USER MOD reduce.3.24.130724 H: found=0, std=0, add=1084, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1084 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 GLN : amide:sc=-0.00333 K(o=-0.78,f=0.061) USER MOD Set 1.2: A 106 GLN : amide:sc= -0.776 K(o=-0.78,f=0.061) USER MOD Set 2.1: A 29 THR OG1 : rot -23:sc= 0.642 USER MOD Set 2.2: A 45 LYS NZ :NH3+ -139:sc= 0.727 (180deg=-0.289) USER MOD Single : A 1 SER N :NH3+ -105:sc= 0.134 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00527 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -1.68 K(o=-1.7,f=-0.1) USER MOD Single : A 10 SER OG : rot -92:sc= 1.26 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0863 USER MOD Single : A 20 GLN : amide:sc= -1.36! K(o=-1.4!,f=-0.057) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.0107 X(o=-0.011,f=-0.37) USER MOD Single : A 42 THR OG1 : rot 80:sc= 1.06 USER MOD Single : A 47 CYS SG : rot 74:sc= -0.142 USER MOD Single : A 52 GLN : amide:sc= -3.16! K(o=-3.2!,f=-1.2) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0.301 X(o=0.3,f=-0.052) USER MOD Single : A 60 GLN : amide:sc= -0.58 X(o=-0.58,f=-0.62) USER MOD Single : A 63 GLN : amide:sc= -1.72! K(o=-1.7!,f=-0.0066) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= 0.616 K(o=0.62,f=-3.7!) USER MOD Single : A 74 SER OG : rot 158:sc= -1.01 USER MOD Single : A 75 SER OG : rot 180:sc= 0.00835 USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 79 SER OG : rot 180:sc= -0.028 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 MET CE :methyl 170:sc= 0 (180deg=-0.13) USER MOD Single : A 105 GLN : amide:sc= -1.86! C(o=-1.9!,f=-5!) USER MOD Single : A 108 GLN : amide:sc= -0.664 X(o=-0.66,f=-0.9) USER MOD Single : A 111 ASN : amide:sc= 0.646 K(o=0.65,f=-0.059) USER MOD Single : A 113 MET CE :methyl -121:sc= -0.23 (180deg=-0.744) USER MOD Single : A 114 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.046) USER MOD Single : A 117 SER OG : rot -78:sc= 0.349 USER MOD Single : A 118 TYR OH : rot -140:sc= -0.309 USER MOD Single : A 123 LYS NZ :NH3+ 168:sc=-0.000247 (180deg=-0.116) USER MOD Single : A 124 SER OG : rot -167:sc= 1.76 USER MOD Single : A 127 TYR OH : rot -130:sc= -0.024 USER MOD Single : A 130 CYS SG : rot -174:sc= 0.144 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -27.151 -5.826 -2.975 1.00 0.00 N ATOM 2 CA SER A 1 -27.111 -4.962 -4.174 1.00 0.00 C ATOM 3 C SER A 1 -26.969 -5.819 -5.432 1.00 0.00 C ATOM 4 O SER A 1 -26.741 -7.027 -5.336 1.00 0.00 O ATOM 5 CB SER A 1 -25.941 -3.979 -4.051 1.00 0.00 C ATOM 6 OG SER A 1 -26.020 -3.252 -2.832 1.00 0.00 O ATOM 0 H1 SER A 1 -28.126 -5.877 -2.616 1.00 0.00 H new ATOM 0 H2 SER A 1 -26.823 -6.781 -3.224 1.00 0.00 H new ATOM 0 H3 SER A 1 -26.532 -5.429 -2.240 1.00 0.00 H new ATOM 0 HA SER A 1 -28.040 -4.397 -4.251 1.00 0.00 H new ATOM 0 HB2 SER A 1 -24.997 -4.522 -4.095 1.00 0.00 H new ATOM 0 HB3 SER A 1 -25.951 -3.288 -4.894 1.00 0.00 H new ATOM 0 HG SER A 1 -25.264 -2.632 -2.772 1.00 0.00 H new ATOM 14 N MET A 2 -27.116 -5.202 -6.608 1.00 0.00 N ATOM 15 CA MET A 2 -26.947 -5.914 -7.878 1.00 0.00 C ATOM 16 C MET A 2 -25.513 -6.420 -8.008 1.00 0.00 C ATOM 17 O MET A 2 -25.257 -7.454 -8.628 1.00 0.00 O ATOM 18 CB MET A 2 -27.284 -5.005 -9.072 1.00 0.00 C ATOM 19 CG MET A 2 -28.746 -4.579 -9.144 1.00 0.00 C ATOM 20 SD MET A 2 -29.262 -3.591 -7.726 1.00 0.00 S ATOM 21 CE MET A 2 -30.938 -3.166 -8.200 1.00 0.00 C ATOM 0 H MET A 2 -27.351 -4.214 -6.707 1.00 0.00 H new ATOM 0 HA MET A 2 -27.634 -6.760 -7.884 1.00 0.00 H new ATOM 0 HB2 MET A 2 -26.660 -4.113 -9.022 1.00 0.00 H new ATOM 0 HB3 MET A 2 -27.023 -5.525 -9.994 1.00 0.00 H new ATOM 0 HG2 MET A 2 -28.907 -4.006 -10.057 1.00 0.00 H new ATOM 0 HG3 MET A 2 -29.375 -5.467 -9.209 1.00 0.00 H new ATOM 0 HE1 MET A 2 -31.392 -2.554 -7.421 1.00 0.00 H new ATOM 0 HE2 MET A 2 -30.921 -2.608 -9.136 1.00 0.00 H new ATOM 0 HE3 MET A 2 -31.521 -4.077 -8.331 1.00 0.00 H new ATOM 31 N THR A 3 -24.586 -5.668 -7.426 1.00 0.00 N ATOM 32 CA THR A 3 -23.183 -6.044 -7.408 1.00 0.00 C ATOM 33 C THR A 3 -22.937 -7.115 -6.340 1.00 0.00 C ATOM 34 O THR A 3 -23.053 -6.848 -5.141 1.00 0.00 O ATOM 35 CB THR A 3 -22.293 -4.812 -7.122 1.00 0.00 C ATOM 36 OG1 THR A 3 -22.706 -3.716 -7.952 1.00 0.00 O ATOM 37 CG2 THR A 3 -20.820 -5.120 -7.382 1.00 0.00 C ATOM 0 H THR A 3 -24.787 -4.785 -6.956 1.00 0.00 H new ATOM 0 HA THR A 3 -22.924 -6.446 -8.388 1.00 0.00 H new ATOM 0 HB THR A 3 -22.407 -4.548 -6.071 1.00 0.00 H new ATOM 0 HG1 THR A 3 -22.142 -2.936 -7.768 1.00 0.00 H new ATOM 0 HG21 THR A 3 -20.220 -4.234 -7.172 1.00 0.00 H new ATOM 0 HG22 THR A 3 -20.499 -5.937 -6.735 1.00 0.00 H new ATOM 0 HG23 THR A 3 -20.687 -5.409 -8.425 1.00 0.00 H new ATOM 45 N GLU A 4 -22.625 -8.330 -6.783 1.00 0.00 N ATOM 46 CA GLU A 4 -22.355 -9.441 -5.873 1.00 0.00 C ATOM 47 C GLU A 4 -20.933 -9.358 -5.329 1.00 0.00 C ATOM 48 O GLU A 4 -20.679 -9.686 -4.167 1.00 0.00 O ATOM 49 CB GLU A 4 -22.565 -10.778 -6.597 1.00 0.00 C ATOM 50 CG GLU A 4 -24.028 -11.087 -6.905 1.00 0.00 C ATOM 51 CD GLU A 4 -24.807 -11.508 -5.667 1.00 0.00 C ATOM 52 OE1 GLU A 4 -25.260 -10.631 -4.902 1.00 0.00 O ATOM 53 OE2 GLU A 4 -24.955 -12.726 -5.440 1.00 0.00 O ATOM 0 H GLU A 4 -22.553 -8.571 -7.771 1.00 0.00 H new ATOM 0 HA GLU A 4 -23.049 -9.377 -5.035 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -22.001 -10.768 -7.530 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -22.155 -11.581 -5.985 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -24.497 -10.207 -7.344 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -24.079 -11.881 -7.650 1.00 0.00 H new ATOM 60 N GLU A 5 -20.013 -8.910 -6.176 1.00 0.00 N ATOM 61 CA GLU A 5 -18.599 -8.834 -5.819 1.00 0.00 C ATOM 62 C GLU A 5 -18.159 -7.382 -5.669 1.00 0.00 C ATOM 63 O GLU A 5 -18.188 -6.618 -6.634 1.00 0.00 O ATOM 64 CB GLU A 5 -17.751 -9.526 -6.893 1.00 0.00 C ATOM 65 CG GLU A 5 -18.173 -10.965 -7.173 1.00 0.00 C ATOM 66 CD GLU A 5 -17.346 -11.610 -8.272 1.00 0.00 C ATOM 67 OE1 GLU A 5 -17.598 -11.315 -9.461 1.00 0.00 O ATOM 68 OE2 GLU A 5 -16.447 -12.416 -7.954 1.00 0.00 O ATOM 0 H GLU A 5 -20.222 -8.591 -7.122 1.00 0.00 H new ATOM 0 HA GLU A 5 -18.456 -9.340 -4.864 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -17.812 -8.952 -7.818 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -16.707 -9.517 -6.581 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.079 -11.552 -6.260 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.225 -10.983 -7.456 1.00 0.00 H new ATOM 75 N GLN A 6 -17.766 -7.005 -4.455 1.00 0.00 N ATOM 76 CA GLN A 6 -17.233 -5.670 -4.191 1.00 0.00 C ATOM 77 C GLN A 6 -15.704 -5.716 -4.171 1.00 0.00 C ATOM 78 O GLN A 6 -15.101 -6.142 -3.181 1.00 0.00 O ATOM 79 CB GLN A 6 -17.769 -5.117 -2.855 1.00 0.00 C ATOM 80 CG GLN A 6 -19.150 -4.463 -2.946 1.00 0.00 C ATOM 81 CD GLN A 6 -20.262 -5.409 -3.379 1.00 0.00 C ATOM 82 OE1 GLN A 6 -21.218 -4.991 -4.033 1.00 0.00 O ATOM 83 NE2 GLN A 6 -20.173 -6.673 -2.994 1.00 0.00 N ATOM 0 H GLN A 6 -17.807 -7.609 -3.634 1.00 0.00 H new ATOM 0 HA GLN A 6 -17.561 -5.003 -4.988 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -17.814 -5.931 -2.131 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -17.059 -4.385 -2.469 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -19.405 -4.042 -1.973 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -19.100 -3.632 -3.650 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -19.367 -6.986 -2.453 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -20.911 -7.334 -3.238 1.00 0.00 H new ATOM 92 N PRO A 7 -15.049 -5.304 -5.274 1.00 0.00 N ATOM 93 CA PRO A 7 -13.590 -5.323 -5.386 1.00 0.00 C ATOM 94 C PRO A 7 -12.949 -4.139 -4.660 1.00 0.00 C ATOM 95 O PRO A 7 -12.314 -4.300 -3.619 1.00 0.00 O ATOM 96 CB PRO A 7 -13.333 -5.247 -6.910 1.00 0.00 C ATOM 97 CG PRO A 7 -14.687 -5.257 -7.559 1.00 0.00 C ATOM 98 CD PRO A 7 -15.662 -4.799 -6.509 1.00 0.00 C ATOM 0 HA PRO A 7 -13.153 -6.210 -4.926 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -12.783 -4.342 -7.168 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.732 -6.092 -7.247 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -14.708 -4.595 -8.425 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -14.940 -6.256 -7.915 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -15.767 -3.714 -6.497 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -16.657 -5.214 -6.669 1.00 0.00 H new ATOM 106 N VAL A 8 -13.175 -2.943 -5.194 1.00 0.00 N ATOM 107 CA VAL A 8 -12.536 -1.725 -4.696 1.00 0.00 C ATOM 108 C VAL A 8 -12.988 -1.372 -3.277 1.00 0.00 C ATOM 109 O VAL A 8 -12.338 -0.591 -2.588 1.00 0.00 O ATOM 110 CB VAL A 8 -12.831 -0.531 -5.634 1.00 0.00 C ATOM 111 CG1 VAL A 8 -12.295 -0.799 -7.041 1.00 0.00 C ATOM 112 CG2 VAL A 8 -14.329 -0.235 -5.668 1.00 0.00 C ATOM 0 H VAL A 8 -13.804 -2.788 -5.982 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.464 -1.922 -4.673 1.00 0.00 H new ATOM 0 HB VAL A 8 -12.318 0.348 -5.242 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.514 0.054 -7.683 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.217 -0.952 -6.997 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.771 -1.691 -7.448 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.518 0.608 -6.333 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -14.865 -1.112 -6.032 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.674 0.010 -4.664 1.00 0.00 H new ATOM 122 N ALA A 9 -14.096 -1.951 -2.836 1.00 0.00 N ATOM 123 CA ALA A 9 -14.643 -1.641 -1.517 1.00 0.00 C ATOM 124 C ALA A 9 -13.806 -2.271 -0.401 1.00 0.00 C ATOM 125 O ALA A 9 -14.025 -1.997 0.782 1.00 0.00 O ATOM 126 CB ALA A 9 -16.097 -2.095 -1.426 1.00 0.00 C ATOM 0 H ALA A 9 -14.634 -2.635 -3.368 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.606 -0.560 -1.383 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -16.491 -1.858 -0.438 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -16.687 -1.581 -2.185 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -16.153 -3.171 -1.590 1.00 0.00 H new ATOM 132 N SER A 10 -12.848 -3.114 -0.781 1.00 0.00 N ATOM 133 CA SER A 10 -11.965 -3.758 0.184 1.00 0.00 C ATOM 134 C SER A 10 -10.890 -2.783 0.666 1.00 0.00 C ATOM 135 O SER A 10 -10.229 -3.021 1.679 1.00 0.00 O ATOM 136 CB SER A 10 -11.316 -4.997 -0.444 1.00 0.00 C ATOM 137 OG SER A 10 -10.596 -4.656 -1.616 1.00 0.00 O ATOM 0 H SER A 10 -12.665 -3.366 -1.752 1.00 0.00 H new ATOM 0 HA SER A 10 -12.558 -4.067 1.045 1.00 0.00 H new ATOM 0 HB2 SER A 10 -10.644 -5.464 0.276 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.085 -5.731 -0.686 1.00 0.00 H new ATOM 0 HG SER A 10 -11.182 -4.743 -2.397 1.00 0.00 H new ATOM 143 N TRP A 11 -10.732 -1.677 -0.063 1.00 0.00 N ATOM 144 CA TRP A 11 -9.735 -0.663 0.269 1.00 0.00 C ATOM 145 C TRP A 11 -9.938 -0.141 1.688 1.00 0.00 C ATOM 146 O TRP A 11 -9.004 -0.118 2.490 1.00 0.00 O ATOM 147 CB TRP A 11 -9.814 0.512 -0.708 1.00 0.00 C ATOM 148 CG TRP A 11 -9.522 0.161 -2.137 1.00 0.00 C ATOM 149 CD1 TRP A 11 -8.981 -0.996 -2.626 1.00 0.00 C ATOM 150 CD2 TRP A 11 -9.755 1.002 -3.268 1.00 0.00 C ATOM 151 NE1 TRP A 11 -8.873 -0.921 -3.996 1.00 0.00 N ATOM 152 CE2 TRP A 11 -9.340 0.300 -4.410 1.00 0.00 C ATOM 153 CE3 TRP A 11 -10.276 2.286 -3.417 1.00 0.00 C ATOM 154 CZ2 TRP A 11 -9.434 0.841 -5.688 1.00 0.00 C ATOM 155 CZ3 TRP A 11 -10.372 2.824 -4.682 1.00 0.00 C ATOM 156 CH2 TRP A 11 -9.952 2.104 -5.805 1.00 0.00 C ATOM 0 H TRP A 11 -11.286 -1.462 -0.892 1.00 0.00 H new ATOM 0 HA TRP A 11 -8.754 -1.133 0.196 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -10.812 0.947 -0.652 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -9.112 1.282 -0.387 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -8.683 -1.843 -2.026 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -8.506 -1.653 -4.604 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -10.599 2.850 -2.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -9.111 0.286 -6.556 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -10.778 3.817 -4.808 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -10.038 2.552 -6.784 1.00 0.00 H new ATOM 167 N ALA A 12 -11.170 0.262 1.989 1.00 0.00 N ATOM 168 CA ALA A 12 -11.505 0.821 3.298 1.00 0.00 C ATOM 169 C ALA A 12 -11.412 -0.238 4.395 1.00 0.00 C ATOM 170 O ALA A 12 -11.558 0.075 5.578 1.00 0.00 O ATOM 171 CB ALA A 12 -12.895 1.442 3.274 1.00 0.00 C ATOM 0 H ALA A 12 -11.957 0.212 1.342 1.00 0.00 H new ATOM 0 HA ALA A 12 -10.777 1.601 3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.127 1.853 4.257 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -12.925 2.239 2.531 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.630 0.679 3.017 1.00 0.00 H new ATOM 177 N LEU A 13 -11.178 -1.485 4.002 1.00 0.00 N ATOM 178 CA LEU A 13 -11.014 -2.574 4.957 1.00 0.00 C ATOM 179 C LEU A 13 -9.533 -2.781 5.274 1.00 0.00 C ATOM 180 O LEU A 13 -9.171 -3.093 6.411 1.00 0.00 O ATOM 181 CB LEU A 13 -11.627 -3.869 4.405 1.00 0.00 C ATOM 182 CG LEU A 13 -13.113 -3.774 4.009 1.00 0.00 C ATOM 183 CD1 LEU A 13 -13.621 -5.114 3.480 1.00 0.00 C ATOM 184 CD2 LEU A 13 -13.963 -3.301 5.190 1.00 0.00 C ATOM 0 H LEU A 13 -11.097 -1.767 3.025 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.535 -2.310 5.877 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -11.054 -4.180 3.532 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.516 -4.653 5.154 1.00 0.00 H new ATOM 0 HG LEU A 13 -13.202 -3.037 3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -14.672 -5.022 3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -13.042 -5.402 2.603 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.512 -5.875 4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -15.008 -3.242 4.886 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.865 -4.007 6.015 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -13.623 -2.317 5.512 1.00 0.00 H new ATOM 196 N SER A 14 -8.674 -2.595 4.272 1.00 0.00 N ATOM 197 CA SER A 14 -7.237 -2.780 4.456 1.00 0.00 C ATOM 198 C SER A 14 -6.433 -1.857 3.537 1.00 0.00 C ATOM 199 O SER A 14 -6.482 -1.973 2.305 1.00 0.00 O ATOM 200 CB SER A 14 -6.852 -4.231 4.185 1.00 0.00 C ATOM 201 OG SER A 14 -7.718 -5.131 4.862 1.00 0.00 O ATOM 0 H SER A 14 -8.948 -2.318 3.329 1.00 0.00 H new ATOM 0 HA SER A 14 -7.001 -2.527 5.490 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.889 -4.425 3.113 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.824 -4.402 4.505 1.00 0.00 H new ATOM 0 HG SER A 14 -7.448 -6.053 4.668 1.00 0.00 H new ATOM 207 N PHE A 15 -5.676 -0.962 4.158 1.00 0.00 N ATOM 208 CA PHE A 15 -4.830 -0.008 3.438 1.00 0.00 C ATOM 209 C PHE A 15 -3.799 -0.735 2.583 1.00 0.00 C ATOM 210 O PHE A 15 -3.574 -0.379 1.430 1.00 0.00 O ATOM 211 CB PHE A 15 -4.118 0.924 4.432 1.00 0.00 C ATOM 212 CG PHE A 15 -3.168 1.907 3.784 1.00 0.00 C ATOM 213 CD1 PHE A 15 -3.609 2.765 2.786 1.00 0.00 C ATOM 214 CD2 PHE A 15 -1.836 1.971 4.171 1.00 0.00 C ATOM 215 CE1 PHE A 15 -2.746 3.663 2.192 1.00 0.00 C ATOM 216 CE2 PHE A 15 -0.970 2.869 3.580 1.00 0.00 C ATOM 217 CZ PHE A 15 -1.426 3.715 2.589 1.00 0.00 C ATOM 0 H PHE A 15 -5.628 -0.874 5.173 1.00 0.00 H new ATOM 0 HA PHE A 15 -5.468 0.585 2.783 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -4.869 1.478 4.996 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -3.564 0.318 5.149 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -4.641 2.729 2.470 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.473 1.310 4.944 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.104 4.325 1.417 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.063 2.910 3.893 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.750 4.417 2.125 1.00 0.00 H new ATOM 227 N GLU A 16 -3.181 -1.754 3.169 1.00 0.00 N ATOM 228 CA GLU A 16 -2.162 -2.549 2.496 1.00 0.00 C ATOM 229 C GLU A 16 -2.663 -3.061 1.146 1.00 0.00 C ATOM 230 O GLU A 16 -1.934 -3.015 0.159 1.00 0.00 O ATOM 231 CB GLU A 16 -1.739 -3.720 3.393 1.00 0.00 C ATOM 232 CG GLU A 16 -0.586 -4.553 2.842 1.00 0.00 C ATOM 233 CD GLU A 16 -0.199 -5.689 3.774 1.00 0.00 C ATOM 234 OE1 GLU A 16 -0.829 -6.766 3.697 1.00 0.00 O ATOM 235 OE2 GLU A 16 0.713 -5.504 4.605 1.00 0.00 O ATOM 0 H GLU A 16 -3.373 -2.052 4.125 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.297 -1.913 2.308 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -1.454 -3.329 4.370 