USER MOD reduce.3.24.130724 H: found=0, std=0, add=1354, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1353 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: B 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 104 GLN :FLIP amide:sc= -0.053 F(o=-3.2,f=-1) USER MOD Set 2.2: A 152 ASN :FLIP amide:sc= -0.99 F(o=-2.1!,f=-1) USER MOD Set 3.1: A 44 TYR OH : rot -130:sc= 0.28 USER MOD Set 3.2: A 93 THR OG1 : rot -107:sc= 0.872 USER MOD Set 3.3: A 115 ASN : amide:sc= 0.0918 K(o=1.2,f=0.12) USER MOD Set 4.1: A 23 GLN :FLIP amide:sc= -0.145 X(o=-0.62,f=-0.39) USER MOD Set 4.2: A 75 GLN :FLIP amide:sc= -0.246 F(o=-1.4!,f=-0.39) USER MOD Set 5.1: A 41 LYS NZ :NH3+ -172:sc= -0.413! (180deg=-0.823!) USER MOD Set 5.2: A 100 THR OG1 : rot 110:sc= -1.28 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= 1.25 (180deg=1.18) USER MOD Single : A 3 LYS NZ :NH3+ -127:sc= 1.19 (180deg=0.0677) USER MOD Single : A 5 GLN :FLIP amide:sc= -0.0233 F(o=-2.4!,f=-0.023) USER MOD Single : A 7 ASN : amide:sc= -0.468 X(o=-0.47,f=0) USER MOD Single : A 8 ASN :FLIP amide:sc= -3.1! C(o=-4.1!,f=-3.1!) USER MOD Single : A 14 ASN :FLIP amide:sc= -2.09 F(o=-3.8!,f=-2.1) USER MOD Single : A 16 SER OG : rot 67:sc= 1.22 USER MOD Single : A 19 TYR OH : rot 30:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0.437 K(o=0.44,f=-0.69) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.669 USER MOD Single : A 30 CYS SG : rot -56:sc= -1.76! USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= -2.1 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -4.13! C(o=-4.1!,f=-12!) USER MOD Single : A 59 SER OG : rot 41:sc= 0.17 USER MOD Single : A 70 HIS :FLIP no HE2:sc= 0.627 F(o=-2!,f=0.63) USER MOD Single : A 71 MET CE :methyl 152:sc= -0.87 (180deg=-3!) USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 98 THR OG1 : rot -99:sc= -0.913 USER MOD Single : A 99 CYS SG : rot -71:sc= -1.51 USER MOD Single : A 101 TYR OH : rot 0:sc= 1.79 USER MOD Single : A 111 TYR OH : rot 180:sc= -1.2 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 ASN :FLIP amide:sc= -2.07 F(o=-7.1!,f=-2.1) USER MOD Single : A 117 TYR OH : rot 180:sc= -2.47! USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.0166 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN :FLIP amide:sc= -3.74! C(o=-5!,f=-3.7!) USER MOD Single : A 129 LYS NZ :NH3+ -159:sc= 1.12 (180deg=1.01) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -155:sc= 1.26 (180deg=1.13) USER MOD Single : A 136 GLN :FLIP amide:sc= -0.772 F(o=-1.9!,f=-0.77) USER MOD Single : A 138 ASN : amide:sc= -3.79! C(o=-3.8!,f=-8.2!) USER MOD Single : A 142 SER OG : rot 180:sc= 0.0636 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0.033) USER MOD Single : A 147 THR OG1 : rot 148:sc= 0.696 USER MOD Single : A 150 HIS :FLIP no HE2:sc= 0.122 F(o=-1.6,f=0.12) USER MOD Single : A 156 ASN : amide:sc= -0.691 X(o=-0.69,f=-0.33) USER MOD Single : B 125 GLN :FLIP amide:sc= -0.398 F(o=-2.7!,f=-0.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.614 -1.873 -6.370 1.00 0.00 N ATOM 2 CA MET A 1 -24.085 -3.006 -5.574 1.00 0.00 C ATOM 3 C MET A 1 -22.879 -2.560 -4.757 1.00 0.00 C ATOM 4 O MET A 1 -22.949 -2.475 -3.531 1.00 0.00 O ATOM 5 CB MET A 1 -23.702 -4.181 -6.480 1.00 0.00 C ATOM 6 CG MET A 1 -23.005 -5.312 -5.737 1.00 0.00 C ATOM 7 SD MET A 1 -22.589 -6.706 -6.808 1.00 0.00 S ATOM 8 CE MET A 1 -21.775 -7.794 -5.640 1.00 0.00 C ATOM 0 H1 MET A 1 -25.297 -2.229 -7.069 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.086 -1.195 -5.738 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.830 -1.399 -6.863 1.00 0.00 H new ATOM 0 HA MET A 1 -24.870 -3.339 -4.895 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.601 -4.570 -6.959 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.048 -3.820 -7.274 1.00 0.00 H new ATOM 0 HG2 MET A 1 -22.094 -4.930 -5.276 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.649 -5.660 -4.929 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.458 -8.703 -6.150 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.904 -7.291 -5.220 1.00 0.00 H new ATOM 0 HE3 MET A 1 -22.467 -8.051 -4.838 1.00 0.00 H new ATOM 18 N ALA A 2 -21.771 -2.276 -5.436 1.00 0.00 N ATOM 19 CA ALA A 2 -20.586 -1.766 -4.767 1.00 0.00 C ATOM 20 C ALA A 2 -20.850 -0.353 -4.275 1.00 0.00 C ATOM 21 O ALA A 2 -21.399 0.467 -5.007 1.00 0.00 O ATOM 22 CB ALA A 2 -19.383 -1.801 -5.700 1.00 0.00 C ATOM 0 H ALA A 2 -21.672 -2.391 -6.445 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.358 -2.401 -3.911 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -18.507 -1.415 -5.179 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -19.195 -2.828 -6.013 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -19.584 -1.185 -6.577 1.00 0.00 H new ATOM 28 N LYS A 3 -20.484 -0.073 -3.036 1.00 0.00 N ATOM 29 CA LYS A 3 -20.788 1.215 -2.435 1.00 0.00 C ATOM 30 C LYS A 3 -19.578 2.133 -2.457 1.00 0.00 C ATOM 31 O LYS A 3 -19.699 3.313 -2.178 1.00 0.00 O ATOM 32 CB LYS A 3 -21.260 1.041 -1.001 1.00 0.00 C ATOM 33 CG LYS A 3 -22.034 -0.236 -0.766 1.00 0.00 C ATOM 34 CD LYS A 3 -23.497 -0.063 -0.968 1.00 0.00 C ATOM 35 CE LYS A 3 -24.253 -1.341 -0.676 1.00 0.00 C ATOM 36 NZ LYS A 3 -25.635 -1.063 -0.203 1.00 0.00 N ATOM 0 H LYS A 3 -19.978 -0.717 -2.428 1.00 0.00 H new ATOM 0 HA LYS A 3 -21.584 1.669 -3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -20.395 1.058 -0.339 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -21.886 1.890 -0.729 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -21.667 -1.009 -1.441 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -21.850 -0.586 0.250 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -23.863 0.733 -0.320 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -23.689 0.248 -1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -24.292 -1.955 -1.576 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -23.718 -1.916 0.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -25.801 -1.560 0.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -25.754 -0.040 -0.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -26.318 -1.394 -0.914 1.00 0.00 H new ATOM 50 N VAL A 4 -18.410 1.591 -2.772 1.00 0.00 N ATOM 51 CA VAL A 4 -17.214 2.409 -2.934 1.00 0.00 C ATOM 52 C VAL A 4 -16.366 1.899 -4.079 1.00 0.00 C ATOM 53 O VAL A 4 -15.969 0.736 -4.125 1.00 0.00 O ATOM 54 CB VAL A 4 -16.345 2.503 -1.647 1.00 0.00 C ATOM 55 CG1 VAL A 4 -14.880 2.778 -1.979 1.00 0.00 C ATOM 56 CG2 VAL A 4 -16.851 3.602 -0.740 1.00 0.00 C ATOM 0 H VAL A 4 -18.264 0.592 -2.920 1.00 0.00 H new ATOM 0 HA VAL A 4 -17.573 3.415 -3.152 1.00 0.00 H new ATOM 0 HB VAL A 4 -16.420 1.540 -1.141 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -14.303 2.837 -1.056 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -14.490 1.971 -2.600 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -14.800 3.722 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -16.230 3.651 0.154 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -16.807 4.556 -1.265 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -17.882 3.392 -0.454 1.00 0.00 H new ATOM 66 N GLN A 5 -16.135 2.788 -5.014 1.00 0.00 N ATOM 67 CA GLN A 5 -15.214 2.563 -6.093 1.00 0.00 C ATOM 68 C GLN A 5 -14.173 3.654 -6.016 1.00 0.00 C ATOM 69 O GLN A 5 -14.438 4.791 -6.406 1.00 0.00 O ATOM 70 CB GLN A 5 -15.958 2.629 -7.433 1.00 0.00 C ATOM 71 CG GLN A 5 -15.082 2.463 -8.663 1.00 0.00 C ATOM 72 CD GLN A 5 -14.821 1.013 -9.041 1.00 0.00 C ATOM 73 OE1 GLN A 5 -14.854 0.113 -8.067 1.00 0.00 O flip ATOM 74 NE2 GLN A 5 -14.607 0.703 -10.215 1.00 0.00 N flip ATOM 0 H GLN A 5 -16.590 3.700 -5.044 1.00 0.00 H new ATOM 0 HA GLN A 5 -14.749 1.580 -6.017 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -16.725 1.854 -7.444 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -16.473 3.588 -7.499 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -15.555 2.969 -9.505 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -14.128 2.960 -8.488 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -14.589 1.423 -10.937 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -14.448 -0.273 -10.464 1.00 0.00 H new ATOM 83 N VAL A 6 -13.012 