828 6.508 4.262 1.00 0.00 H new ATOM 0 HG2 PRO C 20 -1.629 9.113 5.170 1.00 0.00 H new ATOM 0 HG3 PRO C 20 -1.795 7.608 6.054 1.00 0.00 H new ATOM 0 HD2 PRO C 20 0.551 8.415 4.810 1.00 0.00 H new ATOM 0 HD3 PRO C 20 0.176 6.745 5.188 1.00 0.00 H new ATOM 1091 N ASN C 21 -0.768 9.719 2.148 1.00 0.00 N ATOM 1092 CA ASN C 21 -0.746 11.048 1.554 1.00 0.00 C ATOM 1093 C ASN C 21 -0.334 10.952 0.098 1.00 0.00 C ATOM 1094 O ASN C 21 -0.414 11.924 -0.654 1.00 0.00 O ATOM 1095 CB ASN C 21 0.220 11.960 2.310 1.00 0.00 C ATOM 1096 CG ASN C 21 -0.157 12.126 3.766 1.00 0.00 C ATOM 1097 OD1 ASN C 21 0.253 11.338 4.615 1.00 0.00 O ATOM 1098 ND2 ASN C 21 -0.937 13.148 4.064 1.00 0.00 N ATOM 0 H ASN C 21 0.097 9.457 2.621 1.00 0.00 H new ATOM 0 HA ASN C 21 -1.747 11.475 1.619 1.00 0.00 H new ATOM 0 HB2 ASN C 21 1.228 11.550 2.244 1.00 0.00 H new ATOM 0 HB3 ASN C 21 0.241 12.938 1.830 1.00 0.00 H new ATOM 0 HD21 ASN C 21 -1.222 13.307 5.030 1.00 0.00 H new ATOM 0 HD22 ASN C 21 -1.255 13.779 3.328 1.00 0.00 H new ATOM 1105 N LEU C 22 0.132 9.774 -0.286 1.00 0.00 N ATOM 1106 CA LEU C 22 0.451 9.499 -1.671 1.00 0.00 C ATOM 1107 C LEU C 22 -0.819 9.349 -2.480 1.00 0.00 C ATOM 1108 O LEU C 22 -1.791 8.741 -2.028 1.00 0.00 O ATOM 1109 CB LEU C 22 1.278 8.227 -1.806 1.00 0.00 C ATOM 1110 CG LEU C 22 2.729 8.307 -1.347 1.00 0.00 C ATOM 1111 CD1 LEU C 22 3.432 7.006 -1.676 1.00 0.00 C ATOM 1112 CD2 LEU C 22 3.450 9.472 -1.997 1.00 0.00 C ATOM 0 H LEU C 22 0.297 8.992 0.348 1.00 0.00 H new ATOM 0 HA LEU C 22 1.034 10.339 -2.048 1.00 0.00 H new ATOM 0 HB2 LEU C 22 0.784 7.437 -1.240 1.00 0.00 H new ATOM 0 HB3 LEU C 22 1.268 7.923 -2.853 1.00 0.00 H new ATOM 0 HG LEU C 22 2.743 8.470 -0.269 1.00 0.00 H new ATOM 0 HD11 LEU C 22 4.470 7.061 -1.349 1.00 0.00 H new ATOM 0 HD12 LEU C 22 2.933 6.183 -1.164 1.00 0.00 H new ATOM 0 HD13 LEU C 22 3.399 6.837 -2.752 1.00 0.00 H new ATOM 0 HD21 LEU C 22 4.482 9.501 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU C 22 3.436 9.350 -3.080 1.00 0.00 H new ATOM 0 HD23 LEU C 22 2.951 10.403 -1.730 1.00 0.00 H new ATOM 1124 N ASN C 23 -0.810 9.916 -3.667 1.00 0.00 N ATOM 1125 CA ASN C 23 -1.920 9.749 -4.583 1.00 0.00 C ATOM 1126 C ASN C 23 -1.778 8.411 -5.294 1.00 0.00 C ATOM 1127 O ASN C 23 -0.656 7.987 -5.587 1.00 0.00 O ATOM 1128 CB ASN C 23 -1.979 10.901 -5.595 1.00 0.00 C ATOM 1129 CG ASN C 23 -0.758 10.963 -6.490 1.00 0.00 C ATOM 1130 OD1 ASN C 23 -0.723 10.352 -7.557 1.00 0.00 O ATOM 1131 ND2 ASN C 23 0.249 11.710 -6.064 1.00 0.00 N ATOM 0 H ASN C 23 -0.049 10.496 -4.021 1.00 0.00 H new ATOM 0 HA ASN C 23 -2.854 9.764 -4.021 1.00 0.00 H new ATOM 0 HB2 ASN C 23 -2.870 10.790 -6.212 1.00 0.00 H new ATOM 0 HB3 ASN C 23 -2.078 11.845 -5.058 1.00 0.00 H new ATOM 0 HD21 ASN C 23 1.095 11.795 -6.628 1.00 0.00 H new ATOM 0 HD22 ASN C 23 0.179 12.200 -5.172 1.00 0.00 H new ATOM 1138 N PRO C 24 -2.901 7.713 -5.535 1.00 0.00 N ATOM 1139 CA PRO C 24 -2.912 6.375 -6.142 1.00 0.00 C ATOM 1140 C PRO C 24 -1.917 6.212 -7.289 1.00 0.00 C ATOM 1141 O PRO C 24 -1.111 5.284 -7.289 1.00 0.00 O ATOM 1142 CB PRO C 24 -4.338 6.263 -6.658 1.00 0.00 C ATOM 1143 CG PRO C 24 -5.145 7.039 -5.679 1.00 0.00 C ATOM 1144 CD PRO C 24 -4.268 8.175 -5.219 1.00 0.00 C ATOM 0 HA PRO C 24 -2.618 5.605 -5.428 1.00 0.00 H new ATOM 0 HB2 PRO C 24 -4.430 6.673 -7.664 1.00 0.00 H new ATOM 0 HB3 PRO C 24 -4.663 5.224 -6.706 1.00 0.00 H new ATOM 0 HG2 PRO C 24 -6.059 7.414 -6.139 1.00 0.00 H new ATOM 0 HG3 PRO C 24 -5.445 6.413 -4.838 1.00 0.00 H new ATOM 0 HD2 PRO C 24 -4.508 9.102 -5.740 1.00 0.00 H new ATOM 0 HD3 PRO C 24 -4.389 8.368 -4.153 1.00 0.00 H new ATOM 1152 N ASP C 25 -1.959 7.136 -8.243 1.00 0.00 N ATOM 1153 CA ASP C 25 -1.111 7.058 -9.434 1.00 0.00 C ATOM 1154 C ASP C 25 0.372 7.071 -9.076 1.00 0.00 C ATOM 1155 O ASP C 25 1.178 6.382 -9.703 1.00 0.00 O ATOM 1156 CB ASP C 25 -1.414 8.214 -10.389 1.00 0.00 C ATOM 1157 CG ASP C 25 -2.798 8.125 -10.995 1.00 0.00 C ATOM 1158 OD1 ASP C 25 -3.722 8.791 -10.484 1.00 0.00 O ATOM 1159 OD2 ASP C 25 -2.969 7.396 -11.992 1.00 0.00 O ATOM 0 H ASP C 25 -2.572 7.951 -8.217 1.00 0.00 H new ATOM 0 HA ASP C 25 -1.337 6.111 -9.925 1.00 0.00 H new ATOM 0 HB2 ASP C 25 -1.317 9.158 -9.852 1.00 0.00 H new ATOM 0 HB3 ASP C 25 -0.672 8.224 -11.188 1.00 0.00 H new ATOM 1164 N GLN C 26 0.726 7.838 -8.057 1.00 0.00 N ATOM 1165 CA GLN C 26 2.106 7.989 -7.655 1.00 0.00 C ATOM 1166 C GLN C 26 2.575 6.766 -6.868 1.00 0.00 C ATOM 1167 O GLN C 26 3.637 6.212 -7.148 1.00 0.00 O ATOM 1168 CB GLN C 26 2.248 9.282 -6.845 1.00 0.00 C ATOM 1169 CG GLN C 26 3.269 9.227 -5.732 1.00 0.00 C ATOM 1170 CD GLN C 26 4.698 9.078 -6.226 1.00 0.00 C ATOM 1171 OE1 GLN C 26 5.048 9.551 -7.306 1.00 0.00 O ATOM 1172 NE2 GLN C 26 5.529 8.414 -5.438 1.00 0.00 N ATOM 0 H GLN C 26 0.064 8.369 -7.491 1.00 0.00 H new ATOM 0 HA GLN C 26 2.745 8.059 -8.535 1.00 0.00 H new ATOM 0 HB2 GLN C 26 2.516 10.091 -7.524 1.00 0.00 H new ATOM 0 HB3 GLN C 26 1.278 9.533 -6.416 1.00 0.00 H new ATOM 0 HG2 GLN C 26 3.193 10.136 -5.135 1.00 0.00 H new ATOM 0 HG3 GLN C 26 3.032 8.392 -5.073 1.00 0.00 H new ATOM 0 HE21 GLN C 26 5.198 8.038 -4.550 1.00 0.00 H new ATOM 0 HE22 GLN C 26 6.500 8.279 -5.719 1.00 0.00 H new ATOM 1181 N LEU C 27 1.778 6.324 -5.902 1.00 0.00 N ATOM 1182 CA LEU C 27 2.155 5.162 -5.106 1.00 0.00 C ATOM 1183 C LEU C 27 2.057 3.889 -5.943 1.00 0.00 C ATOM 1184 O LEU C 27 2.681 2.877 -5.628 1.00 0.00 O ATOM 1185 CB LEU C 27 1.324 5.068 -3.812 1.00 0.00 C ATOM 1186 CG LEU C 27 -0.200 5.141 -3.959 1.00 0.00 C ATOM 1187 CD1 LEU C 27 -0.760 3.824 -4.467 1.00 0.00 C ATOM 1188 CD2 LEU C 27 -0.843 5.534 -2.633 1.00 0.00 C ATOM 0 H LEU C 27 0.882 6.744 -5.654 1.00 0.00 H new ATOM 0 HA LEU C 27 3.194 5.280 -4.799 1.00 0.00 H new ATOM 0 HB2 LEU C 27 1.572 4.129 -3.317 1.00 0.00 H new ATOM 0 HB3 LEU C 27 1.639 5.872 -3.147 1.00 0.00 H new ATOM 0 HG LEU C 27 -0.438 5.908 -4.696 1.00 0.00 H new ATOM 0 HD11 LEU C 27 -1.843 3.902 -4.563 1.00 0.00 H new ATOM 0 HD12 LEU C 27 -0.325 3.595 -5.440 1.00 0.00 H new ATOM 0 HD13 LEU C 27 -0.514 3.029 -3.763 1.00 0.00 H new ATOM 0 HD21 LEU C 27 -1.925 5.582 -2.753 1.00 0.00 H new ATOM 0 HD22 LEU C 27 -0.595 4.792 -1.874 1.00 0.00 H new ATOM 0 HD23 LEU C 27 -0.469 6.510 -2.322 1.00 0.00 H new ATOM 1200 N CYS C 28 1.288 3.961 -7.024 1.00 0.00 N ATOM 1201 CA CYS C 28 1.187 2.869 -7.980 1.00 0.00 C ATOM 1202 C CYS C 28 2.559 2.572 -8.572 1.00 0.00 C ATOM 1203 O CYS C 28 2.964 1.412 -8.694 1.00 0.00 O ATOM 1204 CB CYS C 28 0.197 3.237 -9.090 1.00 0.00 C ATOM 1205 SG CYS C 28 -0.136 1.902 -10.285 1.00 0.00 S ATOM 0 H CYS C 28 0.720 4.775 -7.260 1.00 0.00 H new ATOM 0 HA CYS C 28 0.824 1.977 -7.469 1.00 0.00 H new ATOM 0 HB2 CYS C 28 -0.745 3.540 -8.633 1.00 0.00 H new ATOM 0 HB3 CYS C 28 0.582 4.102 -9.630 1.00 0.00 H new ATOM 1210 N ALA C 29 3.285 3.634 -8.909 1.00 0.00 N ATOM 1211 CA ALA C 29 4.625 3.503 -9.455 1.00 0.00 C ATOM 1212 C ALA C 29 5.578 2.954 -8.403 1.00 0.00 C ATOM 1213 O ALA C 29 6.453 2.146 -8.704 1.00 0.00 O ATOM 1214 CB ALA C 29 5.118 4.844 -9.977 1.00 0.00 C ATOM 0 H ALA C 29 2.963 4.597 -8.812 1.00 0.00 H new ATOM 0 HA ALA C 29 4.593 2.800 -10.288 1.00 0.00 H new ATOM 0 HB1 ALA C 29 6.123 4.729 -10.383 1.00 0.00 H new ATOM 0 HB2 ALA C 29 4.448 5.198 -10.761 1.00 0.00 H new ATOM 0 HB3 ALA C 29 5.136 5.567 -9.162 1.00 0.00 H new ATOM 1220 N PHE C 30 5.380 3.381 -7.161 1.00 0.00 N ATOM 1221 CA PHE C 30 6.198 2.927 -6.050 1.00 0.00 C ATOM 1222 C PHE C 30 6.023 1.424 -5.828 1.00 0.00 C ATOM 1223 O PHE C 30 7.003 0.692 -5.695 1.00 0.00 O ATOM 1224 CB PHE C 30 5.832 3.734 -4.796 1.00 0.00 C ATOM 1225 CG PHE C 30 5.972 2.987 -3.503 1.00 0.00 C ATOM 1226 CD1 PHE C 30 4.846 2.498 -2.866 1.00 0.00 C ATOM 1227 CD2 PHE C 30 7.211 2.778 -2.927 1.00 0.00 C ATOM 1228 CE1 PHE C 30 4.951 1.809 -1.674 1.00 0.00 C ATOM 1229 CE2 PHE C 30 7.325 2.089 -1.735 1.00 0.00 C ATOM 1230 CZ PHE C 30 6.193 1.604 -1.107 1.00 0.00 C ATOM 0 H PHE C 30 4.653 4.047 -6.900 1.00 0.00 H new ATOM 0 HA PHE C 30 7.251 3.093 -6.276 1.00 0.00 H new ATOM 0 HB2 PHE C 30 6.463 4.622 -4.756 1.00 0.00 H new ATOM 0 HB3 PHE C 30 4.802 4.078 -4.891 1.00 0.00 H new ATOM 0 HD1 PHE C 30 3.873 2.657 -3.306 1.00 0.00 H new ATOM 0 HD2 PHE C 30 8.098 3.157 -3.413 1.00 0.00 H new ATOM 0 HE1 PHE C 30 4.064 1.432 -1.187 1.00 0.00 H new ATOM 0 HE2 PHE C 30 8.298 1.929 -1.294 1.00 0.00 H new ATOM 0 HZ PHE C 30 6.280 1.066 -0.175 1.00 0.00 H new ATOM 1240 N ILE C 31 4.776 0.968 -5.819 1.00 0.00 N ATOM 1241 CA ILE C 31 4.479 -0.452 -5.654 1.00 0.00 C ATOM 1242 C ILE C 31 5.095 -1.269 -6.787 1.00 0.00 C ATOM 1243 O ILE C 31 5.724 -2.304 -6.554 1.00 0.00 O ATOM 1244 CB ILE C 31 2.958 -0.704 -5.604 1.00 0.00 C ATOM 1245 CG1 ILE C 31 2.351 -0.014 -4.380 1.00 0.00 C ATOM 1246 CG2 ILE C 31 2.660 -2.197 -5.583 1.00 0.00 C ATOM 1247 CD1 ILE C 31 0.846 -0.132 -4.301 1.00 0.00 C ATOM 0 H ILE C 31 3.953 1.561 -5.924 1.00 0.00 H new ATOM 0 HA ILE C 31 4.916 -0.768 -4.706 1.00 0.00 H new ATOM 0 HB ILE C 31 2.505 -0.283 -6.502 1.00 0.00 H new ATOM 0 HG12 ILE C 31 2.788 -0.442 -3.478 1.00 0.00 H new ATOM 0 HG13 ILE C 31 2.624 1.041 -4.396 1.00 0.00 H new ATOM 0 HG21 ILE C 31 1.582 -2.352 -5.548 1.00 0.00 H new ATOM 0 HG22 ILE C 31 3.064 -2.661 -6.482 1.00 0.00 H new ATOM 0 HG23 ILE C 31 3.120 -2.648 -4.704 1.00 0.00 H new ATOM 0 HD11 ILE C 31 0.487 0.380 -3.408 1.00 0.00 H new ATOM 0 HD12 ILE C 31 0.399 0.322 -5.185 1.00 0.00 H new ATOM 0 HD13 ILE C 31 0.566 -1.184 -4.253 1.00 0.00 H new ATOM 1259 N HIS C 32 4.926 -0.791 -8.013 1.00 0.00 N ATOM 1260 CA HIS C 32 5.495 -1.465 -9.177 1.00 0.00 C ATOM 1261 C HIS C 32 7.023 -1.434 -9.140 1.00 0.00 C ATOM 1262 O HIS C 32 7.679 -2.296 -9.720 1.00 0.00 O ATOM 1263 CB HIS C 32 4.982 -0.846 -10.481 1.00 0.00 C ATOM 1264 CG HIS C 32 3.570 -1.228 -10.817 1.00 0.00 C ATOM 1265 ND1 HIS C 32 2.564 -0.308 -11.011 1.00 0.00 N ATOM 1266 CD2 HIS C 32 3.003 -2.443 -11.008 1.00 0.00 C ATOM 1267 CE1 HIS C 32 1.443 -0.939 -11.305 1.00 0.00 C ATOM 1268 NE2 HIS C 32 1.680 -2.237 -11.311 1.00 0.00 N ATOM 0 H HIS C 32 4.402 0.057 -8.229 1.00 0.00 H new ATOM 0 HA HIS C 32 5.172 -2.505 -9.142 1.00 0.00 H new ATOM 0 HB2 HIS C 32 5.047 0.240 -10.408 1.00 0.00 H new ATOM 0 HB3 HIS C 32 5.635 -1.150 -11.299 1.00 0.00 H new ATOM 0 HD2 HIS C 32 3.501 -3.399 -10.935 1.00 0.00 H new ATOM 0 HE1 HIS C 32 0.491 -0.471 -11.507 1.00 0.00 H new ATOM 0 HE2 HIS C 32 0.994 -2.966 -11.508 1.00 0.00 H new ATOM 1277 N SER C 33 7.586 -0.447 -8.451 1.00 0.00 N ATOM 1278 CA SER C 33 9.032 -0.361 -8.287 1.00 0.00 C ATOM 1279 C SER C 33 9.526 -1.422 -7.306 1.00 0.00 C ATOM 1280 O SER C 33 10.582 -2.012 -7.506 1.00 0.00 O ATOM 1281 CB SER C 33 9.444 1.033 -7.809 1.00 0.00 C ATOM 1282 OG SER C 33 9.111 2.022 -8.771 1.00 0.00 O ATOM 0 H SER C 33 7.064 0.303 -7.998 1.00 0.00 H new ATOM 0 HA SER C 33 9.492 -0.542 -9.258 1.00 0.00 H new ATOM 0 HB2 SER C 33 8.948 1.258 -6.865 1.00 0.00 H new ATOM 0 HB3 SER C 33 10.517 1.053 -7.619 1.00 0.00 H new ATOM 0 HG SER C 33 8.138 2.139 -8.797 1.00 0.00 H new ATOM 1288 N ILE C 34 8.749 -1.672 -6.254 1.00 0.00 N ATOM 1289 CA ILE C 34 9.095 -2.707 -5.282 1.00 0.00 C ATOM 