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.599 -4.371 3.549 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.867 -4.962 1.872 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.279 -3.910 2.678 1.00 0.00 H new ATOM 242 N ARG A 17 -3.912 -3.534 1.097 1.00 0.00 N ATOM 243 CA ARG A 17 -4.476 -4.036 -0.156 1.00 0.00 C ATOM 244 C ARG A 17 -4.600 -2.906 -1.175 1.00 0.00 C ATOM 245 O ARG A 17 -4.134 -3.037 -2.303 1.00 0.00 O ATOM 246 CB ARG A 17 -5.838 -4.717 0.054 1.00 0.00 C ATOM 247 CG ARG A 17 -6.441 -5.240 -1.251 1.00 0.00 C ATOM 248 CD ARG A 17 -7.717 -6.043 -1.038 1.00 0.00 C ATOM 249 NE ARG A 17 -8.287 -6.477 -2.319 1.00 0.00 N ATOM 250 CZ ARG A 17 -9.122 -7.506 -2.474 1.00 0.00 C ATOM 251 NH1 ARG A 17 -9.491 -8.238 -1.430 1.00 0.00 N ATOM 252 NH2 ARG A 17 -9.582 -7.799 -3.683 1.00 0.00 N ATOM 0 H ARG A 17 -4.542 -3.579 1.898 1.00 0.00 H new ATOM 0 HA ARG A 17 -3.790 -4.791 -0.540 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -5.722 -5.545 0.754 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -6.528 -4.008 0.510 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -6.654 -4.398 -1.909 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -5.706 -5.864 -1.760 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -7.504 -6.913 -0.418 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -8.446 -5.438 -0.498 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.025 -5.952 -3.154 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -9.136 -8.016 -0.500 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -10.130 -9.023 -1.558 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -9.297 -7.239 -4.487 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -10.221 -8.584 -3.809 1.00 0.00 H new ATOM 266 N LEU A 18 -5.219 -1.794 -0.768 1.00 0.00 N ATOM 267 CA LEU A 18 -5.349 -0.620 -1.641 1.00 0.00 C ATOM 268 C LEU A 18 -3.982 -0.215 -2.187 1.00 0.00 C ATOM 269 O LEU A 18 -3.804 -0.010 -3.389 1.00 0.00 O ATOM 270 CB LEU A 18 -5.993 0.554 -0.865 1.00 0.00 C ATOM 271 CG LEU A 18 -5.958 1.943 -1.561 1.00 0.00 C ATOM 272 CD1 LEU A 18 -7.144 2.800 -1.134 1.00 0.00 C ATOM 273 CD2 LEU A 18 -4.657 2.690 -1.253 1.00 0.00 C ATOM 0 H LEU A 18 -5.637 -1.680 0.156 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.995 -0.876 -2.481 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -7.033 0.300 -0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.492 0.642 0.099 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.014 1.763 -2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.094 3.766 -1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.072 2.297 -1.405 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.115 2.950 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.665 3.657 -1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.570 2.840 -0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.809 2.105 -1.607 1.00 0.00 H new ATOM 285 N LEU A 19 -3.023 -0.126 -1.280 1.00 0.00 N ATOM 286 CA LEU A 19 -1.680 0.343 -1.591 1.00 0.00 C ATOM 287 C LEU A 19 -0.906 -0.685 -2.423 1.00 0.00 C ATOM 288 O LEU A 19 -0.006 -0.332 -3.183 1.00 0.00 O ATOM 289 CB LEU A 19 -0.946 0.646 -0.278 1.00 0.00 C ATOM 290 CG LEU A 19 0.476 1.201 -0.418 1.00 0.00 C ATOM 291 CD1 LEU A 19 0.491 2.477 -1.260 1.00 0.00 C ATOM 292 CD2 LEU A 19 1.086 1.461 0.953 1.00 0.00 C ATOM 0 H LEU A 19 -3.154 -0.378 -0.300 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.750 1.250 -2.191 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.540 1.361 0.291 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.901 -0.270 0.310 1.00 0.00 H new ATOM 0 HG LEU A 19 1.079 0.452 -0.931 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.513 2.847 -1.342 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.103 2.261 -2.255 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.132 3.234 -0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.095 1.855 0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.475 2.186 1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.124 0.529 1.517 1.00 0.00 H new ATOM 304 N GLN A 20 -1.260 -1.954 -2.279 1.00 0.00 N ATOM 305 CA GLN A 20 -0.578 -3.028 -3.004 1.00 0.00 C ATOM 306 C GLN A 20 -1.357 -3.420 -4.266 1.00 0.00 C ATOM 307 O GLN A 20 -0.895 -4.235 -5.067 1.00 0.00 O ATOM 308 CB GLN A 20 -0.378 -4.235 -2.073 1.00 0.00 C ATOM 309 CG GLN A 20 0.392 -5.402 -2.689 1.00 0.00 C ATOM 310 CD GLN A 20 0.819 -6.438 -1.660 1.00 0.00 C ATOM 311 OE1 GLN A 20 0.869 -7.634 -1.948 1.00 0.00 O ATOM 312 NE2 GLN A 20 1.165 -5.983 -0.464 1.00 0.00 N ATOM 0 H GLN A 20 -2.014 -2.270 -1.669 1.00 0.00 H new ATOM 0 HA GLN A 20 0.400 -2.672 -3.326 1.00 0.00 H new ATOM 0 HB2 GLN A 20 0.149 -3.902 -1.179 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.356 -4.593 -1.751 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.230 -5.882 -3.445 1.00 0.00 H new ATOM 0 HG3 GLN A 20 1.275 -5.019 -3.200 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.110 -4.985 -0.263 1.00 0.00 H new ATOM 0 HE22 GLN A 20 1.486 -6.631 0.255 1.00 0.00 H new ATOM 321 N ASP A 21 -2.532 -2.827 -4.447 1.00 0.00 N ATOM 322 CA ASP A 21 -3.349 -3.072 -5.639 1.00 0.00 C ATOM 323 C ASP A 21 -3.056 -2.007 -6.696 1.00 0.00 C ATOM 324 O ASP A 21 -2.989 -0.823 -6.373 1.00 0.00 O ATOM 325 CB ASP A 21 -4.845 -3.060 -5.281 1.00 0.00 C ATOM 326 CG ASP A 21 -5.735 -3.416 -6.465 1.00 0.00 C ATOM 327 OD1 ASP A 21 -6.018 -4.617 -6.662 1.00 0.00 O ATOM 328 OD2 ASP A 21 -6.154 -2.498 -7.204 1.00 0.00 O ATOM 0 H ASP A 21 -2.944 -2.171 -3.784 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.097 -4.054 -6.039 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.026 -3.766 -4.470 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.118 -2.072 -4.911 1.00 0.00 H new ATOM 333 N PRO A 22 -2.867 -2.405 -7.972 1.00 0.00 N ATOM 334 CA PRO A 22 -2.536 -1.461 -9.051 1.00 0.00 C ATOM 335 C PRO A 22 -3.598 -0.368 -9.230 1.00 0.00 C ATOM 336 O PRO A 22 -3.266 0.811 -9.357 1.00 0.00 O ATOM 337 CB PRO A 22 -2.441 -2.352 -10.306 1.00 0.00 C ATOM 338 CG PRO A 22 -3.152 -3.615 -9.944 1.00 0.00 C ATOM 339 CD PRO A 22 -2.950 -3.794 -8.465 1.00 0.00 C ATOM 0 HA PRO A 22 -1.616 -0.916 -8.839 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -2.906 -1.871 -11.167 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -1.402 -2.547 -10.573 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.212 -3.550 -10.188 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -2.749 -4.463 -10.498 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -3.777 -4.336 -8.007 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -2.041 -4.355 -8.246 1.00 0.00 H new ATOM 347 N LEU A 23 -4.870 -0.763 -9.219 1.00 0.00 N ATOM 348 CA LEU A 23 -5.969 0.181 -9.416 1.00 0.00 C ATOM 349 C LEU A 23 -6.078 1.092 -8.194 1.00 0.00 C ATOM 350 O LEU A 23 -6.257 2.311 -8.320 1.00 0.00 O ATOM 351 CB LEU A 23 -7.286 -0.591 -9.664 1.00 0.00 C ATOM 352 CG LEU A 23 -8.478 0.226 -10.219 1.00 0.00 C ATOM 353 CD1 LEU A 23 -9.533 -0.704 -10.816 1.00 0.00 C ATOM 354 CD2 LEU A 23 -9.113 1.095 -9.137 1.00 0.00 C ATOM 0 H LEU A 23 -5.165 -1.729 -9.076 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.775 0.801 -10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.078 -1.404 -10.360 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.595 -1.047 -8.724 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.090 0.880 -11.000 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.363 -0.112 -11.201 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.091 -1.281 -11.628 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.898 -1.383 -10.045 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.946 1.654 -9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.477 0.461 -8.328 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.370 1.791 -8.747 1.00 0.00 H new ATOM 366 N GLY A 24 -5.944 0.490 -7.017 1.00 0.00 N ATOM 367 CA GLY A 24 -6.005 1.239 -5.775 1.00 0.00 C ATOM 368 C GLY A 24 -4.911 2.280 -5.678 1.00 0.00 C ATOM 369 O GLY A 24 -5.184 3.471 -5.492 1.00 0.00 O ATOM 0 H GLY A 24 -5.793 -0.512 -6.901 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -6.976 1.727 -5.695 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -5.924 0.551 -4.934 1.00 0.00 H new ATOM 373 N LEU A 25 -3.669 1.831 -5.827 1.00 0.00 N ATOM 374 CA LEU A 25 -2.511 2.713 -5.753 1.00 0.00 C ATOM 375 C LEU A 25 -2.585 3.774 -6.852 1.00 0.00 C ATOM 376 O LEU A 25 -2.111 4.889 -6.670 1.00 0.00 O ATOM 377 CB LEU A 25 -1.201 1.907 -5.879 1.00 0.00 C ATOM 378 CG LEU A 25 -0.072 2.305 -4.905 1.00 0.00 C ATOM 379 CD1 LEU A 25 1.229 1.593 -5.267 1.00 0.00 C ATOM 380 CD2 LEU A 25 0.130 3.820 -4.861 1.00 0.00 C ATOM 0 H LEU A 25 -3.438 0.853 -6.001 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.518 3.208 -4.782 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.430 0.852 -5.729 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.829 2.011 -6.898 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.373 1.988 -3.906 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.012 1.888 -4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.081 0.514 -5.212 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.525 1.868 -6.280 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.933 4.060 -4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.392 4.181 -5.855 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.791 4.301 -4.532 1.00 0.00 H new ATOM 392 N ALA A 26 -3.186 3.418 -7.987 1.00 0.00 N ATOM 393 CA ALA A 26 -3.327 4.349 -9.107 1.00 0.00 C ATOM 394 C ALA A 26 -4.059 5.618 -8.672 1.00 0.00 C ATOM 395 O ALA A 26 -3.522 6.724 -8.768 1.00 0.00 O ATOM 396 CB ALA A 26 -4.055 3.683 -10.269 1.00 0.00 C ATOM 0 H ALA A 26 -3.583 2.493 -8.155 1.00 0.00 H new ATOM 0 HA ALA A 26 -2.328 4.631 -9.441 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.150 4.391 -11.092 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.489 2.813 -10.602 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.047 3.368 -9.945 1.00 0.00 H new ATOM 402 N TYR A 27 -5.279 5.455 -8.167 1.00 0.00 N ATOM 403 CA TYR A 27 -6.079 6.599 -7.740 1.00 0.00 C ATOM 404 C TYR A 27 -5.481 7.243 -6.493 1.00 0.00 C ATOM 405 O TYR A 27 -5.500 8.467 -6.343 1.00 0.00 O ATOM 406 CB TYR A 27 -7.530 6.179 -7.477 1.00 0.00 C ATOM 407 CG TYR A 27 -8.331 5.909 -8.737 1.00 0.00 C ATOM 408 CD1 TYR A 27 -8.753 6.957 -9.547 1.00 0.00 C ATOM 409 CD2 TYR A 27 -8.673 4.614 -9.112 1.00 0.00 C ATOM 410 CE1 TYR A 27 -9.489 6.726 -10.692 1.00 0.00 C ATOM 411 CE2 TYR A 27 -9.412 4.375 -10.257 1.00 0.00 C ATOM 412 CZ TYR A 27 -9.818 5.433 -11.042 1.00 0.00 C ATOM 413 OH TYR A 27 -10.560 5.198 -12.181 1.00 0.00 O ATOM 0 H TYR A 27 -5.732 4.550 -8.044 1.00 0.00 H new ATOM 0 HA TYR A 27 -6.072 7.334 -8.545 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -7.531 5.282 -6.858 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -8.026 6.962 -6.904 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -8.500 7.971 -9.275 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -8.357 3.782 -8.500 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -9.805 7.553 -11.310 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -9.670 3.364 -10.535 1.00 0.00 H new ATOM 0 HH TYR A 27 -10.704 4.234 -12.284 1.00 0.00 H new ATOM 423 N PHE A 28 -4.936 6.414 -5.610 1.00 0.00 N ATOM 424 CA PHE A 28 -4.363 6.889 -4.355 1.00 0.00 C ATOM 425 C PHE A 28 -3.150 7.786 -4.615 1.00 0.00 C ATOM 426 O PHE A 28 -3.023 8.859 -4.025 1.00 0.00 O ATOM 427 CB PHE A 28 -3.975 5.695 -3.473 1.00 0.00 C ATOM 428 CG PHE A 28 -3.452 6.078 -2.111 1.00 0.00 C ATOM 429 CD1 PHE A 28 -4.190 6.907 -1.277 1.00 0.00 C ATOM 430 CD2 PHE A 28 -2.230 5.601 -1.660 1.00 0.00 C ATOM 431 CE1 PHE A 28 -3.719 7.251 -0.025 1.00 0.00 C ATOM 432 CE2 PHE A 28 -1.755 5.944 -0.410 1.00 0.00 C ATOM 433 CZ PHE A 28 -2.501 6.769 0.409 1.00 0.00 C ATOM 0 H PHE A 28 -4.879 5.404 -5.741 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.112 7.484 -3.832 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -4.846 5.052 -3.348 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -3.216 5.107 -3.989 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -5.144 7.287 -1.611 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.643 4.953 -2.294 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -4.303 7.897 0.614 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.801 5.567 -0.073 1.00 0.00 H new ATOM 0 HZ PHE A 28 -2.131 7.037 1.388 1.00 0.00 H new ATOM 443 N THR A 29 -2.279 7.355 -5.525 1.00 0.00 N ATOM 444 CA THR A 29 -1.061 8.097 -5.840 1.00 0.00 C ATOM 445 C THR A 29 -1.408 9.383 -6.593 1.00 0.00 C ATOM 446 O THR A 29 -0.667 10.367 -6.537 1.00 0.00 O ATOM 447 CB THR A 29 -0.066 7.238 -6.673 1.00 0.00 C ATOM 448 OG1 THR A 29 1.247 7.817 -6.648 1.00 0.00 O ATOM 449 CG2 THR A 29 -0.516 7.096 -8.126 1.00 0.00 C ATOM 0 H THR A 29 -2.395 6.493 -6.058 1.00 0.00 H new ATOM 0 HA THR A 29 -0.573 8.351 -4.899 1.00 0.00 H new ATOM 0 HB THR A 29 -0.044 6.249 -6.216 1.00 0.00 H new ATOM 0 HG1 THR A 29 1.179 8.774 -6.447 1.00 0.00 H new ATOM 0 HG21 THR A 29 0.206 6.489 -8.673 1.00 0.00 H new ATOM 0 HG22 THR A 29 -1.493 6.614 -8.159 1.00 0.00 H new ATOM 0 HG23 THR A 29 -0.582 8.083 -8.584 1.00 0.00 H new ATOM 457 N GLU A 30 -2.542 9.361 -7.297 1.00 0.00 N ATOM 458 CA GLU A 30 -3.033 10.529 -8.022 1.00 0.00 C ATOM 459 C GLU A 30 -3.641 11.554 -7.066 1.00 0.00 C ATOM 460 O GLU A 30 -3.417 12.759 -7.215 1.00 0.00 O ATOM 461 CB GLU A 30 -4.074 10.108 -9.072 1.00 0.00 C ATOM 462 CG GLU A 30 -3.467 9.480 -10.322 1.00 0.00 C ATOM 463 CD GLU A 30 -2.647 10.473 -11.130 1.00 0.00 C ATOM 464 OE1 GLU A 30 -3.254 11.319 -11.826 1.00 0.00 O ATOM 465 OE2 GLU A 30 -1.398 10.417 -11.078 1.00 0.00 O ATOM 0 H GLU A 30 -3.140 8.539 -7.379 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.185 10.992 -8.526 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.766 9.398 -8.619 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.658 10.982 -9.362 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -2.834 8.641 -10.033 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -4.264 9.078 -10.947 1.00 0.00 H new ATOM 472 N PHE A 31 -4.402 11.078 -6.083 1.00 0.00 N ATOM 473 CA PHE A 31 -5.087 11.975 -5.157 1.00 0.00 C ATOM 474 C PHE A 31 -4.111 12.537 -4.125 1.00 0.00 C ATOM 475 O PHE A 31 -4.215 13.694 -3.730 1.00 0.00 O ATOM 476 CB PHE A 31 -6.253 11.269 -4.455 1.00 0.00 C ATOM 477 CG PHE A 31 -7.133 12.229 -3.694 1.00 0.00 C ATOM 478 CD1 PHE A 31 -8.127 12.941 -4.350 1.00 0.00 C ATOM 479 CD2 PHE A 31 -6.953 12.439 -2.333 1.00 0.00 C ATOM 480 CE1 PHE A 31 -8.920 13.841 -3.668 1.00 0.00 C ATOM 481 CE2 PHE A 31 -7.747 13.335 -1.648 1.00 0.00 C ATOM 482 CZ PHE A 31 -8.731 14.039 -2.316 1.00 0.00 C ATOM 0 H PHE A 31 -4.559 10.085 -5.908 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.493 12.801 -5.740 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.853 10.740 -5.196 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -5.860 10.519 -3.769 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.282 12.789 -5.408 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.183 11.895 -1.806 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -9.688 14.390 -4.192 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -7.600 13.487 -0.589 1.00 0.00 H new ATOM 0 HZ PHE A 31 -9.351 14.743 -1.780 1.00 0.00 H new ATOM 492 N LEU A 32 -3.146 11.721 -3.717 1.00 0.00 N ATOM 493 CA LEU A 32 -2.129 12.144 -2.750 1.00 0.00 C ATOM 494 C LEU A 32 -1.107 13.077 -3.422 1.00 0.00 C ATOM 495 O LEU A 32 -0.095 13.466 -2.829 1.00 0.00 O ATOM 496 CB LEU A 32 -1.445 10.896 -2.152 1.00 0.00 C ATOM 497 CG LEU A 32 -0.481 11.143 -0.978 1.00 0.00 C ATOM 498 CD1 LEU A 32 -1.163 11.923 0.139 1.00 0.00 C ATOM 499 CD2 LEU A 32 0.070 9.820 -0.448 1.00 0.00 C ATOM 0 H LEU A 32 -3.043 10.759 -4.040 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.600 12.703 -1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.221 10.207 -1.818 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.894 10.394 -2.947 1.00 0.00 H new ATOM 0 HG LEU A 32 0.351 11.743 -1.348 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.458 12.082 0.955 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.500 12.887 -0.243 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.020 11.359 0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.750 10.015 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.754 9.195 -0.103 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.608 9.305 -1.244 1.00 0.00 H new ATOM 511 N LYS A 33 -1.390 13.431 -4.674 1.00 0.00 N ATOM 512 CA LYS A 33 -0.535 14.309 -5.465 1.00 0.00 C ATOM 513 C LYS A 33 -1.175 15.699 -5.609 1.00 0.00 C ATOM 514 O LYS A 33 -0.557 16.626 -6.141 1.00 0.00 O ATOM 515 CB LYS A 33 -0.314 13.667 -6.844 1.00 0.00 C ATOM 516 CG LYS A 33 0.693 14.385 -7.741 1.00 0.00 C ATOM 517 CD LYS A 33 0.795 13.703 -9.105 1.00 0.00 C ATOM 518 CE LYS A 33 1.813 14.376 -10.019 1.00 0.00 C ATOM 519 NZ LYS A 33 1.839 13.747 -11.368 1.00 0.00 N ATOM 0 H LYS A 33 -2.224 13.114 -5.169 1.00 0.00 H new ATOM 0 HA LYS A 33 0.424 14.438 -4.964 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.020 12.640 -6.700 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -1.271 13.621 -7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.392 15.425 -7.872 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.671 14.394 -7.261 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.072 12.658 -8.965 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.183 13.712 -9.586 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.572 15.435 -10.115 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.804 14.314 -9.