USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1033 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 113 GLN : amide:sc= -2.69! C(o=-1.6!,f=-5.6!) USER MOD Set 1.2: A 116 TYR OH : rot -177:sc= 1.07 USER MOD Set 2.1: A 114 MET CE :methyl 168:sc= -0.0571 (180deg=-0.295) USER MOD Set 2.2: A 115 GLN : amide:sc= 0.34 K(o=0.28,f=-0.29) USER MOD Set 3.1: A 102 THR OG1 : rot -72:sc= 2.09 USER MOD Set 3.2: A 104 SER OG : rot 77:sc= 1.46 USER MOD Set 4.1: A 89 ASN : amide:sc= -0.296 K(o=-0.59,f=-1.7) USER MOD Set 4.2: A 94 ASN : amide:sc= -0.298 X(o=-0.59,f=-0.45) USER MOD Set 5.1: A 59 ASN : amide:sc= 0.814 K(o=3.2,f=-7.3!) USER MOD Set 5.2: A 75 LYS NZ :NH3+ 153:sc= 2.35 (180deg=0.315) USER MOD Set 6.1: A 16 HIS : no HD1:sc= 0 X(o=0.041,f=0.019) USER MOD Set 6.2: A 54 THR OG1 : rot 180:sc= 0.0408 USER MOD Single : A 3 THR OG1 : rot -170:sc= 0.326 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc=-0.00982 K(o=-0.0098,f=-1.1) USER MOD Single : A 11 GLN :FLIP amide:sc= -0.251 F(o=-1.4,f=-0.25) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= 0.873 K(o=0.87,f=-6.5!) USER MOD Single : A 25 LYS NZ :NH3+ -106:sc= 1.32 (180deg=0.549) USER MOD Single : A 28 LYS NZ :NH3+ -165:sc= -0.0572 (180deg=-0.282) USER MOD Single : A 29 THR OG1 : rot 71:sc= 0.923 USER MOD Single : A 32 SER OG : rot 1:sc= 0.926 USER MOD Single : A 33 GLN :FLIP amide:sc= -0.0298 F(o=-1.6!,f=-0.03) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.732 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 96:sc= 1.26 USER MOD Single : A 51 ASN : amide:sc= 0.33 X(o=0.33,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0486 USER MOD Single : A 60 THR OG1 : rot 59:sc= 0.747 USER MOD Single : A 67 SER OG : rot 180:sc= -0.045 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-0.00028) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.26 K(o=-0.26,f=-0.81) USER MOD Single : A 82 CYS SG : rot 144:sc= 0.399 USER MOD Single : A 85 THR OG1 : rot 80:sc= 1.13 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 1.15 K(o=1.2,f=-0.11) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 MET CE :methyl -170:sc= -0.0237 (180deg=-0.193) USER MOD Single : A 106 ASN : amide:sc= 1.17 K(o=1.2,f=-0.21) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= -0.684 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.401 K(o=-0.4,f=-0.99) USER MOD Single : A 125 GLN : amide:sc= -0.575 X(o=-0.58,f=-0.42) USER MOD Single : A 129 THR OG1 : rot 120:sc= -0.089 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -170:sc= 0.00225 (180deg=-0.0528) USER MOD Single : A 138 LYS NZ :NH3+ -142:sc= 0.0954 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 4.135 11.824 1.383 1.00 0.00 N ATOM 2 CA PRO A 1 4.525 11.052 2.566 1.00 0.00 C ATOM 3 C PRO A 1 6.026 11.152 2.787 1.00 0.00 C ATOM 4 O PRO A 1 6.493 11.637 3.812 1.00 0.00 O ATOM 5 CB PRO A 1 4.122 9.610 2.345 1.00 0.00 C ATOM 6 CG PRO A 1 3.141 9.696 1.224 1.00 0.00 C ATOM 7 CD PRO A 1 3.531 10.911 0.405 1.00 0.00 C ATOM 0 H2 PRO A 1 4.949 12.287 0.979 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.472 12.555 1.640 1.00 0.00 H new ATOM 0 HA PRO A 1 4.027 11.447 3.451 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.978 8.989 2.083 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.674 9.176 3.239 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.167 8.792 0.615 1.00 0.00 H new ATOM 0 HG3 PRO A 1 2.124 9.794 1.605 1.00 0.00 H new ATOM 0 HD2 PRO A 1 4.236 10.650 -0.385 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.664 11.361 -0.078 1.00 0.00 H new ATOM 17 N VAL A 2 6.765 10.633 1.869 1.00 0.00 N ATOM 18 CA VAL A 2 8.188 10.792 1.892 1.00 0.00 C ATOM 19 C VAL A 2 8.530 11.818 0.853 1.00 0.00 C ATOM 20 O VAL A 2 7.931 11.812 -0.225 1.00 0.00 O ATOM 21 CB VAL A 2 8.899 9.426 1.619 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.397 9.582 1.475 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.610 8.474 2.758 1.00 0.00 C ATOM 0 H VAL A 2 6.409 10.089 1.083 1.00 0.00 H new ATOM 0 HA VAL A 2 8.533 11.125 2.871 1.00 0.00 H new ATOM 0 HB VAL A 2 8.510 9.034 0.679 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.848 8.608 1.287 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.615 10.250 0.642 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.809 10.001 2.393 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.105 7.521 2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.982 8.898 3.690 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.534 8.315 2.836 1.00 0.00 H new ATOM 33 N THR A 3 9.426 12.717 1.163 1.00 0.00 N ATOM 34 CA THR A 3 9.833 13.696 0.215 1.00 0.00 C ATOM 35 C THR A 3 11.003 13.109 -0.474 1.00 0.00 C ATOM 36 O THR A 3 11.706 12.285 0.140 1.00 0.00 O ATOM 37 CB THR A 3 10.238 14.998 0.916 1.00 0.00 C ATOM 38 OG1 THR A 3 11.307 14.731 1.861 1.00 0.00 O ATOM 39 CG2 THR A 3 9.062 15.570 1.664 1.00 0.00 C ATOM 0 H THR A 3 9.885 12.784 2.072 1.00 0.00 H new ATOM 0 HA THR A 3 9.026 13.943 -0.475 1.00 0.00 H new ATOM 0 HB THR A 3 10.574 15.711 0.163 1.00 0.00 H new ATOM 0 HG1 THR A 3 11.457 15.523 2.418 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.360 16.495 2.158 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.252 15.777 0.965 1.00 0.00 H new ATOM 0 HG23 THR A 3 8.722 14.853 2.411 1.00 0.00 H new ATOM 47 N GLU A 4 11.229 13.464 -1.714 1.00 0.00 N ATOM 48 CA GLU A 4 12.239 12.799 -2.467 1.00 0.00 C ATOM 49 C GLU A 4 12.936 13.697 -3.472 1.00 0.00 C ATOM 50 O GLU A 4 12.584 14.872 -3.648 1.00 0.00 O ATOM 51 CB GLU A 4 11.629 11.617 -3.165 1.00 0.00 C ATOM 52 CG GLU A 4 10.709 11.969 -4.345 1.00 0.00 C ATOM 53 CD GLU A 4 9.389 12.644 -3.990 1.00 0.00 C ATOM 54 OE1 GLU A 4 9.353 13.900 -3.884 1.00 0.00 O ATOM 55 OE2 GLU A 4 8.358 11.959 -3.866 1.00 0.00 O ATOM 0 H GLU A 4 10.729 14.202 -2.211 1.00 0.00 H new ATOM 0 HA GLU A 4 13.009 12.480 -1.764 1.00 0.00 H new ATOM 0 HB2 GLU A 4 12.431 10.973 -3.527 1.00 0.00 H new ATOM 0 HB3 GLU A 4 11.059 11.038 -2.438 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.257 12.623 -5.024 1.00 0.00 H new ATOM 0 HG3 GLU A 4 10.489 11.053 -4.893 1.00 0.00 H new ATOM 62 N THR A 5 13.905 13.122 -4.103 1.00 0.00 N ATOM 63 CA THR A 5 14.729 13.752 -5.072 1.00 0.00 C ATOM 64 C THR A 5 15.504 12.611 -5.698 1.00 0.00 C ATOM 65 O THR A 5 15.352 11.454 -5.236 1.00 0.00 O ATOM 66 CB THR A 5 15.724 14.746 -4.358 1.00 0.00 C ATOM 67 OG1 THR A 5 16.472 15.523 -5.312 1.00 0.00 O ATOM 68 CG2 THR A 5 16.712 13.977 -3.479 1.00 0.00 C ATOM 0 H THR A 5 14.154 12.146 -3.945 1.00 0.00 H new ATOM 0 HA THR A 5 14.160 14.326 -5.803 1.00 0.00 H new ATOM 0 HB THR A 5 15.120 15.417 -3.747 1.00 0.00 H new ATOM 0 HG1 THR A 5 17.078 16.130 -4.837 1.00 0.00 H new ATOM 0 HG21 THR A 5 17.391 14.679 -2.994 1.00 0.00 H new ATOM 0 HG22 THR A 5 16.165 13.418 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.285 13.285 -4.096 1.00 0.00 H new ATOM 76 N VAL A 6 16.323 12.892 -6.670 1.00 0.00 N ATOM 77 CA VAL A 6 17.189 11.902 -7.240 1.00 0.00 C ATOM 78 C VAL A 6 18.588 12.438 -7.226 1.00 0.00 C ATOM 79 O VAL A 6 18.883 13.449 -7.868 1.00 0.00 O ATOM 80 CB VAL A 6 16.773 11.490 -8.689 1.00 0.00 C ATOM 81 CG1 VAL A 6 17.698 10.420 -9.248 1.00 0.00 C ATOM 82 CG2 VAL A 6 15.323 11.020 -8.734 1.00 0.00 C ATOM 0 H VAL A 6 16.409 13.817 -7.091 1.00 0.00 H new ATOM 0 HA VAL A 6 17.116 10.996 -6.639 1.00 0.00 H new ATOM 0 HB VAL A 6 16.864 12.376 -9.317 1.00 0.00 H new ATOM 0 HG11 VAL A 6 17.381 10.156 -10.257 1.00 0.00 H new ATOM 0 HG12 VAL A 6 18.719 10.800 -9.276 1.00 0.00 H new ATOM 0 HG13 VAL A 6 17.658 9.536 -8.612 1.00 0.00 H new ATOM 0 HG21 VAL A 6 15.063 10.740 -9.755 1.00 0.00 H new ATOM 0 HG22 VAL A 6 15.199 10.158 -8.079 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.669 11.826 -8.401 1.00 0.00 H new ATOM 92 N ASP A 7 19.447 11.800 -6.450 1.00 0.00 N ATOM 93 CA ASP A 7 20.834 12.231 -6.367 1.00 0.00 C ATOM 94 C ASP A 7 21.510 11.900 -7.699 1.00 0.00 C ATOM 95 O ASP A 7 20.952 11.126 -8.476 1.00 0.00 O ATOM 96 CB ASP A 7 21.532 11.508 -5.220 1.00 0.00 C ATOM 97 CG ASP A 7 22.821 12.148 -4.804 1.00 0.00 C ATOM 98 OD1 ASP A 7 22.799 13.131 -4.047 1.00 0.00 O ATOM 99 OD2 ASP A 7 23.869 11.682 -5.210 1.00 0.00 O ATOM 0 H ASP A 7 19.214 10.991 -5.874 1.00 0.00 H new ATOM 0 HA ASP A 7 20.892 13.303 -6.176 1.00 0.00 H new ATOM 0 HB2 ASP A 7 20.861 11.472 -4.362 1.00 0.00 H new ATOM 0 HB3 ASP A 7 21.727 10.477 -5.516 1.00 0.00 H new ATOM 104 N GLY A 8 22.699 12.431 -7.942 1.00 0.00 N ATOM 105 CA GLY A 8 23.376 12.257 -9.232 1.00 0.00 C ATOM 106 C GLY A 8 23.603 10.817 -9.616 1.00 0.00 C ATOM 107 O GLY A 8 23.596 10.481 -10.796 1.00 0.00 O ATOM 0 H GLY A 8 23.221 12.988 -7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 8 22.784 12.741 -10.009 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.338 12.769 -9.198 1.00 0.00 H new ATOM 111 N GLN A 9 23.750 9.965 -8.627 1.00 0.00 N ATOM 112 CA GLN A 9 23.963 8.555 -8.858 1.00 0.00 C ATOM 113 C GLN A 9 22.634 7.789 -9.060 1.00 0.00 C ATOM 114 O GLN A 9 22.612 6.553 -9.074 1.00 0.00 O ATOM 115 CB GLN A 9 24.790 7.959 -7.713 1.00 0.00 C ATOM 116 CG GLN A 9 24.168 8.056 -6.327 1.00 0.00 C ATOM 117 CD GLN A 9 25.119 7.560 -5.262 1.00 0.00 C ATOM 118 OE1 GLN A 9 26.338 7.686 -5.401 1.00 0.00 O ATOM 119 NE2 GLN A 9 24.595 7.002 -4.210 1.00 0.00 N ATOM 0 H GLN A 9 23.725 10.229 -7.642 1.00 0.00 H new ATOM 0 HA GLN A 9 24.522 8.445 -9.787 1.00 0.00 H new ATOM 0 HB2 GLN A 9 24.977 6.908 -7.934 1.00 0.00 H new ATOM 0 HB3 GLN A 9 25.759 8.458 -7.692 1.00 0.00 H new ATOM 0 HG2 GLN A 9 23.895 9.091 -6.120 1.00 0.00 H new ATOM 0 HG3 GLN A 9 23.248 7.472 -6.297 1.00 0.00 H new ATOM 0 HE21 GLN A 9 23.582 6.915 -4.130 1.00 0.00 H new ATOM 0 HE22 GLN A 9 25.197 6.651 -3.465 1.00 0.00 H new ATOM 128 N GLY A 10 21.545 8.531 -9.239 1.00 0.00 N ATOM 129 CA GLY A 10 20.233 7.944 -9.437 1.00 0.00 C ATOM 130 C GLY A 10 19.669 7.409 -8.158 1.00 0.00 C ATOM 131 O GLY A 10 19.330 6.237 -8.054 1.00 0.00 O ATOM 0 H GLY A 10 21.552 9.551 -9.250 1.00 0.00 H new ATOM 0 HA2 GLY A 10 19.557 8.694 -9.848 1.00 0.00 H new ATOM 0 HA3 GLY A 10 20.301 7.140 -10.170 1.00 0.00 H new ATOM 135 N GLN A 11 19.567 8.277 -7.195 1.00 0.00 N ATOM 136 CA GLN A 11 19.084 7.929 -5.888 1.00 0.00 C ATOM 137 C GLN A 11 17.771 8.570 -5.605 1.00 0.00 C ATOM 138 O GLN A 11 17.705 9.759 -5.549 1.00 0.00 O ATOM 139 CB GLN A 11 20.041 8.409 -4.863 1.00 0.00 C ATOM 140 CG GLN A 11 20.800 7.338 -4.223 1.00 0.00 C ATOM 141 CD GLN A 11 19.910 6.380 -3.480 1.00 0.00 C ATOM 142 OE1 GLN A 11 18.846 6.882 -2.920 1.00 0.00 O flip ATOM 143 NE2 GLN A 11 20.201 5.207 -3.384 1.00 0.00 N flip ATOM 0 H GLN A 11 19.820 9.260 -7.295 1.00 0.00 H new ATOM 0 HA GLN A 11 18.976 6.845 -5.857 1.00 0.00 H new ATOM 0 HB2 GLN A 11 20.737 9.108 -5.327 1.00 0.00 H new ATOM 0 HB3 GLN A 11 19.495 8.962 -4.099 1.00 0.00 H new ATOM 0 HG2 GLN A 11 21.366 6.794 -4.979 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.524 7.770 -3.532 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.043 4.852 -3.837 1.00 0.00 H new ATOM 0 HE22 GLN A 11 19.604 4.575 -2.850 1.00 0.00 H new ATOM 152 N ALA A 12 16.787 7.787 -5.323 1.00 0.00 N ATOM 153 CA ALA A 12 15.474 8.317 -5.052 1.00 0.00 C ATOM 154 C ALA A 12 15.246 8.292 -3.556 1.00 0.00 C ATOM 155 O ALA A 12 14.936 7.255 -2.979 1.00 0.00 O ATOM 156 CB ALA A 12 14.383 7.568 -5.825 1.00 0.00 C ATOM 0 H ALA A 12 16.857 6.771 -5.271 1.00 0.00 H new ATOM 0 HA ALA A 12 15.417 9.348 -5.402 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.410 8.000 -5.591 1.00 0.00 H new ATOM 0 HB2 ALA A 12 14.571 7.654 -6.895 1.00 0.00 H new ATOM 0 HB3 ALA A 12 14.391 6.516 -5.539 1.00 0.00 H new ATOM 162 N TRP A 13 15.447 9.413 -2.932 1.00 0.00 N ATOM 163 CA TRP A 13 15.424 9.488 -1.480 1.00 0.00 C ATOM 164 C TRP A 13 15.176 10.879 -0.998 1.00 0.00 C ATOM 165 O TRP A 13 15.108 11.801 -1.804 1.00 0.00 O ATOM 166 CB TRP A 13 16.772 9.015 -0.900 1.00 0.00 C ATOM 167 CG TRP A 13 17.997 9.785 -1.398 1.00 0.00 C ATOM 168 CD1 TRP A 13 18.030 10.858 -2.256 1.00 0.00 C ATOM 169 CD2 TRP A 13 19.358 9.529 -1.051 1.00 0.00 C ATOM 170 NE1 TRP A 13 19.307 11.229 -2.497 1.00 0.00 N ATOM 171 CE2 TRP A 13 20.149 10.450 -1.761 1.00 0.00 C ATOM 172 CE3 TRP A 13 19.983 8.600 -0.219 1.00 0.00 C ATOM 173 CZ2 TRP A 13 21.534 10.474 -1.662 1.00 0.00 C ATOM 174 CZ3 TRP A 13 21.355 8.627 -0.119 1.00 0.00 C ATOM 175 CH2 TRP A 13 22.118 9.557 -0.839 1.00 0.00 C ATOM 0 H TRP A 13 15.631 10.301 -3.399 1.00 0.00 H new ATOM 0 HA TRP A 13 14.611 8.844 -1.144 1.00 0.00 H new ATOM 0 HB2 TRP A 13 16.730 9.093 0.186 1.00 0.00 H new ATOM 0 HB3 TRP A 13 16.903 7.960 -1.139 1.00 0.00 H new ATOM 0 HD1 TRP A 13 17.159 11.337 -2.678 1.00 0.00 H new ATOM 0 HE1 TRP A 13 19.595 11.975 -3.130 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.403 7.876 0.334 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 22.125 11.190 -2.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 21.853 7.919 0.526 1.00 0.00 H new ATOM 0 HH2 TRP A 13 23.193 9.547 -0.739 1.00 0.00 H new ATOM 186 N ARG A 14 14.949 10.965 0.302 1.00 0.00 N ATOM 187 CA ARG A 14 14.895 12.162 1.127 1.00 0.00 C ATOM 188 C ARG A 14 14.434 11.836 2.512 1.00 0.00 C ATOM 189 O ARG A 14 14.993 10.977 3.148 1.00 0.00 O ATOM 190 CB ARG A 14 14.226 13.409 0.577 1.00 0.00 C ATOM 191 CG ARG A 14 15.107 14.340 -0.196 1.00 0.00 C ATOM 192 CD ARG A 14 14.248 15.285 -0.984 1.00 0.00 C ATOM 193 NE ARG A 14 13.308 15.978 -0.127 1.00 0.00 N ATOM 194 CZ ARG A 14 13.125 17.313 -0.079 1.00 0.00 C ATOM 195 NH1 ARG A 14 13.745 18.105 -0.950 1.00 0.00 N ATOM 196 NH2 ARG A 14 12.309 17.844 0.826 1.00 0.00 N ATOM 0 H ARG A 14 14.783 10.125 0.856 1.00 0.00 H new ATOM 0 HA ARG A 14 15.937 12.483 1.132 1.00 0.00 H new ATOM 0 HB2 ARG A 14 13.402 13.101 -0.067 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.790 13.961 1.410 1.00 0.00 H new ATOM 0 HG2 ARG A 14 15.754 14.896 0.482 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.757 13.775 -0.865 1.00 0.00 H new ATOM 0 HD2 ARG A 14 14.878 16.011 -1.498 1.00 0.00 H new ATOM 0 HD3 ARG A 14 13.706 14.733 -1.752 1.00 0.00 H new ATOM 0 HE ARG A 14 12.735 15.407 0.494 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.361 17.703 -1.657 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.604 19.115 -0.911 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.819 17.241 1.487 1.00 0.00 H new ATOM 0 HH22 ARG A 14 12.173 18.854 0.860 1.00 0.00 H new ATOM 210 N HIS A 15 13.361 12.456 2.939 1.00 0.00 N ATOM 211 CA HIS A 15 12.971 12.407 4.352 1.00 0.00 C ATOM 212 C HIS A 15 11.631 11.767 4.526 1.00 0.00 C ATOM 213 O HIS A 15 10.787 11.848 3.633 1.00 0.00 O ATOM 214 CB HIS A 15 12.928 13.825 4.960 1.00 0.00 C ATOM 215 CG HIS A 15 14.265 14.494 5.145 1.00 0.00 C ATOM 216 ND1 HIS A 15 14.774 14.834 6.379 1.00 0.00 N ATOM 217 CD2 HIS A 15 15.171 14.927 4.247 1.00 0.00 C ATOM 218 CE1 HIS A 15 15.925 15.444 6.226 1.00 0.00 C ATOM 219 NE2 HIS A 15 16.189 15.512 4.946 1.00 0.00 N ATOM 0 H HIS A 15 12.737 13.001 2.343 1.00 0.00 H new ATOM 0 HA HIS A 15 13.722 11.809 4.869 1.00 0.00 H new ATOM 0 HB2 HIS A 15 12.311 14.457 4.321 1.00 0.00 H new ATOM 0 HB3 HIS A 15 12.432 13.771 5.929 1.00 0.00 H new ATOM 0 HD2 HIS A 15 15.105 14.830 3.173 1.00 0.00 H new ATOM 0 HE1 HIS A 15 16.549 15.825 7.021 1.00 0.00 H new ATOM 0 HE2 HIS A 15 17.022 15.934 4.536 1.00 0.00 H new ATOM 228 N HIS A 16 11.399 11.173 5.678 1.00 0.00 N ATOM 229 CA HIS A 16 10.110 10.589 5.960 1.00 0.00 C ATOM 230 C HIS A 16 9.365 11.692 6.613 1.00 0.00 C ATOM 231 O HIS A 16 9.784 12.191 7.657 1.00 0.00 O ATOM 232 CB HIS A 16 10.235 9.383 6.917 1.00 0.00 C ATOM 233 CG HIS A 16 8.932 8.676 7.198 1.00 0.00 C ATOM 234 ND1 HIS A 16 8.245 8.808 8.381 1.00 0.00 N ATOM 235 CD2 HIS A 16 8.210 7.807 6.445 1.00 0.00 C ATOM 236 CE1 HIS A 16 7.169 8.062 8.354 1.00 0.00 C ATOM 237 NE2 HIS A 16 7.117 7.438 7.188 1.00 0.00 N ATOM 0 H HIS A 16 12.084 11.083 6.429 1.00 0.00 H new ATOM 0 HA HIS A 16 9.621 10.208 5.064 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.939 8.668 6.491 1.00 0.00 H new ATOM 0 HB3 HIS A 16 10.660 9.725 7.861 1.00 0.00 H new ATOM 0 HD2 HIS A 16 8.451 7.469 5.448 1.00 0.00 H new ATOM 0 HE1 HIS A 16 6.445 7.971 9.150 1.00 0.00 H new ATOM 0 HE2 HIS A 16 6.387 6.791 6.891 1.00 0.00 H new ATOM 246 N ASN A 17 8.294 12.087 6.054 1.00 0.00 N ATOM 247 CA ASN A 17 7.611 13.245 6.510 1.00 0.00 C ATOM 248 C ASN A 17 6.164 12.879 6.762 1.00 0.00 C ATOM 249 O ASN A 17 5.827 11.689 6.828 1.00 0.00 O ATOM 250 CB ASN A 17 7.777 14.323 5.408 1.00 0.00 C ATOM 251 CG ASN A 17 7.652 15.759 5.872 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.897 16.088 6.787 1.00 0.00 O ATOM 253 ND2 ASN A 17 8.436 16.614 5.264 1.00 0.00 N ATOM 0 H ASN A 17 7.855 11.619 5.261 1.00 0.00 H