3.352 -5.462 1.00 0.00 N ATOM 84 CA VAL A 6 -11.982 4.357 -5.423 1.00 0.00 C ATOM 85 C VAL A 6 -11.323 4.413 -6.779 1.00 0.00 C ATOM 86 O VAL A 6 -11.108 3.390 -7.436 1.00 0.00 O ATOM 87 CB VAL A 6 -10.949 4.194 -4.273 1.00 0.00 C ATOM 88 CG1 VAL A 6 -11.459 3.255 -3.180 1.00 0.00 C ATOM 89 CG2 VAL A 6 -9.573 3.805 -4.791 1.00 0.00 C ATOM 0 H VAL A 6 -12.770 2.451 -5.049 1.00 0.00 H new ATOM 0 HA VAL A 6 -12.461 5.308 -5.192 1.00 0.00 H new ATOM 0 HB VAL A 6 -10.830 5.172 -3.806 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.708 3.168 -2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.381 3.655 -2.757 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -11.653 2.271 -3.607 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -8.884 3.702 -3.952 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -9.640 2.857 -5.324 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.208 4.577 -5.468 1.00 0.00 H new ATOM 99 N ASN A 7 -11.033 5.615 -7.195 1.00 0.00 N ATOM 100 CA ASN A 7 -10.717 5.883 -8.579 1.00 0.00 C ATOM 101 C ASN A 7 -9.338 6.456 -8.677 1.00 0.00 C ATOM 102 O ASN A 7 -8.440 5.892 -9.299 1.00 0.00 O ATOM 103 CB ASN A 7 -11.697 6.904 -9.162 1.00 0.00 C ATOM 104 CG ASN A 7 -13.143 6.458 -9.119 1.00 0.00 C ATOM 105 OD1 ASN A 7 -13.604 5.709 -9.979 1.00 0.00 O ATOM 106 ND2 ASN A 7 -13.878 6.960 -8.139 1.00 0.00 N ATOM 0 H ASN A 7 -11.008 6.436 -6.590 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.785 4.947 -9.133 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -11.599 7.841 -8.614 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -11.421 7.109 -10.196 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.870 6.729 -8.075 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -13.453 7.577 -7.447 1.00 0.00 H new ATOM 113 N ASN A 8 -9.187 7.594 -8.048 1.00 0.00 N ATOM 114 CA ASN A 8 -7.952 8.325 -8.140 1.00 0.00 C ATOM 115 C ASN A 8 -7.175 8.168 -6.868 1.00 0.00 C ATOM 116 O ASN A 8 -7.738 7.923 -5.814 1.00 0.00 O ATOM 117 CB ASN A 8 -8.157 9.808 -8.447 1.00 0.00 C ATOM 118 CG ASN A 8 -6.829 10.468 -8.773 1.00 0.00 C ATOM 119 OD1 ASN A 8 -5.942 9.711 -9.423 1.00 0.00 O flip ATOM 120 ND2 ASN A 8 -6.607 11.636 -8.464 1.00 0.00 N flip ATOM 0 H ASN A 8 -9.903 8.032 -7.468 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.394 7.905 -8.977 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -8.843 9.921 -9.287 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -8.616 10.303 -7.592 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -7.316 12.176 -7.967 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -5.714 12.066 -8.704 1.00 0.00 H new ATOM 127 N VAL A 9 -5.884 8.267 -6.979 1.00 0.00 N ATOM 128 CA VAL A 9 -5.037 8.284 -5.836 1.00 0.00 C ATOM 129 C VAL A 9 -3.834 9.165 -6.119 1.00 0.00 C ATOM 130 O VAL A 9 -2.893 8.763 -6.806 1.00 0.00 O ATOM 131 CB VAL A 9 -4.619 6.868 -5.463 1.00 0.00 C ATOM 132 CG1 VAL A 9 -4.106 6.162 -6.696 1.00 0.00 C ATOM 133 CG2 VAL A 9 -3.612 6.907 -4.337 1.00 0.00 C ATOM 0 H VAL A 9 -5.392 8.338 -7.870 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.577 8.697 -4.984 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.472 6.298 -5.094 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.805 5.147 -6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.894 6.125 -7.448 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.248 6.704 -7.095 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.318 5.890 -4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -2.733 7.469 -4.654 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.057 7.390 -3.467 1.00 0.00 H new ATOM 143 N VAL A 10 -3.874 10.380 -5.633 1.00 0.00 N ATOM 144 CA VAL A 10 -2.768 11.279 -5.859 1.00 0.00 C ATOM 145 C VAL A 10 -1.803 11.188 -4.697 1.00 0.00 C ATOM 146 O VAL A 10 -2.027 11.748 -3.629 1.00 0.00 O ATOM 147 CB VAL A 10 -3.213 12.736 -6.121 1.00 0.00 C ATOM 148 CG1 VAL A 10 -3.640 12.905 -7.569 1.00 0.00 C ATOM 149 CG2 VAL A 10 -4.336 13.158 -5.194 1.00 0.00 C ATOM 0 H VAL A 10 -4.645 10.766 -5.088 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.264 10.965 -6.773 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.357 13.381 -5.920 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.951 13.936 -7.739 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.803 12.665 -8.225 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.473 12.235 -7.783 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -4.619 14.188 -5.411 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -5.196 12.506 -5.344 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -4.001 13.084 -4.159 1.00 0.00 H new ATOM 159 N VAL A 11 -0.764 10.399 -4.896 1.00 0.00 N ATOM 160 CA VAL A 11 0.228 10.178 -3.879 1.00 0.00 C ATOM 161 C VAL A 11 1.086 11.412 -3.715 1.00 0.00 C ATOM 162 O VAL A 11 1.636 11.949 -4.674 1.00 0.00 O ATOM 163 CB VAL A 11 1.136 8.987 -4.203 1.00 0.00 C ATOM 164 CG1 VAL A 11 1.503 8.245 -2.933 1.00 0.00 C ATOM 165 CG2 VAL A 11 0.481 8.051 -5.205 1.00 0.00 C ATOM 0 H VAL A 11 -0.591 9.898 -5.767 1.00 0.00 H new ATOM 0 HA VAL A 11 -0.308 9.958 -2.956 1.00 0.00 H new ATOM 0 HB VAL A 11 2.049 9.370 -4.658 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.148 7.401 -3.178 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.028 8.919 -2.257 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.597 7.880 -2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 11 1.150 7.216 -5.414 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -0.454 7.672 -4.792 1.00 0.00 H new ATOM 0 HG23 VAL A 11 0.276 8.592 -6.129 1.00 0.00 H new ATOM 175 N LEU A 12 1.187 11.835 -2.489 1.00 0.00 N ATOM 176 CA LEU A 12 1.889 13.036 -2.124 1.00 0.00 C ATOM 177 C LEU A 12 3.252 12.641 -1.645 1.00 0.00 C ATOM 178 O LEU A 12 4.258 13.292 -1.929 1.00 0.00 O ATOM 179 CB LEU A 12 1.106 13.671 -1.009 1.00 0.00 C ATOM 180 CG LEU A 12 -0.390 13.408 -1.121 1.00 0.00 C ATOM 181 CD1 LEU A 12 -1.061 13.615 0.206 1.00 0.00 C ATOM 182 CD2 LEU A 12 -1.012 14.265 -2.205 1.00 0.00 C ATOM 0 H LEU A 12 0.775 11.345 -1.695 1.00 0.00 H new ATOM 0 HA LEU A 12 1.991 13.733 -2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.468 13.291 -0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.283 14.746 -1.012 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.538 12.367 -1.409 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.129 13.423 0.107 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.635 12.930 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.906 14.642 0.536 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.080 14.058 -2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.859 15.318 -1.969 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.544 14.036 -3.163 1.00 0.00 H new ATOM 194 N ASP A 13 3.242 11.560 -0.883 1.00 0.00 N ATOM 195 CA ASP A 13 4.453 10.839 -0.535 1.00 0.00 C ATOM 196 C ASP A 13 5.090 10.259 -1.787 1.00 0.00 C ATOM 197 O ASP A 13 4.919 9.093 -2.135 1.00 0.00 O ATOM 198 CB ASP A 13 4.166 9.741 0.472 1.00 0.00 C ATOM 199 CG ASP A 13 5.388 8.915 0.801 1.00 0.00 C ATOM 200 OD1 ASP A 13 6.511 9.445 0.694 1.00 0.00 O ATOM 201 OD2 ASP A 13 5.226 7.734 1.169 1.00 0.00 O ATOM 0 H ASP A 13 2.392 11.158 -0.488 1.00 0.00 H new ATOM 0 HA ASP A 13 5.149 11.540 -0.074 1.00 0.00 H new ATOM 0 HB2 ASP A 13 3.777 10.186 1.388 1.00 0.00 H new ATOM 0 HB3 ASP A 13 3.387 9.088 0.079 1.00 0.00 H new ATOM 206 N ASN A 14 5.725 11.141 -2.501 1.00 0.00 N ATOM 207 CA ASN A 14 6.588 10.804 -3.616 1.00 0.00 C ATOM 208 C ASN A 14 8.022 10.773 -3.103 1.00 0.00 C ATOM 209 O ASN A 14 8.231 11.144 -1.951 1.00 0.00 O ATOM 210 CB ASN A 14 6.394 11.791 -4.754 1.00 0.00 C ATOM 211 CG ASN A 14 6.049 11.081 -6.049 1.00 0.00 C ATOM 212 OD1 ASN A 14 5.482 9.886 -5.933 1.00 0.00 O flip ATOM 213 ND2 ASN A 14 6.309 11.585 -7.137 1.00 0.00 N flip ATOM 0 H ASN A 14 5.661 12.144 -2.327 1.00 0.00 H new ATOM 0 HA ASN A 14 6.340 9.823 -4.022 1.00 0.00 H new ATOM 0 HB2 ASN A 14 5.599 12.492 -4.498 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.304 12.376 -4.889 1.00 0.00 H new ATOM 0 HD21 ASN A 14 6.745 12.506 -7.181 1.00 0.00 H new ATOM 0 HD22 ASN A 14 6.089 11.083 -7.997 1.00 0.00 H new ATOM 