1290 C ILE C 34 9.068 -4.078 -5.946 1.00 0.00 C ATOM 1291 O ILE C 34 9.888 -4.944 -5.656 1.00 0.00 O ATOM 1292 CB ILE C 34 8.129 -2.719 -4.076 1.00 0.00 C ATOM 1293 CG1 ILE C 34 8.074 -1.338 -3.412 1.00 0.00 C ATOM 1294 CG2 ILE C 34 8.550 -3.786 -3.068 1.00 0.00 C ATOM 1295 CD1 ILE C 34 9.409 -0.852 -2.891 1.00 0.00 C ATOM 0 H ILE C 34 7.881 -1.176 -6.053 1.00 0.00 H new ATOM 0 HA ILE C 34 10.097 -2.480 -4.917 1.00 0.00 H new ATOM 0 HB ILE C 34 7.130 -2.961 -4.437 1.00 0.00 H new ATOM 0 HG12 ILE C 34 7.692 -0.615 -4.132 1.00 0.00 H new ATOM 0 HG13 ILE C 34 7.364 -1.371 -2.586 1.00 0.00 H new ATOM 0 HG21 ILE C 34 7.860 -3.782 -2.224 1.00 0.00 H new ATOM 0 HG22 ILE C 34 8.533 -4.765 -3.546 1.00 0.00 H new ATOM 0 HG23 ILE C 34 9.558 -3.573 -2.713 1.00 0.00 H new ATOM 0 HD11 ILE C 34 9.286 0.131 -2.436 1.00 0.00 H new ATOM 0 HD12 ILE C 34 9.785 -1.552 -2.145 1.00 0.00 H new ATOM 0 HD13 ILE C 34 10.119 -0.784 -3.716 1.00 0.00 H new ATOM 1307 N HIS C 35 8.114 -4.261 -6.844 1.00 0.00 N ATOM 1308 CA HIS C 35 7.998 -5.506 -7.592 1.00 0.00 C ATOM 1309 C HIS C 35 9.166 -5.661 -8.556 1.00 0.00 C ATOM 1310 O HIS C 35 9.660 -6.766 -8.779 1.00 0.00 O ATOM 1311 CB HIS C 35 6.679 -5.539 -8.370 1.00 0.00 C ATOM 1312 CG HIS C 35 6.450 -6.817 -9.125 1.00 0.00 C ATOM 1313 ND1 HIS C 35 6.258 -6.865 -10.489 1.00 0.00 N ATOM 1314 CD2 HIS C 35 6.377 -8.098 -8.695 1.00 0.00 C ATOM 1315 CE1 HIS C 35 6.079 -8.118 -10.862 1.00 0.00 C ATOM 1316 NE2 HIS C 35 6.147 -8.886 -9.794 1.00 0.00 N ATOM 0 H HIS C 35 7.407 -3.563 -7.074 1.00 0.00 H new ATOM 0 HA HIS C 35 8.014 -6.333 -6.882 1.00 0.00 H new ATOM 0 HB2 HIS C 35 5.854 -5.387 -7.674 1.00 0.00 H new ATOM 0 HB3 HIS C 35 6.662 -4.705 -9.072 1.00 0.00 H new ATOM 0 HD2 HIS C 35 6.481 -8.437 -7.675 1.00 0.00 H new ATOM 0 HE1 HIS C 35 5.906 -8.457 -11.873 1.00 0.00 H new ATOM 0 HE2 HIS C 35 6.045 -9.901 -9.786 1.00 0.00 H new ATOM 1325 N ASP C 36 9.600 -4.546 -9.121 1.00 0.00 N ATOM 1326 CA ASP C 36 10.642 -4.560 -10.141 1.00 0.00 C ATOM 1327 C ASP C 36 12.034 -4.610 -9.526 1.00 0.00 C ATOM 1328 O ASP C 36 12.971 -5.127 -10.130 1.00 0.00 O ATOM 1329 CB ASP C 36 10.517 -3.333 -11.041 1.00 0.00 C ATOM 1330 CG ASP C 36 11.391 -3.431 -12.273 1.00 0.00 C ATOM 1331 OD1 ASP C 36 12.436 -2.752 -12.325 1.00 0.00 O ATOM 1332 OD2 ASP C 36 11.029 -4.185 -13.203 1.00 0.00 O ATOM 0 H ASP C 36 9.247 -3.617 -8.892 1.00 0.00 H new ATOM 0 HA ASP C 36 10.506 -5.463 -10.736 1.00 0.00 H new ATOM 0 HB2 ASP C 36 9.477 -3.213 -11.345 1.00 0.00 H new ATOM 0 HB3 ASP C 36 10.789 -2.442 -10.476 1.00 0.00 H new ATOM 1337 N ASP C 37 12.159 -4.082 -8.323 1.00 0.00 N ATOM 1338 CA ASP C 37 13.436 -4.063 -7.623 1.00 0.00 C ATOM 1339 C ASP C 37 13.212 -4.174 -6.118 1.00 0.00 C ATOM 1340 O ASP C 37 13.346 -3.194 -5.383 1.00 0.00 O ATOM 1341 CB ASP C 37 14.215 -2.783 -7.941 1.00 0.00 C ATOM 1342 CG ASP C 37 15.705 -2.934 -7.693 1.00 0.00 C ATOM 1343 OD1 ASP C 37 16.497 -2.363 -8.475 1.00 0.00 O ATOM 1344 OD2 ASP C 37 16.097 -3.632 -6.730 1.00 0.00 O ATOM 0 H ASP C 37 11.389 -3.658 -7.805 1.00 0.00 H new ATOM 0 HA ASP C 37 14.022 -4.917 -7.963 1.00 0.00 H new ATOM 0 HB2 ASP C 37 14.049 -2.510 -8.983 1.00 0.00 H new ATOM 0 HB3 ASP C 37 13.829 -1.966 -7.332 1.00 0.00 H new ATOM 1349 N PRO C 38 12.858 -5.377 -5.641 1.00 0.00 N ATOM 1350 CA PRO C 38 12.598 -5.625 -4.219 1.00 0.00 C ATOM 1351 C PRO C 38 13.848 -5.470 -3.355 1.00 0.00 C ATOM 1352 O PRO C 38 13.766 -5.443 -2.130 1.00 0.00 O ATOM 1353 CB PRO C 38 12.099 -7.071 -4.189 1.00 0.00 C ATOM 1354 CG PRO C 38 12.654 -7.687 -5.426 1.00 0.00 C ATOM 1355 CD PRO C 38 12.654 -6.590 -6.452 1.00 0.00 C ATOM 0 HA PRO C 38 11.886 -4.908 -3.810 1.00 0.00 H new ATOM 0 HB2 PRO C 38 12.447 -7.592 -3.297 1.00 0.00 H new ATOM 0 HB3 PRO C 38 11.010 -7.114 -4.179 1.00 0.00 H new ATOM 0 HG2 PRO C 38 13.661 -8.067 -5.258 1.00 0.00 H new ATOM 0 HG3 PRO C 38 12.045 -8.530 -5.752 1.00 0.00 H new ATOM 0 HD2 PRO C 38 13.449 -6.723 -7.185 1.00 0.00 H new ATOM 0 HD3 PRO C 38 11.715 -6.553 -7.004 1.00 0.00 H new ATOM 1363 N SER C 39 15.004 -5.366 -3.991 1.00 0.00 N ATOM 1364 CA SER C 39 16.237 -5.122 -3.265 1.00 0.00 C ATOM 1365 C SER C 39 16.224 -3.707 -2.698 1.00 0.00 C ATOM 1366 O SER C 39 16.523 -3.487 -1.525 1.00 0.00 O ATOM 1367 CB SER C 39 17.447 -5.313 -4.181 1.00 0.00 C ATOM 1368 OG SER C 39 18.657 -5.093 -3.477 1.00 0.00 O ATOM 0 H SER C 39 15.113 -5.446 -5.002 1.00 0.00 H new ATOM 0 HA SER C 39 16.312 -5.837 -2.446 1.00 0.00 H new ATOM 0 HB2 SER C 39 17.440 -6.322 -4.593 1.00 0.00 H new ATOM 0 HB3 SER C 39 17.382 -4.625 -5.024 1.00 0.00 H new ATOM 0 HG SER C 39 19.416 -5.222 -4.083 1.00 0.00 H new ATOM 1374 N GLN C 40 15.840 -2.754 -3.538 1.00 0.00 N ATOM 1375 CA GLN C 40 15.781 -1.356 -3.150 1.00 0.00 C ATOM 1376 C GLN C 40 14.510 -1.052 -2.372 1.00 0.00 C ATOM 1377 O GLN C 40 14.271 0.097 -2.024 1.00 0.00 O ATOM 1378 CB GLN C 40 15.834 -0.482 -4.392 1.00 0.00 C ATOM 1379 CG GLN C 40 16.963 -0.845 -5.326 1.00 0.00 C ATOM 1380 CD GLN C 40 18.327 -0.485 -4.772 1.00 0.00 C ATOM 1381 OE1 GLN C 40 18.816 0.627 -4.973 1.00 0.00 O ATOM 1382 NE2 GLN C 40 18.954 -1.421 -4.076 1.00 0.00 N ATOM 0 H GLN C 40 15.562 -2.930 -4.503 1.00 0.00 H new ATOM 0 HA GLN C 40 16.635 -1.145 -2.506 1.00 0.00 H new ATOM 0 HB2 GLN C 40 14.888 -0.564 -4.927 1.00 0.00 H new ATOM 0 HB3 GLN C 40 15.941 0.560 -4.091 1.00 0.00 H new ATOM 0 HG2 GLN C 40 16.930 -1.915 -5.529 1.00 0.00 H new ATOM 0 HG3 GLN C 40 16.818 -0.336 -6.279 1.00 0.00 H new ATOM 0 HE21 GLN C 40 18.514 -2.330 -3.932 1.00 0.00 H new ATOM 0 HE22 GLN C 40 19.877 -1.233 -3.684 1.00 0.00 H new ATOM 1391 N SER C 41 13.701 -2.086 -2.141 1.00 0.00 N ATOM 1392 CA SER C 41 12.391 -1.957 -1.492 1.00 0.00 C ATOM 1393 C SER C 41 12.386 -0.907 -0.378 1.00 0.00 C ATOM 1394 O SER C 41 11.764 0.140 -0.523 1.00 0.00 O ATOM 1395 CB SER C 41 11.953 -3.310 -0.931 1.00 0.00 C ATOM 1396 OG SER C 41 10.657 -3.246 -0.366 1.00 0.00 O ATOM 0 H SER C 41 13.935 -3.044 -2.400 1.00 0.00 H new ATOM 0 HA SER C 41 11.687 -1.622 -2.254 1.00 0.00 H new ATOM 0 HB2 SER C 41 11.967 -4.056 -1.726 1.00 0.00 H new ATOM 0 HB3 SER C 41 12.665 -3.638 -0.173 1.00 0.00 H new ATOM 0 HG SER C 41 10.408 -4.128 -0.019 1.00 0.00 H new ATOM 1402 N ALA C 42 13.087 -1.187 0.717 1.00 0.00 N ATOM 1403 CA ALA C 42 13.159 -0.276 1.855 1.00 0.00 C ATOM 1404 C ALA C 42 13.515 1.148 1.448 1.00 0.00 C ATOM 1405 O ALA C 42 12.953 2.109 1.966 1.00 0.00 O ATOM 1406 CB ALA C 42 14.179 -0.791 2.843 1.00 0.00 C ATOM 0 H ALA C 42 13.619 -2.048 0.840 1.00 0.00 H new ATOM 0 HA ALA C 42 12.168 -0.241 2.308 1.00 0.00 H new ATOM 0 HB1 ALA C 42 14.235 -0.113 3.694 1.00 0.00 H new ATOM 0 HB2 ALA C 42 13.884 -1.782 3.187 1.00 0.00 H new ATOM 0 HB3 ALA C 42 15.155 -0.850 2.361 1.00 0.00 H new ATOM 1412 N ASN C 43 14.448 1.281 0.526 1.00 0.00 N ATOM 1413 CA ASN C 43 14.879 2.594 0.067 1.00 0.00 C ATOM 1414 C ASN C 43 13.823 3.249 -0.815 1.00 0.00 C ATOM 1415 O ASN C 43 13.693 4.469 -0.826 1.00 0.00 O ATOM 1416 CB ASN C 43 16.209 2.486 -0.675 1.00 0.00 C ATOM 1417 CG ASN C 43 16.675 3.814 -1.246 1.00 0.00 C ATOM 1418 OD1 ASN C 43 17.330 4.599 -0.565 1.00 0.00 O ATOM 1419 ND2 ASN C 43 16.354 4.071 -2.506 1.00 0.00 N ATOM 0 H ASN C 43 14.924 0.498 0.078 1.00 0.00 H new ATOM 0 HA ASN C 43 15.017 3.228 0.943 1.00 0.00 H new ATOM 0 HB2 ASN C 43 16.969 2.102 0.005 1.00 0.00 H new ATOM 0 HB3 ASN C 43 16.110 1.762 -1.484 1.00 0.00 H new ATOM 0 HD21 ASN C 43 16.652 