new ATOM 0 HA ASN A 17 8.009 13.637 7.446 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.755 14.194 4.943 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.030 14.144 4.634 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.436 17.595 5.544 1.00 0.00 H new ATOM 0 HD22 ASN A 17 9.047 16.299 4.510 1.00 0.00 H new ATOM 260 N GLY A 18 5.334 13.868 6.943 1.00 0.00 N ATOM 261 CA GLY A 18 3.939 13.644 7.175 1.00 0.00 C ATOM 262 C GLY A 18 3.243 13.135 5.931 1.00 0.00 C ATOM 263 O GLY A 18 3.699 13.368 4.808 1.00 0.00 O ATOM 0 H GLY A 18 5.608 14.851 6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.815 12.923 7.983 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.470 14.572 7.501 1.00 0.00 H new ATOM 267 N PHE A 19 2.170 12.440 6.127 1.00 0.00 N ATOM 268 CA PHE A 19 1.406 11.880 5.046 1.00 0.00 C ATOM 269 C PHE A 19 0.427 12.912 4.575 1.00 0.00 C ATOM 270 O PHE A 19 -0.146 13.643 5.396 1.00 0.00 O ATOM 271 CB PHE A 19 0.704 10.603 5.510 1.00 0.00 C ATOM 272 CG PHE A 19 1.679 9.546 5.938 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.181 8.656 5.021 1.00 0.00 C ATOM 274 CD2 PHE A 19 2.127 9.466 7.255 1.00 0.00 C ATOM 275 CE1 PHE A 19 3.110 7.707 5.390 1.00 0.00 C ATOM 276 CE2 PHE A 19 3.051 8.511 7.630 1.00 0.00 C ATOM 277 CZ PHE A 19 3.545 7.632 6.691 1.00 0.00 C ATOM 0 H PHE A 19 1.790 12.239 7.052 1.00 0.00 H new ATOM 0 HA PHE A 19 2.057 11.607 4.215 1.00 0.00 H new ATOM 0 HB2 PHE A 19 0.037 10.838 6.340 1.00 0.00 H new ATOM 0 HB3 PHE A 19 0.083 10.217 4.701 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.843 8.700 3.996 1.00 0.00 H new ATOM 0 HD2 PHE A 19 1.747 10.159 7.991 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.498 7.019 4.653 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.385 8.453 8.655 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.272 6.886 6.977 1.00 0.00 H new ATOM 287 N ASP A 20 0.244 13.023 3.275 1.00 0.00 N ATOM 288 CA ASP A 20 -0.621 14.033 2.719 1.00 0.00 C ATOM 289 C ASP A 20 -2.026 13.553 2.874 1.00 0.00 C ATOM 290 O ASP A 20 -2.433 12.580 2.218 1.00 0.00 O ATOM 291 CB ASP A 20 -0.306 14.228 1.229 1.00 0.00 C ATOM 292 CG ASP A 20 1.152 14.517 0.968 1.00 0.00 C ATOM 293 OD1 ASP A 20 1.558 15.701 0.995 1.00 0.00 O ATOM 294 OD2 ASP A 20 1.932 13.554 0.749 1.00 0.00 O ATOM 0 H ASP A 20 0.688 12.420 2.583 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.477 14.985 3.230 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.597 13.332 0.681 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.909 15.049 0.840 1.00 0.00 H new ATOM 299 N PHE A 21 -2.763 14.203 3.735 1.00 0.00 N ATOM 300 CA PHE A 21 -4.078 13.763 4.073 1.00 0.00 C ATOM 301 C PHE A 21 -5.038 13.906 2.908 1.00 0.00 C ATOM 302 O PHE A 21 -5.952 13.132 2.789 1.00 0.00 O ATOM 303 CB PHE A 21 -4.600 14.449 5.340 1.00 0.00 C ATOM 304 CG PHE A 21 -5.856 13.810 5.852 1.00 0.00 C ATOM 305 CD1 PHE A 21 -5.832 12.500 6.272 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.056 14.501 5.893 1.00 0.00 C ATOM 307 CE1 PHE A 21 -6.968 11.879 6.727 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.209 13.886 6.354 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.165 12.570 6.771 1.00 0.00 C ATOM 0 H PHE A 21 -2.464 15.050 4.218 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.012 12.698 4.296 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.833 14.411 6.114 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.789 15.502 5.130 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.903 11.951 6.243 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.093 15.529 5.563 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.927 10.850 7.051 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.139 14.434 6.387 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.060 12.084 7.129 1.00 0.00 H new ATOM 319 N ALA A 22 -4.790 14.876 2.047 1.00 0.00 N ATOM 320 CA ALA A 22 -5.582 15.126 0.839 1.00 0.00 C ATOM 321 C ALA A 22 -5.944 13.848 0.059 1.00 0.00 C ATOM 322 O ALA A 22 -7.106 13.651 -0.285 1.00 0.00 O ATOM 323 CB ALA A 22 -4.875 16.112 -0.075 1.00 0.00 C ATOM 0 H ALA A 22 -4.017 15.531 2.164 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.522 15.554 1.186 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.481 16.282 -0.965 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.729 17.056 0.451 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -3.906 15.707 -0.368 1.00 0.00 H new ATOM 329 N VAL A 23 -4.977 12.956 -0.160 1.00 0.00 N ATOM 330 CA VAL A 23 -5.243 11.753 -0.951 1.00 0.00 C ATOM 331 C VAL A 23 -6.044 10.715 -0.129 1.00 0.00 C ATOM 332 O VAL A 23 -6.907 10.004 -0.658 1.00 0.00 O ATOM 333 CB VAL A 23 -3.931 11.123 -1.552 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.047 10.450 -0.503 1.00 0.00 C ATOM 335 CG2 VAL A 23 -4.260 10.183 -2.711 1.00 0.00 C ATOM 0 H VAL A 23 -4.023 13.039 0.190 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.855 12.060 -1.799 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.338 11.950 -1.943 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.161 10.037 -0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.745 11.184 0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.604 9.648 -0.019 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.338 9.760 -3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.904 9.379 -2.356 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.773 10.739 -3.496 1.00 0.00 H new ATOM 345 N ILE A 24 -5.795 10.697 1.177 1.00 0.00 N ATOM 346 CA ILE A 24 -6.473 9.795 2.107 1.00 0.00 C ATOM 347 C ILE A 24 -7.940 10.225 2.199 1.00 0.00 C ATOM 348 O ILE A 24 -8.860 9.417 2.145 1.00 0.00 O ATOM 349 CB ILE A 24 -5.828 9.893 3.542 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.304 9.653 3.472 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.494 8.920 4.522 1.00 0.00 C ATOM 352 CD1 ILE A 24 -3.582 9.698 4.815 1.00 0.00 C ATOM 0 H ILE A 24 -5.114 11.311 1.624 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.382 8.769 1.750 1.00 0.00 H new ATOM 0 HB ILE A 24 -5.998 10.902 3.917 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.125 8.681 3.013 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -3.863 10.402 2.814 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.026 9.013 5.502 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.555 9.155 4.603 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.375 7.899 4.159 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -2.518 9.518 4.662 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -3.723 10.678 5.271 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -3.989 8.930 5.473 1.00 0.00 H new ATOM 364 N LYS A 25 -8.097 11.514 2.274 1.00 0.00 N ATOM 365 CA LYS A 25 -9.354 12.206 2.410 1.00 0.00 C ATOM 366 C LYS A 25 -10.249 11.943 1.202 1.00 0.00 C ATOM 367 O LYS A 25 -11.422 11.618 1.356 1.00 0.00 O ATOM 368 CB LYS A 25 -9.029 13.693 2.567 1.00 0.00 C ATOM 369 CG LYS A 25 -10.188 14.639 2.758 1.00 0.00 C ATOM 370 CD LYS A 25 -9.653 16.055 2.969 1.00 0.00 C ATOM 371 CE LYS A 25 -9.102 16.677 1.693 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.153 16.984 0.703 1.00 0.00 N ATOM 0 H LYS A 25 -7.303 12.154 2.240 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.907 11.851 3.280 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.360 13.803 3.420 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.475 14.012 1.684 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.843 14.611 1.887 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.786 14.332 3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.452 16.686 3.359 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.868 16.032 3.725 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.567 17.593 1.943 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.377 15.996 1.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.111 16.294 -0.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.086 16.934 1.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.004 17.941 0.324 1.00 0.00 H new ATOM 386 N GLU A 26 -9.683 12.046 0.003 1.00 0.00 N ATOM 387 CA GLU A 26 -10.455 11.793 -1.210 1.00 0.00 C ATOM 388 C GLU A 26 -10.875 10.335 -1.308 1.00 0.00 C ATOM 389 O GLU A 26 -11.979 10.029 -1.778 1.00 0.00 O ATOM 390 CB GLU A 26 -9.700 12.209 -2.479 1.00 0.00 C ATOM 391 CG GLU A 26 -9.357 13.688 -2.545 1.00 0.00 C ATOM 392 CD GLU A 26 -10.540 14.564 -2.238 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.437 14.701 -3.093 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.595 15.126 -1.128 1.00 0.00 O ATOM 0 H GLU A 26 -8.707 12.299 -0.155 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.350 12.411 -1.137 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -8.778 11.631 -2.546 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.303 11.949 -3.349 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.555 13.904 -1.839 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.980 13.927 -3.539 1.00 0.00 H new ATOM 401 N LEU A 27 -10.000 9.441 -0.874 1.00 0.00 N ATOM 402 CA LEU A 27 -10.313 8.022 -0.911 1.00 0.00 C ATOM 403 C LEU A 27 -11.400 7.704 0.119 1.00 0.00 C ATOM 404 O LEU A 27 -12.293 6.919 -0.142 1.00 0.00 O ATOM 405 CB LEU A 27 -9.062 7.161 -0.691 1.00 0.00 C ATOM 406 CG LEU A 27 -9.215 5.650 -0.923 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.849 5.378 -2.265 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.854 4.996 -0.855 1.00 0.00 C ATOM 0 H LEU A 27 -9.080 9.669 -0.497 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.691 7.777 -1.904 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.276 7.529 -1.350 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.718 7.315 0.332 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.862 5.237 -0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.948 4.302 -2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.835 5.841 -2.302 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.223 5.794 -3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.957 3.923 -1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.208 5.420 -1.623 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.414 5.172 0.127 1.00 0.00 H new ATOM 420 N LYS A 28 -11.319 8.357 1.266 1.00 0.00 N ATOM 421 CA LYS A 28 -12.304 8.229 2.325 1.00 0.00 C ATOM 422 C LYS A 28 -13.685 8.731 1.838 1.00 0.00 C ATOM 423 O LYS A 28 -14.730 8.104 2.088 1.00 0.00 O ATOM 424 CB LYS A 28 -11.808 9.015 3.543 1.00 0.00 C ATOM 425 CG LYS A 28 -12.736 9.036 4.734 1.00 0.00 C ATOM 426 CD LYS A 28 -12.089 9.801 5.880 1.00 0.00 C ATOM 427 CE LYS A 28 -13.032 9.997 7.052 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.219 10.793 6.686 1.00 0.00 N ATOM 0 H LYS A 28 -10.558 8.998 1.490 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.428 7.183 2.606 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.853 8.595 3.858 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -11.619 10.043 3.236 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.682 9.504 4.461 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -12.963 8.017 5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.203 9.264 6.217 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -11.754 10.774 5.520 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.351 9.024 7.426 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.501 10.493 7.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.700 11.116 7.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.925 11.617 6.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.871 10.207 6.126 1.00 0.00 H new ATOM 442 N THR A 29 -13.673 9.841 1.131 1.00 0.00 N ATOM 443 CA THR A 29 -14.877 10.377 0.551 1.00 0.00 C ATOM 444 C THR A 29 -15.443 9.397 -0.491 1.00 0.00 C ATOM 445 O THR A 29 -16.630 9.029 -0.425 1.00 0.00 O ATOM 446 CB THR A 29 -14.634 11.771 -0.064 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.054 12.626 0.945 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.944 12.385 -0.544 1.00 0.00 C ATOM 0 H THR A 29 -12.834 10.390 0.945 1.00 0.00 H new ATOM 0 HA THR A 29 -15.614 10.502 1.344 1.00 0.00 H new ATOM 0 HB THR A 29 -13.963 11.671 -0.917 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.134 12.341 1.126 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.749 13.368 -0.974 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.392 11.740 -1.300 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.628 12.487 0.298 1.00 0.00 H new ATOM 456 N ALA A 30 -14.583 8.911 -1.395 1.00 0.00 N ATOM 457 CA ALA A 30 -14.981 7.959 -2.396 1.00 0.00 C ATOM 458 C ALA A 30 -15.533 6.704 -1.739 1.00 0.00 C ATOM 459 O ALA A 30 -16.456 6.121 -2.214 1.00 0.00 O ATOM 460 CB ALA A 30 -13.808 7.621 -3.297 1.00 0.00 C ATOM 0 H ALA A 30 -13.599 9.176 -1.439 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.767 8.401 -3.008 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.124 6.899 -4.050 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.454 8.527 -3.789 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.002 7.194 -2.700 1.00 0.00 H new ATOM 466 N ALA A 31 -14.935 6.300 -0.675 1.00 0.00 N ATOM 467 CA ALA A 31 -15.375 5.155 0.097 1.00 0.00 C ATOM 468 C ALA A 31 -16.859 5.273 0.505 1.00 0.00 C ATOM 469 O ALA A 31 -17.625 4.308 0.367 1.00 0.00 O ATOM 470 CB ALA A 31 -14.555 5.085 1.332 1.00 0.00 C ATOM 0 H ALA A 31 -14.106 6.756 -0.295 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.260 4.262 -0.518 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.869 4.229 1.929 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.504 4.975 1.065 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.689 6.000 1.910 1.00 0.00 H new ATOM 476 N SER A 32 -17.250 6.437 0.995 1.00 0.00 N ATOM 477 CA SER A 32 -18.616 6.658 1.454 1.00 0.00 C ATOM 478 C SER A 32 -19.589 6.950 0.292 1.00 0.00 C ATOM 479 O SER A 32 -20.767 6.605 0.344 1.00 0.00 O ATOM 480 CB SER A 32 -18.636 7.806 2.478 1.00 0.00 C ATOM 481 OG SER A 32 -18.021 8.988 1.952 1.00 0.00 O ATOM 0 H SER A 32 -16.639 7.249 1.087 1.00 0.00 H new ATOM 0 HA SER A 32 -18.961 5.738 1.926 1.00 0.00 H new ATOM 0 HB2 SER A 32 -19.666 8.025 2.761 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.116 7.496 3.384 1.00 0.00 H new ATOM 0 HG SER A 32 -17.721 8.820 1.034 1.00 0.00 H new ATOM 487 N GLN A 33 -19.079 7.557 -0.750 1.00 0.00 N ATOM 488 CA GLN A 33 -19.877 8.020 -1.874 1.00 0.00 C ATOM 489 C GLN A 33 -19.974 6.983 -2.982 1.00 0.00 C ATOM 490 O GLN A 33 -21.050 6.572 -3.401 1.00 0.00 O ATOM 491 CB GLN A 33 -19.214 9.278 -2.423 1.00 0.00 C ATOM 492 CG GLN A 33 -19.260 10.458 -1.486 1.00 0.00 C ATOM 493 CD GLN A 33 -20.646 11.018 -1.340 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.366 11.032 -2.417 1.00 0.00 O flip ATOM 495 NE2 GLN A 33 -21.032 11.510 -0.272 1.00 0.00 N flip ATOM 0 H GLN A 33 -18.082 7.750 -0.850 1.00 0.00 H new ATOM 0 HA GLN A 33 -20.892 8.213 -1.526 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.173 9.054 -2.657 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.700 9.552 -3.359 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -18.888 10.156 -0.507 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.593 11.237 -1.854 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.431 11.476 0.552 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -21.951 11.949 -0.215 1.00 0.00 H new ATOM 504 N TYR A 34 -18.835 6.561 -3.399 1.00 0.00 N ATOM 505 CA TYR A 34 -18.630 5.718 -4.553 1.00 0.00 C ATOM 506 C TYR A 34 -18.537 4.235 -4.185 1.00 0.00 C ATOM 507 O TYR A 34 -19.148 3.381 -4.839 1.00 0.00 O ATOM 508 CB TYR A 34 -17.357 6.244 -5.263 1.00 0.00 C ATOM 509 CG TYR A 34 -17.617 7.513 -6.043 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.601 8.749 -5.415 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.937 7.471 -7.392 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.881 9.909 -6.092 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.213 8.631 -8.088 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.187 9.846 -7.435 1.00 0.00 C ATOM 515 OH TYR A 34 -18.473 10.998 -8.133 1.00 0.00 O ATOM 0 H TYR A 34 -17.963 6.800 -2.927 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.486 5.771 -5.226 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.580 6.429 -4.521 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -16.977 5.477 -5.938 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.361 8.800 -4.363 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.971 6.520 -7.904 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.862 10.859 -5.579 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.449 8.587 -9.141 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.666 10.775 -9.068 1.00 0.00 H new ATOM 525 N GLY A 35 -17.869 