220 N PRO A 15 9.040 10.370 -3.907 1.00 0.00 N ATOM 221 CA PRO A 15 10.300 9.865 -3.361 1.00 0.00 C ATOM 222 C PRO A 15 10.931 10.779 -2.333 1.00 0.00 C ATOM 223 O PRO A 15 11.526 11.815 -2.637 1.00 0.00 O ATOM 224 CB PRO A 15 11.229 9.764 -4.573 1.00 0.00 C ATOM 225 CG PRO A 15 10.520 10.450 -5.689 1.00 0.00 C ATOM 226 CD PRO A 15 9.059 10.366 -5.373 1.00 0.00 C ATOM 0 HA PRO A 15 10.126 8.922 -2.842 1.00 0.00 H new ATOM 0 HB2 PRO A 15 12.189 10.239 -4.370 1.00 0.00 H new ATOM 0 HB3 PRO A 15 11.434 8.723 -4.822 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.841 11.488 -5.773 1.00 0.00 H new ATOM 0 HG3 PRO A 15 10.740 9.970 -6.643 1.00 0.00 H new ATOM 0 HD2 PRO A 15 8.507 11.210 -5.786 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.609 9.461 -5.780 1.00 0.00 H new ATOM 234 N SER A 16 10.775 10.340 -1.104 1.00 0.00 N ATOM 235 CA SER A 16 11.303 11.027 0.062 1.00 0.00 C ATOM 236 C SER A 16 11.963 10.017 0.990 1.00 0.00 C ATOM 237 O SER A 16 11.877 8.813 0.733 1.00 0.00 O ATOM 238 CB SER A 16 10.181 11.768 0.792 1.00 0.00 C ATOM 239 OG SER A 16 9.521 12.674 -0.077 1.00 0.00 O ATOM 0 H SER A 16 10.270 9.483 -0.879 1.00 0.00 H new ATOM 0 HA SER A 16 12.046 11.758 -0.256 1.00 0.00 H new ATOM 0 HB2 SER A 16 9.463 11.050 1.188 1.00 0.00 H new ATOM 0 HB3 SER A 16 10.592 12.310 1.644 1.00 0.00 H new ATOM 0 HG SER A 16 9.043 12.173 -0.770 1.00 0.00 H new ATOM 245 N PRO A 17 12.674 10.477 2.038 1.00 0.00 N ATOM 246 CA PRO A 17 13.245 9.591 3.051 1.00 0.00 C ATOM 247 C PRO A 17 12.279 8.483 3.456 1.00 0.00 C ATOM 248 O PRO A 17 11.078 8.710 3.608 1.00 0.00 O ATOM 249 CB PRO A 17 13.476 10.524 4.230 1.00 0.00 C ATOM 250 CG PRO A 17 13.739 11.856 3.620 1.00 0.00 C ATOM 251 CD PRO A 17 12.986 11.893 2.315 1.00 0.00 C ATOM 0 HA PRO A 17 14.142 9.085 2.694 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.606 10.555 4.886 1.00 0.00 H new ATOM 0 HB3 PRO A 17 14.320 10.194 4.836 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.407 12.656 4.281 1.00 0.00 H new ATOM 0 HG3 PRO A 17 14.807 12.002 3.455 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.079 12.493 2.395 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.589 12.331 1.519 1.00 0.00 H new ATOM 259 N PHE A 18 12.822 7.284 3.610 1.00 0.00 N ATOM 260 CA PHE A 18 12.044 6.110 3.969 1.00 0.00 C ATOM 261 C PHE A 18 11.257 6.314 5.260 1.00 0.00 C ATOM 262 O PHE A 18 10.192 5.727 5.432 1.00 0.00 O ATOM 263 CB PHE A 18 12.971 4.900 4.090 1.00 0.00 C ATOM 264 CG PHE A 18 12.364 3.734 4.806 1.00 0.00 C ATOM 265 CD1 PHE A 18 11.296 3.043 4.265 1.00 0.00 C ATOM 266 CD2 PHE A 18 12.869 3.334 6.026 1.00 0.00 C ATOM 267 CE1 PHE A 18 10.740 1.977 4.934 1.00 0.00 C ATOM 268 CE2 PHE A 18 12.328 2.267 6.703 1.00 0.00 C ATOM 269 CZ PHE A 18 11.250 1.581 6.153 1.00 0.00 C ATOM 0 H PHE A 18 13.818 7.099 3.489 1.00 0.00 H new ATOM 0 HA PHE A 18 11.315 5.935 3.178 1.00 0.00 H new ATOM 0 HB2 PHE A 18 13.270 4.583 3.091 1.00 0.00 H new ATOM 0 HB3 PHE A 18 13.878 5.202 4.613 1.00 0.00 H new ATOM 0 HD1 PHE A 18 10.894 3.343 3.308 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.703 3.868 6.456 1.00 0.00 H new ATOM 0 HE1 PHE A 18 9.902 1.449 4.504 1.00 0.00 H new ATOM 0 HE2 PHE A 18 12.737 1.963 7.655 1.00 0.00 H new ATOM 0 HZ PHE A 18 10.815 0.743 6.677 1.00 0.00 H new ATOM 279 N TYR A 19 11.773 7.147 6.157 1.00 0.00 N ATOM 280 CA TYR A 19 11.124 7.373 7.439 1.00 0.00 C ATOM 281 C TYR A 19 9.936 8.320 7.312 1.00 0.00 C ATOM 282 O TYR A 19 9.070 8.353 8.187 1.00 0.00 O ATOM 283 CB TYR A 19 12.121 7.899 8.464 1.00 0.00 C ATOM 284 CG TYR A 19 13.154 6.876 8.881 1.00 0.00 C ATOM 285 CD1 TYR A 19 12.788 5.560 9.161 1.00 0.00 C ATOM 286 CD2 TYR A 19 14.492 7.221 8.990 1.00 0.00 C ATOM 287 CE1 TYR A 19 13.733 4.623 9.539 1.00 0.00 C ATOM 288 CE2 TYR A 19 15.439 6.292 9.368 1.00 0.00 C ATOM 289 CZ TYR A 19 15.055 4.995 9.641 1.00 0.00 C ATOM 290 OH TYR A 19 16.001 4.072 10.021 1.00 0.00 O ATOM 0 H TYR A 19 12.635 7.674 6.019 1.00 0.00 H new ATOM 0 HA TYR A 19 10.743 6.412 7.785 1.00 0.00 H new ATOM 0 HB2 TYR A 19 12.630 8.770 8.050 1.00 0.00 H new ATOM 0 HB3 TYR A 19 11.578 8.236 9.347 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.751 5.268 9.082 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.798 8.234 8.775 1.00 0.00 H new ATOM 0 HE1 TYR A 19 13.436 3.607 9.753 1.00 0.00 H new ATOM 0 HE2 TYR A 19 16.477 6.579 9.450 1.00 0.00 H new ATOM 0 HH TYR A 19 15.723 3.179 9.729 1.00 0.00 H new ATOM 300 N ASN A 20 9.896 9.095 6.234 1.00 0.00 N ATOM 301 CA ASN A 20 8.734 9.907 5.930 1.00 0.00 C ATOM 302 C ASN A 20 7.537 8.991 5.711 1.00 0.00 C ATOM 303 O ASN A 20 7.644 7.976 5.039 1.00 0.00 O ATOM 304 CB ASN A 20 9.009 10.792 4.706 1.00 0.00 C ATOM 305 CG ASN A 20 7.908 10.761 3.659 1.00 0.00 C ATOM 306 OD1 ASN A 20 6.993 11.588 3.677 1.00 0.00 O ATOM 307 ND2 ASN A 20 7.994 9.808 2.741 1.00 0.00 N ATOM 0 H ASN A 20 10.657 9.175 5.559 1.00 0.00 H new ATOM 0 HA ASN A 20 8.512 10.574 6.763 1.00 0.00 H new ATOM 0 HB2 ASN A 20 9.151 11.820 5.039 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.944 10.475 4.244 1.00 0.00 H new ATOM 0 HD21 ASN A 20 7.285 9.738 2.011 1.00 0.00 H new ATOM 0 HD22 ASN A 20 8.769 9.145 2.765 1.00 0.00 H new ATOM 314 N PRO A 21 6.411 9.314 6.339 1.00 0.00 N ATOM 315 CA PRO A 21 5.203 8.476 6.331 1.00 0.00 C ATOM 316 C PRO A 21 4.466 8.478 4.991 1.00 0.00 C ATOM 317 O PRO A 21 4.553 9.432 4.219 1.00 0.00 O ATOM 318 CB PRO A 21 4.340 9.116 7.430 1.00 0.00 C ATOM 319 CG PRO A 21 5.289 9.977 8.188 1.00 0.00 C ATOM 320 CD PRO A 21 6.220 10.507 7.155 1.00 0.00 C ATOM 0 HA PRO A 21 5.439 7.425 6.497 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.524 9.701 7.005 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.889 8.360 8.072 1.00 0.00 H new ATOM 0 HG2 PRO A 21 4.768 10.784 8.703 1.00 0.00 H new ATOM 0 HG3 PRO A 21 5.823 9.406 8.948 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.787 11.332 6.590 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.154 10.870 7.584 1.00 0.00 H new ATOM 328 N PHE A 22 3.731 7.390 4.740 1.00 0.00 N ATOM 329 CA PHE A 22 2.980 7.217 3.513 1.00 0.00 C ATOM 330 C PHE A 22 1.927 8.286 3.421 1.00 0.00 C ATOM 331 O PHE A 22 1.224 8.563 4.388 1.00 0.00 O ATOM 332 CB PHE A 22 2.337 5.826 3.454 1.00 0.00 C ATOM 333 CG PHE A 22 3.334 4.718 3.266 1.00 0.00 C ATOM 334 CD1 PHE A 22 3.875 4.471 2.014 1.00 0.00 C ATOM 335 CD2 PHE A 22 3.743 3.935 4.335 1.00 0.00 C ATOM 336 CE1 PHE A 22 4.803 3.466 1.831 1.00 0.00 C ATOM 337 CE2 PHE A 22 4.669 2.926 4.156 1.00 0.00 C ATOM 338 CZ PHE A 22 5.201 2.694 2.904 1.00 0.00 C ATOM 0 H PHE A 22 3.646 6.608 5.390 1.00 0.00 H new ATOM 0 HA PHE A 22 3.661 7.304 2.667 1.00 0.00 H new ATOM 0 HB2 PHE A 22 1.780 5.652 4.374 1.00 0.00 H new ATOM 0 HB3 PHE A 22 1.617 5.800 2.636 1.00 0.00 H new ATOM 0 HD1 PHE A 22 3.567 5.072 1.172 1.00 0.00 H new ATOM 0 HD2 PHE A 22 3.333 4.116 5.318 1.00 0.00 H new ATOM 0 HE1 PHE A 22 5.217 3.284 0.850 1.00 0.00 H new ATOM 0 HE2 PHE A 22 4.976 2.319 4.995 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.929 1.908 2.764 1.00 0.00 H new ATOM 348 N GLN A 23 1.834 8.883 2.262 1.00 0.00 N ATOM 349 CA GLN A 23 1.018 10.051 2.079 1.00 0.00 C ATOM 350 C GLN A 23 0.245 9.933 0.785 1.00 0.00 C ATOM 351 O GLN A 23 0.666 10.428 -0.251 1.00 0.00 O ATOM 352 CB GLN A 23 1.923 11.275 2.058 1.00 0.00 C ATOM 353 CG GLN A 23 1.221 12.580 2.304 1.00 0.00 C ATOM 354 CD GLN A 23 2.179 13.710 2.643 1.00 0.00 C ATOM 355 OE1 GLN A 23 3.393 13.649 2.118 1.00 0.00 O flip ATOM 356 NE2 GLN A 23 1.829 14.635 3.369 1.00 0.00 N flip ATOM 0 H GLN A 23 2.321 8.573 1.421 1.00 0.00 H new ATOM 0 HA GLN A 23 0.302 10.147 2.895 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.700 11.148 2.812 1.00 0.00 H new ATOM 0 HB3 GLN A 23 2.423 11.324 1.091 1.00 0.00 H new ATOM 0 HG2 GLN A 23 0.646 12.851 1.418 1.00 0.00 H new ATOM 0 HG3 GLN A 23 0.509 12.456 3.120 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.886 14.650 3.757 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.481 15.389 3.585 1.00 0.00 H new ATOM 365 N PHE A 24 -0.862 9.238 0.849 1.00 0.00 N ATOM 366 CA PHE A 24 -1.744 9.080 -0.286 1.00 0.00 C ATOM 367 C PHE A 24 -2.859 10.089 -0.189 1.00 0.00 C ATOM 368 O PHE A 24 -3.195 10.542 0.896 1.00 0.00 O ATOM 369 CB PHE A 24 -2.367 7.687 -0.300 1.00 0.00 C ATOM 370 CG PHE A 24 -1.399 6.560 -0.480 1.00 0.00 C ATOM 371 CD1 PHE A 24 -0.809 5.948 0.614 1.00 0.00 C ATOM 372 CD2 PHE A 24 -1.112 6.090 -1.744 1.00 0.00 C ATOM 373 CE1 PHE A 24 0.059 4.885 0.447 1.00 0.00 C ATOM 374 CE2 PHE A 24 -0.257 5.024 -1.927 1.00 0.00 C ATOM 375 CZ PHE A 24 0.336 4.412 -0.826 1.00 0.00 C ATOM 0 H PHE A 24 -1.181 8.762 1.693 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.161 9.225 -1.196 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.905 7.537 0.636 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.104 7.644 -1.102 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.030 6.306 1.609 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -1.563 6.564 -2.603 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.521 4.424 1.307 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -0.047 4.664 -2.923 1.00 0.00 H new ATOM 0 HZ PHE A 24 1.006 3.576 -0.963 1.00 0.00 H new ATOM 385 N GLU A 25 -3.416 10.449 -1.314 1.00 0.00 N ATOM 386 CA GLU A 25 -4.630 11.222 -1.323 1.00 0.00 C ATOM 387 C GLU A 25 -5.591 10.569 -2.306 1.00 0.00 C ATOM 388 O GLU A 25 -5.619 10.901 -3.491 1.00 0.00 O ATOM 389 CB GLU A 25 -4.308 12.665 -1.701 1.00 0.00 C ATOM 390 CG GLU A 25 -5.448 13.637 -1.493 1.00 0.00 C ATOM 391 CD GLU A 25 -5.071 15.060 -1.850 1.00 0.00 C ATOM 392 OE1 GLU A 25 -5.200 15.436 -3.034 1.00 0.00 O ATOM 393 OE2 GLU A 25 -4.648 15.815 -0.951 1.00 0.00 O ATOM 0 H GLU A 25 -3.049 10.219 -2.237 1.00 0.00 H new ATOM 0 HA GLU A 25 -5.099 11.245 -0.339 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -3.452 12.998 -1.115 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -4.008 12.695 -2.749 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -6.300 13.328 -2.099 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -5.767 13.600 -0.451 1.00 0.00 H new ATOM 400 N ILE A 26 -6.360 9.610 -1.811 1.00 0.00 N ATOM 401 CA ILE A 26 -7.215 8.812 -2.674 1.00 0.00 C ATOM 402 C ILE A 26 -8.583 9.436 -2.884 1.00 0.00 C ATOM 403 O ILE A 26 -9.340 9.658 -1.947 1.00 0.00 O ATOM 404 CB ILE A 26 -7.414 7.390 -2.133 1.00 0.00 C ATOM 405 CG1 ILE A 26 -6.068 6.695 -1.969 1.00 0.00 C ATOM 406 CG2 ILE A 26 -8.299 6.610 -3.092 1.00 0.00 C ATOM 407 CD1 ILE A 26 -6.033 5.699 -0.834 1.00 0.00 C ATOM 0 H ILE A 26 -6.409 9.367 -0.821 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.692 8.773 -3.629 1.00 0.00 H new ATOM 0 HB ILE A 26 -7.895 7.437 -1.156 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.818 6.183 -2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.298 7.448 -1.803 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -8.444 5.599 -2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -9.265 7.106 -3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -7.823 6.565 -4.072 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.044 5.245 -0.779 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -6.251 6.209 0.104 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.779 4.924 -1.007 1.00 0.00 H new ATOM 419 N THR A 27 -8.898 9.671 -4.134 1.00 0.00 N ATOM 420 CA THR A 27 -10.221 10.119 -4.521 1.00 0.00 C ATOM 421 C THR A 27 -11.089 8.913 -4.849 1.00 0.00 C ATOM 422 O THR A 27 -10.895 8.260 -5.879 1.00 0.00 O ATOM 423 CB THR A 27 -10.167 11.050 -5.747 1.00 0.00 C ATOM 424 OG1 THR A 27 -9.157 12.053 -5.562 1.00 0.00 O ATOM 425 CG2 THR A 27 -11.514 11.717 -5.977 1.00 0.00 C ATOM 0 H THR A 27 -8.249 9.559 -4.913 1.00 0.00 H new ATOM 0 HA THR A 27 -10.644 10.677 -3.686 1.00 0.00 H new ATOM 0 HB THR A 27 -9.921 10.447 -6.621 1.00 0.00 H new ATOM 0 HG1 THR A 27 -9.130 12.638 -6.347 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.453 12.370 -6.848 1.00 0.00 H new ATOM 0 HG22 THR A 27 -12.273 10.954 -6.148 1.00 0.00 H new ATOM 0 HG23 THR A 27 -11.783 12.306 -5.100 1.00 0.00 H new ATOM 433 N PHE A 28 -12.034 8.596 -3.978 1.00 0.00 N ATOM 434 CA PHE A 28 -12.889 7.489 -4.216 1.00 0.00 C ATOM 435 C PHE A 28 -14.306 7.948 -4.298 1.00 0.00 C ATOM 436 O PHE A 28 -14.715 8.917 -3.657 1.00 0.00 O ATOM 437 CB PHE A 28 -12.730 6.430 -3.139 1.00 0.00 C ATOM 438 CG PHE A 28 -13.343 6.716 -1.795 1.00 0.00 C ATOM 439 CD1 PHE A 28 -12.723 7.546 -0.872 1.00 0.00 C ATOM 440 CD2 PHE A 28 -14.514 6.077 -1.429 1.00 0.00 C ATOM 441 CE1 PHE A 28 -13.266 7.720 0.391 1.00 0.00 C ATOM 442 CE2 PHE A 28 -15.064 6.261 -0.183 1.00 0.00 C ATOM 443 CZ PHE A 28 -14.441 7.072 0.730 1.00 0.00 C ATOM 0 H PHE A 28 -12.213 9.099 -3.109 1.00 0.00 H new ATOM 0 HA PHE A 28 -12.608 7.037 -5.167 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -13.158 5.500 -3.514 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -11.664 6.254 -2.993 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -11.811 8.060 -1.140 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -15.004 5.422 -2.134 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -12.774 8.359 1.109 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -15.988 5.766 0.077 1.00 0.00 H new ATOM 0 HZ PHE A 28 -14.867 7.205 1.713 1.00 0.00 H new ATOM 453 N GLU A 29 -15.049 7.260 -5.095 1.00 0.00 N ATOM 454 CA GLU A 29 -16.424 7.573 -5.244 1.00 0.00 C ATOM 455 C GLU A 29 -17.218 6.573 -4.482 1.00 0.00 C ATOM 456 O GLU A 29 -17.192 5.377 -4.783 1.00 0.00 O ATOM 457 CB GLU A 29 -16.827 7.582 -6.703 1.00 0.00 C ATOM 458 CG GLU A 29 -18.266 8.004 -6.940 1.00 0.00 C ATOM 459 CD GLU A 29 -18.697 7.803 -8.376 1.00 0.00 C ATOM 460 OE1 GLU A 29 -17.872 8.035 -9.287 1.00 0.00 O ATOM 461 OE2 GLU A 29 -19.859 7.400 -8.598 1.00 0.00 O ATOM 0 H GLU A 29 -14.723 6.473 -5.656 1.00 0.00 H new ATOM 0 HA GLU A 29 -16.615 8.573 -4.854 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -16.166 8.256 -7.248 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -16.678 6.585 -7.117 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -18.922 7.433 -6.283 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -18.383 9.054 -6.672 1.00 0.00 H new ATOM 468 N CYS A 30 -17.888 7.044 -3.469 1.00 0.00 N ATOM 469 CA CYS A 30 -18.810 6.205 -2.794 1.00 0.00 C ATOM 470 C CYS A 30 -19.969 6.080 -3.719 1.00 0.00 C ATOM 471 O CYS A 30 -20.679 7.028 -4.003 1.00 0.00 O ATOM 472 CB CYS A 30 -19.196 6.790 -1.441 1.00 0.00 C ATOM 473 SG CYS A 30 -19.829 5.600 -0.245 1.00 0.00 S ATOM 0 H CYS A 30 -17.809 7.993 -3.103 1.00 0.00 H new ATOM 0 HA CYS A 30 -18.391 5.226 -2.564 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -18.323 7.282 -1.013 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -19.951 7.560 -1.598 1.00 0.00 H new ATOM 0 HG CYS A 30 -20.849 4.974 -0.753 1.00 0.00 H new ATOM 479 N ILE A 31 -20.058 4.928 -4.287 1.00 0.00 N ATOM 480 CA ILE A 31 -21.014 4.678 -5.308 1.00 0.00 C ATOM 481 C ILE A 31 -22.381 4.538 -4.701 1.00 0.00 C ATOM 482 O ILE A 31 -23.395 4.751 -5.369 1.00 0.00 O ATOM 483 CB ILE A 31 -20.657 3.430 -6.124 1.00 0.00 C ATOM 484 CG1 ILE A 31 -19.305 2.841 -5.717 1.00 0.00 C ATOM 485 CG2 ILE A 31 -20.611 3.819 -7.565 1.00 0.00 C ATOM 486 CD1 ILE A 31 -18.928 1.621 -6.530 1.00 0.00 C ATOM 0 H ILE A 31 -19.467 4.129 -4.055 1.00 0.00 H new ATOM 0 HA ILE A 31 -21.009 5.526 -5.993 1.00 0.00 H new ATOM 0 HB ILE A 31 -21.412 2.666 -5.939 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -18.533 3.602 -5.832 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -19.334 2.573 -4.661 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -20.359 2.948 -8.169 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -21.585 4.202 -7.870 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -19.856 4.592 -7.709 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -17.960 1.247 -6.197 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -19.683 0.846 -6.395 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.870 1.890 -7.585 1.00 0.00 H new ATOM 498 N GLU A 32 -22.405 4.204 -3.415 1.00 0.00 N ATOM 499 CA GLU A 32 -23.656 3.994 -2.711 1.00 0.00 C ATOM 500 C GLU A 32 -23.437 4.245 -1.228 1.00 0.00 C ATOM 501 O GLU A 32 -22.299 4.333 -0.784 1.00 0.00 O ATOM 502 CB GLU A 32 -24.179 2.566 -2.928 1.00 0.00 C ATOM 503 CG GLU A 32 -24.003 2.033 -4.348 1.00 