4.944 -2.940 1.00 0.00 H new ATOM 0 HD22 ASN C 43 15.809 3.395 -3.041 1.00 0.00 H new ATOM 1426 N LEU C 44 13.069 2.441 -1.547 1.00 0.00 N ATOM 1427 CA LEU C 44 11.953 2.941 -2.340 1.00 0.00 C ATOM 1428 C LEU C 44 10.812 3.319 -1.401 1.00 0.00 C ATOM 1429 O LEU C 44 10.035 4.237 -1.669 1.00 0.00 O ATOM 1430 CB LEU C 44 11.507 1.879 -3.358 1.00 0.00 C ATOM 1431 CG LEU C 44 12.284 1.835 -4.692 1.00 0.00 C ATOM 1432 CD1 LEU C 44 13.730 2.270 -4.522 1.00 0.00 C ATOM 1433 CD2 LEU C 44 12.247 0.431 -5.283 1.00 0.00 C ATOM 0 H LEU C 44 13.210 1.433 -1.609 1.00 0.00 H new ATOM 0 HA LEU C 44 12.259 3.825 -2.899 1.00 0.00 H new ATOM 0 HB2 LEU C 44 11.584 0.900 -2.886 1.00 0.00 H new ATOM 0 HB3 LEU C 44 10.453 2.043 -3.582 1.00 0.00 H new ATOM 0 HG LEU C 44 11.795 2.535 -5.370 1.00 0.00 H new ATOM 0 HD11 LEU C 44 14.239 2.224 -5.485 1.00 0.00 H new ATOM 0 HD12 LEU C 44 13.760 3.292 -4.144 1.00 0.00 H new ATOM 0 HD13 LEU C 44 14.229 1.607 -3.815 1.00 0.00 H new ATOM 0 HD21 LEU C 44 12.799 0.417 -6.223 1.00 0.00 H new ATOM 0 HD22 LEU C 44 12.703 -0.270 -4.584 1.00 0.00 H new ATOM 0 HD23 LEU C 44 11.212 0.140 -5.466 1.00 0.00 H new ATOM 1445 N LEU C 45 10.752 2.607 -0.282 1.00 0.00 N ATOM 1446 CA LEU C 45 9.835 2.911 0.802 1.00 0.00 C ATOM 1447 C LEU C 45 10.219 4.233 1.456 1.00 0.00 C ATOM 1448 O LEU C 45 9.370 5.081 1.722 1.00 0.00 O ATOM 1449 CB LEU C 45 9.847 1.765 1.808 1.00 0.00 C ATOM 1450 CG LEU C 45 8.681 0.801 1.651 1.00 0.00 C ATOM 1451 CD1 LEU C 45 9.025 -0.338 0.710 1.00 0.00 C ATOM 1452 CD2 LEU C 45 8.232 0.313 3.000 1.00 0.00 C ATOM 0 H LEU C 45 11.345 1.796 -0.103 1.00 0.00 H new ATOM 0 HA LEU C 45 8.822 3.017 0.413 1.00 0.00 H new ATOM 0 HB2 LEU C 45 10.781 1.212 1.704 1.00 0.00 H new ATOM 0 HB3 LEU C 45 9.832 2.178 2.816 1.00 0.00 H new ATOM 0 HG LEU C 45 7.846 1.332 1.194 1.00 0.00 H new ATOM 0 HD11 LEU C 45 8.169 -1.008 0.621 1.00 0.00 H new ATOM 0 HD12 LEU C 45 9.275 0.064 -0.272 1.00 0.00 H new ATOM 0 HD13 LEU C 45 9.878 -0.890 1.104 1.00 0.00 H new ATOM 0 HD21 LEU C 45 7.397 -0.377 2.878 1.00 0.00 H new ATOM 0 HD22 LEU C 45 9.057 -0.200 3.494 1.00 0.00 H new ATOM 0 HD23 LEU C 45 7.916 1.161 3.607 1.00 0.00 H new ATOM 1464 N ALA C 46 11.515 4.403 1.680 1.00 0.00 N ATOM 1465 CA ALA C 46 12.063 5.647 2.203 1.00 0.00 C ATOM 1466 C ALA C 46 11.922 6.774 1.181 1.00 0.00 C ATOM 1467 O ALA C 46 11.786 7.945 1.535 1.00 0.00 O ATOM 1468 CB ALA C 46 13.529 5.447 2.562 1.00 0.00 C ATOM 0 H ALA C 46 12.216 3.683 1.504 1.00 0.00 H new ATOM 0 HA ALA C 46 11.505 5.927 3.097 1.00 0.00 H new ATOM 0 HB1 ALA C 46 13.938 6.378 2.953 1.00 0.00 H new ATOM 0 HB2 ALA C 46 13.615 4.667 3.318 1.00 0.00 H new ATOM 0 HB3 ALA C 46 14.085 5.152 1.672 1.00 0.00 H new ATOM 1474 N GLU C 47 11.966 6.404 -0.090 1.00 0.00 N ATOM 1475 CA GLU C 47 11.868 7.358 -1.186 1.00 0.00 C ATOM 1476 C GLU C 47 10.472 7.956 -1.261 1.00 0.00 C ATOM 1477 O GLU C 47 10.304 9.170 -1.161 1.00 0.00 O ATOM 1478 CB GLU C 47 12.211 6.674 -2.510 1.00 0.00 C ATOM 1479 CG GLU C 47 12.368 7.636 -3.671 1.00 0.00 C ATOM 1480 CD GLU C 47 13.604 8.495 -3.539 1.00 0.00 C ATOM 1481 OE1 GLU C 47 13.565 9.494 -2.793 1.00 0.00 O ATOM 1482 OE2 GLU C 47 14.627 8.167 -4.173 1.00 0.00 O ATOM 0 H GLU C 47 12.071 5.435 -0.391 1.00 0.00 H new ATOM 0 HA GLU C 47 12.579 8.163 -1.001 1.00 0.00 H new ATOM 0 HB2 GLU C 47 13.136 6.111 -2.389 1.00 0.00 H new ATOM 0 HB3 GLU C 47 11.429 5.954 -2.750 1.00 0.00 H new ATOM 0 HG2 GLU C 47 12.417 7.073 -4.603 1.00 0.00 H new ATOM 0 HG3 GLU C 47 11.488 8.276 -3.732 1.00 0.00 H new ATOM 1489 N ALA C 48 9.473 7.098 -1.430 1.00 0.00 N ATOM 1490 CA ALA C 48 8.088 7.543 -1.491 1.00 0.00 C ATOM 1491 C ALA C 48 7.710 8.306 -0.228 1.00 0.00 C ATOM 1492 O