3.944 -3.093 1.00 0.00 N ATOM 526 CA GLY A 35 -17.584 2.570 -2.737 1.00 0.00 C ATOM 527 C GLY A 35 -16.405 2.085 -3.561 1.00 0.00 C ATOM 528 O GLY A 35 -16.059 2.721 -4.545 1.00 0.00 O ATOM 0 H GLY A 35 -17.513 4.638 -2.436 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.357 2.495 -1.673 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.457 1.944 -2.922 1.00 0.00 H new ATOM 532 N ALA A 36 -15.820 0.959 -3.229 1.00 0.00 N ATOM 533 CA ALA A 36 -14.644 0.549 -3.961 1.00 0.00 C ATOM 534 C ALA A 36 -15.021 -0.324 -5.127 1.00 0.00 C ATOM 535 O ALA A 36 -15.273 -1.505 -4.964 1.00 0.00 O ATOM 536 CB ALA A 36 -13.590 -0.096 -3.098 1.00 0.00 C ATOM 0 H ALA A 36 -16.123 0.330 -2.485 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.184 1.460 -4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.737 -0.378 -3.715 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.267 0.608 -2.331 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.003 -0.985 -2.623 1.00 0.00 H new ATOM 542 N THR A 37 -14.979 0.256 -6.310 1.00 0.00 N ATOM 543 CA THR A 37 -15.425 -0.404 -7.523 1.00 0.00 C ATOM 544 C THR A 37 -15.411 0.605 -8.678 1.00 0.00 C ATOM 545 O THR A 37 -15.079 0.262 -9.803 1.00 0.00 O ATOM 546 CB THR A 37 -16.849 -1.048 -7.366 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.157 -1.884 -8.494 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.909 0.021 -7.246 1.00 0.00 C ATOM 0 H THR A 37 -14.633 1.204 -6.459 1.00 0.00 H new ATOM 0 HA THR A 37 -14.738 -1.223 -7.736 1.00 0.00 H new ATOM 0 HB THR A 37 -16.838 -1.652 -6.459 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.047 -2.277 -8.377 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.887 -0.447 -7.138 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.705 0.640 -6.372 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.901 0.643 -8.141 1.00 0.00 H new ATOM 556 N ALA A 38 -15.736 1.859 -8.369 1.00 0.00 N ATOM 557 CA ALA A 38 -15.740 2.909 -9.353 1.00 0.00 C ATOM 558 C ALA A 38 -14.303 3.227 -9.742 1.00 0.00 C ATOM 559 O ALA A 38 -13.442 3.299 -8.851 1.00 0.00 O ATOM 560 CB ALA A 38 -16.428 4.135 -8.784 1.00 0.00 C ATOM 0 H ALA A 38 -16.001 2.162 -7.432 1.00 0.00 H new ATOM 0 HA ALA A 38 -16.285 2.591 -10.242 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -16.431 4.930 -9.530 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -17.455 3.885 -8.517 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -15.894 4.473 -7.896 1.00 0.00 H new ATOM 566 N PRO A 39 -14.014 3.387 -11.063 1.00 0.00 N ATOM 567 CA PRO A 39 -12.666 3.696 -11.593 1.00 0.00 C ATOM 568 C PRO A 39 -11.925 4.733 -10.761 1.00 0.00 C ATOM 569 O PRO A 39 -10.733 4.590 -10.499 1.00 0.00 O ATOM 570 CB PRO A 39 -12.970 4.273 -12.964 1.00 0.00 C ATOM 571 CG PRO A 39 -14.167 3.524 -13.412 1.00 0.00 C ATOM 572 CD PRO A 39 -14.988 3.252 -12.168 1.00 0.00 C ATOM 0 HA PRO A 39 -12.023 2.816 -11.594 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.166 5.344 -12.912 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.134 4.135 -13.649 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -14.739 4.103 -14.137 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -13.882 2.593 -13.901 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -15.808 3.963 -12.067 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.431 2.256 -12.191 1.00 0.00 H new ATOM 580 N TYR A 40 -12.669 5.739 -10.319 1.00 0.00 N ATOM 581 CA TYR A 40 -12.157 6.806 -9.501 1.00 0.00 C ATOM 582 C TYR A 40 -11.476 6.279 -8.235 1.00 0.00 C ATOM 583 O TYR A 40 -10.269 6.418 -8.086 1.00 0.00 O ATOM 584 CB TYR A 40 -13.288 7.788 -9.146 1.00 0.00 C ATOM 585 CG TYR A 40 -12.890 8.921 -8.234 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.094 9.961 -8.697 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.325 8.959 -6.916 1.00 0.00 C ATOM 588 CE1 TYR A 40 -11.739 11.005 -7.874 1.00 0.00 C ATOM 589 CE2 TYR A 40 -12.973 9.998 -6.090 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.181 11.017 -6.569 1.00 0.00 C ATOM 591 OH TYR A 40 -11.836 12.056 -5.736 1.00 0.00 O ATOM 0 H TYR A 40 -13.663 5.828 -10.529 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.396 7.333 -10.077 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -13.686 8.208 -10.070 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.097 7.230 -8.675 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -11.748 9.950 -9.720 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.947 8.162 -6.536 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -11.120 11.807 -8.247 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.317 10.016 -5.066 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.231 11.910 -4.851 1.00 0.00 H new ATOM 601 N THR A 41 -12.241 5.640 -7.326 1.00 0.00 N ATOM 602 CA THR A 41 -11.751 5.217 -6.040 1.00 0.00 C ATOM 603 C THR A 41 -10.536 4.273 -6.107 1.00 0.00 C ATOM 604 O THR A 41 -9.589 4.461 -5.356 1.00 0.00 O ATOM 605 CB THR A 41 -12.897 4.629 -5.169 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.437 4.353 -3.858 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.435 3.361 -5.760 1.00 0.00 C ATOM 0 H THR A 41 -13.222 5.411 -7.486 1.00 0.00 H new ATOM 0 HA THR A 41 -11.378 6.118 -5.553 1.00 0.00 H new ATOM 0 HB THR A 41 -13.690 5.376 -5.136 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.172 3.985 -3.324 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.235 2.975 -5.127 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.826 3.562 -6.757 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.636 2.622 -5.826 1.00 0.00 H new ATOM 615 N LEU A 42 -10.524 3.299 -7.009 1.00 0.00 N ATOM 616 CA LEU A 42 -9.371 2.423 -7.057 1.00 0.00 C ATOM 617 C LEU A 42 -8.183 3.025 -7.752 1.00 0.00 C ATOM 618 O LEU A 42 -7.066 2.634 -7.487 1.00 0.00 O ATOM 619 CB LEU A 42 -9.608 0.900 -7.344 1.00 0.00 C ATOM 620 CG LEU A 42 -10.603 0.471 -8.429 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.024 0.622 -7.941 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.388 1.222 -9.739 1.00 0.00 C ATOM 0 H LEU A 42 -11.263 3.104 -7.685 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.102 2.365 -6.002 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.642 0.464 -7.599 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.929 0.440 -6.409 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.420 -0.583 -8.637 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -12.713 0.312 -8.726 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.174 -0.001 -7.060 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.212 1.665 -7.684 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.116 0.884 -10.476 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.513 2.292 -9.570 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.381 1.028 -10.108 1.00 0.00 H new ATOM 634 N ALA A 43 -8.421 4.032 -8.604 1.00 0.00 N ATOM 635 CA ALA A 43 -7.316 4.773 -9.208 1.00 0.00 C ATOM 636 C ALA A 43 -6.536 5.466 -8.101 1.00 0.00 C ATOM 637 O ALA A 43 -5.301 5.554 -8.123 1.00 0.00 O ATOM 638 CB ALA A 43 -7.804 5.781 -10.247 1.00 0.00 C ATOM 0 H ALA A 43 -9.351 4.344 -8.884 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.669 4.074 -9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.950 6.309 -10.670 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.336 5.257 -11.041 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.475 6.497 -9.772 1.00 0.00 H new ATOM 644 N ILE A 44 -7.266 5.897 -7.105 1.00 0.00 N ATOM 645 CA ILE A 44 -6.699 6.519 -5.943 1.00 0.00 C ATOM 646 C ILE A 44 -5.915 5.471 -5.149 1.00 0.00 C ATOM 647 O ILE A 44 -4.795 5.721 -4.764 1.00 0.00 O ATOM 648 CB ILE A 44 -7.809 7.126 -5.065 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.675 8.059 -5.915 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.203 7.889 -3.877 1.00 0.00 C ATOM 651 CD1 ILE A 44 -9.942 8.501 -5.243 1.00 0.00 C ATOM 0 H ILE A 44 -8.283 5.824 -7.081 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.030 7.322 -6.252 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.429 6.323 -4.667 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.090 8.940 -6.179 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.928 7.554 -6.847 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.003 8.310 -3.269 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.608 7.206 -3.271 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.567 8.693 -4.247 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.498 9.159 -5.911 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.550 7.629 -5.004 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.699 9.037 -4.325 1.00 0.00 H new ATOM 663 N VAL A 45 -6.495 4.264 -4.994 1.00 0.00 N ATOM 664 CA VAL A 45 -5.865 3.159 -4.243 1.00 0.00 C ATOM 665 C VAL A 45 -4.476 2.841 -4.854 1.00 0.00 C ATOM 666 O VAL A 45 -3.455 2.743 -4.133 1.00 0.00 O ATOM 667 CB VAL A 45 -6.790 1.861 -4.229 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.153 0.705 -3.489 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.153 2.138 -3.598 1.00 0.00 C ATOM 0 H VAL A 45 -7.408 4.028 -5.383 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.736 3.473 -3.207 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.918 1.589 -5.277 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.824 -0.154 -3.509 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.211 0.441 -3.969 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.965 0.994 -2.455 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.751 1.227 -3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.017 2.470 -2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.665 2.915 -4.165 1.00 0.00 H new ATOM 679 N GLU A 46 -4.446 2.789 -6.181 1.00 0.00 N ATOM 680 CA GLU A 46 -3.228 2.518 -6.943 1.00 0.00 C ATOM 681 C GLU A 46 -2.209 3.636 -6.761 1.00 0.00 C ATOM 682 O GLU A 46 -1.010 3.381 -6.692 1.00 0.00 O ATOM 683 CB GLU A 46 -3.538 2.393 -8.436 1.00 0.00 C ATOM 684 CG GLU A 46 -4.642 1.413 -8.781 1.00 0.00 C ATOM 685 CD GLU A 46 -4.777 1.211 -10.263 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.110 2.176 -10.987 1.00 0.00 O ATOM 687 OE2 GLU A 46 -4.511 0.090 -10.742 1.00 0.00 O ATOM 0 H GLU A 46 -5.270 2.934 -6.764 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.817 1.581 -6.568 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.813 3.376 -8.818 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -2.629 2.091 -8.956 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.438 0.455 -8.302 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.587 1.776 -8.378 1.00 0.00 H new ATOM 694 N SER A 47 -2.695 4.873 -6.638 1.00 0.00 N ATOM 695 CA SER A 47 -1.837 6.034 -6.551 1.00 0.00 C ATOM 696 C SER A 47 -1.311 6.240 -5.143 1.00 0.00 C ATOM 697 O SER A 47 -0.185 6.683 -4.968 1.00 0.00 O ATOM 698 CB SER A 47 -2.575 7.274 -7.024 1.00 0.00 C ATOM 699 OG SER A 47 -3.081 7.063 -8.335 1.00 0.00 O ATOM 0 H SER A 47 -3.691 5.087 -6.597 1.00 0.00 H new ATOM 0 HA SER A 47 -0.980 5.859 -7.202 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.393 7.504 -6.341 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.903 8.133 -7.017 1.00 0.00 H new ATOM 0 HG SER A 47 -4.016 6.774 -8.282 1.00 0.00 H new ATOM 705 N VAL A 48 -2.116 5.906 -4.136 1.00 0.00 N ATOM 706 CA VAL A 48 -1.674 6.024 -2.763 1.00 0.00 C ATOM 707 C VAL A 48 -0.497 5.098 -2.541 1.00 0.00 C ATOM 708 O VAL A 48 0.531 5.513 -2.026 1.00 0.00 O ATOM 709 CB VAL A 48 -2.793 5.724 -1.721 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.250 5.860 -0.298 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.970 6.659 -1.915 1.00 0.00 C ATOM 0 H VAL A 48 -3.067 5.556 -4.251 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.385 7.063 -2.607 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.131 4.699 -1.874 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.045 5.647 0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.432 5.155 -0.152 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.885 6.875 -0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.740 6.433 -1.177 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.640 7.690 -1.790 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.378 6.527 -2.917 1.00 0.00 H new ATOM 721 N ALA A 49 -0.618 3.872 -3.039 1.00 0.00 N ATOM 722 CA ALA A 49 0.442 2.884 -2.894 1.00 0.00 C ATOM 723 C ALA A 49 1.591 3.134 -3.864 1.00 0.00 C ATOM 724 O ALA A 49 2.600 2.473 -3.807 1.00 0.00 O ATOM 725 CB ALA A 49 -0.107 1.466 -3.025 1.00 0.00 C ATOM 0 H ALA A 49 -1.439 3.540 -3.546 1.00 0.00 H new ATOM 0 HA ALA A 49 0.850 2.990 -1.889 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.706 0.749 -2.913 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.854 1.292 -2.250 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.566 1.343 -4.006 1.00 0.00 H new ATOM 731 N ASP A 50 1.448 4.154 -4.688 1.00 0.00 N ATOM 732 CA ASP A 50 2.449 4.513 -5.692 1.00 0.00 C ATOM 733 C ASP A 50 3.438 5.493 -5.058 1.00 0.00 C ATOM 734 O ASP A 50 4.440 5.890 -5.652 1.00 0.00 O ATOM 735 CB ASP A 50 1.741 5.139 -6.918 1.00 0.00 C ATOM 736 CG ASP A 50 2.640 5.425 -8.097 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.907 4.491 -8.898 1.00 0.00 O ATOM 738 OD2 ASP A 50 3.053 6.591 -8.278 1.00 0.00 O ATOM 0 H ASP A 50 0.631 4.765 -4.685 1.00 0.00 H new ATOM 0 HA ASP A 50 2.994 3.633 -6.032 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.946 4.468 -7.241 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.266 6.070 -6.608 1.00 0.00 H new ATOM 743 N ASN A 51 3.137 5.871 -3.835 1.00 0.00 N ATOM 744 CA ASN A 51 3.986 6.746 -3.053 1.00 0.00 C ATOM 745 C ASN A 51 4.934 5.912 -2.230 1.00 0.00 C ATOM 746 O ASN A 51 4.799 4.695 -2.156 1.00 0.00 O ATOM 747 CB ASN A 51 3.161 7.620 -2.083 1.00 0.00 C ATOM 748 CG ASN A 51 2.301 8.665 -2.750 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.743 9.775 -3.002 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.065 8.336 -2.999 1.00 0.00 N ATOM 0 H ASN A 51 2.289 5.578 -3.350 1.00 0.00 H new ATOM 0 HA ASN A 51 4.523 7.393 -3.747 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.521 6.971 -1.485 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.844 8.117 -1.394 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.431 9.016 -3.418 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.732 7.399 -2.774 1.00 0.00 H new ATOM 757 N TRP A 52 5.887 6.547 -1.610 1.00 0.00 N ATOM 758 CA TRP A 52 6.724 5.861 -0.683 1.00 0.00 C ATOM 759 C TRP A 52 6.131 6.044 0.702 1.00 0.00 C ATOM 760 O TRP A 52 6.184 7.136 1.286 1.00 0.00 O ATOM 761 CB TRP A 52 8.185 6.348 -0.768 1.00 0.00 C ATOM 762 CG TRP A 52 8.836 6.038 -2.096 1.00 0.00 C ATOM 763 CD1 TRP A 52 9.376 4.845 -2.481 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.021 6.932 -3.208 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.869 4.935 -3.753 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.671 6.201 -4.225 1.00 0.00 C ATOM 767 CE3 TRP A 52 8.705 8.265 -3.445 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.000 6.759 -5.453 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.034 8.815 -4.665 1.00 0.00 C ATOM 770 CH2 TRP A 52 9.675 8.065 -5.651 1.00 0.00 C ATOM 0 H TRP A 52 6.099 7.537 -1.733 1.00 0.00 H new ATOM 0 HA TRP A 52 6.760 4.798 -0.923 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.214 7.424 -0.598 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.764 5.884 0.031 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.409 3.956 -1.868 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.315 4.176 -4.268 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.212 8.857 -2.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.494 6.180 -6.