0.00 C ATOM 504 CD GLU A 32 -25.220 1.286 -4.840 1.00 0.00 C ATOM 505 OE1 GLU A 32 -26.119 1.927 -5.421 1.00 0.00 O ATOM 506 OE2 GLU A 32 -25.285 0.055 -4.651 1.00 0.00 O ATOM 0 H GLU A 32 -21.571 4.074 -2.843 1.00 0.00 H new ATOM 0 HA GLU A 32 -24.401 4.687 -3.102 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -23.667 1.897 -2.237 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -25.238 2.538 -2.672 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -23.794 2.864 -5.021 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -23.137 1.372 -4.380 1.00 0.00 H new ATOM 513 N ASP A 33 -24.517 4.357 -0.470 1.00 0.00 N ATOM 514 CA ASP A 33 -24.421 4.600 0.969 1.00 0.00 C ATOM 515 C ASP A 33 -23.841 3.382 1.680 1.00 0.00 C ATOM 516 O ASP A 33 -24.109 2.238 1.296 1.00 0.00 O ATOM 517 CB ASP A 33 -25.797 4.935 1.551 1.00 0.00 C ATOM 518 CG ASP A 33 -26.790 3.799 1.413 1.00 0.00 C ATOM 519 OD1 ASP A 33 -27.349 3.628 0.307 1.00 0.00 O ATOM 520 OD2 ASP A 33 -27.020 3.077 2.404 1.00 0.00 O ATOM 0 H ASP A 33 -25.471 4.284 -0.823 1.00 0.00 H new ATOM 0 HA ASP A 33 -23.756 5.449 1.126 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -25.688 5.189 2.605 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -26.192 5.819 1.050 1.00 0.00 H new ATOM 525 N LEU A 34 -23.037 3.625 2.707 1.00 0.00 N ATOM 526 CA LEU A 34 -22.419 2.535 3.445 1.00 0.00 C ATOM 527 C LEU A 34 -23.229 2.167 4.678 1.00 0.00 C ATOM 528 O LEU A 34 -23.954 2.992 5.231 1.00 0.00 O ATOM 529 CB LEU A 34 -21.002 2.903 3.862 1.00 0.00 C ATOM 530 CG LEU A 34 -19.935 2.782 2.776 1.00 0.00 C ATOM 531 CD1 LEU A 34 -18.557 2.973 3.379 1.00 0.00 C ATOM 532 CD2 LEU A 34 -20.025 1.436 2.086 1.00 0.00 C ATOM 0 H LEU A 34 -22.800 4.558 3.044 1.00 0.00 H new ATOM 0 HA LEU A 34 -22.388 1.672 2.780 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -21.006 3.930 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -20.714 2.268 4.700 1.00 0.00 H new ATOM 0 HG LEU A 34 -20.107 3.560 2.032 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -17.802 2.885 2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -18.493 3.961 3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.383 2.211 4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -19.256 1.370 1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.875 0.642 2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -21.008 1.327 1.628 1.00 0.00 H new ATOM 544 N SER A 35 -23.114 0.915 5.087 1.00 0.00 N ATOM 545 CA SER A 35 -23.789 0.429 6.278 1.00 0.00 C ATOM 546 C SER A 35 -22.757 0.080 7.347 1.00 0.00 C ATOM 547 O SER A 35 -22.976 0.285 8.540 1.00 0.00 O ATOM 548 CB SER A 35 -24.657 -0.788 5.936 1.00 0.00 C ATOM 549 OG SER A 35 -25.394 -1.237 7.061 1.00 0.00 O ATOM 0 H SER A 35 -22.554 0.211 4.606 1.00 0.00 H new ATOM 0 HA SER A 35 -24.442 1.210 6.667 1.00 0.00 H new ATOM 0 HB2 SER A 35 -25.344 -0.531 5.130 1.00 0.00 H new ATOM 0 HB3 SER A 35 -24.024 -1.596 5.569 1.00 0.00 H new ATOM 0 HG SER A 35 -25.937 -2.012 6.808 1.00 0.00 H new ATOM 555 N GLU A 36 -21.625 -0.433 6.893 1.00 0.00 N ATOM 556 CA GLU A 36 -20.531 -0.806 7.769 1.00 0.00 C ATOM 557 C GLU A 36 -19.389 0.174 7.536 1.00 0.00 C ATOM 558 O GLU A 36 -19.588 1.200 6.883 1.00 0.00 O ATOM 559 CB GLU A 36 -20.090 -2.246 7.479 1.00 0.00 C ATOM 560 CG GLU A 36 -19.279 -2.874 8.597 1.00 0.00 C ATOM 561 CD GLU A 36 -18.659 -4.196 8.201 1.00 0.00 C ATOM 562 OE1 GLU A 36 -17.533 -4.185 7.667 1.00 0.00 O ATOM 563 OE2 GLU A 36 -19.292 -5.251 8.422 1.00 0.00 O ATOM 0 H GLU A 36 -21.440 -0.602 5.904 1.00 0.00 H new ATOM 0 HA GLU A 36 -20.843 -0.764 8.812 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -20.974 -2.857 7.296 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -19.499 -2.258 6.563 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -18.491 -2.184 8.899 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -19.921 -3.025 9.465 1.00 0.00 H new ATOM 570 N ASP A 37 -18.207 -0.123 8.045 1.00 0.00 N ATOM 571 CA ASP A 37 -17.095 0.784 7.888 1.00 0.00 C ATOM 572 C ASP A 37 -16.222 0.338 6.738 1.00 0.00 C ATOM 573 O ASP A 37 -16.007 -0.855 6.516 1.00 0.00 O ATOM 574 CB ASP A 37 -16.237 0.899 9.158 1.00 0.00 C ATOM 575 CG ASP A 37 -17.037 1.245 10.397 1.00 0.00 C ATOM 576 OD1 ASP A 37 -17.714 2.292 10.405 1.00 0.00 O ATOM 577 OD2 ASP A 37 -16.988 0.475 11.382 1.00 0.00 O ATOM 0 H ASP A 37 -17.998 -0.976 8.564 1.00 0.00 H new ATOM 0 HA ASP A 37 -17.519 1.768 7.686 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -15.717 -0.045 9.323 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -15.473 1.661 9.003 1.00 0.00 H new ATOM 582 N LEU A 38 -15.739 1.309 6.008 1.00 0.00 N ATOM 583 CA LEU A 38 -14.825 1.085 4.922 1.00 0.00 C ATOM 584 C LEU A 38 -13.435 0.953 5.493 1.00 0.00 C ATOM 585 O LEU A 38 -12.927 1.891 6.100 1.00 0.00 O ATOM 586 CB LEU A 38 -14.885 2.282 3.984 1.00 0.00 C ATOM 587 CG LEU A 38 -14.782 1.971 2.501 1.00 0.00 C ATOM 588 CD1 LEU A 38 -13.436 1.352 2.177 1.00 0.00 C ATOM 589 CD2 LEU A 38 -15.917 1.046 2.084 1.00 0.00 C ATOM 0 H LEU A 38 -15.974 2.291 6.154 1.00 0.00 H new ATOM 0 HA LEU A 38 -15.085 0.180 4.374 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.822 2.810 4.160 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.079 2.967 4.248 1.00 0.00 H new ATOM 0 HG LEU A 38 -14.867 2.902 1.940 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -13.382 1.137 1.110 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.641 2.047 2.448 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -13.316 0.427 2.740 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -15.836 0.828 1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -15.856 0.117 2.651 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -16.873 1.530 2.283 1.00 0.00 H new ATOM 601 N GLU A 39 -12.820 -0.192 5.301 1.00 0.00 N ATOM 602 CA GLU A 39 -11.526 -0.438 5.916 1.00 0.00 C ATOM 603 C GLU A 39 -10.415 -0.361 4.886 1.00 0.00 C ATOM 604 O GLU A 39 -10.068 -1.351 4.256 1.00 0.00 O ATOM 605 CB GLU A 39 -11.507 -1.797 6.625 1.00 0.00 C ATOM 606 CG GLU A 39 -10.160 -2.158 7.244 1.00 0.00 C ATOM 607 CD GLU A 39 -10.104 -3.590 7.741 1.00 0.00 C ATOM 608 OE1 GLU A 39 -10.726 -3.893 8.781 1.00 0.00 O ATOM 609 OE2 GLU A 39 -9.422 -4.422 7.100 1.00 0.00 O ATOM 0 H GLU A 39 -13.183 -0.959 4.735 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.357 0.339 6.661 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.266 -1.797 7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.786 -2.571 5.910 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -9.373 -2.004 6.505 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -9.954 -1.482 8.074 1.00 0.00 H new ATOM 616 N TRP A 40 -9.871 0.825 4.709 1.00 0.00 N ATOM 617 CA TRP A 40 -8.709 1.004 3.857 1.00 0.00 C ATOM 618 C TRP A 40 -7.492 0.564 4.622 1.00 0.00 C ATOM 619 O TRP A 40 -7.486 0.616 5.842 1.00 0.00 O ATOM 620 CB TRP A 40 -8.498 2.454 3.468 1.00 0.00 C ATOM 621 CG TRP A 40 -9.680 3.127 2.883 1.00 0.00 C ATOM 622 CD1 TRP A 40 -10.856 3.426 3.503 1.00 0.00 C ATOM 623 CD2 TRP A 40 -9.784 3.631 1.561 1.00 0.00 C ATOM 624 NE1 TRP A 40 -11.690 4.066 2.635 1.00 0.00 N ATOM 625 CE2 TRP A 40 -11.056 4.208 1.443 1.00 0.00 C ATOM 626 CE3 TRP A 40 -8.928 3.649 0.456 1.00 0.00 C ATOM 627 CZ2 TRP A 40 -11.493 4.796 0.280 1.00 0.00 C ATOM 628 CZ3 TRP A 40 -9.368 4.234 -0.699 1.00 0.00 C ATOM 629 CH2 TRP A 40 -10.639 4.806 -0.774 1.00 0.00 C ATOM 0 H TRP A 40 -10.214 1.682 5.143 1.00 0.00 H new ATOM 0 HA TRP A 40 -8.869 0.420 2.951 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -8.184 3.009 4.352 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -7.678 2.506 2.751 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -11.092 3.191 4.530 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -12.635 4.386 2.846 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -7.942 3.211 0.