ALA C 48 6.868 9.210 -0.259 1.00 0.00 O ATOM 1493 CB ALA C 48 7.154 6.358 -1.691 1.00 0.00 C ATOM 0 H ALA C 48 9.597 6.090 -1.527 1.00 0.00 H new ATOM 0 HA ALA C 48 7.985 8.215 -2.343 1.00 0.00 H new ATOM 0 HB1 ALA C 48 6.123 6.710 -1.734 1.00 0.00 H new ATOM 0 HB2 ALA C 48 7.404 5.851 -2.623 1.00 0.00 H new ATOM 0 HB3 ALA C 48 7.265 5.663 -0.859 1.00 0.00 H new ATOM 1499 N LYS C 49 8.335 7.931 0.887 1.00 0.00 N ATOM 1500 CA LYS C 49 8.081 8.571 2.170 1.00 0.00 C ATOM 1501 C LYS C 49 8.372 10.064 2.122 1.00 0.00 C ATOM 1502 O LYS C 49 7.793 10.834 2.884 1.00 0.00 O ATOM 1503 CB LYS C 49 8.905 7.909 3.273 1.00 0.00 C ATOM 1504 CG LYS C 49 8.126 6.904 4.098 1.00 0.00 C ATOM 1505 CD LYS C 49 7.053 7.566 4.950 1.00 0.00 C ATOM 1506 CE LYS C 49 7.662 8.432 6.039 1.00 0.00 C ATOM 1507 NZ LYS C 49 6.627 9.015 6.931 1.00 0.00 N ATOM 0 H LYS C 49 9.025 7.181 0.924 1.00 0.00 H new ATOM 0 HA LYS C 49 7.022 8.444 2.393 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.763 7.409 2.823 1.00 0.00 H new ATOM 0 HB3 LYS C 49 9.297 8.682 3.934 1.00 0.00 H new ATOM 0 HG2 LYS C 49 7.662 6.174 3.435 1.00 0.00 H new ATOM 0 HG3 LYS C 49 8.813 6.356 4.743 1.00 0.00 H new ATOM 0 HD2 LYS C 49 6.409 8.176 4.316 1.00 0.00 H new ATOM 0 HD3 LYS C 49 6.423 6.800 5.402 1.00 0.00 H new ATOM 0 HE2 LYS C 49 8.356 7.835 6.631 1.00 0.00 H new ATOM 0 HE3 LYS C 49 8.241 9.235 5.582 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 7.045 9.786 7.490 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 5.844 9.388 6.357 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 6.266 8.279 7.571 1.00 0.00 H new ATOM 1521 N LYS C 50 9.254 10.471 1.217 1.00 0.00 N ATOM 1522 CA LYS C 50 9.564 11.883 1.049 1.00 0.00 C ATOM 1523 C LYS C 50 8.325 12.667 0.617 1.00 0.00 C ATOM 1524 O LYS C 50 8.088 13.775 1.099 1.00 0.00 O ATOM 1525 CB LYS C 50 10.688 12.078 0.033 1.00 0.00 C ATOM 1526 CG LYS C 50 12.002 11.441 0.450 1.00 0.00 C ATOM 1527 CD LYS C 50 13.127 11.820 -0.495 1.00 0.00 C ATOM 1528 CE LYS C 50 14.438 11.160 -0.103 1.00 0.00 C ATOM 1529 NZ LYS C 50 14.374 9.682 -0.234 1.00 0.00 N ATOM 0 H LYS C 50 9.764 9.846 0.592 1.00 0.00 H new ATOM 0 HA LYS C 50 9.898 12.265 2.014 1.00 0.00 H new ATOM 0 HB2 LYS C 50 10.378 11.658 -0.924 1.00 0.00 H new ATOM 0 HB3 LYS C 50 10.845 13.145 -0.123 1.00 0.00 H new ATOM 0 HG2 LYS C 50 12.255 11.755 1.463 1.00 0.00 H new ATOM 0 HG3 LYS C 50 11.892 10.357 0.470 1.00 0.00 H new ATOM 0 HD2 LYS C 50 12.862 11.528 -1.511 1.00 0.00 H new ATOM 0 HD3 LYS C 50 13.251 12.903 -0.497 1.00 0.00 H new ATOM 0 HE2 LYS C 50 15.241 11.546 -0.731 1.00 0.00 H new ATOM 0 HE3 LYS C 50 14.684 11.423 0.926 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 15.282 9.268 0.059 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 13.614 9.312 0.372 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 14.182 9.429 -1.224 1.00 0.00 H new ATOM 1543 N LEU C 51 7.524 12.088 -0.275 1.00 0.00 N ATOM 1544 CA LEU C 51 6.300 12.746 -0.724 1.00 0.00 C ATOM 1545 C LEU C 51 5.247 12.676 0.372 1.00 0.00 C ATOM 1546 O LEU C 51 4.557 13.656 0.646 1.00 0.00 O ATOM 1547 CB LEU C 51 5.738 12.114 -2.001 1.00 0.00 C ATOM 1548 CG LEU C 51 6.708 11.983 -3.174 1.00 0.00 C ATOM 1549 CD1 LEU C 51 7.340 10.602 -3.182 1.00 0.00 C ATOM 1550 CD2 LEU C 51 5.995 12.257 -4.490 1.00 0.00 C ATOM 0 H LEU C 51 7.698 11.176 -0.697 1.00 0.00 H new ATOM 0 HA LEU C 51 6.552 13.783 -0.945 1.00 0.00 H new ATOM 0 HB2 LEU C 51 5.363 11.121 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU C 51 4.883 12.706 -2.328 1.00 0.00 H new ATOM 0 HG LEU C 51 7.499 12.724 -3.056 1.00 0.00 H new ATOM 0 HD11 LEU C 51 8.029 10.522 -4.023 1.00 0.00 H new ATOM 0 HD12 LEU C 51 7.884 10.446 -2.251 1.00 