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.790 9.849 -4.862 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.919 8.532 -6.594 1.00 0.00 H new ATOM 781 N LEU A 53 5.463 5.024 1.163 1.00 0.00 N ATOM 782 CA LEU A 53 4.833 5.036 2.460 1.00 0.00 C ATOM 783 C LEU A 53 4.973 3.694 3.133 1.00 0.00 C ATOM 784 O LEU A 53 4.949 2.650 2.471 1.00 0.00 O ATOM 785 CB LEU A 53 3.336 5.512 2.422 1.00 0.00 C ATOM 786 CG LEU A 53 2.283 4.638 1.705 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.892 5.239 1.879 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.581 4.475 0.226 1.00 0.00 C ATOM 0 H LEU A 53 5.338 4.153 0.648 1.00 0.00 H new ATOM 0 HA LEU A 53 5.361 5.780 3.056 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.007 5.642 3.453 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.317 6.497 1.955 1.00 0.00 H new ATOM 0 HG LEU A 53 2.322 3.650 2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.159 4.614 1.369 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.649 5.292 2.940 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.873 6.242 1.452 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.813 3.853 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.590 5.454 -0.253 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.555 4.001 0.101 1.00 0.00 H new ATOM 800 N THR A 54 5.150 3.753 4.437 1.00 0.00 N ATOM 801 CA THR A 54 5.349 2.618 5.294 1.00 0.00 C ATOM 802 C THR A 54 4.144 1.633 5.204 1.00 0.00 C ATOM 803 O THR A 54 2.996 2.076 5.172 1.00 0.00 O ATOM 804 CB THR A 54 5.441 3.146 6.744 1.00 0.00 C ATOM 805 OG1 THR A 54 6.198 4.384 6.783 1.00 0.00 O ATOM 806 CG2 THR A 54 6.110 2.138 7.656 1.00 0.00 C ATOM 0 H THR A 54 5.158 4.638 4.945 1.00 0.00 H new ATOM 0 HA THR A 54 6.253 2.088 4.993 1.00 0.00 H new ATOM 0 HB THR A 54 4.423 3.320 7.092 1.00 0.00 H new ATOM 0 HG1 THR A 54 6.247 4.708 7.706 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.159 2.540 8.668 1.00 0.00 H new ATOM 0 HG22 THR A 54 5.534 1.213 7.660 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.119 1.936 7.297 1.00 0.00 H new ATOM 814 N PRO A 55 4.383 0.294 5.173 1.00 0.00 N ATOM 815 CA PRO A 55 3.301 -0.716 5.160 1.00 0.00 C ATOM 816 C PRO A 55 2.384 -0.612 6.400 1.00 0.00 C ATOM 817 O PRO A 55 1.210 -1.014 6.369 1.00 0.00 O ATOM 818 CB PRO A 55 4.055 -2.046 5.171 1.00 0.00 C ATOM 819 CG PRO A 55 5.386 -1.730 4.590 1.00 0.00 C ATOM 820 CD PRO A 55 5.711 -0.345 5.057 1.00 0.00 C ATOM 0 HA PRO A 55 2.640 -0.590 4.303 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.148 -2.440 6.183 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.535 -2.801 4.582 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.139 -2.443 4.925 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.361 -1.781 3.501 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.237 -0.355 6.011 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.350 0.180 4.346 1.00 0.00 H new ATOM 828 N THR A 56 2.925 -0.065 7.484 1.00 0.00 N ATOM 829 CA THR A 56 2.173 0.179 8.700 1.00 0.00 C ATOM 830 C THR A 56 1.116 1.274 8.419 1.00 0.00 C ATOM 831 O THR A 56 -0.017 1.250 8.943 1.00 0.00 O ATOM 832 CB THR A 56 3.119 0.686 9.784 1.00 0.00 C ATOM 833 OG1 THR A 56 4.383 -0.014 9.686 1.00 0.00 O ATOM 834 CG2 THR A 56 2.506 0.459 11.155 1.00 0.00 C ATOM 0 H THR A 56 3.902 0.221 7.539 1.00 0.00 H new ATOM 0 HA THR A 56 1.691 -0.742 9.027 1.00 0.00 H new ATOM 0 HB THR A 56 3.286 1.754 9.646 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.992 0.312 10.381 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.188 0.824 11.923 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.560 0.996 11.224 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.329 -0.606 11.303 1.00 0.00 H new ATOM 842 N ASP A 57 1.475 2.167 7.517 1.00 0.00 N ATOM 843 CA ASP A 57 0.612 3.262 7.160 1.00 0.00 C ATOM 844 C ASP A 57 -0.340 2.847 6.101 1.00 0.00 C ATOM 845 O ASP A 57 -1.396 3.407 5.976 1.00 0.00 O ATOM 846 CB ASP A 57 1.383 4.493 6.744 1.00 0.00 C ATOM 847 CG ASP A 57 0.549 5.742 6.944 1.00 0.00 C ATOM 848 OD1 ASP A 57 0.567 6.295 8.072 1.00 0.00 O ATOM 849 OD2 ASP A 57 -0.132 6.185 6.021 1.00 0.00 O ATOM 0 H ASP A 57 2.365 2.150 7.019 1.00 0.00 H new ATOM 0 HA ASP A 57 0.048 3.534 8.052 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.302 4.566 7.326 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.675 4.409 5.697 1.00 0.00 H new ATOM 854 N TRP A 58 0.049 1.846 5.323 1.00 0.00 N ATOM 855 CA TRP A 58 -0.874 1.216 4.404 1.00 0.00 C ATOM 856 C TRP A 58 -2.077 0.741 5.188 1.00 0.00 C ATOM 857 O TRP A 58 -3.211 1.047 4.865 1.00 0.00 O ATOM 858 CB TRP A 58 -0.246 0.012 3.711 1.00 0.00 C ATOM 859 CG TRP A 58 0.574 0.290 2.498 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.969 1.488 1.990 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.065 -0.698 1.612 1.00 0.00 C ATOM 862 NE1 TRP A 58 1.688 1.278 0.825 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.759 -0.046 0.584 1.00 0.00 C ATOM 864 CE3 TRP A 58 0.984 -2.080 1.598 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.366 -0.726 -0.451 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.583 -2.758 0.578 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.269 -2.079 -0.439 1.00 0.00 C ATOM 0 H TRP A 58 0.992 1.458 5.313 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.151 1.945 3.642 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.382 -0.508 4.435 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.045 -0.675 3.431 1.00 0.00 H new ATOM 0 HD1 TRP A 58 0.755 2.452 2.427 1.00 0.00 H new ATOM 0 HE1 TRP A 58 2.098 2.008 0.243 1.00 0.00 H new ATOM 0 HE3 TRP A 58 0.458 -2.610 2.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.895 -0.205 -1.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 1.528 -3.836 0.553 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.732 -2.647 -1.232 1.00 0.00 H new ATOM 878 N ASN A 59 -1.821 0.024 6.257 1.00 0.00 N ATOM 879 CA ASN A 59 -2.888 -0.485 7.099 1.00 0.00 C ATOM 880 C ASN A 59 -3.656 0.669 7.755 1.00 0.00 C ATOM 881 O ASN A 59 -4.861 0.611 7.921 1.00 0.00 O ATOM 882 CB ASN A 59 -2.351 -1.489 8.117 1.00 0.00 C ATOM 883 CG ASN A 59 -1.767 -2.725 7.440 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.190 -3.114 6.332 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.818 -3.349 8.071 1.00 0.00 N ATOM 0 H ASN A 59 -0.882 -0.223 6.568 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.599 -1.026 6.475 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.584 -1.013 8.728 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.154 -1.789 8.790 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.396 -4.183 7.662 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.495 -3.005 8.975 1.00 0.00 H new ATOM 892 N THR A 60 -2.943 1.746 7.991 1.00 0.00 N ATOM 893 CA THR A 60 -3.589 2.939 8.538 1.00 0.00 C ATOM 894 C THR A 60 -4.563 3.534 7.483 1.00 0.00 C ATOM 895 O THR A 60 -5.693 3.955 7.805 1.00 0.00 O ATOM 896 CB THR A 60 -2.530 3.984 8.943 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.601 3.377 9.873 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.171 5.202 9.591 1.00 0.00 C ATOM 0 H THR A 60 -1.941 1.832 7.822 1.00 0.00 H new ATOM 0 HA THR A 60 -4.154 2.663 9.428 1.00 0.00 H new ATOM 0 HB THR A 60 -2.009 4.315 8.044 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.174 2.603 9.450 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.397 5.919 9.864 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.863 5.666 8.888 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.713 4.895 10.485 1.00 0.00 H new ATOM 906 N LEU A 61 -4.125 3.462 6.230 1.00 0.00 N ATOM 907 CA LEU A 61 -4.818 3.963 5.075 1.00 0.00 C ATOM 908 C LEU A 61 -6.114 3.227 4.891 1.00 0.00 C ATOM 909 O LEU A 61 -7.149 3.846 4.969 1.00 0.00 O ATOM 910 CB LEU A 61 -3.870 3.850 3.835 1.00 0.00 C ATOM 911 CG LEU A 61 -4.282 4.500 2.492 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.452 3.814 1.824 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.563 5.972 2.671 1.00 0.00 C ATOM 0 H LEU A 61 -3.232 3.029 5.994 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.078 5.014 5.203 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.908 4.275 4.121 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.706 2.789 3.646 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.430 4.375 1.824 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.686 4.322 0.889 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.195 2.775 1.618 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.319 3.850 2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.850 6.407 1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.374 6.103 3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.668 6.471 3.042 1.00 0.00 H new ATOM 925 N VAL A 62 -6.048 1.898 4.695 1.00 0.00 N ATOM 926 CA VAL A 62 -7.257 1.086 4.459 1.00 0.00 C ATOM 927 C VAL A 62 -8.285 1.302 5.539 1.00 0.00 C ATOM 928 O VAL A 62 -9.464 1.518 5.242 1.00 0.00 O ATOM 929 CB VAL A 62 -6.959 -0.444 4.282 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.174 -1.003 5.440 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.245 -1.232 4.117 1.00 0.00 C ATOM 0 H VAL A 62 -5.178 1.366 4.695 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.663 1.436 3.510 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.356 -0.543 3.380 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.990 -2.065 5.276 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.222 -0.478 5.522 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.741 -0.871 6.361 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.011 -2.290 3.996 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.870 -1.097 5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.780 -0.876 3.236 1.00 0.00 H new ATOM 941 N ARG A 63 -7.816 1.311 6.776 1.00 0.00 N ATOM 942 CA ARG A 63 -8.733 1.513 7.908 1.00 0.00 C ATOM 943 C ARG A 63 -9.474 2.840 7.824 1.00 0.00 C ATOM 944 O ARG A 63 -10.693 2.852 7.731 1.00 0.00 O ATOM 945 CB ARG A 63 -8.053 1.419 9.294 1.00 0.00 C ATOM 946 CG ARG A 63 -7.957 0.023 9.913 1.00 0.00 C ATOM 947 CD ARG A 63 -7.006 -0.880 9.182 1.00 0.00 C ATOM 948 NE ARG A 63 -6.833 -2.175 9.844 1.00 0.00 N ATOM 949 CZ ARG A 63 -5.673 -2.664 10.318 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.603 -1.887 10.431 1.00 0.00 N ATOM 951 NH2 ARG A 63 -5.617 -3.905 10.761 1.00 0.00 N ATOM 0 H ARG A 63 -6.836 1.185 7.028 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.439 0.687 7.821 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.045 1.824 9.208 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.597 2.062 9.986 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.638 0.113 10.951 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -8.947 -0.433 9.923 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.372 -1.041 8.168 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.037 -0.388 9.097 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.664 -2.756 9.955 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.654 -0.906 10.157 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.730 -2.271 10.792 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.452 -4.491 10.744 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.739 -4.279 11.121 1.00 0.00 H new ATOM 965 N ALA A 64 -8.778 3.949 8.029 1.00 0.00 N ATOM 966 CA ALA A 64 -9.343 5.290 7.829 1.00 0.00 C ATOM 967 C ALA A 64 -10.183 5.468 6.527 1.00 0.00 C ATOM 968 O ALA A 64 -11.317 5.962 6.586 1.00 0.00 O ATOM 969 CB ALA A 64 -8.229 6.325 7.880 1.00 0.00 C ATOM 0 H ALA A 64 -7.806 3.952 8.338 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.052 5.435 8.644 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.649 7.320 7.731 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.736 6.281 8.851 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.503 6.117 7.094 1.00 0.00 H new ATOM 975 N VAL A 65 -9.588 5.108 5.431 1.00 0.00 N ATOM 976 CA VAL A 65 -10.280 5.375 4.143 1.00 0.00 C ATOM 977 C VAL A 65 -11.636 4.680 3.962 1.00 0.00 C ATOM 978 O VAL A 65 -12.612 5.349 3.668 1.00 0.00 O ATOM 979 CB VAL A 65 -9.416 5.242 2.859 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.206 6.145 2.917 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.025 3.808 2.548 1.00 0.00 C ATOM 0 H VAL A 65 -8.678 4.653 5.367 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.485 6.439 4.259 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.045 5.569 2.031 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.621 6.029 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.530 7.182 3.011 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.593 5.877 3.777 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.423 3.784 1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.447 3.400 3.377 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.924 3.209 2.403 1.00 0.00 H new ATOM 991 N LEU A 66 -11.720 3.395 4.192 1.00 0.00 N ATOM 992 CA LEU A 66 -12.942 2.673 3.909 1.00 0.00 C ATOM 993 C LEU A 66 -13.277 1.799 5.130 1.00 0.00 C ATOM 994 O LEU A 66 -12.506 1.737 6.055 1.00 0.00 O ATOM 995 CB LEU A 66 -12.737 1.855 2.600 1.00 0.00 C ATOM 996 CG LEU A 66 -13.881 1.866 1.535 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.420 1.316 0.214 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.153 1.160 2.004 1.00 0.00 C ATOM 0 H LEU A 66 -10.964 2.826 4.572 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.790 3.338 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.830 2.220 2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.554 0.818 2.881 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.141 2.916 1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.245 1.341 -0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.595 1.920 -0.164 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.085 0.287 0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.905 1.205 1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.928 0.118 2.232 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.534 1.653 2.899 1.00 0.00 H new ATOM 1010 N SER A 67 -14.418 1.171 5.151 1.00 0.00 N ATOM 1011 CA SER A 67 -14.836 0.384 6.303 1.00 0.00 C ATOM 1012 C SER A 67 -15.770 -0.730 5.880 1.00 0.00 C ATOM 1013 O SER A 67 -16.397 -0.647 4.816 1.00 0.00 O ATOM 1014 CB SER A 67 -15.507 1.280 7.364 1.00 0.00 C ATOM 1015 OG SER A 67 -14.621 2.326 7.798 1.00 0.00 O ATOM 0 H SER A 67 -15.088 1.182 4.382 1.00 0.00 H new ATOM 0 HA SER A 67 -13.947 -0.064 6.747 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.416 1.718 6.952 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.805 0.674 8.220 1.00 0.00 H new ATOM 0 HG SER A 67 -15.072 2.880 8.469 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.805 -1.779 6.683 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.671 -2.899 6.466 1.00 0.00 C ATOM 1023 C GLY A 68 -16.171 -3.802 5.373 1.00 0.00 C ATOM 1024 O GLY A 68 -15.469 -4.792 5.631 1.00 0.00 O ATOM 0 H GLY A 68 -15.219 -1.867 7.514 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.764 -3.468 7.391 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.668 -2.541 6.211 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.506 -3.440 4.154 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.128 -4.208 3.001 1.00 0.00 C ATOM 1030 C GLY A 69 -14.630 -4.217 2.768 1.00 0.00 C ATOM 1031 O GLY A 69 -14.099 -5.165 2.185 1.00 0.00 O ATOM 0 H GLY A 69 -17.049 -2.603 3.940 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.479 -5.233 3.122 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.626 -3.802 2.120 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.968 -3.157 3.229 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.519 -2.966 3.076 1.00 0.00 C ATOM 1037 C ASP A 70 -11.767 -4.215 3.489 1.00 0.00 C ATOM 1038 O ASP A 70 -11.065 -4.825 2.677 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.002 -1.725 3.887 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.006 -1.903 5.408 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.053 -2.271 5.965 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.955 -1.751 6.058 1.00 0.00 O ATOM 0 H ASP A 70 -14.426 -2.394 3.727 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.329 -2.772 2.020 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.986 -1.496 3.565 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.618 -0.862 3.635 1.00 0.00 H new ATOM 1047 N HIS A 71 -12.013 -4.649 4.709 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.304 -5.743 5.280 1.00 0.00 C ATOM 1049 C HIS A 71 -11.559 -7.004 4.491 1.00 0.00 C ATOM 1050 O HIS A 71 -10.626 -7.654 4.034 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.691 -5.939 6.754 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.853 -6.959 7.468 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.238 -8.258 7.664 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.631 -6.851 8.018 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.289 -8.904 8.301 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.299 -8.069 8.527 1.00 0.00 N ATOM 0 H HIS A 71 -12.717 -4.241 5.324 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.238 -5.518 5.239 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.606 -4.984 7.273 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.737 -6.239 6.809 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.023 -5.959 8.050 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.317 -9.944 8.590 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.427 -8.296 9.005 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.819 -7.294 4.265 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.178 -8.523 3.628 1.00 0.00 C ATOM 1067 C LEU A 72 -12.548 -8.741 2.245 1.00 0.00 C ATOM 1068 O LEU A 72 -11.797 -9.707 2.071 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.688 -8.891 3.792 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.757 -7.828 3.487 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.000 -7.663 2.010 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -17.045 -8.164 4.196 1.00 0.00 C ATOM 0 H LEU A 72 -13.605 -6.693 4.515 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.682 -9.308 4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.888 -9.750 3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.836 -9.219 4.821 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.378 -6.875 3.857 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.763 -6.901 1.850 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.075 -7.359 1.521 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.338 -8.610 1.589 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.793 -7.404 3.972 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.403 -9.136 3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.871 -8.195 5.272 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.750 -7.852 1.302 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.129 -8.073 0.001 1.00 0.00 C ATOM 1086 C LEU A 73 -10.729 -7.501 -0.156 1.00 0.00 C ATOM 1087 O LEU A 73 -9.812 -8.262 -0.493 1.00 0.00 O ATOM 1088 CB LEU A 73 -13.025 -7.796 -1.192 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.927 -8.970 -1.670 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.105 -10.164 -2.130 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.906 -9.410 -0.615 1.00 0.00 C ATOM 0 H LEU A 73 -13.310 -7.005 1.393 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.984 -9.153 -0.003 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.667 -6.950 -0.947 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.396 -7.487 -2.027 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.491 -8.582 -2.518 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.773 -10.962 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.464 -9.866 -2.960 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.489 -10.521 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.511 -10.231 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.363 -9.743 0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.555 -8.575 -0.350 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.545 -6.179 0.112 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.229 -5.549 0.012 1.00 0.00 C ATOM 1105 C TRP A 74 -8.223 -6.332 0.858 1.00 0.00 C ATOM 1106 O TRP A 74 -7.118 -6.638 0.465 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.224 -4.086 0.562 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.862 -2.907 -0.225 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.789 -2.898 -1.220 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.504 -1.546 -0.036 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.065 -1.593 -1.618 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.295 -0.749 -0.880 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.601 -0.954 0.787 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.198 0.644 -0.900 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.479 0.442 0.787 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.291 1.226 -0.047 1.00 0.00 C ATOM 0 H TRP A 74 -11.294 -5.547 0.395 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.969 -5.542 -1.046 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.713 -4.115 1.536 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.182 -3.820 0.737 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.247 -3.780 -1.642 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.731 -1.317 -2.340 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.981 -1.554 1.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.811 1.240 -1.559 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.756 0.917 1.433 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.202 2.302 -0.018 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.637 -6.629 2.016 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.762 -7.167 3.002 1.00 0.00 C ATOM 1129 C LYS A 75 -7.589 -8.658 3.023 1.00 0.00 C ATOM 1130 O LYS A 75 -6.475 -9.097 3.253 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.942 -6.509 4.339 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.844 -4.995 4.207 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.436 -4.542 3.815 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.527 -4.599 5.027 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.168 -4.106 4.782 1.00 0.00 N ATOM 0 H LYS A 75 -9.602 -6.510 2.326 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.767 -6.882 2.661 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.911 -6.781 4.757 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.183 -6.869 5.033 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.557 -4.650 3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -8.124 -4.530 5.152 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -6.044 -5.182 3.024 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.467 -3.527 3.418 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.974 -4.014 5.831 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.470 -5.630 5.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.764 -3.747 5.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.577 -4.882 4.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.198 -3.339 4.080 1.00 0.00 H new ATOM 1149 N SER A 76 -8.639 -9.463 2.788 1.00 0.00 N ATOM 1150 CA SER A 76 -8.394 -10.900 2.733 1.00 0.00 C ATOM 1151 C SER A 76 -7.438 -11.175 1.579 1.00 0.00 C ATOM 1152 O SER A 76 -6.488 -11.957 1.704 1.00 0.00 O ATOM 1153 CB SER A 76 -9.686 -11.712 2.576 1.00 0.00 C ATOM 1154 OG SER A 76 -9.441 -13.111 2.683 1.00 0.00 O ATOM 0 H SER A 76 -9.603 -9.163 2.642 1.00 0.00 H new ATOM 0 HA SER A 76 -7.954 -11.217 3.679 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.403 -11.408 3.339 1.00 0.00 H new ATOM 0 HB3 SER A 76 -10.138 -11.494 1.609 1.00 0.00 H new ATOM 0 HG SER A 76 -10.284 -13.600 2.580 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.630 -10.451 0.492 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.768 -10.581 -0.641 1.00 0.00 C ATOM 1162 C GLU A 77 -5.414 -9.913 -0.398 1.00 0.00 C ATOM 1163 O GLU A 77 -4.478 -10.194 -1.099 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.443 -10.035 -1.891 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.639 -10.837 -2.367 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.247 -12.122 -3.036 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.017 -13.119 -2.347 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.178 -12.145 -4.289 1.00 0.00 O ATOM 0 H GLU A 77 -8.380 -9.769 0.381 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.575 -11.642 -0.797 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.763 -9.011 -1.697 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.708 -9.992 -2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.285 -11.057 -1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.222 -10.233 -3.063 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.305 -8.999 0.575 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.995 -8.435 0.922 1.00 0.00 C ATOM 1177 C PHE A 78 -3.114 -9.534 1.458 1.00 0.00 C ATOM 1178 O PHE A 78 -1.988 -9.699 1.029 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.141 -7.300 1.959 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.840 -6.746 2.502 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -2.075 -5.871 1.752 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.404 -7.086 3.775 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.901 -5.343 2.254 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.227 -6.564 4.280 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.476 -5.690 3.517 1.00 0.00 C ATOM 0 H PHE A 78 -6.087 -8.642 1.124 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.540 -8.007 0.028 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.702 -6.484 1.503 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.736 -7.668 2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.400 -5.596 0.759 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.990 -7.765 4.377 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.317 -4.659 1.656 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.895 -6.839 5.270 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.442 -5.280 3.911 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.662 -10.307 2.355 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.948 -11.401 2.955 1.00 0.00 C ATOM 1197 C PHE A 79 -2.612 -12.466 1.929 1.00 0.00 C ATOM 1198 O PHE A 79 -1.468 -12.929 1.851 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.750 -11.967 4.121 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.811 -10.997 5.269 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.713 -10.810 6.086 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.937 -10.232 5.495 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.740 -9.888 7.113 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.973 -9.299 6.513 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.872 -9.127 7.325 1.00 0.00 C ATOM 0 H PHE A 79 -4.618 -10.196 2.691 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.000 -11.031 3.344 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.761 -12.203 3.788 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.298 -12.901 4.456 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.820 -11.394 5.919 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.804 -10.365 4.866 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.877 -9.762 7.750 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.861 -8.706 6.672 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.895 -8.400 8.123 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.587 -12.787 1.111 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.446 -13.787 0.079 1.00 0.00 C ATOM 1217 C GLU A 80 -2.485 -13.354 -1.013 1.00 0.00 C ATOM 1218 O GLU A 80 -1.453 -13.946 -1.168 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.799 -14.111 -0.505 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.720 -14.814 0.459 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.281 -16.219 0.768 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -5.701 -17.152 0.047 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.527 -16.430 1.731 1.00 0.00 O ATOM 0 H GLU A 80 -4.511 -12.356 1.144 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.023 -14.681 0.538 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.272 -13.187 -0.838 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.664 -14.737 -1.387 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.772 -14.243 1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.727 -14.837 0.041 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.799 -12.267 -1.698 1.00 0.00 N ATOM 1231 CA ASN A 81 -2.029 -11.812 -2.869 1.00 0.00 C ATOM 1232 C ASN A 81 -0.610 -11.470 -2.529 1.00 0.00 C ATOM 1233 O ASN A 81 0.313 -11.821 -3.276 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.666 -10.608 -3.569 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.951 -10.916 -4.303 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -4.158 -12.020 -4.800 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.810 -9.933 -4.401 1.00 0.00 N ATOM 0 H ASN A 81 -3.592 -11.668 -1.467 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.039 -12.663 -3.550 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.863 -9.835 -2.826 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.948 -10.194 -4.277 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.687 -10.070 -4.904 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.602 -9.030 -3.975 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.408 -10.806 -1.410 1.00 0.00 N ATOM 1245 CA CYS A 82 0.921 -10.409 -1.051 1.00 0.00 C ATOM 1246 C CYS A 82 1.764 -11.610 -0.611 1.00 0.00 C ATOM 1247 O CYS A 82 2.868 -11.807 -1.123 1.00 0.00 O ATOM 1248 CB CYS A 82 0.918 -9.309 -0.024 1.00 0.00 C ATOM 1249 SG CYS A 82 0.034 -7.819 -0.537 1.00 0.00 S ATOM 0 H CYS A 82 -1.138 -10.538 -0.750 1.00 0.00 H new ATOM 0 HA CYS A 82 1.392 -9.999 -1.944 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.469 -9.686 0.895 1.00 0.00 H new ATOM 0 HB3 CYS A 82 1.949 -9.044 0.211 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.580 -7.305 0.487 1.00 0.00 H new ATOM 1255 N ARG A 83 1.231 -12.466 0.270 1.00 0.00 N ATOM 1256 CA ARG A 83 1.991 -13.652 0.676 1.00 0.00 C ATOM 1257 C ARG A 83 2.148 -14.629 -0.488 1.00 0.00 C ATOM 1258 O ARG A 83 3.113 -15.386 -0.542 1.00 0.00 O ATOM 1259 CB ARG A 83 1.435 -14.365 1.932 1.00 0.00 C ATOM 1260 CG ARG A 83 1.916 -13.809 3.287 1.00 0.00 C ATOM 1261 CD ARG A 83 1.366 -12.437 3.593 1.00 0.00 C ATOM 1262 NE ARG A 83 2.062 -11.783 4.733 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.502 -11.477 5.913 1.00 0.00 C ATOM 1264 NH1 ARG A 83 0.350 -12.028 6.275 1.00 0.00 N ATOM 1265 NH2 ARG A 83 2.137 -10.671 6.764 1.00 0.00 N ATOM 0 H ARG A 83 0.312 -12.366 0.701 1.00 0.00 H new ATOM 0 HA ARG A 83 2.975 -13.282 0.965 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.347 -14.312 1.905 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.704 -15.420 1.877 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.622 -14.497 4.080 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.005 -13.766 3.289 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.456 -11.808 2.708 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.303 -12.518 3.819 1.00 0.00 H new ATOM 0 HE ARG A 83 3.046 -11.548 4.607 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.116 -12.690 5.654 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.069 -11.790 7.174 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.049 -10.287 6.518 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.711 -10.439 7.661 1.00 0.00 H new ATOM 1279 N ASP A 84 1.209 -14.573 -1.424 1.00 0.00 N ATOM 1280 CA ASP A 84 1.238 -15.389 -2.645 1.00 0.00 C ATOM 1281 C ASP A 84 2.427 -14.995 -3.454 1.00 0.00 C ATOM 1282 O ASP A 84 3.279 -15.798 -3.752 1.00 0.00 O ATOM 1283 CB ASP A 84 0.006 -15.127 -3.495 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.251 -16.221 -4.503 1.00 0.00 C ATOM 1285 OD1 ASP A 84 0.278 -16.153 -5.618 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.984 -17.178 -4.189 1.00 0.00 O ATOM 0 H ASP A 84 0.398 -13.958 -1.363 1.00 0.00 H new ATOM 0 HA ASP A 84 1.273 -16.440 -2.358 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.863 -15.026 -2.845 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.126 -14.178 -4.018 1.00 0.00 H new ATOM 1291 N THR A 85 2.514 -13.724 -3.711 1.00 0.00 N ATOM 1292 CA THR A 85 3.570 -13.158 -4.491 1.00 0.00 C ATOM 1293 C THR A 85 4.918 -13.415 -3.786 1.00 0.00 C ATOM 1294 O THR A 85 5.926 -13.775 -4.409 1.00 0.00 O ATOM 1295 CB THR A 85 3.309 -11.653 -4.624 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.080 -11.425 -5.358 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.462 -10.922 -5.282 1.00 0.00 C ATOM 0 H THR A 85 1.837 -13.038 -3.376 1.00 0.00 H new ATOM 0 HA THR A 85 3.608 -13.611 -5.482 1.00 0.00 H new ATOM 0 HB THR A 85 3.211 -11.249 -3.616 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.314 -11.545 -4.759 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.227 -9.860 -5.352 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.365 -11.055 -4.686 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.625 -11.324 -6.282 1.00 0.00 H new ATOM 1305 N ALA A 86 4.882 -13.315 -2.485 1.00 0.00 N ATOM 1306 CA ALA A 86 6.044 -13.531 -1.690 1.00 0.00 C ATOM 1307 C ALA A 86 6.532 -14.987 -1.759 1.00 0.00 C ATOM 1308 O ALA A 86 7.721 -15.220 -1.978 1.00 0.00 O ATOM 1309 CB ALA A 86 5.786 -13.105 -0.289 1.00 0.00 C ATOM 0 H ALA A 86 4.043 -13.081 -1.953 1.00 0.00 H new ATOM 0 HA ALA A 86 6.850 -12.920 -2.097 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.679 -13.273 0.313 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.531 -12.045 -0.272 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.958 -13.684 0.121 1.00 0.00 H new ATOM 1315 N LYS A 87 5.620 -15.970 -1.625 1.00 0.00 N ATOM 1316 CA LYS A 87 6.017 -17.392 -1.695 1.00 0.00 C ATOM 1317 C LYS A 87 6.519 -17.764 -3.075 1.00 0.00 C ATOM 1318 O LYS A 87 7.389 -18.630 -3.227 1.00 0.00 O ATOM 1319 CB LYS A 87 4.913 -18.361 -1.214 1.00 0.00 C ATOM 1320 CG LYS A 87 3.573 -18.265 -1.919 1.00 0.00 C ATOM 1321 CD LYS A 87 2.588 -19.279 -1.355 1.00 0.00 C ATOM 1322 CE LYS A 87 1.192 -19.117 -1.950 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.253 -20.125 -1.429 1.00 0.00 N ATOM 0 H LYS A 87 4.624 -15.812 -1.471 1.00 0.00 H new ATOM 0 HA LYS A 87 6.844 -17.506 -0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.283 -19.380 -1.322 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.751 -18.192 -0.149 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.170 -17.259 -1.806 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.706 -18.437 -2.987 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.952 -20.287 -1.555 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.535 -19.168 -0.272 1.00 0.00 H new ATOM 0 HE2 LYS A 87 0.815 -18.119 -1.725 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.248 -19.200 -3.