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -12.478 5.233 0.208 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -8.723 4.254 -1.565 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -10.952 5.270 -1.698 1.00 0.00 H new ATOM 640 N LYS A 41 -6.469 0.138 3.928 1.00 0.00 N ATOM 641 CA LYS A 41 -5.275 -0.311 4.603 1.00 0.00 C ATOM 642 C LYS A 41 -4.054 -0.140 3.727 1.00 0.00 C ATOM 643 O LYS A 41 -4.120 -0.397 2.537 1.00 0.00 O ATOM 644 CB LYS A 41 -5.443 -1.775 4.953 1.00 0.00 C ATOM 645 CG LYS A 41 -4.452 -2.284 5.969 1.00 0.00 C ATOM 646 CD LYS A 41 -4.773 -3.712 6.359 1.00 0.00 C ATOM 647 CE LYS A 41 -6.226 -3.859 6.777 1.00 0.00 C ATOM 648 NZ LYS A 41 -7.135 -4.213 5.640 1.00 0.00 N ATOM 0 H LYS A 41 -6.435 0.092 2.910 1.00 0.00 H new ATOM 0 HA LYS A 41 -5.131 0.287 5.503 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.452 -1.932 5.335 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.351 -2.368 4.043 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -3.443 -2.231 5.559 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -4.470 -1.647 6.853 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -4.565 -4.375 5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -4.124 -4.022 7.178 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -6.300 -4.628 7.546 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.564 -2.925 7.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -8.124 -4.166 5.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.991 -3.542 4.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.922 -5.177 5.313 1.00 0.00 H new ATOM 662 N ILE A 42 -2.940 0.272 4.313 1.00 0.00 N ATOM 663 CA ILE A 42 -1.680 0.287 3.582 1.00 0.00 C ATOM 664 C ILE A 42 -0.859 -0.895 4.029 1.00 0.00 C ATOM 665 O ILE A 42 -0.464 -0.982 5.194 1.00 0.00 O ATOM 666 CB ILE A 42 -0.828 1.552 3.812 1.00 0.00 C ATOM 667 CG1 ILE A 42 -1.654 2.824 3.628 1.00 0.00 C ATOM 668 CG2 ILE A 42 0.377 1.548 2.861 1.00 0.00 C ATOM 669 CD1 ILE A 42 -0.873 4.077 3.929 1.00 0.00 C ATOM 0 H ILE A 42 -2.881 0.596 5.278 1.00 0.00 H new ATOM 0 HA ILE A 42 -1.939 0.259 2.524 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.471 1.541 4.842 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -2.021 2.868 2.603 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.528 2.781 4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.975 2.444 3.028 1.00 0.00 H new ATOM 0 HG22 ILE A 42 0.987 0.664 3.050 1.00 0.00 H new ATOM 0 HG23 ILE A 42 0.026 1.533 1.829 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.511 4.948 3.781 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.528 4.051 4.963 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.014 4.139 3.261 1.00 0.00 H new ATOM 681 N ILE A 43 -0.618 -1.802 3.113 1.00 0.00 N ATOM 682 CA ILE A 43 0.119 -3.002 3.424 1.00 0.00 C ATOM 683 C ILE A 43 1.450 -2.983 2.717 1.00 0.00 C ATOM 684 O ILE A 43 1.536 -3.094 1.492 1.00 0.00 O ATOM 685 CB ILE A 43 -0.682 -4.280 3.097 1.00 0.00 C ATOM 686 CG1 ILE A 43 -1.855 -4.379 4.074 1.00 0.00 C ATOM 687 CG2 ILE A 43 0.204 -5.519 3.179 1.00 0.00 C ATOM 688 CD1 ILE A 43 -2.846 -5.484 3.775 1.00 0.00 C ATOM 0 H ILE A 43 -0.923 -1.731 2.142 1.00 0.00 H new ATOM 0 HA ILE A 43 0.295 -3.022 4.499 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.058 -4.225 2.075 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.460 -4.528 5.079 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.386 -3.427 4.078 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.386 -6.405 2.944 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.023 -5.429 2.465 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.610 -5.610 4.187 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.640 -5.473 4.522 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.277 -5.329 2.786 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.336 -6.447 3.802 1.00 0.00 H new ATOM 700 N TYR A 44 2.475 -2.788 3.514 1.00 0.00 N ATOM 701 CA TYR A 44 3.825 -2.685 3.025 1.00 0.00 C ATOM 702 C TYR A 44 4.454 -4.055 2.947 1.00 0.00 C ATOM 703 O TYR A 44 4.399 -4.833 3.901 1.00 0.00 O ATOM 704 CB TYR A 44 4.665 -1.804 3.945 1.00 0.00 C ATOM 705 CG TYR A 44 6.086 -1.618 3.465 1.00 0.00 C ATOM 706 CD1 TYR A 44 6.399 -0.632 2.545 1.00 0.00 C ATOM 707 CD2 TYR A 44 7.116 -2.425 3.936 1.00 0.00 C ATOM 708 CE1 TYR A 44 7.694 -0.451 2.103 1.00 0.00 C ATOM 709 CE2 TYR A 44 8.414 -2.251 3.498 1.00 0.00 C ATOM 710 CZ TYR A 44 8.698 -1.262 2.581 1.00 0.00 C ATOM 711 OH TYR A 44 9.986 -1.083 2.140 1.00 0.00 O ATOM 0 H TYR A 44 2.392 -2.696 4.526 1.00 0.00 H new ATOM 0 HA TYR A 44 3.792 -2.237 2.032 1.00 0.00 H new ATOM 0 HB2 TYR A 44 4.189 -0.828 4.035 1.00 0.00 H new ATOM 0 HB3 TYR A 44 4.681 -2.244 4.942 1.00 0.00 H new ATOM 0 HD1 TYR A 44 5.615 0.007 2.166 1.00 0.00 H new ATOM 0 HD2 TYR A 44 6.897 -3.200 4.656 1.00 0.00 H new ATOM 0 HE1 TYR A 44 7.919 0.324 1.385 1.00 0.00 H new ATOM 0 HE2 TYR A 44 9.203 -2.887 3.872 1.00 0.00 H new ATOM 0 HH TYR A 44 10.357 -1.944 1.854 1.00 0.00 H new ATOM 721 N VAL A 45 5.050 -4.348 1.817 1.00 0.00 N ATOM 722 CA VAL A 45 5.805 -5.570 1.679 1.00 0.00 C ATOM 723 C VAL A 45 7.163 -5.424 2.358 1.00 0.00 C ATOM 724 O VAL A 45 8.093 -4.863 1.822 1.00 0.00 O ATOM 725 CB VAL A 45 5.922 -5.968 0.192 1.00 0.00 C ATOM 726 CG1 VAL A 45 7.079 -6.919 -0.071 1.00 0.00 C ATOM 727 CG2 VAL A 45 4.612 -6.602 -0.220 1.00 0.00 C ATOM 0 H VAL A 45 5.028 -3.761 0.983 1.00 0.00 H new ATOM 0 HA VAL A 45 5.279 -6.383 2.180 1.00 0.00 H new ATOM 0 HB VAL A 45 6.128 -5.074 -0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 45 7.114 -7.165 -1.132 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.015 -6.443 0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 45 6.939 -7.831 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 45 4.663 -6.895 -1.269 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.425 -7.483 0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.802 -5.886 -0.083 1.00 0.00 H new ATOM 737 N GLY A 46 7.243 -5.913 3.580 1.00 0.00 N ATOM 738 CA GLY A 46 8.459 -5.785 4.345 1.00 0.00 C ATOM 739 C GLY A 46 9.487 -6.833 4.001 1.00 0.00 C ATOM 740 O GLY A 46 10.566 -6.822 4.557 1.00 0.00 O ATOM 0 H GLY A 46 6.484 -6.399 4.058 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.886 -4.796 4.175 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.222 -5.852 5.407 1.00 0.00 H new ATOM 744 N SER A 47 9.145 -7.757 3.111 1.00 0.00 N ATOM 745 CA SER A 47 10.059 -8.819 2.704 1.00 0.00 C ATOM 746 C SER A 47 9.599 -9.461 1.402 1.00 0.00 C ATOM 747 O SER A 47 9.004 -10.530 1.418 1.00 0.00 O ATOM 748 CB SER A 47 10.161 -9.915 3.777 1.00 0.00 C ATOM 749 OG SER A 47 10.525 -9.398 5.046 1.00 0.00 O ATOM 0 H SER A 47 8.234 -7.792 2.654 1.00 0.00 H new ATOM 0 HA SER A 47 11.037 -8.358 2.566 1.00 0.00 H new ATOM 0 HB2 SER A 47 9.204 -10.430 3.859 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.896 -10.657 3.466 1.00 0.00 H new ATOM 0 HG SER A 47 10.576 -10.130 5.695 1.00 0.00 H new ATOM 755 N ALA A 48 9.889 -8.816 0.284 1.00 0.00 N ATOM 756 CA ALA A 48 9.616 -9.364 -1.056 1.00 0.00 C ATOM 757 C ALA A 48 10.244 -10.750 -1.263 1.00 0.00 C ATOM 758 O ALA A 48 10.126 -11.345 -2.329 1.00 0.00 O ATOM 759 CB ALA A 48 10.113 -8.401 -2.121 1.00 0.00 C ATOM 0 H ALA A 48 10.322 -7.893 0.269 1.00 0.00 H new ATOM 0 HA ALA A 48 8.536 -9.485 -1.143 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.908 -8.813 -3.109 1.00 0.00 H new ATOM 0 HB2 ALA A 48 9.602 -7.444 -2.014 1.00 0.00 H new ATOM 0 HB3 ALA A 48 11.187 -8.254 -2.006 1.00 0.00 H new ATOM 765 N GLU A 49 10.932 -11.235 -0.249 1.00 0.00 N ATOM 766 CA GLU A 49 11.590 -12.516 -0.294 1.00 0.00 C ATOM 767 C GLU A 49 10.712 -13.617 0.318 1.00 0.00 C ATOM 768 O GLU A 49 10.844 -14.788 -0.032 1.00 0.00 O ATOM 769 CB GLU A 49 12.913 -12.417 0.429 1.00 0.00 C ATOM 770 CG GLU A 49 14.070 -12.722 -0.488 1.00 0.00 C ATOM 771 CD GLU A 49 14.127 -14.178 -0.896 1.00 0.00 C ATOM 772 OE1 GLU A 49 14.498 -15.023 -0.055 1.00 0.00 O ATOM 773 OE2 GLU A 49 13.813 -14.488 -2.060 1.00 0.00 O ATOM 0 H GLU A 49 11.048 -10.742 0.636 1.00 0.00 H new ATOM 0 HA GLU A 49 11.765 -12.788 -1.335 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.029 -11.415 0.841 1.00 0.00 H new ATOM 0 HB3 GLU A 49 12.922 -13.110 1.270 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.993 -12.102 -1.381 1.00 0.00 H new ATOM 0 HG3 GLU A 49 15.002 -12.452 0.008 1.00 0.00 H new ATOM 780 N SER A 50 9.808 -13.237 1.224 1.00 0.00 N ATOM 781 CA SER A 50 8.956 -14.188 1.906 1.00 0.00 C ATOM 782 C SER A 50 7.494 -13.882 1.588 1.00 0.00 C ATOM 783 O SER A 50 7.191 -13.319 0.543 1.00 0.00 O ATOM 784 CB SER A 50 9.209 -14.066 3.404 1.00 0.00 C ATOM 785 OG SER A 50 10.591 -14.156 3.704 1.00 0.00 O ATOM 0 H SER A 50 9.654 -12.266 1.497 1.00 0.00 H new ATOM 0 HA SER A 50 9.176 -15.204 1.577 1.00 0.00 H new ATOM 0 HB2 SER A 50 8.818 -13.114 3.764 1.00 0.00 H new ATOM 0 HB3 SER A 50 8.669 -14.852 3.931 1.00 0.00 H new ATOM 0 HG SER A 50 10.722 -14.073 4.672 1.00 0.00 H new ATOM 791 N GLU A 51 6.592 -14.251 2.490 1.00 0.00 N ATOM 792 CA GLU A 51 5.179 -13.845 2.388 1.00 0.00 C ATOM 793 C GLU A 51 4.551 -13.707 3.776 1.00 0.00 C ATOM 794 O GLU A 51 3.336 -13.762 3.945 1.00 0.00 O ATOM 795 CB GLU A 51 4.387 -14.818 1.516 1.00 0.00 C ATOM 796 CG GLU A 51 4.459 -16.264 1.977 1.00 0.00 C ATOM 797 CD GLU A 51 3.512 -17.152 1.205 1.00 0.00 C ATOM 798 OE1 GLU A 51 3.831 -17.504 0.050 1.00 0.00 O ATOM 799 OE2 GLU A 51 2.439 -17.491 1.739 1.00 0.00 O ATOM 0 H GLU A 51 6.805 -14.830 3.302 1.00 0.00 H new ATOM 0 HA GLU A 51 5.143 -12.868 1.906 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.343 -14.505 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 51 4.757 -14.755 0.493 1.00 0.00 H new ATOM 0 HG2 GLU A 51 5.478 -16.632 1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.222 -16.318 3.039 1.00 0.00 H new ATOM 806 N GLU A 52 5.418 -13.538 4.757 1.00 0.00 N ATOM 807 CA GLU A 52 5.044 -13.395 6.167 1.00 0.00 C ATOM 808 C GLU A 52 5.007 -11.942 6.629 1.00 0.00 C ATOM 809 O GLU A 52 4.192 -11.540 7.460 1.00 0.00 O ATOM 810 CB GLU A 52 6.101 -14.122 6.955 1.00 0.00 C ATOM 811 CG GLU A 52 5.986 -15.618 6.880 1.00 0.00 C ATOM 812 CD GLU A 52 7.107 -16.318 7.611 1.00 0.00 C ATOM 813 OE1 GLU A 52 7.234 -16.130 8.837 1.00 0.00 O ATOM 814 OE2 GLU A 52 7.873 -17.053 6.953 1.00 0.00 O ATOM 0 H GLU A 52 6.425 -13.494 4.601 1.00 0.00 H new ATOM 0 HA GLU A 52 4.041 -13.795 6.313 1.00 0.00 H new ATOM 0 HB2 GLU A 52 7.084 -13.823 6.590 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.041 -13.813 7.999 1.00 0.00 H new ATOM 0 HG2 GLU A 52 5.030 -15.928 7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.988 -15.928 5.835 1.00 0.00 H new ATOM 821 N TYR A 53 5.916 -11.201 6.055 1.00 0.00 N ATOM 822 CA TYR A 53 6.297 -9.858 6.459 1.00 0.00 C ATOM 823 C TYR A 53 5.133 -8.895 6.456 1.00 0.00 C ATOM 824 O TYR A 53 4.902 -8.201 7.442 1.00 0.00 O ATOM 825 CB TYR A 53 7.334 -9.358 5.462 1.00 0.00 C ATOM 826 CG TYR A 53 6.871 -9.627 4.058 1.00 0.00 C ATOM 827 CD1 TYR A 53 6.904 -10.899 3.582 1.00 0.00 C ATOM 828 CD2 TYR A 53 6.338 -8.643 3.252 1.00 0.00 C ATOM 829 CE1 TYR A 53 6.431 -11.209 2.353 1.00 0.00 C ATOM 830 CE2 TYR A 53 5.864 -8.938 1.995 1.00 0.00 C ATOM 831 CZ TYR A 53 5.907 -10.232 1.547 1.00 0.00 C ATOM 832 OH TYR A 53 5.427 -10.548 0.298 1.00 0.00 O ATOM 0 H TYR A 53 6.445 -11.529 5.247 1.00 0.00 H new ATOM 0 HA TYR A 53 6.681 -9.903 7.478 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.498 -8.289 5.601 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.289 -9.853 5.640 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.318 -11.682 4.200 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.292 -7.626 3.613 1.00 0.00 H new ATOM 0 HE1 TYR A 53 6.466 -12.231 2.005 1.00 0.00 H new ATOM 0 HE2 TYR A 53 5.462 -8.157 1.367 1.00 0.00 H new ATOM 0 HH TYR A 53 5.091 -9.737 -0.138 1.00 0.00 H new ATOM 842 N ASP A 54 4.403 -8.913 5.339 1.00 0.00 N ATOM 843 CA ASP A 54 3.549 -7.812 4.918 1.00 0.00 C ATOM 844 C ASP A 54 2.888 -7.081 6.084 1.00 0.00 C ATOM 845 O ASP A 54 1.966 -7.576 6.733 1.00 0.00 O ATOM 846 CB ASP A 54 2.547 -8.305 3.866 1.00 0.00 C ATOM 847 CG ASP A 54 1.692 -9.476 4.316 1.00 0.00 C ATOM 848 OD1 ASP A 54 2.177 -10.627 4.235 1.00 0.00 O ATOM 849 OD2 ASP A 54 0.529 -9.264 4.709 1.00 0.00 O ATOM 0 H ASP A 54 4.392 -9.705 4.696 1.00 0.00 H new ATOM 0 HA ASP A 54 4.180 -7.055 4.454 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.893 -7.478 3.589 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.094 -8.594 2.968 1.00 0.00 H new ATOM 854 N GLN A 55 3.421 -5.889 6.354 1.00 0.00 N ATOM 855 CA GLN A 55 2.994 -5.077 7.481 1.00 0.00 C ATOM 856 C GLN A 55 1.911 -4.101 7.067 1.00 0.00 C ATOM 857 O GLN A 55 1.671 -3.885 5.888 1.00 0.00 O ATOM 858 CB GLN A 55 4.176 -4.297 8.065 1.00 0.00 C ATOM 859 CG GLN A 55 5.331 -5.180 8.467 1.00 0.00 C ATOM 860 CD GLN A 55 6.452 -5.166 7.446 1.00 0.00 C ATOM 861 OE1 GLN A 55 6.460 -5.946 6.501 1.00 0.00 O ATOM 862 NE2 GLN A 55 7.421 -4.288 7.651 1.00 0.00 N ATOM 0 H GLN A 55 4.160 -5.464 5.794 1.00 0.00 H new ATOM 0 HA GLN A 55 2.596 -5.752 8.239 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.522 -3.570 7.330 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.837 -3.734 8.935 1.00 0.00 H new ATOM 0 HG2 GLN A 55 5.718 -4.851 9.432 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.975 -6.202 8.598 1.00 0.00 H new ATOM 0 HE21 GLN A 55 7.376 -3.656 8.450 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.213 -4.243 7.010 1.00 0.00 H new ATOM 871 N VAL A 56 1.274 -3.500 8.052 1.00 0.00 N ATOM 872 CA VAL A 56 0.176 -2.610 7.825 1.00 0.00 C ATOM 873 C VAL A 56 0.471 -1.324 8.560 1.00 0.00 C ATOM 874 O VAL A 56 0.793 -1.324 9.748 1.00 0.00 O ATOM 875 CB VAL A 56 -1.179 -3.199 8.288 1.00 0.00 C ATOM 876 CG1 VAL A 56 -1.454 -4.536 7.616 1.00 0.00 C ATOM 877 CG2 VAL A 56 -1.250 -3.338 9.801 1.00 0.00 C ATOM 0 H VAL A 56 1.513 -3.623 9.036 1.00 0.00 H new ATOM 0 HA VAL A 56 0.077 -2.439 6.753 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.953 -2.494 7.984 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -2.412 -4.926 7.960 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -1.485 -4.400 6.535 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.663 -5.241 7.871 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.217 -3.755 10.083 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.455 -4.001 10.143 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.129 -2.358 10.262 1.00 0.00 H new ATOM 887 N LEU A 57 0.440 -0.240 7.838 1.00 0.00 N ATOM 888 CA LEU A 57 0.859 1.022 8.383 1.00 0.00 C ATOM 889 C LEU A 57 -0.296 1.746 9.032 1.00 0.00 C ATOM 890 O LEU A 57 -0.116 2.481 10.002 1.00 0.00 O ATOM 891 CB LEU A 57 1.512 1.836 7.281 1.00 0.00 C ATOM 892 CG LEU A 57 2.939 1.402 6.964 1.00 0.00 C ATOM 893 CD1 LEU A 57 3.791 1.580 8.190 1.00 0.00 C ATOM 894 CD2 LEU A 57 3.011 -0.036 6.472 1.00 0.00 C ATOM 0 H LEU A 57 0.128 -0.204 6.868 1.00 0.00 H new ATOM 0 HA LEU A 57 1.592 0.861 9.173 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.908 1.758 6.377 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.517 2.887 7.571 1.00 0.00 H new ATOM 0 HG LEU A 57 3.311 2.029 6.154 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.813 1.271 7.971 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.784 2.628 8.489 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.394 0.969 9.001 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.048 -0.297 6.260 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.619 -0.703 7.240 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.418 -0.140 5.563 1.00 0.00 H new ATOM 906 N ASP A 58 -1.480 1.519 8.496 1.00 0.00 N ATOM 907 CA ASP A 58 -2.709 1.969 9.118 1.00 0.00 C ATOM 908 C ASP A 58 -3.886 1.454 8.317 1.00 0.00 C ATOM 909 O ASP A 58 -3.741 1.094 7.145 1.00 0.00 O ATOM 910 CB ASP A 58 -2.776 3.498 9.218 1.00 0.00 C ATOM 911 CG ASP A 58 -3.986 3.972 10.006 1.00 0.00 C ATOM 912 OD1 ASP A 58 -4.360 3.305 10.996 1.00 0.00 O ATOM 913 OD2 ASP A 58 -4.586 5.001 9.635 1.00 0.00 O ATOM 0 H ASP A 58 -1.616 1.018 7.618 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.740 1.575 10.134 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.868 3.869 9.693 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.808 3.924 8.215 1.00 0.00 H new ATOM 918 N SER A 59 -5.035 1.405 8.950 1.00 0.00 N ATOM 919 CA SER A 59 -6.243 1.006 8.307 1.00 0.00 C ATOM 920 C SER A 59 -7.331 1.968 8.758 1.00 0.00 C ATOM 921 O SER A 59 -7.696 2.011 9.935 1.00 0.00 O ATOM 922 CB SER A 59 -6.573 -0.464 8.630 1.00 0.00 C ATOM 923 OG SER A 59 -6.583 -0.707 10.029 1.00 0.00 