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.542 14.230 -11.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 2.093 12.743 -11.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.900 13.829 -11.807 1.00 0.00 H new ATOM 533 N LYS A 34 -2.408 15.841 -5.111 1.00 0.00 N ATOM 534 CA LYS A 34 -3.155 17.096 -5.237 1.00 0.00 C ATOM 535 C LYS A 34 -2.525 18.171 -4.351 1.00 0.00 C ATOM 536 O LYS A 34 -2.088 19.218 -4.831 1.00 0.00 O ATOM 537 CB LYS A 34 -4.632 16.900 -4.846 1.00 0.00 C ATOM 538 CG LYS A 34 -5.342 15.759 -5.578 1.00 0.00 C ATOM 539 CD LYS A 34 -5.405 15.972 -7.088 1.00 0.00 C ATOM 540 CE LYS A 34 -6.144 14.826 -7.777 1.00 0.00 C ATOM 541 NZ LYS A 34 -6.233 15.016 -9.248 1.00 0.00 N ATOM 0 H LYS A 34 -2.909 15.102 -4.617 1.00 0.00 H new ATOM 0 HA LYS A 34 -3.113 17.414 -6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -4.688 16.716 -3.773 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.171 17.828 -5.039 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.825 14.822 -5.369 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.355 15.658 -5.188 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.908 16.915 -7.304 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -4.395 16.050 -7.489 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.633 13.887 -7.564 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -7.149 14.743 -7.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.742 14.214 -9.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -6.744 15.898 -9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.275 15.069 -9.650 1.00 0.00 H new ATOM 555 N GLU A 35 -2.488 17.898 -3.052 1.00 0.00 N ATOM 556 CA GLU A 35 -1.842 18.786 -2.081 1.00 0.00 C ATOM 557 C GLU A 35 -0.346 18.480 -2.018 1.00 0.00 C ATOM 558 O GLU A 35 0.442 19.249 -1.455 1.00 0.00 O ATOM 559 CB GLU A 35 -2.487 18.652 -0.683 1.00 0.00 C ATOM 560 CG GLU A 35 -2.409 17.255 -0.056 1.00 0.00 C ATOM 561 CD GLU A 35 -3.293 16.229 -0.755 1.00 0.00 C ATOM 562 OE1 GLU A 35 -4.506 16.168 -0.441 1.00 0.00 O ATOM 563 OE2 GLU A 35 -2.780 15.501 -1.633 1.00 0.00 O ATOM 0 H GLU A 35 -2.901 17.061 -2.640 1.00 0.00 H new ATOM 0 HA GLU A 35 -1.981 19.816 -2.408 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.006 19.362 -0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.535 18.942 -0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.375 16.911 -0.081 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.698 17.319 0.993 1.00 0.00 H new ATOM 570 N PHE A 36 0.014 17.334 -2.595 1.00 0.00 N ATOM 571 CA PHE A 36 1.400 16.902 -2.755 1.00 0.00 C ATOM 572 C PHE A 36 1.946 16.343 -1.450 1.00 0.00 C ATOM 573 O PHE A 36 2.524 17.059 -0.631 1.00 0.00 O ATOM 574 CB PHE A 36 2.311 18.019 -3.297 1.00 0.00 C ATOM 575 CG PHE A 36 3.738 17.570 -3.533 1.00 0.00 C ATOM 576 CD1 PHE A 36 4.050 16.746 -4.607 1.00 0.00 C ATOM 577 CD2 PHE A 36 4.761 17.958 -2.675 1.00 0.00 C ATOM 578 CE1 PHE A 36 5.352 16.323 -4.821 1.00 0.00 C ATOM 579 CE2 PHE A 36 6.061 17.534 -2.885 1.00 0.00 C ATOM 580 CZ PHE A 36 6.356 16.718 -3.959 1.00 0.00 C ATOM 0 H PHE A 36 -0.662 16.669 -2.971 1.00 0.00 H new ATOM 0 HA PHE A 36 1.398 16.108 -3.502 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.896 18.394 -4.233 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.311 18.851 -2.593 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.269 16.431 -5.283 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.538 18.598 -1.834 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.582 15.685 -5.661 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.845 17.841 -2.209 1.00 0.00 H new ATOM 0 HZ PHE A 36 7.371 16.389 -4.125 1.00 0.00 H new ATOM 590 N SER A 37 1.699 15.062 -1.250 1.00 0.00 N ATOM 591 CA SER A 37 2.269 14.309 -0.145 1.00 0.00 C ATOM 592 C SER A 37 2.560 12.883 -0.617 1.00 0.00 C ATOM 593 O SER A 37 2.816 11.978 0.179 1.00 0.00 O ATOM 594 CB SER A 37 1.303 14.320 1.045 1.00 0.00 C ATOM 595 OG SER A 37 1.079 15.645 1.509 1.00 0.00 O ATOM 0 H SER A 37 1.092 14.509 -1.855 1.00 0.00 H new ATOM 0 HA SER A 37 3.203 14.766 0.183 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.355 13.869 0.752 1.00 0.00 H new ATOM 0 HB3 SER A 37 1.709 13.712 1.853 1.00 0.00 H new ATOM 0 HG SER A 37 0.458 15.626 2.267 1.00 0.00 H new ATOM 601 N ALA A 38 2.561 12.715 -1.945 1.00 0.00 N ATOM 602 CA ALA A 38 2.756 11.413 -2.582 1.00 0.00 C ATOM 603 C ALA A 38 4.198 10.925 -2.452 1.00 0.00 C ATOM 604 O ALA A 38 4.565 9.893 -3.018 1.00 0.00 O ATOM 605 CB ALA A 38 2.351 11.486 -4.053 1.00 0.00 C ATOM 0 H ALA A 38 2.426 13.480 -2.606 1.00 0.00 H new ATOM 0 HA ALA A 38 2.121 10.692 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 38 2.499 10.512 -4.520 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.301 11.768 -4.128 1.00 0.00 H new ATOM 0 HB3 ALA A 38 2.964 12.230 -4.563 1.00 0.00 H new ATOM 611 N GLU A 39 5.010 11.668 -1.705 1.00 0.00 N ATOM 612 CA GLU A 39 6.391 11.276 -1.443 1.00 0.00 C ATOM 613 C GLU A 39 6.414 9.879 -0.827 1.00 0.00 C ATOM 614 O GLU A 39 7.223 9.026 -1.197 1.00 0.00 O ATOM 615 CB GLU A 39 7.050 12.275 -0.481 1.00 0.00 C ATOM 616 CG GLU A 39 6.974 13.727 -0.944 1.00 0.00 C ATOM 617 CD GLU A 39 7.493 14.699 0.105 1.00 0.00 C ATOM 618 OE1 GLU A 39 6.770 14.945 1.097 1.00 0.00 O ATOM 619 OE2 GLU A 39 8.623 15.207 -0.046 1.00 0.00 O ATOM 0 H GLU A 39 4.734 12.548 -1.269 1.00 0.00 H new ATOM 0 HA GLU A 39 6.945 11.271 -2.382 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.574 12.191 0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.097 12.001 -0.350 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.552 13.844 -1.861 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.940 13.975 -1.185 1.00 0.00 H new ATOM 626 N ASN A 40 5.478 9.661 0.093 1.00 0.00 N ATOM 627 CA ASN A 40 5.364 8.402 0.825 1.00 0.00 C ATOM 628 C ASN A 40 5.160 7.226 -0.129 1.00 0.00 C ATOM 629 O ASN A 40 5.943 6.275 -0.133 1.00 0.00 O ATOM 630 CB ASN A 40 4.190 8.469 1.817 1.00 0.00 C ATOM 631 CG ASN A 40 4.319 9.605 2.820 1.00 0.00 C ATOM 632 OD1 ASN A 40 5.422 9.990 3.208 1.00 0.00 O ATOM 633 ND2 ASN A 40 3.189 10.161 3.235 1.00 0.00 N ATOM 0 H ASN A 40 4.776 10.354 0.353 1.00 0.00 H new ATOM 0 HA ASN A 40 6.294 8.248 1.371 1.00 0.00 H new ATOM 0 HB2 ASN A 40 3.259 8.587 1.262 1.00 0.00 H new ATOM 0 HB3 ASN A 40 4.123 7.523 2.355 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.215 10.935 3.898 1.00 0.00 H new ATOM 0 HD22 ASN A 40 2.294 9.814 2.891 1.00 0.00 H new ATOM 640 N VAL A 41 4.113 7.307 -0.950 1.00 0.00 N ATOM 641 CA VAL A 41 3.741 6.201 -1.832 1.00 0.00 C ATOM 642 C VAL A 41 4.832 5.911 -2.859 1.00 0.00 C ATOM 643 O VAL A 41 5.151 4.753 -3.114 1.00 0.00 O ATOM 644 CB VAL A 41 2.394 6.452 -2.562 1.00 0.00 C ATOM 645 CG1 VAL A 41 1.268 6.613 -1.552 1.00 0.00 C ATOM 646 CG2 VAL A 41 2.471 7.669 -3.483 1.00 0.00 C ATOM 0 H VAL A 41 3.508 8.125 -1.023 1.00 0.00 H new ATOM 0 HA VAL A 41 3.620 5.331 -1.186 1.00 0.00 H new ATOM 0 HB VAL A 41 2.185 5.583 -3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.330 6.788 -2.078 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.184 5.706 -0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.482 7.460 -0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.510 7.813 -3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.714 8.555 -2.896 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.244 7.508 -4.234 1.00 0.00 H new ATOM 656 N THR A 42 5.414 6.961 -3.432 1.00 0.00 N ATOM 657 CA THR A 42 6.448 6.797 -4.447 1.00 0.00 C ATOM 658 C THR A 42 7.683 6.122 -3.841 1.00 0.00 C ATOM 659 O THR A 42 8.299 5.252 -4.460 1.00 0.00 O ATOM 660 CB THR A 42 6.832 8.156 -5.078 1.00 0.00 C ATOM 661 OG1 THR A 42 5.638 8.889 -5.401 1.00 0.00 O ATOM 662 CG2 THR A 42 7.660 7.962 -6.346 1.00 0.00 C ATOM 0 H THR A 42 5.188 7.931 -3.211 1.00 0.00 H new ATOM 0 HA THR A 42 6.049 6.161 -5.237 1.00 0.00 H new ATOM 0 HB THR A 42 7.431 8.710 -4.355 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.287 9.316 -4.592 1.00 0.00 H new ATOM 0 HG21 THR A 42 7.915 8.935 -6.767 1.00 0.00 H new ATOM 0 HG22 THR A 42 8.575 7.421 -6.104 1.00 0.00 H new ATOM 0 HG23 THR A 42 7.083 7.392 -7.074 1.00 0.00 H new ATOM 670 N PHE A 43 8.013 6.509 -2.609 1.00 0.00 N ATOM 671 CA PHE A 43 9.103 5.881 -1.864 1.00 0.00 C ATOM 672 C PHE A 43 8.779 4.414 -1.593 1.00 0.00 C ATOM 673 O PHE A 43 9.638 3.537 -1.727 1.00 0.00 O ATOM 674 CB PHE A 43 9.330 6.629 -0.542 1.00 0.00 C ATOM 675 CG PHE A 43 10.353 5.996 0.371 1.00 0.00 C ATOM 676 CD1 PHE A 43 11.711 6.133 0.117 1.00 0.00 C ATOM 677 CD2 PHE A 43 9.956 5.277 1.492 1.00 0.00 C ATOM 678 CE1 PHE A 43 12.648 5.564 0.960 1.00 0.00 C ATOM 679 CE2 PHE A 43 10.891 4.705 2.335 1.00 0.00 C ATOM 680 CZ PHE A 43 12.238 4.850 2.068 1.00 0.00 C ATOM 0 H PHE A 43 7.538 7.258 -2.104 1.00 0.00 H new ATOM 0 HA PHE A 43 10.015 5.931 -2.459 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.644 7.649 -0.766 1.00 0.00 H new ATOM 0 HB3 PHE A 43 8.381 6.697 -0.011 1.00 0.00 H new ATOM 0 HD1 PHE A 43 12.039 6.690 -0.748 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.904 5.164 1.708 1.00 0.00 H new ATOM 0 HE1 PHE A 43 13.701 5.678 0.751 1.00 0.00 H new ATOM 0 HE2 PHE A 43 10.568 4.146 3.201 1.00 0.00 H new ATOM 0 HZ PHE A 43 12.970 4.405 2.726 1.00 0.00 H new ATOM 690 N TRP A 44 7.526 4.161 -1.218 1.00 0.00 N ATOM 691 CA TRP A 44 7.055 2.809 -0.929 1.00 0.00 C ATOM 692 C TRP A 44 7.212 1.920 -2.167 1.00 0.00 C ATOM 693 O TRP A 44 7.682 0.783 -2.070 1.00 0.00 O ATOM 694 CB TRP A 44 5.586 2.851 -0.471 1.00 0.00 C ATOM 695 CG TRP A 44 5.078 1.547 0.080 1.00 0.00 C ATOM 696 CD1 TRP A 44 5.224 1.086 1.358 1.00 0.00 C ATOM 697 CD2 TRP A 44 4.333 0.545 -0.624 1.00 0.00 C ATOM 698 NE1 TRP A 44 4.634 -0.147 1.487 1.00 0.00 N ATOM 699 CE2 TRP A 44 4.074 -0.498 0.285 1.00 0.00 C ATOM 700 CE3 TRP A 44 3.862 0.427 -1.937 1.00 0.00 C ATOM 701 CZ2 TRP A 44 3.365 -1.641 -0.075 1.00 0.00 C ATOM 702 CZ3 TRP A 44 3.158 -0.707 -2.292 1.00 0.00 C ATOM 703 CH2 TRP A 44 2.914 -1.728 -1.364 1.00 0.00 C ATOM 0 H TRP A 44 6.814 4.883 -1.107 1.00 0.00 H new ATOM 0 HA TRP A 44 7.656 2.386 -0.124 1.00 0.00 H new ATOM 0 HB2 TRP A 44 5.476 3.623 0.291 1.00 0.00 H new ATOM 0 HB3 TRP A 44 4.962 3.145 -1.315 1.00 0.00 H new ATOM 0 HD1 TRP A 44 5.730 1.615 2.152 1.00 0.00 H new ATOM 0 HE1 TRP A 44 4.615 -0.710 2.337 1.00 0.00 H new ATOM 0 HE3 TRP A 44 4.046 1.209 -2.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 3.178 -2.431 0.638 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 2.789 -0.808 -3.302 1.00 0.00 H new ATOM 0 HH2 TRP A 44 2.359 -2.601 -1.672 1.00 0.00 H new ATOM 714 N LYS A 45 6.836 2.461 -3.327 1.00 0.00 N ATOM 715 CA LYS A 45 6.976 1.754 -4.602 1.00 0.00 C ATOM 716 C LYS A 45 8.441 1.408 -4.857 1.00 0.00 C ATOM 717 O LYS A 45 8.781 0.265 -5.166 1.00 0.00 O ATOM 718 CB LYS A 45 6.458 2.619 -5.763 1.00 0.00 C ATOM 719 CG LYS A 45 4.993 3.032 -5.647 1.00 0.00 C ATOM 720 CD LYS A 45 4.594 3.994 -6.767 1.00 0.00 C ATOM 721 CE LYS A 45 3.184 4.544 -6.582 1.00 0.00 C ATOM 722 NZ LYS A 45 2.822 5.512 -7.652 1.00 0.00 N ATOM 0 H LYS A 45 6.429 3.393 -3.410 1.00 0.00 H new ATOM 0 HA LYS A 45 6.387 0.839 -4.544 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.071 3.518 -5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.594 2.071 -6.695 1.00 0.00 H new ATOM 0 HG2 LYS A 45 4.360 2.146 -5.684 1.00 0.00 H new ATOM 0 HG3 LYS A 45 4.822 3.506 -4.680 1.00 0.00 H new ATOM 0 HD2 LYS A 45 5.303 4.821 -6.802 1.00 0.00 H new ATOM 0 HD3 LYS A 45 4.658 3.479 -7.725 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.470 3.720 -6.581 1.00 0.00 H new ATOM 0 HE3 LYS A 45 3.109 5.032 -5.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.307 6.314 -7.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 3.687 5.858 -8.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.218 5.041 -8.356 1.00 0.00 H new ATOM 736 N ALA A 46 9.301 2.413 -4.716 1.00 0.00 N ATOM 737 CA ALA A 46 10.730 2.262 -4.976 1.00 0.00 C ATOM 738 C ALA A 46 11.348 1.193 -4.076 1.00 0.00 C ATOM 739 O ALA A 46 12.151 0.374 -4.526 1.00 0.00 O ATOM 740 CB ALA A 46 11.441 3.598 -4.793 1.00 0.00 C ATOM 0 H ALA A 46 9.029 3.350 -4.420 1.00 0.00 H new ATOM 0 HA ALA A 46 10.855 1.936 -6.008 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.506 3.473 -4.989 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.027 4.329 -5.488 1.00 0.00 H new ATOM 0 HB3 ALA A 46 11.299 3.949 -3.771 1.00 0.00 H new ATOM 746 N CYS A 47 10.958 1.196 -2.806 1.00 0.00 N ATOM 747 CA CYS A 47 11.470 0.228 -1.844 1.00 0.00 C ATOM 748 C CYS A 47 10.966 -1.181 -2.166 1.00 0.00 C ATOM 749 O CYS A 47 11.685 -2.167 -1.979 1.00 0.00 O ATOM 750 CB CYS A 47 11.074 0.632 -0.423 1.00 0.00 C ATOM 751 SG CYS A 47 11.735 2.232 0.096 1.00 0.00 S ATOM 0 H CYS A 47 10.287 1.860 -2.419 1.00 0.00 H new ATOM 0 HA CYS A 47 12.558 0.219 -1.912 1.00 0.00 H new ATOM 0 HB2 CYS A 47 9.987 0.660 -0.354 1.00 0.00 H new ATOM 0 HB3 CYS A 47 11.418 -0.135 0.271 1.00 0.00 H new ATOM 0 HG CYS A 47 11.083 3.185 -0.501 1.00 0.00 H new ATOM 757 N GLU A 48 9.732 -1.274 -2.660 1.00 0.00 N ATOM 758 CA GLU A 48 9.178 -2.556 -3.082 1.00 0.00 C ATOM 759 C GLU A 48 9.914 -3.055 -4.329 1.00 0.00 C ATOM 760 O GLU A 48 10.171 -4.249 -4.478 1.00 0.00 O ATOM 761 CB GLU A 48 7.670 -2.439 -3.348 1.00 0.00 C ATOM 762 CG GLU A 48 7.042 -3.737 -3.845 1.00 0.00 C ATOM 763 CD GLU A 48 5.582 -3.584 -4.230 1.00 0.00 C ATOM 764 OE1 GLU A 48 4.710 -3.740 -3.352 1.00 0.00 O ATOM 765 OE2 GLU A 48 5.302 -3.327 -5.421 1.00 0.00 O ATOM 0 H GLU A 48 9.101 -0.481 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 48 9.318 -3.280 -2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 48 7.169 -2.129 -2.431 1.00 0.00 H new ATOM 0 HB3 GLU A 48 7.498 -1.655 -4.085 1.00 0.00 H new ATOM 0 HG2 GLU A 48 7.603 -4.098 -4.707 1.00 0.00 H new ATOM 0 HG3 GLU A 48 7.129 -4.496 -3.068 1.00 0.00 H new ATOM 772 N ARG A 49 10.266 -2.123 -5.211 1.00 0.00 N ATOM 773 CA ARG A 49 11.067 -2.434 -6.395 1.00 0.00 C ATOM 774 C ARG A 49 12.408 -3.043 -5.989 1.00 0.00 C ATOM 775 O ARG A 49 12.890 -3.994 -6.607 1.00 0.00 O ATOM 776 CB ARG A 49 11.304 -1.166 -7.224 1.00 0.00 C ATOM 777 CG ARG A 49 10.088 -0.685 -8.009 1.00 0.00 C ATOM 778 CD ARG A 49 10.342 0.674 -8.655 1.00 0.00 C ATOM 779 NE ARG A 49 11.657 0.742 -9.300 1.00 0.00 N ATOM 780 CZ ARG A 49 11.958 1.534 -10.327 1.00 0.00 C ATOM 781 NH1 ARG A 49 11.019 2.281 -10.900 1.00 0.00 N ATOM 782 NH2 ARG A 49 13.200 1.558 -10.792 1.00 0.00 N ATOM 0 H ARG A 49 10.008 -1.140 -5.128 1.00 0.00 H new ATOM 0 HA ARG A 49 10.519 -3.158 -6.999 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.629 -0.367 -6.557 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.121 -1.351 -7.922 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.839 -1.415 -8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.227 -0.618 -7.344 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.566 0.874 -9.394 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.270 1.454 -7.897 1.00 0.00 H new ATOM 0 HE ARG A 49 12.394 0.139 -8.936 