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.684 -19.981 -1.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 0.599 -21.077 -1.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.180 -20.030 -0.396 1.00 0.00 H new ATOM 1337 N ARG A 88 6.020 -17.069 -4.067 1.00 0.00 N ATOM 1338 CA ARG A 88 6.486 -17.249 -5.437 1.00 0.00 C ATOM 1339 C ARG A 88 7.914 -16.731 -5.548 1.00 0.00 C ATOM 1340 O ARG A 88 8.745 -17.320 -6.214 1.00 0.00 O ATOM 1341 CB ARG A 88 5.577 -16.529 -6.435 1.00 0.00 C ATOM 1342 CG ARG A 88 4.303 -17.278 -6.869 1.00 0.00 C ATOM 1343 CD ARG A 88 3.552 -17.914 -5.716 1.00 0.00 C ATOM 1344 NE ARG A 88 2.123 -18.054 -5.980 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.440 -19.186 -6.080 1.00 0.00 C ATOM 1346 NH1 ARG A 88 2.053 -20.348 -6.287 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.131 -19.137 -6.028 1.00 0.00 N ATOM 0 H ARG A 88 5.287 -16.368 -3.960 1.00 0.00 H new ATOM 0 HA ARG A 88 6.459 -18.311 -5.681 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.280 -15.575 -5.999 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.161 -16.304 -7.327 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.640 -16.583 -7.384 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.573 -18.052 -7.587 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.977 -18.896 -5.510 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.694 -17.311 -4.819 1.00 0.00 H new ATOM 0 HE ARG A 88 1.594 -17.190 -6.100 1.00 0.00 H new ATOM 0 HH11 ARG A 88 3.069 -20.381 -6.372 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.507 -21.207 -6.361 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.342 -18.240 -5.913 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.415 -19.995 -6.103 1.00 0.00 H new ATOM 1361 N ASN A 89 8.202 -15.660 -4.834 1.00 0.00 N ATOM 1362 CA ASN A 89 9.536 -15.087 -4.801 1.00 0.00 C ATOM 1363 C ASN A 89 10.462 -15.935 -3.988 1.00 0.00 C ATOM 1364 O ASN A 89 11.667 -15.893 -4.181 1.00 0.00 O ATOM 1365 CB ASN A 89 9.538 -13.626 -4.286 1.00 0.00 C ATOM 1366 CG ASN A 89 9.002 -12.656 -5.323 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.158 -13.000 -6.129 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.502 -11.447 -5.327 1.00 0.00 N ATOM 0 H ASN A 89 7.520 -15.163 -4.261 1.00 0.00 H new ATOM 0 HA ASN A 89 9.896 -15.065 -5.830 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.934 -13.560 -3.381 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.554 -13.340 -4.013 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.185 -10.766 -6.017 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.209 -11.185 -4.640 1.00 0.00 H new ATOM 1375 N GLN A 90 9.912 -16.717 -3.078 1.00 0.00 N ATOM 1376 CA GLN A 90 10.733 -17.589 -2.274 1.00 0.00 C ATOM 1377 C GLN A 90 11.145 -18.802 -3.089 1.00 0.00 C ATOM 1378 O GLN A 90 12.305 -19.209 -3.050 1.00 0.00 O ATOM 1379 CB GLN A 90 10.035 -18.032 -0.983 1.00 0.00 C ATOM 1380 CG GLN A 90 9.490 -16.910 -0.091 1.00 0.00 C ATOM 1381 CD GLN A 90 10.463 -15.773 0.108 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.280 -15.796 0.999 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.327 -14.738 -0.686 1.00 0.00 N ATOM 0 H GLN A 90 8.912 -16.764 -2.882 1.00 0.00 H new ATOM 0 HA GLN A 90 11.616 -17.022 -1.979 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.208 -18.691 -1.249 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.739 -18.624 -0.398 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.572 -16.520 -0.531 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.225 -17.326 0.881 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.627 -14.753 -1.428 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.921 -13.918 -0.562 1.00 0.00 H new ATOM 1392 N GLN A 91 10.206 -19.371 -3.846 1.00 0.00 N ATOM 1393 CA GLN A 91 10.532 -20.512 -4.716 1.00 0.00 C ATOM 1394 C GLN A 91 11.390 -20.060 -5.898 1.00 0.00 C ATOM 1395 O GLN A 91 12.168 -20.831 -6.449 1.00 0.00 O ATOM 1396 CB GLN A 91 9.274 -21.259 -5.202 1.00 0.00 C ATOM 1397 CG GLN A 91 8.252 -20.378 -5.886 1.00 0.00 C ATOM 1398 CD GLN A 91 7.096 -21.140 -6.476 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.125 -21.531 -7.652 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.089 -21.387 -5.684 1.00 0.00 N ATOM 0 H GLN A 91 9.231 -19.072 -3.878 1.00 0.00 H new ATOM 0 HA GLN A 91 11.106 -21.219 -4.117 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.577 -22.047 -5.892 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.803 -21.747 -4.349 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.869 -19.654 -5.166 1.00 0.00 H new ATOM 0 HG3 GLN A 91 8.744 -19.812 -6.677 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.102 -21.048 -4.722 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.289 -21.919 -6.027 1.00 0.00 H new ATOM 1409 N ALA A 92 11.226 -18.809 -6.298 1.00 0.00 N ATOM 1410 CA ALA A 92 12.058 -18.237 -7.346 1.00 0.00 C ATOM 1411 C ALA A 92 13.427 -17.915 -6.771 1.00 0.00 C ATOM 1412 O ALA A 92 14.432 -17.853 -7.484 1.00 0.00 O ATOM 1413 CB ALA A 92 11.411 -16.991 -7.920 1.00 0.00 C ATOM 0 H ALA A 92 10.527 -18.172 -5.915 1.00 0.00 H new ATOM 0 HA ALA A 92 12.167 -18.958 -8.156 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.048 -16.578 -8.702 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.439 -17.247 -8.341 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.281 -16.252 -7.130 1.00 0.00 H new ATOM 1419 N GLY A 93 13.453 -17.743 -5.469 1.00 0.00 N ATOM 1420 CA GLY A 93 14.668 -17.479 -4.762 1.00 0.00 C ATOM 1421 C GLY A 93 15.158 -16.078 -4.996 1.00 0.00 C ATOM 1422 O GLY A 93 16.345 -15.847 -5.205 1.00 0.00 O ATOM 0 H GLY A 93 12.624 -17.784 -4.876 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.509 -17.635 -3.695 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.433 -18.189 -5.077 1.00 0.00 H new ATOM 1426 N ASN A 94 14.247 -15.145 -4.969 1.00 0.00 N ATOM 1427 CA ASN A 94 14.597 -13.756 -5.146 1.00 0.00 C ATOM 1428 C ASN A 94 14.970 -13.218 -3.801 1.00 0.00 C ATOM 1429 O ASN A 94 14.430 -13.681 -2.796 1.00 0.00 O ATOM 1430 CB ASN A 94 13.432 -12.921 -5.720 1.00 0.00 C ATOM 1431 CG ASN A 94 12.955 -13.364 -7.095 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.705 -13.948 -7.877 1.00 0.00 O ATOM 1433 ND2 ASN A 94 11.722 -13.045 -7.417 1.00 0.00 N ATOM 0 H ASN A 94 13.252 -15.318 -4.826 1.00 0.00 H new ATOM 0 HA ASN A 94 15.418 -13.688 -5.860 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.593 -12.967 -5.026 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.743 -11.878 -5.776 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.359 -13.281 -8.340 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.128 -12.561 -6.744 1.00 0.00 H new ATOM 1440 N GLY A 95 15.852 -12.232 -3.764 1.00 0.00 N ATOM 1441 CA GLY A 95 16.342 -11.661 -2.505 1.00 0.00 C ATOM 1442 C GLY A 95 15.329 -10.785 -1.778 1.00 0.00 C ATOM 1443 O GLY A 95 15.657 -9.671 -1.345 1.00 0.00 O ATOM 0 H GLY A 95 16.251 -11.802 -4.598 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.643 -12.474 -1.844 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.235 -11.070 -2.711 1.00 0.00 H new ATOM 1447 N TRP A 96 14.129 -11.294 -1.632 1.00 0.00 N ATOM 1448 CA TRP A 96 13.037 -10.634 -0.980 1.00 0.00 C ATOM 1449 C TRP A 96 12.322 -11.615 -0.121 1.00 0.00 C ATOM 1450 O TRP A 96 12.459 -12.821 -0.315 1.00 0.00 O ATOM 1451 CB TRP A 96 12.072 -9.959 -1.972 1.00 0.00 C ATOM 1452 CG TRP A 96 12.711 -8.808 -2.648 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.138 -7.675 -2.040 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.016 -8.668 -4.034 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.713 -6.847 -2.942 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.650 -7.426 -4.184 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.826 -9.470 -5.160 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.093 -6.963 -5.411 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.267 -9.005 -6.385 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.900 -7.763 -6.497 1.00 0.00 C ATOM 0 H TRP A 96 13.882 -12.220 -1.982 1.00 0.00 H new ATOM 0 HA TRP A 96 13.444 -9.831 -0.366 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.746 -10.685 -2.717 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.180 -9.623 -1.443 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.034 -7.463 -0.986 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.127 -5.939 -2.732 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.345 -10.433 -5.076 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.575 -6.001 -5.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.121 -9.609 -7.268 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.243 -7.431 -7.466 1.00 0.00 H new ATOM 1471 N ASP A 97 11.528 -11.128 0.765 1.00 0.00 N ATOM 1472 CA ASP A 97 10.908 -11.985 1.761 1.00 0.00 C ATOM 1473 C ASP A 97 9.488 -11.540 2.000 1.00 0.00 C ATOM 1474 O ASP A 97 9.156 -10.373 1.740 1.00 0.00 O ATOM 1475 CB ASP A 97 11.728 -11.946 3.073 1.00 0.00 C ATOM 1476 CG ASP A 97 11.223 -12.909 4.140 1.00 0.00 C ATOM 1477 OD1 ASP A 97 10.288 -12.557 4.887 1.00 0.00 O ATOM 1478 OD2 ASP A 97 11.754 -14.041 4.240 1.00 0.00 O ATOM 0 H ASP A 97 11.280 -10.141 0.836 1.00 0.00 H new ATOM 0 HA ASP A 97 10.892 -13.013 1.399 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.768 -12.180 2.848 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.709 -10.932 3.473 1.00 0.00 H new ATOM 1483 N PHE A 98 8.662 -12.437 2.519 1.00 0.00 N ATOM 1484 CA PHE A 98 7.260 -12.161 2.727 1.00 0.00 C ATOM 1485 C PHE A 98 7.036 -11.191 3.877 1.00 0.00 C ATOM 1486 O PHE A 98 5.983 -10.628 3.999 1.00 0.00 O ATOM 1487 CB PHE A 98 6.418 -13.451 2.881 1.00 0.00 C ATOM 1488 CG PHE A 98 6.298 -14.005 4.245 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.221 -14.884 4.750 1.00 0.00 C ATOM 1490 CD2 PHE A 98 5.231 -13.631 5.021 1.00 0.00 C ATOM 1491 CE1 PHE A 98 7.071 -15.386 6.022 1.00 0.00 C ATOM 1492 CE2 PHE A 98 5.069 -14.116 6.278 1.00 0.00 C ATOM 1493 CZ PHE A 98 5.991 -14.999 6.794 1.00 0.00 C ATOM 0 H PHE A 98 8.950 -13.373 2.805 1.00 0.00 H new ATOM 0 HA PHE A 98 6.904 -11.669 1.822 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.415 -13.249 2.506 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.850 -14.218 2.239 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.067 -15.183 4.149 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.505 -12.937 4.624 1.00 0.00 H new ATOM 0 HE1 PHE A 98 7.796 -16.082 6.417 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.220 -13.811 6.872 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.871 -15.387 7.795 1.00 0.00 H new ATOM 1503 N ASP A 99 8.003 -11.063 4.749 1.00 0.00 N ATOM 1504 CA ASP A 99 7.917 -10.094 5.834 1.00 0.00 C ATOM 1505 C ASP A 99 7.995 -8.701 5.267 1.00 0.00 C ATOM 1506 O ASP A 99 7.204 -7.815 5.623 1.00 0.00 O ATOM 1507 CB ASP A 99 9.060 -10.273 6.817 1.00 0.00 C ATOM 1508 CG ASP A 99 8.956 -9.315 7.980 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.467 -8.170 7.908 1.00 0.00 O ATOM 1510 OD2 ASP A 99 8.363 -9.687 8.990 1.00 0.00 O ATOM 0 H ASP A 99 8.862 -11.613 4.737 1.00 0.00 H new ATOM 0 HA ASP A 99 6.971 -10.250 6.353 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.062 -11.297 7.189 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.009 -10.119 6.303 1.00 0.00 H new ATOM 1515 N MET A 100 8.958 -8.518 4.368 1.00 0.00 N ATOM 1516 CA MET A 100 9.161 -7.225 3.731 1.00 0.00 C ATOM 1517 C MET A 100 8.055 -6.946 2.750 1.00 0.00 C ATOM 1518 O MET A 100 7.567 -5.823 2.655 1.00 0.00 O ATOM 1519 CB MET A 100 10.545 -7.103 3.064 1.00 0.00 C ATOM 1520 CG MET A 100 11.689 -7.292 4.036 1.00 0.00 C ATOM 1521 SD MET A 100 13.319 -7.040 3.304 1.00 0.00 S ATOM 1522 CE MET A 100 13.400 -8.319 2.055 1.00 0.00 C ATOM 0 H MET A 100 9.606 -9.246 4.067 1.00 0.00 H new ATOM 0 HA MET A 100 9.133 -6.469 4.516 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.625 -7.844 2.269 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.631 -6.122 2.596 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.564 -6.599 4.868 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.639 -8.299 4.450 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.415 -8.380 1.662 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.124 -9.277 2.496 1.00 0.00 H new ATOM 0 HE3 MET A 100 12.711 -8.081 1.245 1.00 0.00 H new ATOM 1532 N LEU A 101 7.636 -7.970 2.044 1.00 0.00 N ATOM 1533 CA LEU A 101 6.550 -7.826 1.136 1.00 0.00 C ATOM 1534 C LEU A 101 5.267 -8.130 1.908 1.00 0.00 C ATOM 1535 O LEU A 101 4.826 -9.265 1.967 1.00 0.00 O ATOM 1536 CB LEU A 101 6.771 -8.769 -0.084 1.00 0.00 C ATOM 1537 CG LEU A 101 5.883 -8.591 -1.335 1.00 0.00 C ATOM 1538 CD1 LEU A 101 6.520 -9.292 -2.514 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.513 -9.181 -1.122 1.00 0.00 C ATOM 0 H LEU A 101 8.038 -8.906 2.089 1.00 0.00 H new ATOM 0 HA LEU A 101 6.477 -6.815 0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.809 -8.663 -0.399 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.647 -9.794 0.265 1.00 0.00 H new ATOM 0 HG LEU A 101 5.787 -7.522 -1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.892 -9.165 -3.396 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.504 -8.863 -2.705 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.624 -10.354 -2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.912 -9.040 -2.020 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.605 -10.246 -0.911 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.030 -8.684 -0.281 1.00 0.00 H new ATOM 1551 N THR A 102 4.803 -7.095 2.597 1.00 0.00 N ATOM 1552 CA THR A 102 3.557 -6.969 3.385 1.00 0.00 C ATOM 1553 C THR A 102 3.839 -6.038 4.542 1.00 0.00 C ATOM 1554 O THR A 102 4.927 -5.472 4.637 1.00 0.00 O ATOM 1555 CB THR A 102 2.968 -8.269 4.016 1.00 0.00 C ATOM 1556 OG1 THR A 102 3.959 -9.092 4.601 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.080 -9.039 3.082 1.00 0.00 C ATOM 0 H THR A 102 5.337 -6.226 2.629 1.00 0.00 H new ATOM 0 HA THR A 102 2.818 -6.626 2.661 1.00 0.00 H new ATOM 0 HB THR A 102 2.325 -7.923 4.826 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.489 -9.517 3.895 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.706 -9.930 3.587 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.240 -8.414 2.780 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.648 -9.334 2.200 1.00 0.00 H new ATOM 1565 N GLY A 103 2.884 -5.902 5.432 1.00 0.00 N ATOM 1566 CA GLY A 103 3.066 -5.075 6.576 1.00 0.00 C ATOM 1567 C GLY A 103 3.420 -5.898 7.782 1.00 0.00 C ATOM 1568 O GLY A 103 2.801 -5.756 8.837 1.00 0.00 O ATOM 0 H GLY A 103 1.974 -6.360 5.375 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.855 -4.348 6.382 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.154 -4.511 6.771 1.00 0.00 H new ATOM 1572 N SER A 104 4.392 -6.781 7.640 1.00 0.00 N ATOM 1573 CA SER A 104 4.798 -7.625 8.744 1.00 0.00 C ATOM 1574 C SER A 104 5.721 -6.810 9.670 1.00 0.00 C ATOM 1575 O SER A 104 5.517 -6.741 10.885 1.00 0.00 O ATOM 1576 CB SER A 104 5.478 -8.873 8.203 1.00 0.00 C ATOM 1577 OG SER A 104 4.634 -9.526 7.239 1.00 0.00 O ATOM 0 H SER A 104 4.911 -6.930 6.775 1.00 0.00 H new ATOM 0 HA SER A 104 3.937 -7.953 9.326 1.00 0.00 H new ATOM 0 HB2 SER A 104 6.429 -8.606 7.742 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.702 -9.557 9.022 1.00 0.00 H new ATOM 0 HG SER A 104 4.670 -9.039 6.389 1.00 0.00 H new ATOM 1583 N GLY A 105 6.691 -6.169 9.055 1.00 0.00 N ATOM 1584 CA GLY A 105 7.520 -5.212 9.761 1.00 0.00 C ATOM 1585 C GLY A 105 8.576 -5.786 10.676 1.00 0.00 C ATOM 1586 O GLY A 105 8.900 -5.164 11.686 1.00 0.00 O ATOM 0 H GLY A 105 6.926 -6.291 8.070 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.014 -4.578 9.024 1.00 0.00 H new ATOM 0 HA3 GLY A 105 6.870 -4.567 10.352 1.00 0.00 H new ATOM 1590 N ASN A 106 9.139 -6.922 10.343 1.00 0.00 N ATOM 1591 CA ASN A 106 10.210 -7.469 11.177 1.00 0.00 C ATOM 1592 C ASN A 106 11.549 -7.221 10.520 1.00 0.00 C ATOM 1593 O ASN A 106 12.507 -6.802 11.170 1.00 0.00 O ATOM 1594 CB ASN A 106 10.023 -8.960 11.497 1.00 0.00 C ATOM 1595 CG ASN A 106 8.740 -9.239 12.262 1.00 0.00 C ATOM 1596 OD1 ASN A 106 8.711 -9.203 13.487 1.00 0.00 O ATOM 1597 ND2 ASN A 106 7.684 -9.527 11.553 1.00 0.00 N ATOM 0 H ASN A 106 8.891 -7.481 9.527 1.00 0.00 H new ATOM 0 HA ASN A 106 10.171 -6.949 12.134 1.00 0.00 H new ATOM 0 HB2 ASN A 106 10.018 -9.529 10.567 1.00 0.00 H new ATOM 0 HB3 ASN A 106 10.873 -9.311 12.081 1.00 0.00 H new ATOM 0 HD21 ASN A 106 6.799 -9.731 12.017 1.00 0.00 H new ATOM 0 HD22 ASN A 106 7.743 -9.548 10.535 1.00 0.00 H new ATOM 1604 N TYR A 107 11.611 -7.443 9.224 1.00 0.00 N ATOM 1605 CA TYR A 107 12.830 -7.170 8.458 1.00 0.00 C ATOM 1606 C TYR A 107 12.562 -5.958 7.585 1.00 0.00 C ATOM 1607 O TYR A 107 13.430 -5.477 6.873 1.00 0.00 O ATOM 1608 CB TYR A 107 13.208 -8.342 7.538 1.00 0.00 C ATOM 1609 CG TYR A 107 13.220 -9.703 8.182 1.00 0.00 C ATOM 1610 CD1 TYR A 107 13.954 -9.967 9.329 1.00 0.00 C ATOM 1611 CD2 TYR A 107 12.500 -10.733 7.617 1.00 0.00 C ATOM 1612 CE1 TYR A 107 13.957 -11.227 9.895 1.00 0.00 C ATOM 1613 CE2 TYR A 107 12.492 -11.985 8.162 1.00 0.00 C ATOM 1614 CZ TYR A 107 13.222 -12.237 9.306 1.00 0.00 C ATOM 1615 OH TYR A 107 13.216 -13.500 9.867 1.00 0.00 O ATOM 0 H TYR A 107 10.838 -7.811 8.670 1.00 0.00 H new ATOM 0 HA TYR A 107 13.650 -7.009 9.158 1.00 0.00 H new ATOM 0 HB2 TYR A 107 12.509 -8.363 6.702 1.00 0.00 H new ATOM 0 HB3 TYR A 107 14.197 -8.149 7.122 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.531 -9.177 9.786 1.00 0.00 H new ATOM 0 HD2 TYR A 107 11.928 -10.545 6.721 1.00 0.00 H new ATOM 0 HE1 TYR A 107 14.529 -11.421 10.790 1.00 0.00 H new ATOM 0 HE2 TYR A 107 11.917 -12.774 7.700 1.00 0.00 H new ATOM 0 HH TYR A 107 12.649 -14.093 9.331 1.00 0.00 H new ATOM 1625 N SER A 108 11.345 -5.499 7.644 1.00 0.00 N ATOM 1626 CA SER A 108 10.910 -4.380 6.856 1.00 0.00 C ATOM 1627 C SER A 108 11.145 -3.095 7.670 1.00 0.00 C ATOM 1628 O SER A 108 11.820 -2.158 7.209 1.00 0.00 O ATOM 1629 CB SER A 108 9.423 -4.560 6.498 1.00 0.00 C ATOM 1630 OG SER A 108 8.975 -3.598 5.565 1.00 0.00 O ATOM 0 H SER A 108 10.621 -5.893 8.244 1.00 0.00 H new ATOM 0 HA SER A 108 11.472 -4.313 5.925 1.00 0.00 H new ATOM 0 HB2 SER A 108 9.268 -5.559 6.089 1.00 0.00 H new ATOM 0 HB3 SER A 108 8.822 -4.490 7.405 1.00 0.00 H new ATOM 0 HG SER A 108 8.028 -3.751 5.366 1.00 0.00 H new ATOM 1636 N SER A 109 10.632 -3.093 8.919 1.00 0.00 N ATOM 1637 CA SER A 109 10.724 -1.954 9.842 1.00 0.00 C ATOM 1638 C SER A 109 10.236 -0.656 9.149 1.00 0.00 C ATOM 1639 O SER A 109 9.499 -0.716 8.185 1.00 0.00 O ATOM 1640 CB SER A 109 12.178 -1.819 10.301 1.00 0.00 C ATOM 1641 OG SER A 109 12.672 -3.067 10.763 1.00 0.00 O ATOM 0 H SER A 109 10.138 -3.893 9.314 1.00 0.00 H new ATOM 0 HA SER A 109 10.084 -2.122 10.709 1.00 0.00 H new ATOM 0 HB2 SER A 109 12.794 -1.460 9.476 1.00 0.00 H new ATOM 0 HB3 SER A 109 12.247 -1.077 11.097 1.00 0.00 H new ATOM 0 HG SER A 109 13.603 -2.964 11.051 1.00 0.00 H new ATOM 1647 N THR A 110 10.550 0.493 9.701 1.00 0.00 N ATOM 1648 CA THR A 110 10.343 1.724 8.975 1.00 0.00 C ATOM 1649 C THR A 110 11.527 1.908 7.998 1.00 0.00 C ATOM 1650 O THR A 110 11.396 2.464 6.915 1.00 0.00 O ATOM 1651 CB THR A 110 10.254 2.930 9.937 1.00 0.00 C ATOM 1652 OG1 THR A 110 9.305 2.638 10.957 1.00 0.00 O ATOM 1653 CG2 THR A 110 9.826 4.205 9.190 1.00 0.00 C ATOM 0 H THR A 110 10.944 0.601 10.636 1.00 0.00 H new ATOM 0 HA THR A 110 9.401 1.672 8.429 1.00 0.00 H new ATOM 0 HB THR A 110 11.238 3.104 10.371 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.243 3.397 11.573 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.772 5.037 9.892 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.555 4.433 8.412 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.848 4.049 8.736 1.00 0.00 H new ATOM 1661 N ASP A 111 12.658 1.369 8.392 1.00 0.00 N ATOM 1662 CA ASP A 111 13.917 1.550 7.681 1.00 0.00 C ATOM 1663 C ASP A 111 13.987 0.876 6.315 1.00 0.00 C ATOM 1664 O ASP A 111 14.064 1.557 5.309 1.00 0.00 O ATOM 1665 CB ASP A 111 15.096 1.104 8.546 1.00 0.00 C ATOM 1666 CG ASP A 111 16.437 1.283 7.850 1.00 0.00 C ATOM 1667 OD1 ASP A 111 16.963 2.412 7.821 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.984 0.301 7.339 1.00 0.00 O ATOM 0 H ASP A 111 12.738 0.785 9.224 1.00 0.00 H new ATOM 0 HA ASP A 111 13.976 2.620 7.484 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.095 1.673 9.475 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.968 0.055 8.814 1.00 0.00 H new ATOM 1673 N ALA A 112 13.845 -0.426 6.268 1.00 0.00 N ATOM 1674 CA ALA A 112 14.174 -1.185 5.058 1.00 0.00 C ATOM 1675 C ALA A 112 13.168 -0.933 4.005 1.00 0.00 C ATOM 1676 O ALA A 112 13.475 -0.945 2.812 1.00 0.00 O ATOM 1677 CB ALA A 112 14.271 -2.675 5.346 1.00 0.00 C ATOM 0 H ALA A 112 13.505 -0.993 7.045 1.00 0.00 H new ATOM 0 HA ALA A 112 15.149 -0.847 4.707 1.00 0.00 H new ATOM 0 HB1 ALA A 112 14.516 -3.208 4.427 1.00 0.00 H new ATOM 0 HB2 ALA A 112 15.050 -2.852 6.087 1.00 0.00 H new ATOM 0 HB3 ALA A 112 13.316 -3.034 5.730 1.00 0.00 H new ATOM 1683 N GLN A 113 11.977 -0.649 4.446 1.00 0.00 N ATOM 1684 CA GLN A 113 10.925 -0.362 3.559 1.00 0.00 C ATOM 1685 C GLN A 113 11.089 1.027 2.990 1.00 0.00 C ATOM 1686 O GLN A 113 10.822 1.236 1.874 1.00 0.00 O ATOM 1687 CB GLN A 113 9.579 -0.571 4.230 1.00 0.00 C ATOM 1688 CG GLN A 113 9.253 0.380 5.378 1.00 0.00 C ATOM 1689 CD GLN A 113 8.699 1.732 4.927 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.011 1.826 3.951 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.102 2.786 5.564 1.00 0.00 N ATOM 0 H GLN A 113 11.724 -0.614 5.433 1.00 0.00 H new ATOM 0 HA GLN A 113 10.960 -1.058 2.721 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.799 -0.478 3.474 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.537 -1.593 4.607 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.527 -0.097 6.037 1.00 0.00 H new ATOM 0 HG3 GLN A 113 10.156 0.547 5.966 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.687 2.688 6.393 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.834 3.714 5.236 1.00 0.00 H new ATOM 1700 N MET A 114 11.600 1.977 3.768 1.00 0.00 N ATOM 1701 CA MET A 114 11.808 3.319 3.230 1.00 0.00 C ATOM 1702 C MET A 114 12.931 3.293 2.193 1.00 0.00 C ATOM 1703 O MET A 114 13.070 4.190 1.372 1.00 0.00 O ATOM 1704 CB MET A 114 12.032 4.356 4.348 1.00 0.00 C ATOM 1705 CG MET A 114 12.211 5.793 3.864 1.00 0.00 C ATOM 1706 SD MET A 114 12.169 7.002 5.203 1.00 0.00 S ATOM 1707 CE MET A 114 13.507 6.427 6.242 1.00 0.00 C ATOM 0 H MET A 114 11.871 1.851 4.743 1.00 0.00 H new ATOM 0 HA MET A 114 10.901 3.642 2.719 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.184 4.321 5.032 1.00 0.00 H new ATOM 0 HB3 MET A 114 12.914 4.068 4.920 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.161 5.877 3.337 1.00 0.00 H new ATOM 0 HG3 MET A 114 11.426 6.028 3.145 1.00 0.00 H new ATOM 0 HE1 MET A 114 13.740 7.186 6.989 1.00 0.00 H new ATOM 0 HE2 MET A 114 13.209 5.506 6.742 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.388 6.238 5.629 1.00 0.00 H new ATOM 1717 N GLN A 115 13.703 2.218 2.223 1.00 0.00 N ATOM 1718 CA GLN A 115 14.709 1.977 1.223 1.00 0.00 C ATOM 1719 C GLN A 115 14.152 0.942 0.222 1.00 0.00 C ATOM 1720 O GLN A 115 14.909 0.084 -0.240 1.00 0.00 O ATOM 1721 CB GLN A 115 16.002 1.391 1.846 1.00 0.00 C ATOM 1722 CG GLN A 115 16.287 1.767 3.289 1.00 0.00 C ATOM 1723 CD GLN A 115 16.287 3.252 3.603 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.643 4.100 2.786 1.00 0.00 O ATOM 1725 NE2 GLN A 115 15.831 3.557 4.795 1.00 0.00 N ATOM 0 H GLN A 115 13.644 1.496 2.941 1.00 0.00 H new ATOM 0 HA GLN A 115 14.952 2.924 0.741 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.951 0.304 1.780 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.849 1.708 1.237 1.00 0.00 H new ATOM 0 HG2 GLN A 115 15.545 1.282 3.923 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.259 1.358 3.565 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.548 2.817 5.437 1.00 0.00 H new ATOM 0 HE22 GLN A 115 15.759 4.534 5.079 1.00 0.00 H new ATOM 1734 N TYR A 116 12.803 1.008 -0.082 1.00 0.00 N ATOM 1735 CA TYR A 116 12.121 0.124 -1.039 1.00 0.00 C ATOM 1736 C TYR A 116 12.976 -0.147 -2.274 1.00 0.00 C ATOM 1737 O TYR A 116 13.227 0.760 -3.077 1.00 0.00 O ATOM 1738 CB TYR A 116 10.786 0.753 -1.548 1.00 0.00 C ATOM 1739 CG TYR A 116 9.565 0.638 -0.648 1.00 0.00 C ATOM 1740 CD1 TYR A 116 9.077 -0.605 -0.289 1.00 0.00 C ATOM 1741 CD2 TYR A 116 8.885 1.771 -0.175 1.00 0.00 C ATOM 1742 CE1 TYR A 116 7.964 -0.732 0.512 1.00 0.00 C ATOM 1743 CE2 TYR A 116 7.767 1.646 0.632 1.00 0.00 C ATOM 1744 CZ TYR A 116 7.312 0.389 0.967 1.00 0.00 C ATOM 1745 OH TYR A 116 6.213 0.247 1.775 1.00 0.00 O ATOM 0 H TYR A 116 12.178 1.690 0.347 1.00 0.00 H new ATOM 0 HA TYR A 116 11.932 -0.802 -0.496 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.964 1.811 -1.738 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.542 0.293 -2.506 1.00 0.00 H new ATOM 0 HD1 TYR A 116 9.578 -1.493 -0.644 1.00 0.00 H new ATOM 0 HD2 TYR A 116 9.239 2.755 -0.445 1.00 0.00 H new ATOM 0 HE1 TYR A 116 7.603 -1.713 0.783 1.00 0.00 H new ATOM 0 HE2 TYR A 116 7.256 2.525 0.996 1.00 0.00 H new ATOM 0 HH TYR A 116 5.837 1.130 1.974 1.00 0.00 H new ATOM 1755 N ASP A 117 13.440 -1.357 -2.412 1.00 0.00 N ATOM 1756 CA ASP A 117 14.218 -1.748 -3.574 1.00 0.00 C ATOM 1757 C ASP A 117 13.247 -1.947 -4.734 1.00 0.00 C ATOM 1758 O ASP A 117 12.127 -2.400 -4.492 1.00 0.00 O ATOM 1759 CB ASP A 117 14.973 -3.040 -3.258 1.00 0.00 C ATOM 1760 CG ASP A 117 15.949 -3.451 -4.331 1.00 0.00 C ATOM 1761 OD1 ASP A 117 17.017 -2.818 -4.460 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.679 -4.424 -5.029 1.00 0.00 O ATOM 0 H ASP A 117 13.296 -2.103 -1.731 1.00 0.00 H new ATOM 0 HA ASP A 117 14.950 -0.986 -3.840 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.511 -2.915 -2.318 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.252 -3.844 -3.108 1.00 0.00 H new ATOM 1767 N PRO A 118 13.627 -1.579 -5.994 1.00 0.00 N ATOM 1768 CA PRO A 118 12.744 -1.641 -7.195 1.00 0.00 C ATOM 1769 C PRO A 118 11.845 -2.890 -7.326 1.00 0.00 C ATOM 1770 O PRO A 118 10.660 -2.773 -7.712 1.00 0.00 O ATOM 1771 CB PRO A 118 13.735 -1.593 -8.345 1.00 0.00 C ATOM 1772 CG PRO A 118 14.829 -0.733 -7.843 1.00 0.00 C ATOM 1773 CD PRO A 118 14.956 -1.026 -6.368 1.00 0.00 C ATOM 0 HA PRO A 118 12.015 -0.832 -7.154 1.00 0.00 H new ATOM 0 HB2 PRO A 118 14.097 -2.589 -8.601 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.282 -1.177 -9.245 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.762 -0.948 -8.364 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.604 0.320 -8.012 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.755 -1.740 -6.171 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.187 -0.124 -5.801 1.00 0.00 H new ATOM 1781 N GLY A 119 12.341 -4.046 -6.921 1.00 0.00 N ATOM 1782 CA GLY A 119 11.573 -5.268 -7.148 1.00 0.00 C ATOM 1783 C GLY A 119 10.630 -5.514 -5.989 1.00 0.00 C ATOM 1784 O GLY A 119 9.519 -6.016 -6.159 1.00 0.00 O ATOM 0 H GLY A 119 13.237 -4.170 -6.450 1.00 0.00 H new ATOM 0 HA2 GLY A 119 11.007 -5.184 -8.076 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.249 -6.115 -7.263 1.00 0.00 H new ATOM 1788 N LEU A 120 11.085 -5.097 -4.830 1.00 0.00 N ATOM 1789 CA LEU A 120 10.322 -5.227 -3.611 1.00 0.00 C ATOM 1790 C LEU A 120 9.109 -4.315 -3.759 1.00 0.00 C ATOM 1791 O LEU A 120 7.975 -4.766 -3.757 1.00 0.00 O ATOM 1792 CB LEU A 120 11.185 -4.747 -2.420 1.00 0.00 C ATOM 1793 CG LEU A 120 10.540 -4.820 -1.036 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.094 -6.245 -0.722 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.501 -4.337 0.030 1.00 0.00 C ATOM 0 H LEU A 120 11.997 -4.657 -4.706 1.00 0.00 H new ATOM 0 HA LEU A 120 10.021 -6.260 -3.434 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.100 -5.339 -2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.478 -3.714 -2.606 1.00 0.00 H new ATOM 0 HG LEU A 120 9.665 -4.170 -1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.638 -6.274 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.367 -6.571 -1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.958 -6.910 -0.743 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.021 -4.398 1.007 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.394 -4.962 0.025 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.780 -3.303 -0.173 1.00 0.00 H new ATOM 1807 N PHE A 121 9.419 -3.036 -3.986 1.00 0.00 N ATOM 1808 CA PHE A 121 8.425 -1.970 -4.149 1.00 0.00 C ATOM 1809 C PHE A 121 7.316 -2.350 -5.144 1.00 0.00 C ATOM 1810 O PHE A 121 6.133 -2.287 -4.808 1.00 0.00 O ATOM 1811 CB PHE A 121 9.123 -0.705 -4.635 1.00 0.00 C ATOM 1812 CG PHE A 121 8.244 0.520 -4.677 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.589 0.957 -3.540 1.00 0.00 C ATOM 1814 CD2 PHE A 121 8.078 1.231 -5.852 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.786 2.080 -3.569 1.00 0.00 C ATOM 1816 CE2 PHE A 121 7.280 2.354 -5.883 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.631 2.779 -4.740 1.00 0.00 C ATOM 0 H PHE A 121 10.381 -2.706 -4.063 1.00 0.00 H new ATOM 0 HA PHE A 121 7.955 -1.807 -3.179 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.975 -0.503 -3.985 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.520 -0.886 -5.634 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.707 0.412 -2.615 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.578 0.903 -6.752 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.281 2.408 -2.672 1.00 0.00 H new ATOM 0 HE2 PHE A 121 7.161 2.904 -6.805 1.00 0.00 H new ATOM 0 HZ PHE A 121 6.004 3.658 -4.768 1.00 0.00 H new ATOM 1827 N ALA A 122 7.716 -2.773 -6.345 1.00 0.00 N ATOM 1828 CA ALA A 122 6.769 -3.098 -7.403 1.00 0.00 C ATOM 1829 C ALA A 122 5.840 -4.232 -7.011 1.00 0.00 C ATOM 1830 O ALA A 122 4.619 -4.148 -7.206 1.00 0.00 O ATOM 1831 CB ALA A 122 7.505 -3.447 -8.681 1.00 0.00 C ATOM 0 H ALA A 122 8.694 -2.897 -6.606 1.00 0.00 H new ATOM 0 HA ALA A 122 6.155 -2.213 -7.569 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.784 -3.687 -9.462 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.111 -2.597 -8.996 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.150 -4.308 -8.506 1.00 0.00 H new ATOM 1837 N GLN A 123 6.399 -5.270 -6.417 1.00 0.00 N ATOM 1838 CA GLN A 123 5.614 -6.430 -6.085 1.00 0.00 C ATOM 1839 C GLN A 123 4.647 -6.170 -4.942 1.00 0.00 C ATOM 1840 O GLN A 123 3.491 -6.606 -5.002 1.00 0.00 O ATOM 1841 CB GLN A 123 6.479 -7.659 -5.806 1.00 0.00 C ATOM 1842 CG GLN A 123 7.227 -8.194 -7.025 1.00 0.00 C ATOM 1843 CD GLN A 123 6.309 -8.495 -8.214 1.00 0.00 C ATOM 1844 OE1 GLN A 123 5.119 -8.829 -8.059 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.853 -8.398 -9.400 1.00 0.00 N ATOM 0 H GLN A 123 7.384 -5.328 -6.159 1.00 0.00 H new ATOM 0 HA GLN A 123 5.017 -6.647 -6.970 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.204 -7.410 -5.031 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.845 -8.451 -5.407 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.979 -7.466 -7.330 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.759 -9.103 -6.746 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.831 -8.122 -9.492 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.299 -8.599 -10.233 1.00 0.00 H new ATOM 1854 N ILE A 124 5.095 -5.448 -3.901 1.00 0.00 N ATOM 1855 CA ILE A 124 4.203 -5.186 -2.772 1.00 0.00 C ATOM 1856 C ILE A 124 3.055 -4.283 -3.238 1.00 0.00 C ATOM 1857 O ILE A 124 1.896 -4.535 -2.927 1.00 0.00 O ATOM 1858 CB ILE A 124 4.873 -4.485 -1.528 1.00 0.00 C ATOM 1859 CG1 ILE A 124 6.330 -4.873 -1.338 1.00 0.00 C ATOM 1860 CG2 ILE A 124 4.123 -4.920 -0.275 1.00 0.00 C ATOM 1861 CD1 ILE A 124 7.019 -4.101 -0.244 1.00 0.00 C ATOM 0 H ILE A 124 6.032 -5.052 -3.822 1.00 0.00 H new ATOM 0 HA ILE A 124 3.873 -6.171 -2.441 1.00 0.00 H new ATOM 0 HB ILE A 124 4.827 -3.410 -1.701 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.388 -5.938 -1.112 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.865 -4.716 -2.275 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.570 -4.447 0.599 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.078 -4.622 -0.355 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.184 -6.003 -0.172 1.00 0.00 H new ATOM 0 HD11 ILE A 124 8.055 -4.429 -0.164 1.00 0.00 H new ATOM 0 HD12 ILE A 124 6.993 -3.037 -0.478 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.508 -4.277 0.703 1.00 0.00 H new ATOM 1873 N GLN A 125 3.398 -3.256 -4.026 1.00 0.00 N ATOM 1874 CA GLN A 125 2.436 -2.252 -4.488 1.00 0.00 C ATOM 1875 C GLN A 125 1.318 -2.883 -5.317 1.00 0.00 