0.00 H new ATOM 0 HD13 LEU C 51 6.561 9.846 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU C 51 6.702 12.159 -5.314 1.00 0.00 H new ATOM 0 HD22 LEU C 51 5.184 11.541 -4.620 1.00 0.00 H new ATOM 0 HD23 LEU C 51 5.588 13.268 -4.480 1.00 0.00 H new ATOM 1562 N ASN C 52 5.126 11.502 0.989 1.00 0.00 N ATOM 1563 CA ASN C 52 4.233 11.318 2.130 1.00 0.00 C ATOM 1564 C ASN C 52 4.510 12.351 3.226 1.00 0.00 C ATOM 1565 O ASN C 52 3.583 12.883 3.827 1.00 0.00 O ATOM 1566 CB ASN C 52 4.360 9.894 2.692 1.00 0.00 C ATOM 1567 CG ASN C 52 3.900 9.788 4.137 1.00 0.00 C ATOM 1568 OD1 ASN C 52 4.704 9.880 5.066 1.00 0.00 O ATOM 1569 ND2 ASN C 52 2.607 9.607 4.337 1.00 0.00 N ATOM 0 H ASN C 52 5.637 10.662 0.716 1.00 0.00 H new ATOM 0 HA ASN C 52 3.212 11.466 1.779 1.00 0.00 H new ATOM 0 HB2 ASN C 52 3.772 9.212 2.077 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.399 9.572 2.622 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.243 9.539 5.287 1.00 0.00 H new ATOM 0 HD22 ASN C 52 1.973 9.536 3.541 1.00 0.00 H new ATOM 1576 N ASP C 53 5.786 12.641 3.460 1.00 0.00 N ATOM 1577 CA ASP C 53 6.186 13.596 4.493 1.00 0.00 C ATOM 1578 C ASP C 53 5.929 15.029 4.042 1.00 0.00 C ATOM 1579 O ASP C 53 5.604 15.903 4.845 1.00 0.00 O ATOM 1580 CB ASP C 53 7.668 13.416 4.834 1.00 0.00 C ATOM 1581 CG ASP C 53 8.141 14.372 5.910 1.00 0.00 C ATOM 1582 OD1 ASP C 53 8.037 14.027 7.107 1.00 0.00 O ATOM 1583 OD2 ASP C 53 8.620 15.472 5.568 1.00 0.00 O ATOM 0 H ASP C 53 6.565 12.228 2.947 1.00 0.00 H new ATOM 0 HA ASP C 53 5.586 13.402 5.382 1.00 0.00 H new ATOM 0 HB2 ASP C 53 7.839 12.391 5.164 1.00 0.00 H new ATOM 0 HB3 ASP C 53 8.264 13.565 3.934 1.00 0.00 H new ATOM 1588 N ALA C 54 6.071 15.253 2.750 1.00 0.00 N ATOM 1589 CA ALA C 54 5.864 16.565 2.163 1.00 0.00 C ATOM 1590 C ALA C 54 4.394 16.959 2.202 1.00 0.00 C ATOM 1591 O ALA C 54 4.047 18.090 2.541 1.00 0.00 O ATOM 1592 CB ALA C 54 6.362 16.551 0.737 1.00 0.00 C ATOM 0 H ALA C 54 6.333 14.532 2.077 1.00 0.00 H new ATOM 0 HA ALA C 54 6.420 17.302 2.742 1.00 0.00 H new ATOM 0 HB1 ALA C 54 6.210 17.533 0.289 1.00 0.00 H new ATOM 0 HB2 ALA C 54 7.424 16.307 0.725 1.00 0.00 H new ATOM 0 HB3 ALA C 54 5.811 15.803 0.167 1.00 0.00 H new ATOM 1598 N GLN C 55 3.539 16.008 1.860 1.00 0.00 N ATOM 1599 CA GLN C 55 2.102 16.236 1.827 1.00 0.00 C ATOM 1600 C GLN C 55 1.502 16.034 3.221 1.00 0.00 C ATOM 1601 O GLN C 55 0.298 16.198 3.429 1.00 0.00 O ATOM 1602 CB GLN C 55 1.460 15.284 0.810 1.00 0.00 C ATOM 1603 CG GLN C 55 -0.013 15.554 0.542 1.00 0.00 C ATOM 1604 CD GLN C 55 -0.260 16.918 -0.071 1.00 0.00 C ATOM 1605 OE1 GLN C 55 0.577 17.447 -0.802 1.00 0.00 O ATOM 1606 NE2 GLN C 55 -1.408 17.500 0.226 1.00 0.00 N ATOM 0 H GLN C 55 3.818 15.062 1.599 1.00 0.00 H new ATOM 0 HA GLN C 55 1.902 17.263 1.522 1.00 0.00 H new ATOM 0 HB2 GLN C 55 2.007 15.353 -0.130 1.00 0.00 H new ATOM 0 HB3 GLN C 55 1.570 14.260 1.168 1.00 0.00 H new ATOM 0 HG2 GLN C 55 -0.403 14.785 -0.125 1.00 0.00 H new ATOM 0 HG3 GLN C 55 -0.568 15.475 1.477 1.00 0.00 H new ATOM 0 HE21 GLN C 55 -2.076 17.029 0.836 1.00 0.00 H new ATOM 0 HE22 GLN C 55 -1.626 18.421 -0.155 1.00 0.00 H new ATOM 1615 N ALA C 56 2.357 15.683 4.172 1.00 0.00 N ATOM 1616 CA ALA C 56 1.929 15.457 5.542 1.00 0.00 C ATOM 1617 C ALA C 56 1.650 16.778 6.250 1.00 0.00 C ATOM 1618 O ALA C 56 2.609 17.404 6.750 1.00 0.00 O ATOM 1619 CB ALA C 56 2.987 14.665 6.287 1.00 0.00 C ATOM 0 H ALA C 56 3.356 15.549 4.016 1.00 0.00 H new ATOM 0 HA ALA C 56 1.002 14.884 5.528 1.00 0.00 H new ATOM 0 HB1 ALA C 56 2.661 14.498 7.314 1.00 0.00 H new ATOM 0 HB2 ALA C 56 3.137 13.705 5.794 1.00 0.00 H new ATOM 0 HB3 ALA C 56 3.924 15.222 6.290 1.00 0.00 H new TER 1625 ALA C 56