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.060 2.250 -10.553 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.257 2.885 -11.686 1.00 0.00 H new ATOM 0 HH21 ARG A 49 13.917 0.972 -10.363 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.439 2.162 -11.579 1.00 0.00 H new ATOM 796 N PHE A 50 12.986 -2.492 -4.930 1.00 0.00 N ATOM 797 CA PHE A 50 14.296 -2.907 -4.441 1.00 0.00 C ATOM 798 C PHE A 50 14.291 -4.386 -4.036 1.00 0.00 C ATOM 799 O PHE A 50 15.203 -5.140 -4.381 1.00 0.00 O ATOM 800 CB PHE A 50 14.690 -2.014 -3.254 1.00 0.00 C ATOM 801 CG PHE A 50 16.055 -2.294 -2.676 1.00 0.00 C ATOM 802 CD1 PHE A 50 17.206 -1.936 -3.366 1.00 0.00 C ATOM 803 CD2 PHE A 50 16.186 -2.904 -1.436 1.00 0.00 C ATOM 804 CE1 PHE A 50 18.456 -2.182 -2.830 1.00 0.00 C ATOM 805 CE2 PHE A 50 17.433 -3.149 -0.897 1.00 0.00 C ATOM 806 CZ PHE A 50 18.570 -2.788 -1.595 1.00 0.00 C ATOM 0 H PHE A 50 12.560 -1.743 -4.384 1.00 0.00 H new ATOM 0 HA PHE A 50 15.030 -2.794 -5.239 1.00 0.00 H new ATOM 0 HB2 PHE A 50 14.653 -0.972 -3.573 1.00 0.00 H new ATOM 0 HB3 PHE A 50 13.946 -2.132 -2.466 1.00 0.00 H new ATOM 0 HD1 PHE A 50 17.123 -1.460 -4.332 1.00 0.00 H new ATOM 0 HD2 PHE A 50 15.302 -3.190 -0.886 1.00 0.00 H new ATOM 0 HE1 PHE A 50 19.343 -1.900 -3.377 1.00 0.00 H new ATOM 0 HE2 PHE A 50 17.520 -3.623 0.070 1.00 0.00 H new ATOM 0 HZ PHE A 50 19.546 -2.980 -1.175 1.00 0.00 H new ATOM 816 N GLN A 51 13.240 -4.801 -3.334 1.00 0.00 N ATOM 817 CA GLN A 51 13.149 -6.169 -2.815 1.00 0.00 C ATOM 818 C GLN A 51 12.736 -7.163 -3.907 1.00 0.00 C ATOM 819 O GLN A 51 12.588 -8.359 -3.645 1.00 0.00 O ATOM 820 CB GLN A 51 12.170 -6.228 -1.632 1.00 0.00 C ATOM 821 CG GLN A 51 10.757 -5.767 -1.964 1.00 0.00 C ATOM 822 CD GLN A 51 9.831 -5.793 -0.759 1.00 0.00 C ATOM 823 OE1 GLN A 51 9.170 -6.796 -0.488 1.00 0.00 O ATOM 824 NE2 GLN A 51 9.777 -4.690 -0.026 1.00 0.00 N ATOM 0 H GLN A 51 12.438 -4.212 -3.110 1.00 0.00 H new ATOM 0 HA GLN A 51 14.141 -6.458 -2.467 1.00 0.00 H new ATOM 0 HB2 GLN A 51 12.128 -7.252 -1.261 1.00 0.00 H new ATOM 0 HB3 GLN A 51 12.560 -5.612 -0.822 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.795 -4.754 -2.366 1.00 0.00 H new ATOM 0 HG3 GLN A 51 10.346 -6.405 -2.746 1.00 0.00 H new ATOM 0 HE21 GLN A 51 10.340 -3.879 -0.283 1.00 0.00 H new ATOM 0 HE22 GLN A 51 9.173 -4.652 0.795 1.00 0.00 H new ATOM 833 N GLN A 52 12.559 -6.666 -5.132 1.00 0.00 N ATOM 834 CA GLN A 52 12.219 -7.521 -6.271 1.00 0.00 C ATOM 835 C GLN A 52 13.470 -8.184 -6.845 1.00 0.00 C ATOM 836 O GLN A 52 13.384 -9.168 -7.580 1.00 0.00 O ATOM 837 CB GLN A 52 11.525 -6.703 -7.369 1.00 0.00 C ATOM 838 CG GLN A 52 10.147 -6.177 -6.980 1.00 0.00 C ATOM 839 CD GLN A 52 9.521 -5.300 -8.056 1.00 0.00 C ATOM 840 OE1 GLN A 52 8.301 -5.277 -8.219 1.00 0.00 O ATOM 841 NE2 GLN A 52 10.346 -4.557 -8.783 1.00 0.00 N ATOM 0 H GLN A 52 12.645 -5.676 -5.361 1.00 0.00 H new ATOM 0 HA GLN A 52 11.539 -8.296 -5.916 1.00 0.00 H new ATOM 0 HB2 GLN A 52 12.162 -5.859 -7.635 1.00 0.00 H new ATOM 0 HB3 GLN A 52 11.427 -7.322 -8.261 1.00 0.00 H new ATOM 0 HG2 GLN A 52 9.487 -7.020 -6.776 1.00 0.00 H new ATOM 0 HG3 GLN A 52 10.230 -5.606 -6.056 1.00 0.00 H new ATOM 0 HE21 GLN A 52 11.352 -4.603 -8.619 1.00 0.00 H new ATOM 0 HE22 GLN A 52 9.974 -3.940 -9.505 1.00 0.00 H new ATOM 850 N ILE A 53 14.629 -7.636 -6.501 1.00 0.00 N ATOM 851 CA ILE A 53 15.902 -8.091 -7.058 1.00 0.00 C ATOM 852 C ILE A 53 16.466 -9.279 -6.264 1.00 0.00 C ATOM 853 O ILE A 53 16.355 -9.316 -5.036 1.00 0.00 O ATOM 854 CB ILE A 53 16.925 -6.930 -7.053 1.00 0.00 C ATOM 855 CG1 ILE A 53 16.343 -5.719 -7.795 1.00 0.00 C ATOM 856 CG2 ILE A 53 18.255 -7.356 -7.676 1.00 0.00 C ATOM 857 CD1 ILE A 53 17.215 -4.487 -7.726 1.00 0.00 C ATOM 0 H ILE A 53 14.716 -6.870 -5.834 1.00 0.00 H new ATOM 0 HA ILE A 53 15.723 -8.418 -8.082 1.00 0.00 H new ATOM 0 HB ILE A 53 17.123 -6.652 -6.018 1.00 0.00 H new ATOM 0 HG12 ILE A 53 16.188 -5.985 -8.841 1.00 0.00 H new ATOM 0 HG13 ILE A 53 15.364 -5.484 -7.377 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.951 -6.517 -7.657 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.673 -8.187 -7.108 1.00 0.00 H new ATOM 0 HG23 ILE A 53 18.090 -7.667 -8.708 1.00 0.00 H new ATOM 0 HD11 ILE A 53 16.739 -3.673 -8.273 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.350 -4.195 -6.685 1.00 0.00 H new ATOM 0 HD13 ILE A 53 18.186 -4.703 -8.171 1.00 0.00 H new ATOM 869 N PRO A 54 17.047 -10.284 -6.960 1.00 0.00 N ATOM 870 CA PRO A 54 17.730 -11.412 -6.308 1.00 0.00 C ATOM 871 C PRO A 54 19.010 -10.973 -5.588 1.00 0.00 C ATOM 872 O PRO A 54 19.668 -10.015 -6.000 1.00 0.00 O ATOM 873 CB PRO A 54 18.069 -12.366 -7.473 1.00 0.00 C ATOM 874 CG PRO A 54 17.239 -11.899 -8.624 1.00 0.00 C ATOM 875 CD PRO A 54 17.060 -10.420 -8.429 1.00 0.00 C ATOM 0 HA PRO A 54 17.107 -11.871 -5.540 1.00 0.00 H new ATOM 0 HB2 PRO A 54 19.131 -12.329 -7.714 1.00 0.00 H new ATOM 0 HB3 PRO A 54 17.837 -13.399 -7.215 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.732 -12.111 -9.573 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.276 -12.410 -8.644 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.873 -9.851 -8.881 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.133 -10.062 -8.877 1.00 0.00 H new ATOM 883 N ALA A 55 19.370 -11.700 -4.530 1.00 0.00 N ATOM 884 CA ALA A 55 20.565 -11.398 -3.739 1.00 0.00 C ATOM 885 C ALA A 55 21.836 -11.484 -4.587 1.00 0.00 C ATOM 886 O ALA A 55 22.866 -10.889 -4.249 1.00 0.00 O ATOM 887 CB ALA A 55 20.661 -12.354 -2.555 1.00 0.00 C ATOM 0 H ALA A 55 18.846 -12.510 -4.198 1.00 0.00 H new ATOM 0 HA ALA A 55 20.476 -10.375 -3.374 1.00 0.00 H new ATOM 0 HB1 ALA A 55 21.552 -12.123 -1.972 1.00 0.00 H new ATOM 0 HB2 ALA A 55 19.777 -12.244 -1.926 1.00 0.00 H new ATOM 0 HB3 ALA A 55 20.722 -13.379 -2.919 1.00 0.00 H new ATOM 893 N SER A 56 21.754 -12.240 -5.676 1.00 0.00 N ATOM 894 CA SER A 56 22.882 -12.435 -6.577 1.00 0.00 C ATOM 895 C SER A 56 23.260 -11.130 -7.285 1.00 0.00 C ATOM 896 O SER A 56 24.442 -10.795 -7.405 1.00 0.00 O ATOM 897 CB SER A 56 22.535 -13.517 -7.605 1.00 0.00 C ATOM 898 OG SER A 56 22.108 -14.709 -6.962 1.00 0.00 O ATOM 0 H SER A 56 20.907 -12.733 -5.958 1.00 0.00 H new ATOM 0 HA SER A 56 23.743 -12.754 -5.990 1.00 0.00 H new ATOM 0 HB2 SER A 56 21.749 -13.155 -8.268 1.00 0.00 H new ATOM 0 HB3 SER A 56 23.406 -13.726 -8.227 1.00 0.00 H new ATOM 0 HG SER A 56 21.890 -15.385 -7.637 1.00 0.00 H new ATOM 904 N ASP A 57 22.252 -10.386 -7.728 1.00 0.00 N ATOM 905 CA ASP A 57 22.477 -9.169 -8.502 1.00 0.00 C ATOM 906 C ASP A 57 22.661 -7.970 -7.578 1.00 0.00 C ATOM 907 O ASP A 57 21.738 -7.181 -7.357 1.00 0.00 O ATOM 908 CB ASP A 57 21.327 -8.925 -9.489 1.00 0.00 C ATOM 909 CG ASP A 57 21.278 -9.969 -10.594 1.00 0.00 C ATOM 910 OD1 ASP A 57 22.171 -9.954 -11.470 1.00 0.00 O ATOM 911 OD2 ASP A 57 20.355 -10.812 -10.591 1.00 0.00 O ATOM 0 H ASP A 57 21.269 -10.604 -7.564 1.00 0.00 H new ATOM 0 HA ASP A 57 23.393 -9.299 -9.079 1.00 0.00 H new ATOM 0 HB2 ASP A 57 20.381 -8.928 -8.948 1.00 0.00 H new ATOM 0 HB3 ASP A 57 21.437 -7.935 -9.933 1.00 0.00 H new ATOM 916 N THR A 58 23.866 -7.850 -7.033 1.00 0.00 N ATOM 917 CA THR A 58 24.188 -6.788 -6.089 1.00 0.00 C ATOM 918 C THR A 58 24.261 -5.424 -6.782 1.00 0.00 C ATOM 919 O THR A 58 23.857 -4.409 -6.212 1.00 0.00 O ATOM 920 CB THR A 58 25.522 -7.087 -5.370 1.00 0.00 C ATOM 921 OG1 THR A 58 25.478 -8.414 -4.822 1.00 0.00 O ATOM 922 CG2 THR A 58 25.790 -6.084 -4.251 1.00 0.00 C ATOM 0 H THR A 58 24.642 -8.482 -7.231 1.00 0.00 H new ATOM 0 HA THR A 58 23.386 -6.751 -5.352 1.00 0.00 H new ATOM 0 HB THR A 58 26.329 -7.005 -6.099 1.00 0.00 H new ATOM 0 HG1 THR A 58 26.324 -8.608 -4.366 1.00 0.00 H new ATOM 0 HG21 THR A 58 26.736 -6.324 -3.766 1.00 0.00 H new ATOM 0 HG22 THR A 58 25.841 -5.078 -4.668 1.00 0.00 H new ATOM 0 HG23 THR A 58 24.985 -6.133 -3.518 1.00 0.00 H new ATOM 930 N GLN A 59 24.755 -5.402 -8.020 1.00 0.00 N ATOM 931 CA GLN A 59 24.862 -4.152 -8.772 1.00 0.00 C ATOM 932 C GLN A 59 23.469 -3.641 -9.137 1.00 0.00 C ATOM 933 O GLN A 59 23.216 -2.433 -9.112 1.00 0.00 O ATOM 934 CB GLN A 59 25.714 -4.335 -10.039 1.00 0.00 C ATOM 935 CG GLN A 59 25.837 -3.071 -10.892 1.00 0.00 C ATOM 936 CD GLN A 59 26.513 -1.920 -10.160 1.00 0.00 C ATOM 937 OE1 GLN A 59 27.731 -1.759 -10.220 1.00 0.00 O ATOM 938 NE2 GLN A 59 25.728 -1.107 -9.468 1.00 0.00 N ATOM 0 H GLN A 59 25.085 -6.228 -8.520 1.00 0.00 H new ATOM 0 HA GLN A 59 25.358 -3.416 -8.140 1.00 0.00 H new ATOM 0 HB2 GLN A 59 26.712 -4.664 -9.749 1.00 0.00 H new ATOM 0 HB3 GLN A 59 25.279 -5.130 -10.645 1.00 0.00 H new ATOM 0 HG2 GLN A 59 26.403 -3.302 -11.794 1.00 0.00 H new ATOM 0 HG3 GLN A 59 24.843 -2.757 -11.211 1.00 0.00 H new ATOM 0 HE21 GLN A 59 24.722 -1.271 -9.440 1.00 0.00 H new ATOM 0 HE22 GLN A 59 26.130 -0.317 -8.963 1.00 0.00 H new ATOM 947 N GLN A 60 22.567 -4.563 -9.470 1.00 0.00 N ATOM 948 CA GLN A 60 21.184 -4.203 -9.767 1.00 0.00 C ATOM 949 C GLN A 60 20.535 -3.610 -8.515 1.00 0.00 C ATOM 950 O GLN A 60 19.869 -2.572 -8.581 1.00 0.00 O ATOM 951 CB GLN A 60 20.397 -5.426 -10.268 1.00 0.00 C ATOM 952 CG GLN A 60 19.001 -5.089 -10.786 1.00 0.00 C ATOM 953 CD GLN A 60 18.244 -6.302 -11.305 1.00 0.00 C ATOM 954 OE1 GLN A 60 18.840 -7.259 -11.808 1.00 0.00 O ATOM 955 NE2 GLN A 60 16.927 -6.268 -11.196 1.00 0.00 N ATOM 0 H GLN A 60 22.769 -5.560 -9.540 1.00 0.00 H new ATOM 0 HA GLN A 60 21.171 -3.457 -10.561 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.963 -5.910 -11.064 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.309 -6.148 -9.456 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.426 -4.626 -9.985 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.085 -4.352 -11.585 1.00 0.00 H new ATOM 0 HE21 GLN A 60 16.471 -5.459 -10.774 1.00 0.00 H new ATOM 0 HE22 GLN A 60 16.367 -7.051 -11.534 1.00 0.00 H new ATOM 964 N LEU A 61 20.761 -4.268 -7.374 1.00 0.00 N ATOM 965 CA LEU A 61 20.324 -3.752 -6.073 1.00 0.00 C ATOM 966 C LEU A 61 20.838 -2.329 -5.868 1.00 0.00 C ATOM 967 O LEU A 61 20.086 -1.432 -5.489 1.00 0.00 O ATOM 968 CB LEU A 61 20.837 -4.654 -4.934 1.00 0.00 C ATOM 969 CG LEU A 61 20.114 -6.001 -4.763 1.00 0.00 C ATOM 970 CD1 LEU A 61 20.889 -6.918 -3.814 1.00 0.00 C ATOM 971 CD2 LEU A 61 18.692 -5.783 -4.249 1.00 0.00 C ATOM 0 H LEU A 61 21.247 -5.164 -7.325 1.00 0.00 H new ATOM 0 HA LEU A 61 19.234 -3.746 -6.057 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.896 -4.851 -5.102 1.00 0.00 H new ATOM 0 HB3 LEU A 61 20.761 -4.102 -3.997 1.00 0.00 H new ATOM 0 HG LEU A 61 20.061 -6.485 -5.738 1.00 0.00 H new ATOM 0 HD11 LEU A 61 20.359 -7.864 -3.709 1.00 0.00 H new ATOM 0 HD12 LEU A 61 21.884 -7.103 -4.219 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.977 -6.441 -2.838 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.195 -6.746 -4.134 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.727 -5.275 -3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.138 -5.172 -4.961 1.00 0.00 H new ATOM 983 N ALA A 62 22.126 -2.137 -6.140 1.00 0.00 N ATOM 984 CA ALA A 62 22.775 -0.842 -5.967 1.00 0.00 C ATOM 985 C ALA A 62 22.098 0.234 -6.813 1.00 0.00 C ATOM 986 O ALA A 62 21.904 1.357 -6.354 1.00 0.00 O ATOM 987 CB ALA A 62 24.255 -0.943 -6.316 1.00 0.00 C ATOM 0 H ALA A 62 22.746 -2.870 -6.485 1.00 0.00 H new ATOM 0 HA ALA A 62 22.679 -0.553 -4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 62 24.727 0.030 -6.183 1.00 0.00 H new ATOM 0 HB2 ALA A 62 24.734 -1.672 -5.662 1.00 0.00 H new ATOM 0 HB3 ALA A 62 24.363 -1.260 -7.353 1.00 0.00 H new ATOM 993 N GLN A 63 21.723 -0.122 -8.040 1.00 0.00 N ATOM 994 CA GLN A 63 21.097 0.827 -8.962 1.00 0.00 C ATOM 995 C GLN A 63 19.764 1.334 -8.412 1.00 0.00 C ATOM 996 O GLN A 63 19.525 2.546 -8.357 1.00 0.00 O ATOM 997 CB GLN A 63 20.903 0.188 -10.344 1.00 0.00 C ATOM 998 CG GLN A 63 22.213 -0.092 -11.072 1.00 0.00 C ATOM 999 CD GLN A 63 22.005 -0.708 -12.443 1.00 0.00 C ATOM 1000 OE1 GLN A 63 21.866 0.002 -13.441 1.00 0.00 O ATOM 1001 NE2 GLN A 63 21.984 -2.030 -12.505 1.00 0.00 N ATOM 0 H GLN A 63 21.841 -1.061 -8.420 1.00 0.00 H new ATOM 0 HA GLN A 63 21.764 1.683 -9.066 1.00 0.00 H new ATOM 0 HB2 GLN A 63 20.353 -0.746 -10.230 1.00 0.00 H new ATOM 0 HB3 GLN A 63 20.289 0.847 -10.958 1.00 0.00 H new ATOM 0 HG2 GLN A 63 22.770 0.839 -11.178 1.00 0.00 H new ATOM 0 HG3 GLN A 63 22.824 -0.762 -10.467 1.00 0.00 H new ATOM 0 HE21 GLN A 63 22.103 -2.582 -11.656 1.00 0.00 H new ATOM 0 HE22 GLN A 63 21.849 -2.496 -13.402 1.00 0.00 H new ATOM 1010 N GLU A 64 18.902 0.408 -7.998 1.00 0.00 N ATOM 1011 CA GLU A 64 17.612 0.775 -7.414 1.00 0.00 C ATOM 1012 C GLU A 64 17.825 1.559 -6.119 1.00 0.00 C ATOM 1013 O GLU A 64 17.177 2.579 -5.890 1.00 0.00 O ATOM 1014 CB GLU A 64 16.758 -0.476 -7.157 1.00 0.00 C ATOM 1015 CG GLU A 64 16.333 -1.209 -8.430 1.00 0.00 C ATOM 1016 CD GLU A 64 15.342 -0.425 -9.280 1.00 0.00 C ATOM 1017 OE1 GLU A 64 15.773 0.365 -10.148 1.00 0.00 O ATOM 1018 OE2 GLU A 64 14.120 -0.607 -9.096 1.00 0.00 O ATOM 0 H GLU A 64 19.071 -0.596 -8.055 1.00 0.00 H new ATOM 0 HA GLU A 64 17.077 1.410 -8.121 1.00 0.00 H new ATOM 0 HB2 GLU A 64 17.319 -1.163 -6.524 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.866 -0.187 -6.601 1.00 0.00 H new ATOM 0 HG2 GLU A 64 17.219 -1.427 -9.027 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.888 -2.166 -8.157 1.00 0.00 H new ATOM 1025 N ALA A 65 18.761 1.088 -5.294 1.00 0.00 N ATOM 1026 CA ALA A 65 19.091 1.749 -4.030 1.00 0.00 C ATOM 1027 C ALA A 65 19.518 3.196 -4.273 1.00 0.00 C ATOM 1028 O ALA A 65 19.109 4.107 -3.552 1.00 0.00 O ATOM 1029 CB ALA A 65 20.193 0.984 -3.302 1.00 0.00 C ATOM 0 H ALA A 65 19.307 0.247 -5.480 1.00 0.00 H new ATOM 0 HA ALA A 65 18.199 1.756 -3.403 1.00 0.00 H new ATOM 0 HB1 ALA A 65 20.427 1.488 -2.364 1.00 0.00 H new ATOM 0 HB2 ALA A 65 19.855 -0.031 -3.094 1.00 0.00 H new ATOM 0 HB3 ALA A 65 21.085 0.948 -3.927 1.00 0.00 H new ATOM 1035 N ARG A 66 20.335 3.394 -5.305 1.00 0.00 N ATOM 1036 CA ARG A 66 20.798 4.726 -5.690 1.00 0.00 C ATOM 1037 C ARG A 66 19.625 5.587 -6.146 1.00 0.00 C ATOM 1038 O ARG A 66 19.597 6.793 -5.898 1.00 0.00 O ATOM 1039 CB ARG A 66 21.842 4.627 -6.814 1.00 0.00 C ATOM 1040 CG ARG A 66 23.192 4.065 -6.372 1.00 0.00 C ATOM 1041 CD ARG A 66 24.008 5.094 -5.597 1.00 0.00 C ATOM 1042 NE ARG A 66 24.305 6.274 -6.413 1.00 0.00 N ATOM 1043 CZ ARG A 66 25.520 6.805 -6.564 1.00 0.00 C ATOM 1044 NH1 ARG A 66 26.569 6.289 -5.931 1.00 0.00 N ATOM 1045 NH2 ARG A 66 25.685 7.857 -7.354 1.00 0.00 N ATOM 0 H ARG A 66 20.693 2.642 -5.894 1.00 0.00 H new ATOM 0 HA ARG A 66 21.260 5.192 -4.820 1.00 0.00 H new ATOM 0 HB2 ARG A 66 21.443 3.998 -7.610 1.00 0.00 H new ATOM 0 HB3 ARG A 66 21.996 5.619 -7.239 1.00 0.00 H new ATOM 0 HG2 ARG A 66 23.033 3.184 -5.750 1.00 0.00 H new ATOM 0 HG3 ARG A 66 23.754 3.740 -7.247 1.00 0.00 H new ATOM 0 HD2 ARG A 66 23.460 5.397 -4.705 1.00 0.00 H new ATOM 0 HD3 ARG A 66 24.940 4.641 -5.260 1.00 0.00 H new ATOM 0 HE ARG A 66 23.528 6.721 -6.900 1.00 0.00 H new ATOM 0 HH11 ARG A 66 26.450 5.479 -5.323 1.00 0.00 H new ATOM 0 HH12 ARG A 66 27.493 6.703 -6.054 1.00 0.00 H new ATOM 0 HH21 ARG A 66 24.885 8.258 -7.844 1.00 0.00 H new ATOM 0 HH22 ARG A 66 26.612 8.266 -7.472 1.00 0.00 H new ATOM 1059 N ASN A 67 18.655 4.958 -6.806 1.00 0.00 N ATOM 1060 CA ASN A 67 17.469 5.665 -7.289 1.00 0.00 C ATOM 1061 C ASN A 67 16.628 6.147 -6.114 1.00 0.00 C ATOM 1062 O ASN A 67 16.187 7.298 -6.087 1.00 0.00 O ATOM 1063 CB ASN A 67 16.632 4.772 -8.216 1.00 0.00 C ATOM 1064 CG ASN A 67 15.372 5.468 -8.711 1.00 0.00 C ATOM 1065 OD1 ASN A 67 14.305 5.358 -8.106 1.00 0.00 O ATOM 1066 ND2 ASN A 67 15.487 6.196 -9.813 1.00 0.00 N ATOM 0 H ASN A 67 18.666 3.961 -7.019 1.00 0.00 H new ATOM 0 HA ASN A 67 17.800 6.530 -7.864 1.00 0.00 H new ATOM 0 HB2 ASN A 67 17.238 4.472 -9.071 1.00 0.00 H new ATOM 0 HB3 ASN A 67 16.356 3.861 -7.686 1.00 0.00 H new ATOM 0 HD21 ASN A 67 14.675 6.688 -10.186 1.00 0.00 H new ATOM 0 HD22 ASN A 67 16.387 6.264 -10.288 1.00 0.00 H new ATOM 1073 N ILE A 68 16.426 5.261 -5.142 1.00 0.00 N ATOM 1074 CA ILE A 68 15.698 5.602 -3.924 1.00 0.00 C ATOM 1075 C ILE A 68 16.438 6.709 -3.172 1.00 0.00 C ATOM 1076 O ILE A 68 15.838 7.676 -2.694 1.00 0.00 O ATOM 1077 CB ILE A 68 15.550 4.372 -2.986 1.00 0.00 C ATOM 1078 CG1 ILE A 68 14.977 3.166 -3.747 1.00 0.00 C ATOM 1079 CG2 ILE A 68 14.662 4.715 -1.790 1.00 