C ATOM 1876 O GLN A 125 0.119 -2.629 -5.075 1.00 0.00 O ATOM 1877 CB GLN A 125 3.118 -1.188 -5.349 1.00 0.00 C ATOM 1878 CG GLN A 125 2.245 0.028 -5.563 1.00 0.00 C ATOM 1879 CD GLN A 125 2.747 0.988 -6.619 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.937 1.075 -6.899 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.839 1.747 -7.186 1.00 0.00 N ATOM 0 H GLN A 125 4.349 -3.099 -4.360 1.00 0.00 H new ATOM 0 HA GLN A 125 2.015 -1.796 -3.592 1.00 0.00 H new ATOM 0 HB2 GLN A 125 4.050 -0.883 -4.874 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.379 -1.619 -6.316 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.244 -0.304 -5.839 1.00 0.00 H new ATOM 0 HG3 GLN A 125 2.154 0.564 -4.618 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.857 1.647 -6.928 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.115 2.437 -7.885 1.00 0.00 H new ATOM 1890 N ALA A 126 1.722 -3.684 -6.300 1.00 0.00 N ATOM 1891 CA ALA A 126 0.799 -4.331 -7.224 1.00 0.00 C ATOM 1892 C ALA A 126 -0.160 -5.237 -6.487 1.00 0.00 C ATOM 1893 O ALA A 126 -1.387 -5.157 -6.663 1.00 0.00 O ATOM 1894 CB ALA A 126 1.572 -5.128 -8.258 1.00 0.00 C ATOM 0 H ALA A 126 2.702 -3.902 -6.477 1.00 0.00 H new ATOM 0 HA ALA A 126 0.220 -3.555 -7.725 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.874 -5.608 -8.944 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.228 -4.460 -8.816 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.170 -5.890 -7.758 1.00 0.00 H new ATOM 1900 N ALA A 127 0.399 -6.063 -5.618 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.381 -7.017 -4.861 1.00 0.00 C ATOM 1902 C ALA A 127 -1.323 -6.306 -3.897 1.00 0.00 C ATOM 1903 O ALA A 127 -2.451 -6.781 -3.650 1.00 0.00 O ATOM 1904 CB ALA A 127 0.527 -7.980 -4.121 1.00 0.00 C ATOM 0 H ALA A 127 1.400 -6.088 -5.421 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.989 -7.592 -5.560 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.078 -8.690 -3.557 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.146 -8.520 -4.838 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.166 -7.424 -3.436 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.870 -5.166 -3.371 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.652 -4.389 -2.450 1.00 0.00 C ATOM 1912 C ALA A 128 -2.934 -3.908 -3.093 1.00 0.00 C ATOM 1913 O ALA A 128 -3.964 -4.331 -2.703 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.859 -3.219 -1.919 1.00 0.00 C ATOM 0 H ALA A 128 0.047 -4.770 -3.580 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.912 -5.036 -1.612 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.475 -2.648 -1.224 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.028 -3.585 -1.402 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.557 -2.578 -2.747 1.00 0.00 H new ATOM 1920 N THR A 129 -2.865 -3.097 -4.127 1.00 0.00 N ATOM 1921 CA THR A 129 -4.115 -2.590 -4.735 1.00 0.00 C ATOM 1922 C THR A 129 -5.011 -3.737 -5.296 1.00 0.00 C ATOM 1923 O THR A 129 -6.303 -3.678 -5.238 1.00 0.00 O ATOM 1924 CB THR A 129 -3.853 -1.466 -5.804 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.066 -1.098 -6.484 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.776 -1.860 -6.813 1.00 0.00 C ATOM 0 H THR A 129 -2.002 -2.774 -4.564 1.00 0.00 H new ATOM 0 HA THR A 129 -4.677 -2.122 -3.927 1.00 0.00 H new ATOM 0 HB THR A 129 -3.484 -0.599 -5.255 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.249 -0.147 -6.335 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.634 -1.050 -7.528 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.839 -2.050 -6.289 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.086 -2.761 -7.342 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.347 -4.837 -5.696 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.012 -5.967 -6.320 1.00 0.00 C ATOM 1936 C LYS A 130 -5.895 -6.640 -5.285 1.00 0.00 C ATOM 1937 O LYS A 130 -6.819 -7.342 -5.612 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.987 -6.966 -6.885 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.574 -8.004 -7.842 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.612 -7.529 -9.319 1.00 0.00 C ATOM 1941 CE LYS A 130 -5.435 -6.260 -9.556 1.00 0.00 C ATOM 1942 NZ LYS A 130 -5.482 -5.915 -10.991 1.00 0.00 N ATOM 0 H LYS A 130 -3.339 -4.955 -5.591 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.619 -5.615 -7.154 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.206 -6.411 -7.405 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.509 -7.485 -6.054 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.986 -8.920 -7.778 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.586 -8.251 -7.522 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -3.591 -7.353 -9.657 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -5.018 -8.331 -9.935 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.448 -6.405 -9.181 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -5.002 -5.432 -8.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -6.046 -5.051 -11.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -4.516 -5.754 -11.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -5.917 -6.696 -11.522 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.524 -6.447 -4.043 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.273 -6.782 -2.892 1.00 0.00 C ATOM 1958 C ALA A 131 -7.251 -5.664 -2.627 1.00 0.00 C ATOM 1959 O ALA A 131 -8.454 -5.873 -2.703 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.270 -6.898 -1.792 1.00 0.00 C ATOM 0 H ALA A 131 -4.626 -6.021 -3.811 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.841 -7.707 -2.993 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.777 -7.157 -0.863 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.547 -7.675 -2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.752 -5.947 -1.670 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.711 -4.455 -2.484 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.413 -3.230 -2.072 1.00 0.00 C ATOM 1968 C TRP A 132 -8.424 -2.676 -3.114 1.00 0.00 C ATOM 1969 O TRP A 132 -8.608 -1.469 -3.248 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.456 -2.113 -1.586 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.570 -2.509 -0.442 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.129 -3.731 -0.216 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.028 -1.707 0.625 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.274 -3.771 0.769 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.190 -2.562 1.346 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.118 -0.363 1.037 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.454 -2.145 2.418 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.395 0.024 2.108 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.571 -0.863 2.772 1.00 0.00 C ATOM 0 H TRP A 132 -5.720 -4.290 -2.661 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.008 -3.558 -1.219 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.831 -1.798 -2.422 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.049 -1.248 -1.288 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.439 -4.598 -0.780 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.749 -4.597 1.057 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.748 0.338 0.510 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.806 -2.822 2.955 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.462 1.046 2.452 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.997 -0.504 3.613 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.988 -3.538 -3.894 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.117 -3.152 -4.741 1.00 0.00 C ATOM 1992 C ARG A 133 -11.584 -3.798 -4.473 1.00 0.00 C ATOM 1993 O ARG A 133 -12.533 -3.052 -4.318 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.714 -3.154 -6.245 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.814 -2.718 -7.218 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.861 -3.793 -7.443 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.156 -3.249 -7.919 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.617 -3.379 -9.187 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.841 -3.920 -10.134 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.844 -2.986 -9.501 1.00 0.00 N ATOM 0 H ARG A 133 -8.703 -4.514 -3.977 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.313 -2.135 -4.400 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.855 -2.496 -6.375 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.389 -4.159 -6.516 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.298 -1.821 -6.833 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.363 -2.451 -8.174 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.485 -4.512 -8.171 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.022 -4.337 -6.512 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.737 -2.745 -7.249 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.899 -4.236 -9.903 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.191 -4.016 -11.087 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.449 -2.582 -8.786 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.183 -3.087 -10.458 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.716 -5.152 -4.431 1.00 0.00 N ATOM 2015 CA LYS A 134 -13.062 -5.944 -4.741 1.00 0.00 C ATOM 2016 C LYS A 134 -14.360 -5.695 -3.942 1.00 0.00 C ATOM 2017 O LYS A 134 -15.079 -6.657 -3.628 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.901 -7.460 -4.836 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.617 -7.895 -5.334 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.714 -8.124 -4.174 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.347 -8.152 -4.613 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.072 -9.229 -5.600 1.00 0.00 N ATOM 0 H LYS A 134 -10.939 -5.768 -4.191 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.225 -5.452 -5.700 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.059 -7.892 -3.848 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.682 -7.856 -5.486 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.727 -8.811 -5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.195 -7.143 -6.000 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.851 -7.335 -3.435 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.967 -9.065 -3.686 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.094 -7.189 -5.056 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.697 -8.286 -3.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.046 -9.308 -5.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.440 -10.132 -5.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.537 -9.001 -6.502 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.681 -4.514 -3.620 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.913 -4.269 -2.865 1.00 0.00 C ATOM 2038 C LEU A 135 -17.138 -4.125 -3.779 1.00 0.00 C ATOM 2039 O LEU A 135 -16.994 -4.120 -5.016 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.756 -3.027 -1.991 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.031 -3.198 -0.645 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.805 -4.057 -0.766 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.613 -1.862 -0.158 1.00 0.00 C ATOM 0 H LEU A 135 -14.138 -3.681 -3.847 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.084 -5.140 -2.232 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.221 -2.273 -2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.750 -2.628 -1.790 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.721 -3.683 0.045 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.327 -4.149 0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.088 -5.046 -1.126 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.109 -3.600 -1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.097 -1.968 0.796 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.942 -1.404 -0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.492 -1.231 -0.027 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.372 -4.126 -3.183 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.622 -3.794 -3.899 1.00 0.00 C ATOM 2057 C PRO A 136 -19.635 -2.305 -4.351 1.00 0.00 C ATOM 2058 O PRO A 136 -18.671 -1.817 -4.910 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.707 -4.055 -2.827 1.00 0.00 C ATOM 2060 CG PRO A 136 -20.079 -4.984 -1.869 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.656 -4.558 -1.793 1.00 0.00 C ATOM 0 HA PRO A 136 -19.762 -4.374 -4.811 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.010 -3.129 -2.338 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.603 -4.490 -3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.560 -4.928 -0.892 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.164 -6.017 -2.208 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.514 -3.746 -1.079 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -18.005 -5.375 -1.481 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.685 -1.580 -4.060 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.791 -0.213 -4.510 1.00 0.00 C ATOM 2071 C VAL A 137 -21.674 0.521 -3.533 1.00 0.00 C ATOM 2072 O VAL A 137 -22.480 -0.107 -2.844 1.00 0.00 O ATOM 2073 CB VAL A 137 -21.377 -0.106 -5.976 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -22.837 -0.501 -6.060 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -21.160 1.282 -6.576 1.00 0.00 C ATOM 0 H VAL A 137 -21.480 -1.912 -3.513 1.00 0.00 H new ATOM 0 HA VAL A 137 -19.796 0.230 -4.548 1.00 0.00 H new ATOM 0 HB VAL A 137 -20.816 -0.827 -6.570 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -23.181 -0.407 -7.090 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -22.954 -1.534 -5.732 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -23.428 0.153 -5.419 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -21.577 1.312 -7.583 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -21.656 2.028 -5.955 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -20.092 1.497 -6.619 1.00 0.00 H new ATOM 2085 N LYS A 138 -21.508 1.807 -3.423 1.00 0.00 N ATOM 2086 CA LYS A 138 -22.371 2.574 -2.564 1.00 0.00 C ATOM 2087 C LYS A 138 -23.606 2.970 -3.341 1.00 0.00 C ATOM 2088 O LYS A 138 -24.722 2.635 -2.954 1.00 0.00 O ATOM 2089 CB LYS A 138 -21.659 3.783 -1.963 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.633 3.453 -0.905 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.279 2.922 0.352 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.277 2.814 1.480 1.00 0.00 C ATOM 2093 NZ LYS A 138 -19.221 1.794 1.239 1.00 0.00 N ATOM 0 H LYS A 138 -20.792 2.345 -3.911 1.00 0.00 H new ATOM 0 HA LYS A 138 -22.666 1.957 -1.715 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -21.168 4.334 -2.765 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -22.406 4.448 -1.530 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -19.933 2.714 -1.295 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -20.055 4.346 -0.668 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -22.096 3.580 0.650 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -21.714 1.943 0.154 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.806 3.785 1.631 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.804 2.569 2.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.999 1.307 2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.560 1.101 0.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -18.365 2.260 0.876 1.00 0.00 H new ATOM 2107 N GLY A 139 -23.405 3.645 -4.451 1.00 0.00 N ATOM 2108 CA GLY A 139 -24.505 3.978 -5.306 1.00 0.00 C ATOM 2109 C GLY A 139 -24.313 5.299 -5.992 1.00 0.00 C ATOM 2110 O GLY A 139 -23.626 6.188 -5.475 1.00 0.00 O ATOM 0 H GLY A 139 -22.494 3.969 -4.775 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -24.629 3.196 -6.056 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.423 4.006 -4.719 1.00 0.00 H new ATOM 2114 N ASP A 140 -24.895 5.426 -7.148 1.00 0.00 N ATOM 2115 CA ASP A 140 -24.854 6.656 -7.911 1.00 0.00 C ATOM 2116 C ASP A 140 -26.259 7.142 -8.093 1.00 0.00 C ATOM 2117 O ASP A 140 -27.085 6.385 -8.675 1.00 0.00 O ATOM 2118 CB ASP A 140 -24.202 6.464 -9.280 1.00 0.00 C ATOM 2119 CG ASP A 140 -24.189 7.755 -10.086 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -23.274 8.593 -9.888 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -25.099 7.966 -10.929 1.00 0.00 O ATOM 2122 OXT ASP A 140 -26.578 8.253 -7.654 1.00 0.00 O ATOM 0 H ASP A 140 -25.419 4.676 -7.599 1.00 0.00 H new ATOM 0 HA ASP A 140 -24.252 7.382 -7.364 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -23.180 6.107 -9.149 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -24.740 5.695 -9.834 1.00 0.00 H new TER 2127 ASP A 140