0.00 C ATOM 1080 CD1 ILE A 68 14.917 1.891 -2.924 1.00 0.00 C ATOM 0 H ILE A 68 16.758 4.297 -5.175 1.00 0.00 H new ATOM 0 HA ILE A 68 14.704 5.940 -4.216 1.00 0.00 H new ATOM 0 HB ILE A 68 16.542 4.105 -2.621 1.00 0.00 H new ATOM 0 HG12 ILE A 68 13.973 3.411 -4.093 1.00 0.00 H new ATOM 0 HG13 ILE A 68 15.585 2.986 -4.634 1.00 0.00 H new ATOM 0 HG21 ILE A 68 14.569 3.842 -1.144 1.00 0.00 H new ATOM 0 HG22 ILE A 68 15.108 5.536 -1.229 1.00 0.00 H new ATOM 0 HG23 ILE A 68 13.674 5.012 -2.143 1.00 0.00 H new ATOM 0 HD11 ILE A 68 14.502 1.086 -3.530 1.00 0.00 H new ATOM 0 HD12 ILE A 68 15.922 1.620 -2.600 1.00 0.00 H new ATOM 0 HD13 ILE A 68 14.285 2.051 -2.051 1.00 0.00 H new ATOM 1092 N TYR A 69 17.756 6.549 -3.091 1.00 0.00 N ATOM 1093 CA TYR A 69 18.614 7.478 -2.369 1.00 0.00 C ATOM 1094 C TYR A 69 18.530 8.880 -2.972 1.00 0.00 C ATOM 1095 O TYR A 69 18.057 9.820 -2.332 1.00 0.00 O ATOM 1096 CB TYR A 69 20.067 6.978 -2.388 1.00 0.00 C ATOM 1097 CG TYR A 69 20.999 7.766 -1.484 1.00 0.00 C ATOM 1098 CD1 TYR A 69 21.024 7.539 -0.110 1.00 0.00 C ATOM 1099 CD2 TYR A 69 21.852 8.736 -2.001 1.00 0.00 C ATOM 1100 CE1 TYR A 69 21.871 8.256 0.717 1.00 0.00 C ATOM 1101 CE2 TYR A 69 22.700 9.454 -1.182 1.00 0.00 C ATOM 1102 CZ TYR A 69 22.705 9.212 0.177 1.00 0.00 C ATOM 1103 OH TYR A 69 23.549 9.927 0.995 1.00 0.00 O ATOM 0 H TYR A 69 18.257 5.773 -3.524 1.00 0.00 H new ATOM 0 HA TYR A 69 18.269 7.531 -1.336 1.00 0.00 H new ATOM 0 HB2 TYR A 69 20.085 5.930 -2.088 1.00 0.00 H new ATOM 0 HB3 TYR A 69 20.443 7.023 -3.410 1.00 0.00 H new ATOM 0 HD1 TYR A 69 20.372 6.791 0.317 1.00 0.00 H new ATOM 0 HD2 TYR A 69 21.851 8.931 -3.063 1.00 0.00 H new ATOM 0 HE1 TYR A 69 21.879 8.068 1.780 1.00 0.00 H new ATOM 0 HE2 TYR A 69 23.356 10.202 -1.602 1.00 0.00 H new ATOM 0 HH TYR A 69 24.069 10.559 0.456 1.00 0.00 H new ATOM 1113 N GLN A 70 18.958 8.997 -4.223 1.00 0.00 N ATOM 1114 CA GLN A 70 19.078 10.287 -4.899 1.00 0.00 C ATOM 1115 C GLN A 70 17.732 10.751 -5.460 1.00 0.00 C ATOM 1116 O GLN A 70 17.628 11.070 -6.647 1.00 0.00 O ATOM 1117 CB GLN A 70 20.114 10.178 -6.027 1.00 0.00 C ATOM 1118 CG GLN A 70 21.511 9.808 -5.544 1.00 0.00 C ATOM 1119 CD GLN A 70 22.476 9.550 -6.689 1.00 0.00 C ATOM 1120 OE1 GLN A 70 22.617 8.420 -7.156 1.00 0.00 O ATOM 1121 NE2 GLN A 70 23.136 10.597 -7.156 1.00 0.00 N ATOM 0 H GLN A 70 19.232 8.201 -4.799 1.00 0.00 H new ATOM 0 HA GLN A 70 19.405 11.029 -4.171 1.00 0.00 H new ATOM 0 HB2 GLN A 70 19.778 9.430 -6.745 1.00 0.00 H new ATOM 0 HB3 GLN A 70 20.163 11.130 -6.556 1.00 0.00 H new ATOM 0 HG2 GLN A 70 21.900 10.612 -4.920 1.00 0.00 H new ATOM 0 HG3 GLN A 70 21.451 8.918 -4.917 1.00 0.00 H new ATOM 0 HE21 GLN A 70 22.991 11.518 -6.741 1.00 0.00 H new ATOM 0 HE22 GLN A 70 23.790 10.484 -7.931 1.00 0.00 H new ATOM 1130 N GLU A 71 16.712 10.791 -4.605 1.00 0.00 N ATOM 1131 CA GLU A 71 15.381 11.242 -5.012 1.00 0.00 C ATOM 1132 C GLU A 71 14.435 11.301 -3.814 1.00 0.00 C ATOM 1133 O GLU A 71 13.514 12.119 -3.785 1.00 0.00 O ATOM 1134 CB GLU A 71 14.806 10.322 -6.103 1.00 0.00 C ATOM 1135 CG GLU A 71 13.497 10.819 -6.711 1.00 0.00 C ATOM 1136 CD GLU A 71 13.104 10.058 -7.968 1.00 0.00 C ATOM 1137 OE1 GLU A 71 13.707 10.317 -9.033 1.00 0.00 O ATOM 1138 OE2 GLU A 71 12.192 9.209 -7.906 1.00 0.00 O ATOM 0 H GLU A 71 16.781 10.516 -3.625 1.00 0.00 H new ATOM 0 HA GLU A 71 15.477 12.248 -5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 71 15.545 10.212 -6.897 1.00 0.00 H new ATOM 0 HB3 GLU A 71 14.644 9.331 -5.679 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.701 10.727 -5.972 1.00 0.00 H new ATOM 0 HG3 GLU A 71 13.591 11.879 -6.948 1.00 0.00 H new ATOM 1145 N PHE A 72 14.665 10.446 -2.817 1.00 0.00 N ATOM 1146 CA PHE A 72 13.823 10.435 -1.616 1.00 0.00 C ATOM 1147 C PHE A 72 14.646 10.599 -0.337 1.00 0.00 C ATOM 1148 O PHE A 72 14.103 10.946 0.712 1.00 0.00 O ATOM 1149 CB PHE A 72 13.027 9.124 -1.535 1.00 0.00 C ATOM 1150 CG PHE A 72 12.256 8.802 -2.789 1.00 0.00 C ATOM 1151 CD1 PHE A 72 11.090 9.487 -3.100 1.00 0.00 C ATOM 1152 CD2 PHE A 72 12.701 7.815 -3.657 1.00 0.00 C ATOM 1153 CE1 PHE A 72 10.387 9.194 -4.251 1.00 0.00 C ATOM 1154 CE2 PHE A 72 12.000 7.519 -4.809 1.00 0.00 C ATOM 1155 CZ PHE A 72 10.843 8.209 -5.106 1.00 0.00 C ATOM 0 H PHE A 72 15.418 9.758 -2.814 1.00 0.00 H new ATOM 0 HA PHE A 72 13.142 11.282 -1.696 1.00 0.00 H new ATOM 0 HB2 PHE A 72 13.714 8.305 -1.322 1.00 0.00 H new ATOM 0 HB3 PHE A 72 12.332 9.183 -0.697 1.00 0.00 H new ATOM 0 HD1 PHE A 72 10.729 10.257 -2.435 1.00 0.00 H new ATOM 0 HD2 PHE A 72 13.606 7.272 -3.429 1.00 0.00 H new ATOM 0 HE1 PHE A 72 9.481 9.734 -4.483 1.00 0.00 H new ATOM 0 HE2 PHE A 72 12.357 6.749 -5.476 1.00 0.00 H new ATOM 0 HZ PHE A 72 10.294 7.979 -6.007 1.00 0.00 H new ATOM 1165 N LEU A 73 15.955 10.360 -0.423 1.00 0.00 N ATOM 1166 CA LEU A 73 16.786 10.228 0.777 1.00 0.00 C ATOM 1167 C LEU A 73 17.981 11.186 0.780 1.00 0.00 C ATOM 1168 O LEU A 73 18.558 11.460 1.834 1.00 0.00 O ATOM 1169 CB LEU A 73 17.274 8.778 0.875 1.00 0.00 C ATOM 1170 CG LEU A 73 16.150 7.726 0.854 1.00 0.00 C ATOM 1171 CD1 LEU A 73 16.712 6.323 0.644 1.00 0.00 C ATOM 1172 CD2 LEU A 73 15.326 7.804 2.138 1.00 0.00 C ATOM 0 H LEU A 73 16.461 10.254 -1.303 1.00 0.00 H new ATOM 0 HA LEU A 73 16.176 10.492 1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 73 17.956 8.580 0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 73 17.847 8.662 1.795 1.00 0.00 H new ATOM 0 HG LEU A 73 15.493 7.944 0.012 1.00 0.00 H new ATOM 0 HD11 LEU A 73 15.895 5.602 0.634 1.00 0.00 H new ATOM 0 HD12 LEU A 73 17.244 6.283 -0.307 1.00 0.00 H new ATOM 0 HD13 LEU A 73 17.399 6.081 1.455 1.00 0.00 H new ATOM 0 HD21 LEU A 73 14.535 7.054 2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 73 15.971 7.617 2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 73 14.883 8.796 2.226 1.00 0.00 H new ATOM 1184 N SER A 74 18.355 11.688 -0.391 1.00 0.00 N ATOM 1185 CA SER A 74 19.511 12.570 -0.515 1.00 0.00 C ATOM 1186 C SER A 74 19.174 13.996 -0.067 1.00 0.00 C ATOM 1187 O SER A 74 18.004 14.379 -0.003 1.00 0.00 O ATOM 1188 CB SER A 74 20.004 12.562 -1.967 1.00 0.00 C ATOM 1189 OG SER A 74 18.930 12.772 -2.869 1.00 0.00 O ATOM 0 H SER A 74 17.874 11.499 -1.270 1.00 0.00 H new ATOM 0 HA SER A 74 20.303 12.202 0.138 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.756 13.339 -2.104 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.487 11.609 -2.186 1.00 0.00 H new ATOM 0 HG SER A 74 19.279 13.110 -3.720 1.00 0.00 H new ATOM 1195 N SER A 75 20.207 14.779 0.239 1.00 0.00 N ATOM 1196 CA SER A 75 20.036 16.178 0.624 1.00 0.00 C ATOM 1197 C SER A 75 19.449 16.987 -0.536 1.00 0.00 C ATOM 1198 O SER A 75 18.807 18.022 -0.334 1.00 0.00 O ATOM 1199 CB SER A 75 21.387 16.752 1.059 1.00 0.00 C ATOM 1200 OG SER A 75 22.396 16.440 0.110 1.00 0.00 O ATOM 0 H SER A 75 21.177 14.465 0.227 1.00 0.00 H new ATOM 0 HA SER A 75 19.338 16.239 1.459 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.309 17.833 1.171 1.00 0.00 H new ATOM 0 HB3 SER A 75 21.661 16.349 2.034 1.00 0.00 H new ATOM 0 HG SER A 75 23.251 16.817 0.406 1.00 0.00 H new ATOM 1206 N GLN A 76 19.684 16.503 -1.750 1.00 0.00 N ATOM 1207 CA GLN A 76 19.127 17.097 -2.962 1.00 0.00 C ATOM 1208 C GLN A 76 18.190 16.081 -3.613 1.00 0.00 C ATOM 1209 O GLN A 76 18.311 15.753 -4.793 1.00 0.00 O ATOM 1210 CB GLN A 76 20.261 17.503 -3.920 1.00 0.00 C ATOM 1211 CG GLN A 76 19.804 18.344 -5.110 1.00 0.00 C ATOM 1212 CD GLN A 76 20.948 18.725 -6.034 1.00 0.00 C ATOM 1213 OE1 GLN A 76 21.924 17.984 -6.178 1.00 0.00 O ATOM 1214 NE2 GLN A 76 20.843 19.884 -6.661 1.00 0.00 N ATOM 0 H GLN A 76 20.268 15.685 -1.923 1.00 0.00 H new ATOM 0 HA GLN A 76 18.564 17.998 -2.718 1.00 0.00 H new ATOM 0 HB2 GLN A 76 21.011 18.062 -3.361 1.00 0.00 H new ATOM 0 HB3 GLN A 76 20.747 16.601 -4.292 1.00 0.00 H new ATOM 0 HG2 GLN A 76 19.055 17.789 -5.675 1.00 0.00 H new ATOM 0 HG3 GLN A 76 19.321 19.250 -4.745 1.00 0.00 H new ATOM 0 HE21 GLN A 76 20.020 20.469 -6.516 1.00 0.00 H new ATOM 0 HE22 GLN A 76 21.585 20.193 -7.289 1.00 0.00 H new ATOM 1223 N ALA A 77 17.269 15.567 -2.808 1.00 0.00 N ATOM 1224 CA ALA A 77 16.342 14.522 -3.239 1.00 0.00 C ATOM 1225 C ALA A 77 15.167 15.091 -4.035 1.00 0.00 C ATOM 1226 O ALA A 77 14.516 14.370 -4.790 1.00 0.00 O ATOM 1227 CB ALA A 77 15.831 13.765 -2.020 1.00 0.00 C ATOM 0 H ALA A 77 17.142 15.860 -1.839 1.00 0.00 H new ATOM 0 HA ALA A 77 16.882 13.844 -3.900 1.00 0.00 H new ATOM 0 HB1 ALA A 77 15.140 12.985 -2.339 1.00 0.00 H new ATOM 0 HB2 ALA A 77 16.672 13.312 -1.495 1.00 0.00 H new ATOM 0 HB3 ALA A 77 15.316 14.456 -1.352 1.00 0.00 H new ATOM 1233 N LEU A 78 14.896 16.379 -3.841 1.00 0.00 N ATOM 1234 CA LEU A 78 13.737 17.069 -4.438 1.00 0.00 C ATOM 1235 C LEU A 78 12.437 16.684 -3.721 1.00 0.00 C ATOM 1236 O LEU A 78 11.482 17.460 -3.694 1.00 0.00 O ATOM 1237 CB LEU A 78 13.612 16.807 -5.956 1.00 0.00 C ATOM 1238 CG LEU A 78 14.594 17.581 -6.863 1.00 0.00 C ATOM 1239 CD1 LEU A 78 16.043 17.194 -6.580 1.00 0.00 C ATOM 1240 CD2 LEU A 78 14.258 17.351 -8.337 1.00 0.00 C ATOM 0 H LEU A 78 15.475 16.986 -3.261 1.00 0.00 H new ATOM 0 HA LEU A 78 13.909 18.137 -4.306 1.00 0.00 H new ATOM 0 HB2 LEU A 78 13.750 15.740 -6.132 1.00 0.00 H new ATOM 0 HB3 LEU A 78 12.595 17.052 -6.264 1.00 0.00 H new ATOM 0 HG LEU A 78 14.484 18.642 -6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 78 16.705 17.758 -7.237 1.00 0.00 H new ATOM 0 HD12 LEU A 78 16.284 17.420 -5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 78 16.176 16.127 -6.760 1.00 0.00 H new ATOM 0 HD21 LEU A 78 14.960 17.904 -8.961 1.00 0.00 H new ATOM 0 HD22 LEU A 78 14.330 16.288 -8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 78 13.244 17.697 -8.537 1.00 0.00 H new ATOM 1252 N SER A 79 12.405 15.482 -3.152 1.00 0.00 N ATOM 1253 CA SER A 79 11.272 15.027 -2.347 1.00 0.00 C ATOM 1254 C SER A 79 11.770 14.126 -1.209 1.00 0.00 C ATOM 1255 O SER A 79 11.636 12.902 -1.268 1.00 0.00 O ATOM 1256 CB SER A 79 10.256 14.284 -3.227 1.00 0.00 C ATOM 1257 OG SER A 79 9.975 15.019 -4.412 1.00 0.00 O ATOM 0 H SER A 79 13.158 14.799 -3.234 1.00 0.00 H new ATOM 0 HA SER A 79 10.773 15.893 -1.912 1.00 0.00 H new ATOM 0 HB2 SER A 79 10.647 13.301 -3.489 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.334 14.122 -2.668 1.00 0.00 H new ATOM 0 HG SER A 79 9.327 14.526 -4.957 1.00 0.00 H new ATOM 1263 N PRO A 80 12.396 14.724 -0.173 1.00 0.00 N ATOM 1264 CA PRO A 80 12.966 13.976 0.951 1.00 0.00 C ATOM 1265 C PRO A 80 11.887 13.435 1.891 1.00 0.00 C ATOM 1266 O PRO A 80 11.265 14.195 2.642 1.00 0.00 O ATOM 1267 CB PRO A 80 13.855 15.014 1.675 1.00 0.00 C ATOM 1268 CG PRO A 80 13.865 16.226 0.794 1.00 0.00 C ATOM 1269 CD PRO A 80 12.595 16.169 -0.007 1.00 0.00 C ATOM 0 HA PRO A 80 13.517 13.097 0.616 1.00 0.00 H new ATOM 0 HB2 PRO A 80 13.456 15.251 2.661 1.00 0.00 H new ATOM 0 HB3 PRO A 80 14.864 14.630 1.823 1.00 0.00 H new ATOM 0 HG2 PRO A 80 13.911 17.139 1.388 1.00 0.00 H new ATOM 0 HG3 PRO A 80 14.738 16.226 0.141 1.00 0.00 H new ATOM 0 HD2 PRO A 80 11.762 16.637 0.517 1.00 0.00 H new ATOM 0 HD3 PRO A 80 12.695 16.679 -0.965 1.00 0.00 H new ATOM 1277 N VAL A 81 11.678 12.122 1.850 1.00 0.00 N ATOM 1278 CA VAL A 81 10.661 11.470 2.674 1.00 0.00 C ATOM 1279 C VAL A 81 11.025 11.539 4.159 1.00 0.00 C ATOM 1280 O VAL A 81 12.193 11.723 4.518 1.00 0.00 O ATOM 1281 CB VAL A 81 10.450 9.996 2.252 1.00 0.00 C ATOM 1282 CG1 VAL A 81 9.958 9.921 0.808 1.00 0.00 C ATOM 1283 CG2 VAL A 81 11.735 9.185 2.432 1.00 0.00 C ATOM 0 H VAL A 81 12.202 11.484 1.251 1.00 0.00 H new ATOM 0 HA VAL A 81 9.728 12.010 2.517 1.00 0.00 H new ATOM 0 HB VAL A 81 9.688 9.561 2.899 1.00 0.00 H new ATOM 0 HG11 VAL A 81 9.814 8.878 0.526 1.00 0.00 H new ATOM 0 HG12 VAL A 81 9.012 10.455 0.718 1.00 0.00 H new ATOM 0 HG13 VAL A 81 10.696 10.377 0.148 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.559 8.153 2.128 1.00 0.00 H new ATOM 0 HG22 VAL A 81 12.526 9.615 1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.037 9.209 3.479 1.00 0.00 H new ATOM 1293 N ASN A 82 10.022 11.388 5.020 1.00 0.00 N ATOM 1294 CA ASN A 82 10.210 11.556 6.460 1.00 0.00 C ATOM 1295 C ASN A 82 10.282 10.214 7.186 1.00 0.00 C ATOM 1296 O ASN A 82 9.282 9.504 7.311 1.00 0.00 O ATOM 1297 CB ASN A 82 9.079 12.412 7.052 1.00 0.00 C ATOM 1298 CG ASN A 82 9.080 13.835 6.515 1.00 0.00 C ATOM 1299 OD1 ASN A 82 9.746 14.716 7.061 1.00 0.00 O ATOM 1300 ND2 ASN A 82 8.336 14.069 5.443 1.00 0.00 N ATOM 0 H ASN A 82 9.069 11.149 4.746 1.00 0.00 H new ATOM 0 HA ASN A 82 11.163 12.065 6.605 1.00 0.00 H new ATOM 0 HB2 ASN A 82 8.120 11.944 6.830 1.00 0.00 H new ATOM 0 HB3 ASN A 82 9.177 12.437 8.137 1.00 0.00 H new ATOM 0 HD21 ASN A 82 8.301 15.006 5.041 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.799 13.312 5.020 1.00 0.00 H new ATOM 1307 N ILE A 83 11.485 9.872 7.640 1.00 0.00 N ATOM 1308 CA ILE A 83 11.704 8.742 8.544 1.00 0.00 C ATOM 1309 C ILE A 83 12.631 9.195 9.672 1.00 0.00 C ATOM 1310 O ILE A 83 12.657 10.386 9.993 1.00 0.00 O ATOM 1311 CB ILE A 83 12.292 7.487 7.833 1.00 0.00 C ATOM 1312 CG1 ILE A 83 13.590 7.814 7.066 1.00 0.00 C ATOM 1313 CG2 ILE A 83 11.252 6.866 6.905 1.00 0.00 C ATOM 1314 CD1 ILE A 83 13.368 8.466 5.716 1.00 0.00 C ATOM 0 H ILE A 83 12.339 10.371 7.392 1.00 0.00 H new ATOM 0 HA ILE A 83 10.734 8.436 8.935 1.00 0.00 H new ATOM 0 HB ILE A 83 12.551 6.761 8.604 1.00 0.00 H new ATOM 0 HG12 ILE A 83 14.204 8.474 7.679 1.00 0.00 H new ATOM 0 HG13 ILE A 83 14.156 6.893 6.923 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.678 5.990 6.416 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.378 6.569 7.485 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.956 7.595 6.151 1.00 0.00 H new ATOM 0 HD11 ILE A 83 14.331 8.662 5.244 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.782 7.800 5.082 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.831 9.405 5.849 1.00 0.00 H new ATOM 1326 N ASP A 84 13.389 8.273 10.271 1.00 0.00 N ATOM 1327 CA ASP A 84 14.250 8.619 11.408 1.00 0.00 C ATOM 1328 C ASP A 84 15.234 9.734 11.021 1.00 0.00 C ATOM 1329 O ASP A 84 15.300 10.765 11.688 1.00 0.00 O ATOM 1330 CB ASP A 84 15.010 7.385 11.929 1.00 0.00 C ATOM 1331 CG ASP A 84 16.141 6.953 11.011 1.00 0.00 C ATOM 1332 OD1 ASP A 84 15.863 6.301 9.986 1.00 0.00 O ATOM 1333 OD2 ASP A 84 17.305 7.306 11.292 1.00 0.00 O ATOM 0 H ASP A 84 13.426 7.292 9.993 1.00 0.00 H new ATOM 0 HA ASP A 84 13.611 8.983 12.212 1.00 0.00 H new ATOM 0 HB2 ASP A 84 15.415 7.605 12.917 1.00 0.00 H new ATOM 0 HB3 ASP A 84 14.310 6.558 12.048 1.00 0.00 H new ATOM 1338 N ARG A 85 15.996 9.506 9.938 1.00 0.00 N ATOM 1339 CA ARG A 85 16.920 10.507 9.383 1.00 0.00 C ATOM 1340 C ARG A 85 17.945 10.999 10.415 1.00 0.00 C ATOM 1341 O ARG A 85 18.644 11.985 10.176 1.00 0.00 O ATOM 1342 CB ARG A 85 16.127 11.696 8.825 1.00 0.00 C ATOM 1343 CG ARG A 85 15.198 11.335 7.666 1.00 0.00 C ATOM 1344 CD ARG A 85 15.976 11.033 6.387 1.00 0.00 C ATOM 1345 NE ARG A 85 16.618 12.236 5.845 1.00 0.00 N ATOM 1346 CZ ARG A 85 17.936 12.396 5.702 1.00 0.00 C ATOM 1347 NH1 ARG A 85 18.771 11.419 6.034 1.00 0.00 N ATOM 1348 NH2 ARG A 85 18.410 13.535 5.214 1.00 0.00 N ATOM 0 H ARG A 85 15.988 8.625 9.425 1.00 0.00 H new ATOM 0 HA ARG A 85 17.478 10.022 8.582 1.00 0.00 H new ATOM 0 HB2 ARG A 85 15.535 12.134 9.629 1.00 0.00 H new ATOM 0 HB3 ARG A 85 16.827 12.462 8.491 1.00 0.00 H new ATOM 0 HG2 ARG A 85 14.597 10.468 7.939 1.00 0.00 H new ATOM 0 HG3 ARG A 85 14.506 12.158 7.485 1.00 0.00 H new ATOM 0 HD2 ARG A 85 16.734 10.277 6.592 1.00 0.00 H new ATOM 0 HD3 ARG A 85 15.301 10.613 5.641 1.00 0.00 H new ATOM 0 HE ARG A 85 16.014 13.006 5.557 1.00 0.00 H new ATOM 0 HH11 ARG A 85 18.407 10.540 6.401 1.00 0.00 H new ATOM 0 HH12 ARG A 85 19.777 11.548 5.922 1.00 0.00 H new ATOM 0 HH21 ARG A 85 17.769 14.283 4.950 1.00 0.00 H new ATOM 0 HH22 ARG A 85 19.416 13.663 5.103 1.00 0.00 H new ATOM 1362 N GLN A 86 18.047 10.305 11.545 1.00 0.00 N ATOM 1363 CA GLN A 86 18.951 10.711 12.627 1.00 0.00 C ATOM 1364 C GLN A 86 19.955 9.604 12.928 1.00 0.00 C ATOM 1365 O GLN A 86 21.094 9.867 13.322 1.00 0.00 O ATOM 1366 CB GLN A 86 18.152 11.071 13.889 1.00 0.00 C ATOM 1367 CG GLN A 86 17.297 12.326 13.731 1.00 0.00 C ATOM 1368 CD GLN A 86 16.493 12.654 14.977 1.00 0.00 C ATOM 1369 OE1 GLN A 86 16.964 13.362 15.868 1.00 0.00 O ATOM 1370 NE2 GLN A 86 15.273 12.147 15.049 1.00 0.00 N ATOM 0 H GLN A 86 17.515 9.456 11.739 1.00 0.00 H new ATOM 0 HA GLN A 86 19.500 11.595 12.303 1.00 0.00 H new ATOM 0 HB2 GLN A 86 17.507 10.233 14.153 1.00 0.00 H new ATOM 0 HB3 GLN A 86 18.844 11.214 14.719 1.00 0.00 H new ATOM 0 HG2 GLN A 86 17.942 13.171 13.488 1.00 0.00 H new ATOM 0 HG3 GLN A 86 16.616 12.192 12.890 1.00 0.00 H new ATOM 0 HE21 GLN A 86 14.917 11.565 14.291 1.00 0.00 H new ATOM 0 HE22 GLN A 86 14.688 12.338 15.863 1.00 0.00 H new ATOM 1379 N ALA A 87 19.517 8.368 12.738 1.00 0.00 N ATOM 1380 CA ALA A 87 20.375 7.195 12.864 1.00 0.00 C ATOM 1381 C ALA A 87 20.386 6.456 11.531 1.00 0.00 C ATOM 1382 O ALA A 87 20.584 5.241 11.468 1.00 0.00 O ATOM 1383 CB ALA A 87 19.868 6.295 13.988 1.00 0.00 C ATOM 0 H ALA A 87 18.552 8.148 12.491 1.00 0.00 H new ATOM 0 HA ALA A 87 21.392 7.496 13.114 1.00 0.00 H new ATOM 0 HB1 ALA A 87 20.515 5.422 14.075 1.00 0.00 H new ATOM 0 HB2 ALA A 87 19.876 6.847 14.928 1.00 0.00 H new ATOM 0 HB3 ALA A 87 18.851 5.973 13.765 1.00 0.00 H new ATOM 1389 N TRP A 88 20.166 7.223 10.464 1.00 0.00 N ATOM 1390 CA TRP A 88 20.042 6.683 9.119 1.00 0.00 C ATOM 1391 C TRP A 88 21.346 5.992 8.677 1.00 0.00 C ATOM 1392 O TRP A 88 22.408 6.210 9.268 1.00 0.00 O ATOM 1393 CB TRP A 88 19.635 7.810 8.147 1.00 0.00 C ATOM 1394 CG TRP A 88 18.760 7.334 7.029 1.00 0.00 C ATOM 1395 CD1 TRP A 88 17.407 7.155 7.072 1.00 0.00 C ATOM 1396 CD2 TRP A 88 19.169 6.972 5.710 1.00 0.00 C ATOM 1397 NE1 TRP A 88 16.958 6.698 5.861 1.00 0.00 N ATOM 1398 CE2 TRP A 88 18.021 6.575 5.011 1.00 0.00 C ATOM 1399 CE3 TRP A 88 20.397 6.943 5.056 1.00 0.00 C ATOM 1400 CZ2 TRP A 88 18.067 6.151 3.690 1.00 0.00 C ATOM 1401 CZ3 TRP A 88 20.442 6.523 3.743 1.00 0.00 C ATOM 1402 CH2 TRP A 88 19.287 6.131 3.073 1.00 0.00 C ATOM 0 H TRP A 88 20.069 8.237 10.512 1.00 0.00 H new ATOM 0 HA TRP A 88 19.263 5.921 9.110 1.00 0.00 H new ATOM 0 HB2 TRP A 88 19.113 8.590 8.702 1.00 0.00 H new ATOM 0 HB3 TRP A 88 20.534 8.263 7.729 1.00 0.00 H new ATOM 0 HD1 TRP A 88 16.783 7.345 7.933 1.00 0.00 H new ATOM 0 HE1 TRP A 88 15.988 6.484 5.631 1.00 0.00 H new ATOM 0 HE3 TRP A 88 21.299 7.244 5.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 17.171 5.848 3.168 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 21.390 6.498 3.226 1.00 0.00 H new ATOM 0 HH2 TRP A 88 19.356 5.805 2.046 1.00 0.00 H new ATOM 1413 N LEU A 89 21.257 5.181 7.623 1.00 0.00 N ATOM 1414 CA LEU A 89 22.355 4.310 7.184 1.00 0.00 C ATOM 1415 C LEU A 89 22.822 4.704 5.780 1.00 0.00 C ATOM 1416 O LEU A 89 22.777 3.911 4.841 1.00 0.00 O ATOM 1417 CB LEU A 89 21.919 2.827 7.249 1.00 0.00 C ATOM 1418 CG LEU A 89 20.429 2.532 6.957 1.00 0.00 C ATOM 1419 CD1 LEU A 89 20.048 2.877 5.517 1.00 0.00 C ATOM 1420 CD2 LEU A 89 20.105 1.069 7.263 1.00 0.00 C ATOM 0 H LEU A 89 20.420 5.107 7.045 1.00 0.00 H new ATOM 0 HA LEU A 89 23.202 4.437 7.858 1.00 0.00 H new ATOM 0 HB2 LEU A 89 22.524 2.262 6.540 1.00 0.00 H new ATOM 0 HB3 LEU A 89 22.154 2.446 8.243 1.00 0.00 H new ATOM 0 HG LEU A 89 19.835 3.171 7.611 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.993 2.654 5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 89 20.226 3.937 5.338 1.00 0.00 H new ATOM 0 HD13 LEU A 89 20.653 2.286 4.829 1.00 0.00 H new ATOM 0 HD21 LEU A 89 19.053 0.878 7.052 1.00 0.00 H new ATOM 0 HD22 LEU A 89 20.723 0.422 6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 89 20.308 0.864 8.314 1.00 0.00 H new ATOM 1432 N GLY A 90 23.266 5.952 5.687 1.00 0.00 N ATOM 1433 CA GLY A 90 23.652 6.589 4.426 1.00 0.00 C ATOM 1434 C GLY A 90 24.419 5.721 3.433 1.00 0.00 C ATOM 1435 O GLY A 90 23.836 4.910 2.719 1.00 0.00 O ATOM 0 H GLY A 90 23.371 6.563 6.497 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.748 6.951 3.936 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.261 7.463 4.657 1.00 0.00 H new ATOM 1439 N GLU A 91 25.728 5.918 3.377 1.00 0.00 N ATOM 1440 CA GLU A 91 26.564 5.356 2.311 1.00 0.00 C ATOM 1441 C GLU A 91 26.582 3.824 2.312 1.00 0.00 C ATOM 1442 O GLU A 91 26.754 3.203 1.258 1.00 0.00 O ATOM 1443 CB GLU A 91 28.002 5.880 2.432 1.00 0.00 C ATOM 1444 CG GLU A 91 28.930 5.380 1.325 1.00 0.00 C ATOM 1445 CD GLU A 91 30.383 5.764 1.547 1.00 0.00 C ATOM 1446 OE1 GLU A 91 31.092 5.032 2.271 1.00 0.00 O ATOM 1447 OE2 GLU A 91 30.824 6.799 1.003 1.00 0.00 O ATOM 0 H GLU A 91 26.245 6.468 4.063 1.00 0.00 H new ATOM 0 HA GLU A 91 26.122 5.678 1.368 1.00 0.00 H new ATOM 0 HB2 GLU A 91 27.985 6.970 2.416 1.00 0.00 H new ATOM 0 HB3 GLU A 91 28.409 5.581 3.398 1.00 0.00 H new ATOM 0 HG2 GLU A 91 28.853 4.295 1.257 1.00 0.00 H new ATOM 0 HG3 GLU A 91 28.596 5.783 0.369 1.00 0.00 H new ATOM 1454 N GLU A 92 26.383 3.215 3.476 1.00 0.00 N ATOM 1455 CA GLU A 92 26.597 1.782 3.629 1.00 0.00 C ATOM 1456 C GLU A 92 25.623 0.989 2.767 1.00 0.00 C ATOM 1457 O GLU A 92 25.954 -0.098 2.283 1.00 0.00 O ATOM 1458 CB GLU A 92 26.480 1.360 5.101 1.00 0.00 C ATOM 1459 CG GLU A 92 25.104 1.584 5.715 1.00 0.00 C ATOM 1460 CD GLU A 92 24.988 0.995 7.112 1.00 0.00 C ATOM 1461 OE1 GLU A 92 24.704 -0.218 7.231 1.00 0.00 O ATOM 1462 OE2 GLU A 92 25.185 1.734 8.101 1.00 0.00 O ATOM 0 H GLU A 92 26.075 3.690 4.324 1.00 0.00 H new ATOM 0 HA GLU A 92 27.610 1.561 3.291 1.00 0.00 H new ATOM 0 HB2 GLU A 92 26.733 0.303 5.184 1.00 0.00 H new ATOM 0 HB3 GLU A 92 27.218 1.911 5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 92 24.898 2.654 5.757 1.00 0.00 H new ATOM 0 HG3 GLU A 92 24.345 1.138 5.072 1.00 0.00 H new ATOM 1469 N VAL A 93 24.431 1.545 2.553 1.00 0.00 N ATOM 1470 CA VAL A 93 23.420 0.862 1.758 1.00 0.00 C ATOM 1471 C VAL A 93 23.741 0.970 0.263 1.00 0.00 C ATOM 1472 O VAL A 93 23.289 0.152 -0.541 1.00 0.00 O ATOM 1473 CB VAL A 93 21.988 1.392 2.049 1.00 0.00 C ATOM 1474 CG1 VAL A 93 21.834 2.853 1.637 1.00 0.00 C ATOM 1475 CG2 VAL A 93 20.936 0.519 1.364 1.00 0.00 C ATOM 0 H VAL A 93 24.147 2.455 2.915 1.00 0.00 H new ATOM 0 HA VAL A 93 23.441 -0.189 2.047 1.00 0.00 H new ATOM 0 HB VAL A 93 21.831 1.338 3.126 1.00 0.00 H new ATOM 0 HG11 VAL A 93 20.820 3.188 1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 93 22.546 3.464 2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 93 22.026 2.952 0.569 1.00 0.00 H new ATOM 0 HG21 VAL A 93 19.942 0.909 1.582 1.00 0.00 H new ATOM 0 HG22 VAL A 93 21.101 0.528 0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 93 21.014 -0.503 1.735 1.00 0.00 H new ATOM 1485 N LEU A 94 24.539 1.974 -0.106 1.00 0.00 N ATOM 1486 CA LEU A 94 24.989 2.127 -1.492 1.00 0.00 C ATOM 1487 C LEU A 94 26.287 1.350 -1.710 1.00 0.00 C ATOM 1488 O LEU A 94 26.623 0.982 -2.838 1.00 0.00 O ATOM 1489 CB LEU A 94 25.207 3.606 -1.865 1.00 0.00 C ATOM 1490 CG LEU A 94 23.972 4.527 -1.771 1.00 0.00 C ATOM 1491 CD1 LEU A 94 22.729 3.846 -2.338 1.00 0.00 C ATOM 1492 CD2 LEU A 94 23.741 4.992 -0.336 1.00 0.00 C ATOM 0 H LEU A 94 24.886 2.690 0.532 1.00 0.00 H new ATOM 0 HA LEU A 94 24.205 1.729 -2.136 1.00 0.00 H new ATOM 0 HB2 LEU A 94 25.985 4.011 -1.217 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.588 3.648 -2.885 1.00 0.00 H new ATOM 0 HG LEU A 94 24.170 5.410 -2.379 1.00 0.00 H new ATOM 0 HD11 LEU A 94 21.876 4.520 -2.257 1.00 0.00 H new ATOM 0 HD12 LEU A 94 22.897 3.597 -3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 94 22.525 2.934 -1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 94 22.865 5.639 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.579 4.126 0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 94 24.614 5.544 0.013 1.00 0.00 H new ATOM 1504 N ALA A 95 27.018 1.124 -0.620 1.00 0.00 N ATOM 1505 CA ALA A 95 28.272 0.379 -0.664 1.00 0.00 C ATOM 1506 C ALA A 95 28.011 -1.090 -0.993 1.00 0.00 C ATOM 1507 O ALA A 95 28.403 -1.578 -2.054 1.00 0.00 O ATOM 1508 CB ALA A 95 29.014 0.514 0.664 1.00 0.00 C ATOM 0 H ALA A 95 26.759 1.450 0.311 1.00 0.00 H new ATOM 0 HA ALA A 95 28.899 0.796 -1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 95 29.948 -0.046 0.618 1.00 0.00 H new ATOM 0 HB2 ALA A 95 29.231 1.565 0.854 1.00 0.00 H new ATOM 0 HB3 ALA A 95 28.394 0.120 1.469 1.00 0.00 H new ATOM 1514 N GLU A 96 27.337 -1.785 -0.080 1.00 0.00 N ATOM 1515 CA GLU A 96 26.962 -3.180 -0.289 1.00 0.00 C ATOM 1516 C GLU A 96 25.496 -3.386 0.084 1.00 0.00 C ATOM 1517 O GLU A 96 25.172 -3.634 1.247 1.00 0.00 O ATOM 1518 CB GLU A 96 27.857 -4.128 0.526 1.00 0.00 C ATOM 1519 CG GLU A 96 29.321 -4.123 0.097 1.00 0.00 C ATOM 1520 CD GLU A 96 30.131 -5.218 0.773 1.00 0.00 C ATOM 1521 OE1 GLU A 96 30.054 -6.383 0.324 1.00 0.00 O ATOM 1522 OE2 GLU A 96 30.850 -4.923 1.757 1.00 0.00 O ATOM 0 H GLU A 96 27.038 -1.402 0.817 1.00 0.00 H new ATOM 0 HA GLU A 96 27.101 -3.415 -1.344 1.00 0.00 H new ATOM 0 HB2 GLU A 96 27.797 -3.852 1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 96 27.467 -5.142 0.440 1.00 0.00 H new ATOM 0 HG2 GLU A 96 29.380 -4.248 -0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 96 29.761 -3.154 0.331 1.00 0.00 H new ATOM 1529 N PRO A 97 24.586 -3.251 -0.896 1.00 0.00 N ATOM 1530 CA PRO A 97 23.151 -3.444 -0.670 1.00 0.00 C ATOM 1531 C PRO A 97 22.792 -4.917 -0.476 1.00 0.00 C ATOM 1532 O PRO A 97 23.610 -5.810 -0.724 1.00 0.00 O ATOM 1533 CB PRO A 97 22.516 -2.887 -1.951 1.00 0.00 C ATOM 1534 CG PRO A 97 23.560 -3.083 -2.997 1.00 0.00 C ATOM 1535 CD PRO A 97 24.882 -2.893 -2.300 1.00 0.00 C ATOM 0 HA PRO A 97 22.803 -2.950 0.237 1.00 0.00 H new ATOM 0 HB2 PRO A 97 21.597 -3.417 -2.202 1.00 0.00 H new ATOM 0 HB3 PRO A 97 22.257 -1.834 -1.841 1.00 0.00 H new ATOM 0 HG2 PRO A 97 23.490 -4.078 -3.438 1.00 0.00 H new ATOM 0 HG3 PRO A 97 23.439 -2.366 -3.809 1.00 0.00 H new ATOM 0 HD2 PRO A 97 25.655 -3.534 -2.723 1.00 0.00 H new ATOM 0 HD3 PRO A 97 25.237 -1.866 -2.386 1.00 0.00 H new ATOM 1543 N ARG A 98 21.563 -5.154 -0.042 1.00 0.00 N ATOM 1544 CA ARG A 98 21.069 -6.499 0.230 1.00 0.00 C ATOM 1545 C ARG A 98 19.616 -6.590 -0.218 1.00 0.00 C ATOM 1546 O ARG A 98 18.947 -5.562 -0.333 1.00 0.00 O ATOM 1547 CB ARG A 98 21.151 -6.794 1.738 1.00 0.00 C ATOM 1548 CG ARG A 98 20.039 -6.120 2.545 1.00 0.00 C ATOM 1549 CD ARG A 98 20.312 -6.131 4.046 1.00 0.00 C ATOM 1550 NE ARG A 98 20.284 -7.483 4.618 1.00 0.00 N ATOM 1551 CZ ARG A 98 19.231 -8.012 5.255 1.00 0.00 C ATOM 1552 NH1 ARG A 98 18.076 -7.359 5.310 1.00 0.00 N ATOM 1553 NH2 ARG A 98 19.333 -9.207 5.819 1.00 0.00 N ATOM 0 H ARG A 98 20.878 -4.419 0.132 1.00 0.00 H new ATOM 0 HA ARG A 98 21.677 -7.225 -0.310 1.00 0.00 H new ATOM 0 HB2 ARG A 98 21.102 -7.872 1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 98 22.118 -6.461 2.115 1.00 0.00 H new ATOM 0 HG2 ARG A 98 19.925 -5.090 2.208 1.00 0.00 H new ATOM 0 HG3 ARG A 98 19.094 -6.627 2.348 1.00 0.00 H new ATOM 0 HD2 ARG A 98 21.286 -5.680 4.237 1.00 0.00 H new ATOM 0 HD3 ARG A 98 19.570 -5.512 4.550 1.00 0.00 H new ATOM 0 HE ARG A 98 21.122 -8.057 4.524 1.00 0.00 H new ATOM 0 HH11 ARG A 98 17.985 -6.446 4.865 1.00 0.00 H new ATOM 0 HH12 ARG A 98 17.280 -7.771 5.798 1.00 0.00 H new ATOM 0 HH21 ARG A 98 20.212 -9.722 5.768 1.00 0.00 H new ATOM 0 HH22 ARG A 98 18.533 -9.612 6.305 1.00 0.00 H new ATOM 1567 N PRO A 99 19.098 -7.797 -0.479 1.00 0.00 N ATOM 1568 CA PRO A 99 17.670 -7.973 -0.712 1.00 0.00 C ATOM 1569 C PRO A 99 16.885 -7.619 0.551 1.00 0.00 C ATOM 1570 O PRO A 99 16.830 -8.412 1.498 1.00 0.00 O ATOM 1571 CB PRO A 99 17.526 -9.459 -1.075 1.00 0.00 C ATOM 1572 CG PRO A 99 18.750 -10.108 -0.524 1.00 0.00 C ATOM 1573 CD PRO A 99 19.840 -9.068 -0.578 1.00 0.00 C ATOM 0 HA PRO A 99 17.279 -7.328 -1.499 1.00 0.00 H new ATOM 0 HB2 PRO A 99 16.622 -9.886 -0.640 1.00 0.00 H new ATOM 0 HB3 PRO A 99 17.457 -9.597 -2.154 1.00 0.00 H new ATOM 0 HG2 PRO A 99 18.584 -10.445 0.499 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.021 -10.987 -1.109 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.549 -9.185 0.241 1.00 0.00 H new ATOM 0 HD3 PRO A 99 20.410 -9.130 -1.505 1.00 0.00 H new ATOM 1581 N ASP A 100 16.372 -6.382 0.570 1.00 0.00 N ATOM 1582 CA ASP A 100 15.536 -5.843 1.657 1.00 0.00 C ATOM 1583 C ASP A 100 16.395 -5.131 2.696 1.00 0.00 C ATOM 1584 O ASP A 100 16.824 -5.724 3.685 1.00 0.00 O ATOM 1585 CB ASP A 100 14.644 -6.909 2.333 1.00 0.00 C ATOM 1586 CG ASP A 100 13.500 -7.381 1.449 1.00 0.00 C ATOM 1587 OD1 ASP A 100 13.681 -8.358 0.692 1.00 0.00 O ATOM 1588 OD2 ASP A 100 12.413 -6.778 1.516 1.00 0.00 O ATOM 0 H ASP A 100 16.528 -5.713 -0.184 1.00 0.00 H new ATOM 0 HA ASP A 100 14.860 -5.125 1.192 1.00 0.00 H new ATOM 0 HB2 ASP A 100 15.259 -7.766 2.609 1.00 0.00 H new ATOM 0 HB3 ASP A 100 14.236 -6.499 3.257 1.00 0.00 H new ATOM 1593 N MET A 101 16.678 -3.857 2.435 1.00 0.00 N ATOM 1594 CA MET A 101 17.415 -3.017 3.382 1.00 0.00 C ATOM 1595 C MET A 101 16.635 -1.737 3.668 1.00 0.00 C ATOM 1596 O MET A 101 16.884 -1.048 4.655 1.00 0.00 O ATOM 1597 CB MET A 101 18.812 -2.689 2.833 1.00 0.00 C ATOM 1598 CG MET A 101 19.781 -2.150 3.881 1.00 0.00 C ATOM 1599 SD MET A 101 21.475 -2.051 3.267 1.00 0.00 S ATOM 1600 CE MET A 101 22.332 -1.440 4.720 1.00 0.00 C ATOM 0 H MET A 101 16.408 -3.381 1.574 1.00 0.00 H new ATOM 0 HA MET A 101 17.535 -3.565 4.316 1.00 0.00 H new ATOM 0 HB2 MET A 101 19.237 -3.589 2.389 1.00 0.00 H new ATOM 0 HB3 MET A 101 18.713 -1.955 2.033 1.00 0.00 H new ATOM 0 HG2 MET A 101 19.454 -1.160 4.199 1.00 0.00 H new ATOM 0 HG3 MET A 101 19.754 -2.792 4.761 1.00 0.00 H new ATOM 0 HE1 MET A 101 23.408 -1.495 4.557 1.00 0.00 H new ATOM 0 HE2 MET A 101 22.045 -0.405 4.903 1.00 0.00 H new ATOM 0 HE3 MET A 101 22.064 -2.049 5.583 1.00 0.00 H new ATOM 1610 N PHE A 102 15.683 -1.424 2.792 1.00 0.00 N ATOM 1611 CA PHE A 102 14.805 -0.270 2.975 1.00 0.00 C ATOM 1612 C PHE A 102 13.426 -0.725 3.447 1.00 0.00 C ATOM 1613 O PHE A 102 12.499 0.072 3.507 1.00 0.00 O ATOM 1614 CB PHE A 102 14.652 0.507 1.659 1.00 0.00 C ATOM 1615 CG PHE A 102 15.928 1.123 1.142 1.00 0.00 C ATOM 1616 CD1 PHE A 102 16.392 2.326 1.656 1.00 0.00 C ATOM 1617 CD2 PHE A 102 16.654 0.509 0.131 1.00 0.00 C ATOM 1618 CE1 PHE A 102 17.553 2.901 1.173 1.00 0.00 C ATOM 1619 CE2 PHE A 102 17.815 1.080 -0.355 1.00 0.00 C ATOM 1620 CZ PHE A 102 18.263 2.278 0.167 1.00 0.00 C ATOM 0 H PHE A 102 15.499 -1.958 1.942 1.00 0.00 H new ATOM 0 HA PHE A 102 15.254 0.380 3.726 1.00 0.00 H new ATOM 0 HB2 PHE A 102 14.255 -0.166 0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 102 13.915 1.297 1.802 1.00 0.00 H new ATOM 0 HD1 PHE A 102 15.840 2.819 2.442 1.00 0.00 H new ATOM 0 HD2 PHE A 102 16.307 -0.427 -0.281 1.00 0.00 H new ATOM 0 HE1 PHE A 102 17.904 3.837 1.583 1.00 0.00 H new ATOM 0 HE2 PHE A 102 18.371 0.591 -1.141 1.00 0.00 H new ATOM 0 HZ PHE A 102 19.169 2.727 -0.212 1.00 0.00 H new ATOM 1630 N ARG A 103 13.308 -2.004 3.797 1.00 0.00 N ATOM 1631 CA ARG A 103 12.007 -2.616 4.083 1.00 0.00 C ATOM 1632 C ARG A 103 11.373 -2.009 5.337 1.00 0.00 C ATOM 1633 O ARG A 103 10.196 -1.643 5.333 1.00 0.00 O ATOM 1634 CB ARG A 103 12.170 -4.134 4.241 1.00 0.00 C ATOM 1635 CG ARG A 103 10.854 -4.898 4.364 1.00 0.00 C ATOM 1636 CD ARG A 103 11.092 -6.402 4.420 1.00 0.00 C ATOM 1637 NE ARG A 103 9.842 -7.164 4.390 1.00 0.00 N ATOM 1638 CZ ARG A 103 9.571 -8.125 3.505 1.00 0.00 C ATOM 1639 NH1 ARG A 103 10.406 -8.366 2.499 1.00 0.00 N ATOM 1640 NH2 ARG A 103 8.449 -8.818 3.605 1.00 0.00 N ATOM 0 H ARG A 103 14.099 -2.641 3.890 1.00 0.00 H new ATOM 0 HA ARG A 103 11.339 -2.414 3.245 1.00 0.00 H new ATOM 0 HB2 ARG A 103 12.722 -4.520 3.384 1.00 0.00 H new ATOM 0 HB3 ARG A 103 12.776 -4.332 5.125 1.00 0.00 H new ATOM 0 HG2 ARG A 103 10.327 -4.577 5.263 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.212 -4.660 3.516 1.00 0.00 H new ATOM 0 HD2 ARG A 103 11.717 -6.700 3.578 1.00 0.00 H new ATOM 0 HD3 ARG A 103 11.643 -6.647 5.328 1.00 0.00 H new ATOM 0 HE ARG A 103 9.133 -6.946 5.090 1.00 0.00 H new ATOM 0 HH11 ARG A 103 11.259 -7.815 2.401 1.00 0.00 H new ATOM 0 HH12 ARG A 103 10.194 -9.102 1.825 1.00 0.00 H new ATOM 0 HH21 ARG A 103 7.791 -8.618 4.358 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.241 -9.553 2.929 1.00 0.00 H new ATOM 1654 N ALA A 104 12.161 -1.899 6.405 1.00 0.00 N ATOM 1655 CA ALA A 104 11.686 -1.306 7.655 1.00 0.00 C ATOM 1656 C ALA A 104 11.302 0.158 7.437 1.00 0.00 C ATOM 1657 O ALA A 104 10.227 0.606 7.844 1.00 0.00 O ATOM 1658 CB ALA A 104 12.755 -1.424 8.742 1.00 0.00 C ATOM 0 H ALA A 104 13.131 -2.213 6.430 1.00 0.00 H new ATOM 0 HA ALA A 104 10.800 -1.850 7.983 1.00 0.00 H new ATOM 0 HB1 ALA A 104 12.386 -0.978 9.665 1.00 0.00 H new ATOM 0 HB2 ALA A 104 12.985 -2.476 8.914 1.00 0.00 H new ATOM 0 HB3 ALA A 104 13.657 -0.903 8.423 1.00 0.00 H new ATOM 1664 N GLN A 105 12.190 0.881 6.764 1.00 0.00 N ATOM 1665 CA GLN A 105 11.986 2.293 6.444 1.00 0.00 C ATOM 1666 C GLN A 105 10.745 2.462 5.561 1.00 0.00 C ATOM 1667 O GLN A 105 9.975 3.415 5.712 1.00 0.00 O ATOM 1668 CB GLN A 105 13.241 2.816 5.738 1.00 0.00 C ATOM 1669 CG GLN A 105 13.318 4.330 5.631 1.00 0.00 C ATOM 1670 CD GLN A 105 14.610 4.804 4.989 1.00 0.00 C ATOM 1671 OE1 GLN A 105 14.644 5.841 4.338 1.00 0.00 O ATOM 1672 NE2 GLN A 105 15.693 4.060 5.182 1.00 0.00 N ATOM 0 H GLN A 105 13.075 0.505 6.423 1.00 0.00 H new ATOM 0 HA GLN A 105 11.820 2.866 7.356 1.00 0.00 H new ATOM 0 HB2 GLN A 105 14.120 2.457 6.273 1.00 0.00 H new ATOM 0 HB3 GLN A 105 13.282 2.391 4.735 1.00 0.00 H new ATOM 0 HG2 GLN A 105 12.472 4.693 5.047 1.00 0.00 H new ATOM 0 HG3 GLN A 105 13.229 4.766 6.626 1.00 0.00 H new ATOM 0 HE21 GLN A 105 15.631 3.202 5.729 1.00 0.00 H new ATOM 0 HE22 GLN A 105 16.587 4.347 4.783 1.00 0.00 H new ATOM 1681 N GLN A 106 10.553 1.504 4.660 1.00 0.00 N ATOM 1682 CA GLN A 106 9.398 1.466 3.771 1.00 0.00 C ATOM 1683 C GLN A 106 8.116 1.329 4.581 1.00 0.00 C ATOM 1684 O GLN A 106 7.141 2.053 4.364 1.00 0.00 O ATOM 1685 CB GLN A 106 9.532 0.282 2.799 1.00 0.00 C ATOM 1686 CG GLN A 106 8.308 0.044 1.922 1.00 0.00 C ATOM 1687 CD GLN A 106 8.425 -1.203 1.058 1.00 0.00 C ATOM 1688 OE1 GLN A 106 9.096 -2.168 1.423 1.00 0.00 O ATOM 1689 NE2 GLN A 106 7.772 -1.191 -0.093 1.00 0.00 N ATOM 0 H GLN A 106 11.200 0.727 4.526 1.00 0.00 H new ATOM 0 HA GLN A 106 9.356 2.395 3.203 1.00 0.00 H new ATOM 0 HB2 GLN A 106 10.396 0.451 2.157 1.00 0.00 H new ATOM 0 HB3 GLN A 106 9.734 -0.622 3.373 1.00 0.00 H new ATOM 0 HG2 GLN A 106 7.426 -0.042 2.556 1.00 0.00 H new ATOM 0 HG3 GLN A 106 8.155 0.911 1.279 1.00 0.00 H new ATOM 0 HE21 GLN A 106 7.226 -0.372 -0.361 1.00 0.00 H new ATOM 0 HE22 GLN A 106 7.815 -2.001 -0.712 1.00 0.00 H new ATOM 1698 N LEU A 107 8.131 0.397 5.528 1.00 0.00 N ATOM 1699 CA LEU A 107 6.967 0.134 6.358 1.00 0.00 C ATOM 1700 C LEU A 107 6.673 1.334 7.259 1.00 0.00 C ATOM 1701 O LEU A 107 5.524 1.564 7.645 1.00 0.00 O ATOM 1702 CB LEU A 107 7.176 -1.132 7.201 1.00 0.00 C ATOM 1703 CG LEU A 107 5.899 -1.694 7.850 1.00 0.00 C ATOM 1704 CD1 LEU A 107 4.952 -2.260 6.793 1.00 0.00 C ATOM 1705 CD2 LEU A 107 6.241 -2.752 8.899 1.00 0.00 C ATOM 0 H LEU A 107 8.939 -0.189 5.738 1.00 0.00 H new ATOM 0 HA LEU A 107 6.110 -0.028 5.705 1.00 0.00 H new ATOM 0 HB2 LEU A 107 7.615 -1.904 6.569 1.00 0.00 H new ATOM 0 HB3 LEU A 107 7.900 -0.913 7.986 1.00 0.00 H new ATOM 0 HG LEU A 107 5.388 -0.873 8.353 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.057 -2.651 7.278 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.671 -1.471 6.096 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.451 -3.063 6.250 1.00 0.00 H new ATOM 0 HD21 LEU A 107 5.322 -3.134 9.343 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.783 -3.571 8.426 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.862 -2.306 9.676 1.00 0.00 H new ATOM 1717 N GLN A 108 7.711 2.102 7.591 1.00 0.00 N ATOM 1718 CA GLN A 108 7.535 3.308 8.397 1.00 0.00 C ATOM 1719 C GLN A 108 6.696 4.326 7.626 1.00 0.00 C ATOM 1720 O GLN A 108 5.784 4.942 8.186 1.00 0.00 O ATOM 1721 CB GLN A 108 8.891 3.912 8.804 1.00 0.00 C ATOM 1722 CG GLN A 108 8.761 5.069 9.793 1.00 0.00 C ATOM 1723 CD GLN A 108 10.098 5.554 10.330 1.00 0.00 C ATOM 1724 OE1 GLN A 108 11.060 4.791 10.428 1.00 0.00 O ATOM 1725 NE2 GLN A 108 10.167 6.826 10.693 1.00 0.00 N ATOM 0 H GLN A 108 8.675 1.912 7.316 1.00 0.00 H new ATOM 0 HA GLN A 108 7.011 3.038 9.314 1.00 0.00 H new ATOM 0 HB2 GLN A 108 9.511 3.132 9.246 1.00 0.00 H new ATOM 0 HB3 GLN A 108 9.408 4.262 7.911 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.250 5.899 9.305 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.134 4.756 10.628 1.00 0.00 H new ATOM 0 HE21 GLN A 108 9.350 7.429 10.597 1.00 0.00 H new ATOM 0 HE22 GLN A 108 11.037 7.203 11.068 1.00 0.00 H new ATOM 1734 N ILE A 109 6.999 4.481 6.336 1.00 0.00 N ATOM 1735 CA ILE A 109 6.197 5.320 5.442 1.00 0.00 C ATOM 1736 C ILE A 109 4.780 4.753 5.331 1.00 0.00 C ATOM 1737 O ILE A 109 3.792 5.494 5.376 1.00 0.00 O ATOM 1738 CB ILE A 109 6.856 5.438 4.025 1.00 0.00 C ATOM 1739 CG1 ILE A 109 7.489 6.830 3.828 1.00 0.00 C ATOM 1740 CG2 ILE A 109 5.859 5.145 2.898 1.00 0.00 C ATOM 1741 CD1 ILE A 109 8.571 7.167 4.833 1.00 0.00 C ATOM 0 H ILE A 109 7.797 4.035 5.885 1.00 0.00 H new ATOM 0 HA ILE A 109 6.149 6.323 5.866 1.00 0.00 H new ATOM 0 HB ILE A 109 7.640 4.682 3.976 1.00 0.00 H new ATOM 0 HG12 ILE A 109 7.910 6.887 2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 109 6.705 7.585 3.888 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.361 5.239 1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.472 4.132 3.009 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.034 5.856 2.948 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.964 8.162 4.625 1.00 0.00 H new ATOM 0 HD12 ILE A 109 8.152 7.146 5.839 1.00 0.00 H new ATOM 0 HD13 ILE A 109 9.376 6.436 4.759 1.00 0.00 H new ATOM 1753 N PHE A 110 4.698 3.431 5.209 1.00 0.00 N ATOM 1754 CA PHE A 110 3.418 2.735 5.129 1.00 0.00 C ATOM 1755 C PHE A 110 2.517 3.134 6.300 1.00 0.00 C ATOM 1756 O PHE A 110 1.373 3.544 6.107 1.00 0.00 O ATOM 1757 CB PHE A 110 3.653 1.214 5.115 1.00 0.00 C ATOM 1758 CG PHE A 110 2.388 0.395 5.111 1.00 0.00 C ATOM 1759 CD1 PHE A 110 1.762 0.076 3.919 1.00 0.00 C ATOM 1760 CD2 PHE A 110 1.823 -0.049 6.298 1.00 0.00 C ATOM 1761 CE1 PHE A 110 0.599 -0.668 3.907 1.00 0.00 C ATOM 1762 CE2 PHE A 110 0.659 -0.790 6.291 1.00 0.00 C ATOM 1763 CZ PHE A 110 0.047 -1.100 5.095 1.00 0.00 C ATOM 0 H PHE A 110 5.511 2.816 5.163 1.00 0.00 H new ATOM 0 HA PHE A 110 2.915 3.021 4.205 1.00 0.00 H new ATOM 0 HB2 PHE A 110 4.242 0.957 4.235 1.00 0.00 H new ATOM 0 HB3 PHE A 110 4.247 0.941 5.987 1.00 0.00 H new ATOM 0 HD1 PHE A 110 2.189 0.413 2.986 1.00 0.00 H new ATOM 0 HD2 PHE A 110 2.300 0.188 7.238 1.00 0.00 H new ATOM 0 HE1 PHE A 110 0.122 -0.911 2.969 1.00 0.00 H new ATOM 0 HE2 PHE A 110 0.228 -1.127 7.222 1.00 0.00 H new ATOM 0 HZ PHE A 110 -0.864 -1.681 5.088 1.00 0.00 H new ATOM 1773 N ASN A 111 3.057 3.036 7.512 1.00 0.00 N ATOM 1774 CA ASN A 111 2.316 3.391 8.724 1.00 0.00 C ATOM 1775 C ASN A 111 2.131 4.903 8.821 1.00 0.00 C ATOM 1776 O ASN A 111 1.134 5.382 9.367 1.00 0.00 O ATOM 1777 CB ASN A 111 3.033 2.866 9.979 1.00 0.00 C ATOM 1778 CG ASN A 111 2.884 1.363 10.157 1.00 0.00 C ATOM 1779 OD1 ASN A 111 1.935 0.893 10.787 1.00 0.00 O ATOM 1780 ND2 ASN A 111 3.815 0.596 9.611 1.00 0.00 N ATOM 0 H ASN A 111 4.009 2.712 7.683 1.00 0.00 H new ATOM 0 HA ASN A 111 1.334 2.922 8.664 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.092 3.117 9.919 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.635 3.373 10.858 1.00 0.00 H new ATOM 0 HD21 ASN A 111 3.760 -0.418 9.705 1.00 0.00 H new ATOM 0 HD22 ASN A 111 4.587 1.019 9.096 1.00 0.00 H new ATOM 1787 N LEU A 112 3.082 5.647 8.264 1.00 0.00 N ATOM 1788 CA LEU A 112 3.058 7.108 8.316 1.00 0.00 C ATOM 1789 C LEU A 112 1.811 7.659 7.624 1.00 0.00 C ATOM 1790 O LEU A 112 1.307 8.718 7.994 1.00 0.00 O ATOM 1791 CB LEU A 112 4.324 7.683 7.660 1.00 0.00 C ATOM 1792 CG LEU A 112 4.479 9.214 7.731 1.00 0.00 C ATOM 1793 CD1 LEU A 112 4.573 9.685 9.181 1.00 0.00 C ATOM 1794 CD2 LEU A 112 5.699 9.670 6.930 1.00 0.00 C ATOM 0 H LEU A 112 3.885 5.260 7.768 1.00 0.00 H new ATOM 0 HA LEU A 112 3.030 7.411 9.363 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.194 7.226 8.131 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.335 7.384 6.612 1.00 0.00 H new ATOM 0 HG LEU A 112 3.592 9.667 7.288 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.682 10.769 9.205 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.667 9.399 9.716 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.437 9.223 9.658 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.791 10.754 6.993 1.00 0.00 H new ATOM 0 HD22 LEU A 112 6.597 9.205 7.338 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.580 9.376 5.887 1.00 0.00 H new ATOM 1806 N MET A 113 1.315 6.931 6.624 1.00 0.00 N ATOM 1807 CA MET A 113 0.135 7.358 5.863 1.00 0.00 C ATOM 1808 C MET A 113 -1.037 6.387 6.044 1.00 0.00 C ATOM 1809 O MET A 113 -2.079 6.533 5.399 1.00 0.00 O ATOM 1810 CB MET A 113 0.497 7.495 4.374 1.00 0.00 C ATOM 1811 CG MET A 113 1.043 6.220 3.745 1.00 0.00 C ATOM 1812 SD MET A 113 1.544 6.458 2.028 1.00 0.00 S ATOM 1813 CE MET A 113 2.200 4.837 1.639 1.00 0.00 C ATOM 0 H MET A 113 1.711 6.041 6.320 1.00 0.00 H new ATOM 0 HA MET A 113 -0.184 8.327 6.247 1.00 0.00 H new ATOM 0 HB2 MET A 113 -0.390 7.808 3.823 1.00 0.00 H new ATOM 0 HB3 MET A 113 1.237 8.288 4.263 1.00 0.00 H new ATOM 0 HG2 MET A 113 1.897 5.870 4.324 1.00 0.00 H new ATOM 0 HG3 MET A 113 0.283 5.440 3.794 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.244 4.929 1.338 1.00 0.00 H new ATOM 0 HE2 MET A 113 2.131 4.196 2.518 1.00 0.00 H new ATOM 0 HE3 MET A 113 1.625 4.398 0.824 1.00 0.00 H new ATOM 1823 N LYS A 114 -0.881 5.423 6.949 1.00 0.00 N ATOM 1824 CA LYS A 114 -1.890 4.375 7.147 1.00 0.00 C ATOM 1825 C LYS A 114 -3.042 4.857 8.037 1.00 0.00 C ATOM 1826 O LYS A 114 -4.086 4.206 8.117 1.00 0.00 O ATOM 1827 CB LYS A 114 -1.247 3.124 7.772 1.00 0.00 C ATOM 1828 CG LYS A 114 -2.179 1.912 7.832 1.00 0.00 C ATOM 1829 CD LYS A 114 -1.515 0.704 8.489 1.00 0.00 C ATOM 1830 CE LYS A 114 -2.410 -0.531 8.436 1.00 0.00 C ATOM 1831 NZ LYS A 114 -1.766 -1.714 9.065 1.00 0.00 N ATOM 0 H LYS A 114 -0.067 5.343 7.558 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.297 4.127 6.167 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.359 2.859 7.198 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -0.914 3.364 8.782 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.079 2.176 8.387 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.493 1.647 6.822 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.571 0.491 7.988 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.279 0.938 9.527 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.351 -0.318 8.943 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.652 -0.759 7.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.180 -2.584 8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.745 -1.698 8.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.922 -1.689 10.093 1.00 0.00 H new ATOM 1845 N PHE A 115 -2.863 5.998 8.698 1.00 0.00 N ATOM 1846 CA PHE A 115 -3.842 6.462 9.684 1.00 0.00 C ATOM 1847 C PHE A 115 -4.223 7.929 9.450 1.00 0.00 C ATOM 1848 O PHE A 115 -4.644 8.627 10.372 1.00 0.00 O ATOM 1849 CB PHE A 115 -3.270 6.260 11.102 1.00 0.00 C ATOM 1850 CG PHE A 115 -4.294 6.379 12.209 1.00 0.00 C ATOM 1851 CD1 PHE A 115 -5.288 5.418 12.353 1.00 0.00 C ATOM 1852 CD2 PHE A 115 -4.265 7.442 13.103 1.00 0.00 C ATOM 1853 CE1 PHE A 115 -6.228 5.517 13.362 1.00 0.00 C ATOM 1854 CE2 PHE A 115 -5.204 7.545 14.113 1.00 0.00 C ATOM 1855 CZ PHE A 115 -6.186 6.582 14.243 1.00 0.00 C ATOM 0 H PHE A 115 -2.060 6.614 8.573 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.754 5.875 9.576 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -2.806 5.275 11.157 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -2.482 6.994 11.271 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -5.326 4.584 11.668 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.499 8.198 13.008 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.995 4.763 13.462 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -5.170 8.378 14.800 1.00 0.00 H new ATOM 0 HZ PHE A 115 -6.920 6.661 15.032 1.00 0.00 H new ATOM 1865 N ASP A 116 -4.107 8.388 8.205 1.00 0.00 N ATOM 1866 CA ASP A 116 -4.451 9.774 7.866 1.00 0.00 C ATOM 1867 C ASP A 116 -4.645 9.930 6.358 1.00 0.00 C ATOM 1868 O ASP A 116 -5.717 10.324 5.912 1.00 0.00 O ATOM 1869 CB ASP A 116 -3.388 10.759 8.388 1.00 0.00 C ATOM 1870 CG ASP A 116 -2.039 10.610 7.705 1.00 0.00 C ATOM 1871 OD1 ASP A 116 -1.506 9.482 7.683 1.00 0.00 O ATOM 1872 OD2 ASP A 116 -1.517 11.615 7.176 1.00 0.00 O ATOM 0 H ASP A 116 -3.780 7.828 7.418 1.00 0.00 H new ATOM 0 HA ASP A 116 -5.393 10.014 8.358 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -3.748 11.778 8.247 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -3.262 10.611 9.461 1.00 0.00 H new ATOM 1877 N SER A 117 -3.620 9.598 5.573 1.00 0.00 N ATOM 1878 CA SER A 117 -3.720 9.652 4.117 1.00 0.00 C ATOM 1879 C SER A 117 -4.693 8.574 3.650 1.00 0.00 C ATOM 1880 O SER A 117 -5.472 8.768 2.713 1.00 0.00 O ATOM 1881 CB SER A 117 -2.339 9.461 3.481 1.00 0.00 C ATOM 1882 OG SER A 117 -2.390 9.590 2.072 1.00 0.00 O ATOM 0 H SER A 117 -2.713 9.289 5.922 1.00 0.00 H new ATOM 0 HA SER A 117 -4.093 10.628 3.807 1.00 0.00 H new ATOM 0 HB2 SER A 117 -1.645 10.196 3.889 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.951 8.477 3.743 1.00 0.00 H new ATOM 0 HG SER A 117 -2.740 8.763 1.680 1.00 0.00 H new ATOM 1888 N TYR A 118 -4.638 7.440 4.338 1.00 0.00 N ATOM 1889 CA TYR A 118 -5.611 6.366 4.173 1.00 0.00 C ATOM 1890 C TYR A 118 -7.036 6.904 4.335 1.00 0.00 C ATOM 1891 O TYR A 118 -7.901 6.671 3.487 1.00 0.00 O ATOM 1892 CB TYR A 118 -5.320 5.276 5.211 1.00 0.00 C ATOM 1893 CG TYR A 118 -6.328 4.144 5.263 1.00 0.00 C ATOM 1894 CD1 TYR A 118 -6.574 3.346 4.152 1.00 0.00 C ATOM 1895 CD2 TYR A 118 -7.015 3.860 6.438 1.00 0.00 C ATOM 1896 CE1 TYR A 118 -7.475 2.300 4.210 1.00 0.00 C ATOM 1897 CE2 TYR A 118 -7.911 2.815 6.506 1.00 0.00 C ATOM 1898 CZ TYR A 118 -8.137 2.038 5.392 1.00 0.00 C ATOM 1899 OH TYR A 118 -9.016 0.986 5.468 1.00 0.00 O ATOM 0 H TYR A 118 -3.915 7.238 5.029 1.00 0.00 H new ATOM 0 HA TYR A 118 -5.529 5.945 3.171 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -4.336 4.855 5.005 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -5.268 5.740 6.196 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -6.052 3.547 3.228 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -6.843 4.469 7.313 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -7.660 1.692 3.337 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -8.433 2.607 7.428 1.00 0.00 H new ATOM 0 HH TYR A 118 -9.798 1.251 5.995 1.00 0.00 H new ATOM 1909 N ALA A 119 -7.264 7.640 5.424 1.00 0.00 N ATOM 1910 CA ALA A 119 -8.576 8.232 5.696 1.00 0.00 C ATOM 1911 C ALA A 119 -8.912 9.288 4.642 1.00 0.00 C ATOM 1912 O ALA A 119 -10.038 9.359 4.147 1.00 0.00 O ATOM 1913 CB ALA A 119 -8.605 8.840 7.098 1.00 0.00 C ATOM 0 H ALA A 119 -6.558 7.841 6.132 1.00 0.00 H new ATOM 0 HA ALA A 119 -9.330 7.447 5.647 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -9.586 9.276 7.285 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -8.406 8.063 7.836 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -7.843 9.616 7.174 1.00 0.00 H new ATOM 1919 N ARG A 120 -7.908 10.086 4.300 1.00 0.00 N ATOM 1920 CA ARG A 120 -8.018 11.137 3.291 1.00 0.00 C ATOM 1921 C ARG A 120 -8.656 10.599 2.009 1.00 0.00 C ATOM 1922 O ARG A 120 -9.679 11.113 1.537 1.00 0.00 O ATOM 1923 CB ARG A 120 -6.608 11.683 3.006 1.00 0.00 C ATOM 1924 CG ARG A 120 -6.504 12.680 1.856 1.00 0.00 C ATOM 1925 CD ARG A 120 -7.186 14.004 2.166 1.00 0.00 C ATOM 1926 NE ARG A 120 -6.814 15.032 1.188 1.00 0.00 N ATOM 1927 CZ ARG A 120 -7.630 15.981 0.740 1.00 0.00 C ATOM 1928 NH1 ARG A 120 -8.889 16.032 1.159 1.00 0.00 N ATOM 1929 NH2 ARG A 120 -7.178 16.870 -0.133 1.00 0.00 N ATOM 0 H ARG A 120 -6.981 10.022 4.720 1.00 0.00 H new ATOM 0 HA ARG A 120 -8.659 11.936 3.662 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -6.234 12.161 3.911 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -5.949 10.841 2.794 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -5.453 12.861 1.631 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -6.951 12.246 0.962 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -8.268 13.869 2.162 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -6.909 14.333 3.167 1.00 0.00 H new ATOM 0 HE ARG A 120 -5.861 15.018 0.826 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -9.233 15.342 1.827 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -9.512 16.762 0.813 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.211 16.822 -0.455 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.797 17.602 -0.482 1.00 0.00 H new ATOM 1943 N PHE A 121 -8.061 9.543 1.470 1.00 0.00 N ATOM 1944 CA PHE A 121 -8.513 8.971 0.210 1.00 0.00 C ATOM 1945 C PHE A 121 -9.940 8.425 0.320 1.00 0.00 C ATOM 1946 O PHE A 121 -10.800 8.753 -0.499 1.00 0.00 O ATOM 1947 CB PHE A 121 -7.556 7.865 -0.247 1.00 0.00 C ATOM 1948 CG PHE A 121 -7.926 7.267 -1.580 1.00 0.00 C ATOM 1949 CD1 PHE A 121 -7.683 7.962 -2.758 1.00 0.00 C ATOM 1950 CD2 PHE A 121 -8.523 6.018 -1.659 1.00 0.00 C ATOM 1951 CE1 PHE A 121 -8.027 7.421 -3.981 1.00 0.00 C ATOM 1952 CE2 PHE A 121 -8.868 5.474 -2.880 1.00 0.00 C ATOM 1953 CZ PHE A 121 -8.622 6.176 -4.041 1.00 0.00 C ATOM 0 H PHE A 121 -7.263 9.065 1.887 1.00 0.00 H new ATOM 0 HA PHE A 121 -8.517 9.768 -0.533 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -6.546 8.270 -0.307 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -7.539 7.076 0.505 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.220 8.937 -2.717 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -8.721 5.464 -0.754 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -7.831 7.971 -4.890 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -9.330 4.499 -2.926 1.00 0.00 H new ATOM 0 HZ PHE A 121 -8.894 5.753 -4.997 1.00 0.00 H new ATOM 1963 N VAL A 122 -10.192 7.610 1.344 1.00 0.00 N ATOM 1964 CA VAL A 122 -11.490 6.944 1.488 1.00 0.00 C ATOM 1965 C VAL A 122 -12.616 7.946 1.777 1.00 0.00 C ATOM 1966 O VAL A 122 -13.788 7.653 1.531 1.00 0.00 O ATOM 1967 CB VAL A 122 -11.470 5.851 2.588 1.00 0.00 C ATOM 1968 CG1 VAL A 122 -10.419 4.785 2.275 1.00 0.00 C ATOM 1969 CG2 VAL A 122 -11.236 6.457 3.971 1.00 0.00 C ATOM 0 H VAL A 122 -9.521 7.395 2.082 1.00 0.00 H new ATOM 0 HA VAL A 122 -11.687 6.462 0.530 1.00 0.00 H new ATOM 0 HB VAL A 122 -12.449 5.372 2.598 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -10.423 4.029 3.060 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -10.650 4.316 1.318 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -9.434 5.249 2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -11.228 5.664 4.719 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -10.278 6.977 3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -12.035 7.163 4.199 1.00 0.00 H new ATOM 1979 N LYS A 123 -12.263 9.121 2.301 1.00 0.00 N ATOM 1980 CA LYS A 123 -13.248 10.183 2.530 1.00 0.00 C ATOM 1981 C LYS A 123 -13.662 10.827 1.210 1.00 0.00 C ATOM 1982 O LYS A 123 -14.826 11.187 1.019 1.00 0.00 O ATOM 1983 CB LYS A 123 -12.696 11.265 3.473 1.00 0.00 C ATOM 1984 CG LYS A 123 -12.590 10.834 4.931 1.00 0.00 C ATOM 1985 CD LYS A 123 -13.931 10.349 5.474 1.00 0.00 C ATOM 1986 CE LYS A 123 -13.877 10.104 6.976 1.00 0.00 C ATOM 1987 NZ LYS A 123 -13.756 11.371 7.746 1.00 0.00 N ATOM 0 H LYS A 123 -11.310 9.362 2.574 1.00 0.00 H new ATOM 0 HA LYS A 123 -14.118 9.723 2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -11.709 11.566 3.123 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -13.337 12.144 3.412 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -11.851 10.038 5.023 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -12.234 11.670 5.533 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -14.701 11.088 5.254 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -14.218 9.428 4.966 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -14.777 9.575 7.289 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -13.030 9.458 7.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -13.926 11.182 8.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -12.800 11.762 7.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -14.457 12.056 7.399 1.00 0.00 H new ATOM 2001 N SER A 124 -12.694 10.968 0.314 1.00 0.00 N ATOM 2002 CA SER A 124 -12.909 11.622 -0.972 1.00 0.00 C ATOM 2003 C SER A 124 -13.991 10.914 -1.802 1.00 0.00 C ATOM 2004 O SER A 124 -14.093 9.681 -1.786 1.00 0.00 O ATOM 2005 CB SER A 124 -11.588 11.660 -1.743 1.00 0.00 C ATOM 2006 OG SER A 124 -10.575 12.266 -0.959 1.00 0.00 O ATOM 0 H SER A 124 -11.741 10.634 0.456 1.00 0.00 H new ATOM 0 HA SER A 124 -13.261 12.637 -0.786 1.00 0.00 H new ATOM 0 HB2 SER A 124 -11.289 10.648 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.718 12.215 -2.672 1.00 0.00 H new ATOM 0 HG SER A 124 -9.803 12.474 -1.526 1.00 0.00 H new ATOM 2012 N PRO A 125 -14.808 11.691 -2.555 1.00 0.00 N ATOM 2013 CA PRO A 125 -15.875 11.139 -3.407 1.00 0.00 C ATOM 2014 C PRO A 125 -15.324 10.177 -4.458 1.00 0.00 C ATOM 2015 O PRO A 125 -16.056 9.361 -5.018 1.00 0.00 O ATOM 2016 CB PRO A 125 -16.499 12.382 -4.073 1.00 0.00 C ATOM 2017 CG PRO A 125 -15.474 13.457 -3.925 1.00 0.00 C ATOM 2018 CD PRO A 125 -14.760 13.164 -2.633 1.00 0.00 C ATOM 0 HA PRO A 125 -16.595 10.556 -2.834 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -16.726 12.195 -5.123 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -17.435 12.660 -3.589 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.780 13.454 -4.765 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -15.940 14.442 -3.900 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.735 13.534 -2.645 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -15.257 13.630 -1.782 1.00 0.00 H new ATOM 2026 N LEU A 126 -14.020 10.282 -4.705 1.00 0.00 N ATOM 2027 CA LEU A 126 -13.320 9.396 -5.630 1.00 0.00 C ATOM 2028 C LEU A 126 -13.572 7.936 -5.235 1.00 0.00 C ATOM 2029 O LEU A 126 -13.800 7.075 -6.088 1.00 0.00 O ATOM 2030 CB LEU A 126 -11.812 9.731 -5.609 1.00 0.00 C ATOM 2031 CG LEU A 126 -10.959 9.174 -6.771 1.00 0.00 C ATOM 2032 CD1 LEU A 126 -9.589 9.852 -6.798 1.00 0.00 C ATOM 2033 CD2 LEU A 126 -10.790 7.659 -6.664 1.00 0.00 C ATOM 0 H LEU A 126 -13.420 10.983 -4.270 1.00 0.00 H new ATOM 0 HA LEU A 126 -13.692 9.540 -6.644 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.705 10.816 -5.598 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.395 9.360 -4.673 1.00 0.00 H new ATOM 0 HG LEU A 126 -11.485 9.391 -7.701 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -9.000 9.449 -7.622 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -9.717 10.926 -6.935 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -9.072 9.665 -5.857 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -10.185 7.301 -7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -10.295 7.414 -5.724 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -11.769 7.181 -6.694 1.00 0.00 H new ATOM 2045 N TYR A 127 -13.557 7.673 -3.928 1.00 0.00 N ATOM 2046 CA TYR A 127 -13.793 6.327 -3.413 1.00 0.00 C ATOM 2047 C TYR A 127 -15.220 5.883 -3.736 1.00 0.00 C ATOM 2048 O TYR A 127 -15.464 4.717 -4.043 1.00 0.00 O ATOM 2049 CB TYR A 127 -13.538 6.282 -1.897 1.00 0.00 C ATOM 2050 CG TYR A 127 -13.637 4.891 -1.288 1.00 0.00 C ATOM 2051 CD1 TYR A 127 -12.945 3.816 -1.841 1.00 0.00 C ATOM 2052 CD2 TYR A 127 -14.416 4.652 -0.159 1.00 0.00 C ATOM 2053 CE1 TYR A 127 -13.029 2.551 -1.292 1.00 0.00 C ATOM 2054 CE2 TYR A 127 -14.502 3.388 0.397 1.00 0.00 C ATOM 2055 CZ TYR A 127 -13.806 2.341 -0.173 1.00 0.00 C ATOM 2056 OH TYR A 127 -13.889 1.082 0.379 1.00 0.00 O ATOM 0 H TYR A 127 -13.384 8.375 -3.208 1.00 0.00 H new ATOM 0 HA TYR A 127 -13.100 5.638 -3.896 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -12.546 6.685 -1.695 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -14.255 6.936 -1.400 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -12.331 3.974 -2.715 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -14.963 5.468 0.291 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -12.488 1.730 -1.738 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -15.111 3.221 1.273 1.00 0.00 H new ATOM 0 HH TYR A 127 -14.830 0.847 0.517 1.00 0.00 H new ATOM 2066 N ARG A 128 -16.157 6.829 -3.691 1.00 0.00 N ATOM 2067 CA ARG A 128 -17.559 6.542 -4.004 1.00 0.00 C ATOM 2068 C ARG A 128 -17.691 6.186 -5.481 1.00 0.00 C ATOM 2069 O ARG A 128 -18.412 5.255 -5.851 1.00 0.00 O ATOM 2070 CB ARG A 128 -18.452 7.749 -3.686 1.00 0.00 C ATOM 2071 CG ARG A 128 -18.267 8.312 -2.279 1.00 0.00 C ATOM 2072 CD ARG A 128 -18.542 7.275 -1.196 1.00 0.00 C ATOM 2073 NE ARG A 128 -18.443 7.861 0.143 1.00 0.00 N ATOM 2074 CZ ARG A 128 -17.299 8.025 0.811 1.00 0.00 C ATOM 2075 NH1 ARG A 128 -16.152 7.615 0.282 1.00 0.00 N ATOM 2076 NH2 ARG A 128 -17.309 8.601 2.007 1.00 0.00 N ATOM 0 H ARG A 128 -15.972 7.801 -3.441 1.00 0.00 H new ATOM 0 HA ARG A 128 -17.883 5.702 -3.390 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -18.249 8.538 -4.410 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -19.495 7.459 -3.815 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.248 8.684 -2.171 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -18.934 9.163 -2.141 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -19.537 6.854 -1.338 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -17.832 6.453 -1.288 1.00 0.00 H new ATOM 0 HE ARG A 128 -19.306 8.164 0.595 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -16.143 7.173 -0.637 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -15.280 7.742 0.795 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -18.189 8.917 2.413 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -16.436 8.727 2.519 1.00 0.00 H new ATOM 2090 N GLU A 129 -16.968 6.936 -6.312 1.00 0.00 N ATOM 2091 CA GLU A 129 -16.934 6.710 -7.752 1.00 0.00 C ATOM 2092 C GLU A 129 -16.596 5.251 -8.047 1.00 0.00 C ATOM 2093 O GLU A 129 -17.292 4.579 -8.805 1.00 0.00 O ATOM 2094 CB GLU A 129 -15.884 7.628 -8.399 1.00 0.00 C ATOM 2095 CG GLU A 129 -15.835 7.545 -9.924 1.00 0.00 C ATOM 2096 CD GLU A 129 -14.580 8.173 -10.520 1.00 0.00 C ATOM 2097 OE1 GLU A 129 -14.199 9.291 -10.102 1.00 0.00 O ATOM 2098 OE2 GLU A 129 -13.979 7.556 -11.426 1.00 0.00 O ATOM 0 H GLU A 129 -16.390 7.717 -6.003 1.00 0.00 H new ATOM 0 HA GLU A 129 -17.916 6.937 -8.168 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -16.090 8.658 -8.109 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -14.901 7.375 -8.001 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -15.889 6.499 -10.226 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -16.713 8.042 -10.337 1.00 0.00 H new ATOM 2105 N CYS A 130 -15.532 4.770 -7.411 1.00 0.00 N ATOM 2106 CA CYS A 130 -15.047 3.413 -7.622 1.00 0.00 C ATOM 2107 C CYS A 130 -16.076 2.378 -7.158 1.00 0.00 C ATOM 2108 O CYS A 130 -16.302 1.370 -7.833 1.00 0.00 O ATOM 2109 CB CYS A 130 -13.723 3.218 -6.875 1.00 0.00 C ATOM 2110 SG CYS A 130 -12.438 4.408 -7.332 1.00 0.00 S ATOM 0 H CYS A 130 -14.985 5.308 -6.739 1.00 0.00 H new ATOM 0 HA CYS A 130 -14.886 3.266 -8.690 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -13.908 3.292 -5.803 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -13.355 2.210 -7.066 1.00 0.00 H new ATOM 0 HG CYS A 130 -11.324 4.093 -6.740 1.00 0.00 H new ATOM 2116 N LEU A 131 -16.706 2.637 -6.011 1.00 0.00 N ATOM 2117 CA LEU A 131 -17.686 1.709 -5.436 1.00 0.00 C ATOM 2118 C LEU A 131 -18.875 1.495 -6.372 1.00 0.00 C ATOM 2119 O LEU A 131 -19.408 0.387 -6.468 1.00 0.00 O ATOM 2120 CB LEU A 131 -18.174 2.210 -4.063 1.00 0.00 C ATOM 2121 CG LEU A 131 -17.422 1.639 -2.847 1.00 0.00 C ATOM 2122 CD1 LEU A 131 -15.922 1.873 -2.971 1.00 0.00 C ATOM 2123 CD2 LEU A 131 -17.960 2.243 -1.550 1.00 0.00 C ATOM 0 H LEU A 131 -16.556 3.482 -5.460 1.00 0.00 H new ATOM 0 HA LEU A 131 -17.185 0.750 -5.303 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -18.093 3.297 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -19.232 1.967 -3.962 1.00 0.00 H new ATOM 0 HG LEU A 131 -17.591 0.563 -2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -15.416 1.460 -2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -15.551 1.384 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -15.725 2.943 -3.032 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -17.416 1.827 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -17.828 3.325 -1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -19.020 2.008 -1.452 1.00 0.00 H new ATOM 2135 N LEU A 132 -19.292 2.556 -7.053 1.00 0.00 N ATOM 2136 CA LEU A 132 -20.440 2.486 -7.957 1.00 0.00 C ATOM 2137 C LEU A 132 -19.991 2.394 -9.417 1.00 0.00 C ATOM 2138 O LEU A 132 -20.824 2.404 -10.326 1.00 0.00 O ATOM 2139 CB LEU A 132 -21.348 3.707 -7.750 1.00 0.00 C ATOM 2140 CG LEU A 132 -21.930 3.860 -6.333 1.00 0.00 C ATOM 2141 CD1 LEU A 132 -22.777 5.126 -6.227 1.00 0.00 C ATOM 2142 CD2 LEU A 132 -22.748 2.627 -5.950 1.00 0.00 C ATOM 0 H LEU A 132 -18.854 3.476 -6.998 1.00 0.00 H new ATOM 0 HA LEU A 132 -21.002 1.582 -7.724 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -20.781 4.606 -7.991 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -22.173 3.650 -8.460 1.00 0.00 H new ATOM 0 HG LEU A 132 -21.100 3.950 -5.633 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -23.177 5.212 -5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -22.159 5.997 -6.448 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -23.600 5.074 -6.940 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -23.150 2.755 -4.945 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -23.569 2.501 -6.656 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -22.109 1.744 -5.975 1.00 0.00 H new ATOM 2154 N ALA A 133 -18.675 2.287 -9.619 1.00 0.00 N ATOM 2155 CA ALA A 133 -18.072 2.193 -10.954 1.00 0.00 C ATOM 2156 C ALA A 133 -18.263 3.493 -11.738 1.00 0.00 C ATOM 2157 O ALA A 133 -17.316 4.261 -11.931 1.00 0.00 O ATOM 2158 CB ALA A 133 -18.631 0.997 -11.728 1.00 0.00 C ATOM 0 H ALA A 133 -17.994 2.263 -8.860 1.00 0.00 H new ATOM 0 HA ALA A 133 -17.001 2.036 -10.825 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -18.167 0.952 -12.713 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -18.416 0.078 -11.183 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -19.710 1.108 -11.840 1.00 0.00 H new ATOM 2164 N GLU A 134 -19.493 3.738 -12.181 1.00 0.00 N ATOM 2165 CA GLU A 134 -19.832 4.958 -12.903 1.00 0.00 C ATOM 2166 C GLU A 134 -20.815 5.787 -12.078 1.00 0.00 C ATOM 2167 O GLU A 134 -22.028 5.556 -12.125 1.00 0.00 O ATOM 2168 CB GLU A 134 -20.441 4.627 -14.273 1.00 0.00 C ATOM 2169 CG GLU A 134 -19.548 3.763 -15.159 1.00 0.00 C ATOM 2170 CD GLU A 134 -20.151 3.534 -16.535 1.00 0.00 C ATOM 2171 OE1 GLU A 134 -21.080 2.705 -16.656 1.00 0.00 O ATOM 2172 OE2 GLU A 134 -19.721 4.201 -17.499 1.00 0.00 O ATOM 0 H GLU A 134 -20.278 3.100 -12.050 1.00 0.00 H new ATOM 0 HA GLU A 134 -18.921 5.534 -13.064 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -21.391 4.114 -14.122 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -20.661 5.558 -14.795 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -18.574 4.241 -15.266 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -19.379 2.802 -14.674 1.00 0.00 H new ATOM 2179 N ALA A 135 -20.283 6.721 -11.299 1.00 0.00 N ATOM 2180 CA ALA A 135 -21.094 7.590 -10.459 1.00 0.00 C ATOM 2181 C ALA A 135 -20.274 8.784 -9.999 1.00 0.00 C ATOM 2182 O ALA A 135 -19.119 8.634 -9.595 1.00 0.00 O ATOM 2183 CB ALA A 135 -21.643 6.827 -9.258 1.00 0.00 C ATOM 0 H ALA A 135 -19.280 6.896 -11.233 1.00 0.00 H new ATOM 0 HA ALA A 135 -21.939 7.947 -11.047 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -22.246 7.498 -8.645 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -22.261 5.999 -9.605 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -20.815 6.439 -8.664 1.00 0.00 H new ATOM 2189 N GLU A 136 -20.878 9.961 -10.091 1.00 0.00 N ATOM 2190 CA GLU A 136 -20.259 11.213 -9.659 1.00 0.00 C ATOM 2191 C GLU A 136 -19.012 11.535 -10.484 1.00 0.00 C ATOM 2192 O GLU A 136 -19.074 12.336 -11.416 1.00 0.00 O ATOM 2193 CB GLU A 136 -19.921 11.177 -8.158 1.00 0.00 C ATOM 2194 CG GLU A 136 -21.148 11.108 -7.257 1.00 0.00 C ATOM 2195 CD GLU A 136 -20.795 10.961 -5.784 1.00 0.00 C ATOM 2196 OE1 GLU A 136 -20.419 11.974 -5.149 1.00 0.00 O ATOM 2197 OE2 GLU A 136 -20.910 9.836 -5.252 1.00 0.00 O ATOM 0 H GLU A 136 -21.818 10.078 -10.470 1.00 0.00 H new ATOM 0 HA GLU A 136 -20.986 12.008 -9.826 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -19.285 10.315 -7.958 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -19.343 12.065 -7.903 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -21.744 12.010 -7.394 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -21.769 10.266 -7.562 1.00 0.00 H new TER 2204 GLU A 136