O ATOM 0 H SER A 59 -5.147 1.645 9.935 1.00 0.00 H new ATOM 0 HA SER A 59 -6.150 1.053 7.222 1.00 0.00 H new ATOM 0 HB2 SER A 59 -7.546 -0.719 8.210 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.840 -1.114 8.153 1.00 0.00 H new ATOM 0 HG SER A 59 -7.014 0.044 10.488 1.00 0.00 H new ATOM 929 N VAL A 60 -7.813 2.771 7.829 1.00 0.00 N ATOM 930 CA VAL A 60 -8.728 3.849 8.161 1.00 0.00 C ATOM 931 C VAL A 60 -10.146 3.425 7.868 1.00 0.00 C ATOM 932 O VAL A 60 -10.437 2.874 6.804 1.00 0.00 O ATOM 933 CB VAL A 60 -8.409 5.146 7.377 1.00 0.00 C ATOM 934 CG1 VAL A 60 -8.277 4.847 5.903 1.00 0.00 C ATOM 935 CG2 VAL A 60 -9.493 6.189 7.586 1.00 0.00 C ATOM 0 H VAL A 60 -7.587 2.698 6.837 1.00 0.00 H new ATOM 0 HA VAL A 60 -8.609 4.061 9.223 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.466 5.541 7.754 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.053 5.767 5.364 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.471 4.130 5.748 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.212 4.428 5.532 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -9.244 7.090 7.025 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -10.448 5.796 7.237 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -9.566 6.431 8.646 1.00 0.00 H new ATOM 945 N LEU A 61 -11.022 3.660 8.824 1.00 0.00 N ATOM 946 CA LEU A 61 -12.384 3.216 8.698 1.00 0.00 C ATOM 947 C LEU A 61 -13.315 4.399 8.473 1.00 0.00 C ATOM 948 O LEU A 61 -13.640 5.140 9.404 1.00 0.00 O ATOM 949 CB LEU A 61 -12.816 2.447 9.951 1.00 0.00 C ATOM 950 CG LEU A 61 -11.776 1.492 10.551 1.00 0.00 C ATOM 951 CD1 LEU A 61 -12.360 0.761 11.748 1.00 0.00 C ATOM 952 CD2 LEU A 61 -11.280 0.498 9.513 1.00 0.00 C ATOM 0 H LEU A 61 -10.811 4.154 9.691 1.00 0.00 H new ATOM 0 HA LEU A 61 -12.445 2.551 7.836 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.099 3.170 10.716 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.710 1.872 9.709 1.00 0.00 H new ATOM 0 HG LEU A 61 -10.924 2.085 10.882 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.611 0.087 12.164 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.658 1.485 12.507 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.231 0.186 11.434 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -10.544 -0.166 9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -12.119 -0.090 9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -10.820 1.036 8.684 1.00 0.00 H new ATOM 964 N VAL A 62 -13.742 4.560 7.237 1.00 0.00 N ATOM 965 CA VAL A 62 -14.738 5.558 6.883 1.00 0.00 C ATOM 966 C VAL A 62 -16.089 4.870 6.861 1.00 0.00 C ATOM 967 O VAL A 62 -16.279 3.938 6.097 1.00 0.00 O ATOM 968 CB VAL A 62 -14.441 6.175 5.497 1.00 0.00 C ATOM 969 CG1 VAL A 62 -15.490 7.220 5.132 1.00 0.00 C ATOM 970 CG2 VAL A 62 -13.042 6.777 5.465 1.00 0.00 C ATOM 0 H VAL A 62 -13.410 4.005 6.448 1.00 0.00 H new ATOM 0 HA VAL A 62 -14.723 6.368 7.612 1.00 0.00 H new ATOM 0 HB VAL A 62 -14.486 5.379 4.754 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -15.260 7.640 4.153 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -16.475 6.753 5.104 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -15.486 8.015 5.878 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -12.853 7.206 4.481 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -12.964 7.557 6.222 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -12.306 5.999 5.669 1.00 0.00 H new ATOM 980 N GLY A 63 -17.036 5.326 7.669 1.00 0.00 N ATOM 981 CA GLY A 63 -18.193 4.522 7.925 1.00 0.00 C ATOM 982 C GLY A 63 -19.238 4.727 6.894 1.00 0.00 C ATOM 983 O GLY A 63 -18.920 5.061 5.759 1.00 0.00 O ATOM 0 H GLY A 63 -17.017 6.229 8.143 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -17.908 3.470 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -18.597 4.767 8.907 1.00 0.00 H new ATOM 987 N PRO A 64 -20.500 4.525 7.249 1.00 0.00 N ATOM 988 CA PRO A 64 -21.594 4.921 6.409 1.00 0.00 C ATOM 989 C PRO A 64 -21.371 6.332 5.925 1.00 0.00 C ATOM 990 O PRO A 64 -21.310 7.284 6.709 1.00 0.00 O ATOM 991 CB PRO A 64 -22.800 4.890 7.329 1.00 0.00 C ATOM 992 CG PRO A 64 -22.259 4.630 8.679 1.00 0.00 C ATOM 993 CD PRO A 64 -20.971 3.904 8.479 1.00 0.00 C ATOM 0 HA PRO A 64 -21.710 4.280 5.535 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.341 5.835 7.298 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.502 4.111 7.030 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -22.100 5.562 9.221 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -22.955 4.033 9.269 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -20.279 4.052 9.308 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -21.114 2.829 8.371 1.00 0.00 H new ATOM 1001 N VAL A 65 -21.260 6.446 4.644 1.00 0.00 N ATOM 1002 CA VAL A 65 -20.866 7.669 4.015 1.00 0.00 C ATOM 1003 C VAL A 65 -21.695 7.858 2.761 1.00 0.00 C ATOM 1004 O VAL A 65 -21.846 6.931 1.964 1.00 0.00 O ATOM 1005 CB VAL A 65 -19.345 7.646 3.710 1.00 0.00 C ATOM 1006 CG1 VAL A 65 -18.939 6.355 3.028 1.00 0.00 C ATOM 1007 CG2 VAL A 65 -18.919 8.837 2.881 1.00 0.00 C ATOM 0 H VAL A 65 -21.442 5.683 3.992 1.00 0.00 H new ATOM 0 HA VAL A 65 -21.045 8.515 4.679 1.00 0.00 H new ATOM 0 HB VAL A 65 -18.830 7.705 4.669 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -17.868 6.371 2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -19.175 5.511 3.676 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -19.482 6.253 2.088 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -17.847 8.783 2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -19.457 8.832 1.933 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -19.145 9.756 3.422 1.00 0.00 H new ATOM 1017 N PRO A 66 -22.306 9.037 2.610 1.00 0.00 N ATOM 1018 CA PRO A 66 -23.153 9.327 1.466 1.00 0.00 C ATOM 1019 C PRO A 66 -22.377 9.214 0.171 1.00 0.00 C ATOM 1020 O PRO A 66 -21.281 9.772 0.048 1.00 0.00 O ATOM 1021 CB PRO A 66 -23.602 10.772 1.689 1.00 0.00 C ATOM 1022 CG PRO A 66 -22.637 11.336 2.673 1.00 0.00 C ATOM 1023 CD PRO A 66 -22.208 10.180 3.530 1.00 0.00 C ATOM 0 HA PRO A 66 -23.987 8.630 1.385 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -23.588 11.336 0.757 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -24.622 10.812 2.071 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.783 11.788 2.169 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -23.102 12.117 3.274 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -21.193 10.310 3.906 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.856 10.057 4.398 1.00 0.00 H new ATOM 1031 N ALA A 67 -22.927 8.443 -0.758 1.00 0.00 N ATOM 1032 CA ALA A 67 -22.370 8.338 -2.107 1.00 0.00 C ATOM 1033 C ALA A 67 -21.899 9.685 -2.635 1.00 0.00 C ATOM 1034 O ALA A 67 -22.501 10.727 -2.358 1.00 0.00 O ATOM 1035 CB ALA A 67 -23.371 7.765 -3.089 1.00 0.00 C ATOM 0 H ALA A 67 -23.762 7.878 -0.604 1.00 0.00 H new ATOM 0 HA ALA A 67 -21.518 7.664 -2.022 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -22.917 7.704 -4.078 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -23.669 6.768 -2.765 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -24.249 8.410 -3.132 1.00 0.00 H new ATOM 1041 N GLY A 68 -20.835 9.658 -3.416 1.00 0.00 N ATOM 1042 CA GLY A 68 -20.254 10.870 -3.883 1.00 0.00 C ATOM 1043 C GLY A 68 -18.784 10.696 -4.089 1.00 0.00 C ATOM 1044 O GLY A 68 -18.064 10.276 -3.183 1.00 0.00 O ATOM 0 H GLY A 68 -20.369 8.807 -3.730 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -20.726 11.170 -4.818 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -20.435 11.669 -3.164 1.00 0.00 H new ATOM 1048 N ARG A 69 -18.351 10.949 -5.292 1.00 0.00 N ATOM 1049 CA ARG A 69 -16.944 10.907 -5.605 1.00 0.00 C ATOM 1050 C ARG A 69 -16.229 12.059 -4.917 1.00 0.00 C ATOM 1051 O ARG A 69 -16.490 13.235 -5.180 1.00 0.00 O ATOM 1052 CB ARG A 69 -16.760 10.886 -7.123 1.00 0.00 C ATOM 1053 CG ARG A 69 -15.693 11.798 -7.668 1.00 0.00 C ATOM 1054 CD ARG A 69 -15.644 11.706 -9.183 1.00 0.00 C ATOM 1055 NE ARG A 69 -14.665 12.608 -9.782 1.00 0.00 N ATOM 1056 CZ ARG A 69 -14.022 12.341 -10.916 1.00 0.00 C ATOM 1057 NH1 ARG A 69 -14.175 11.160 -11.509 1.00 0.00 N ATOM 1058 NH2 ARG A 69 -13.216 13.250 -11.447 1.00 0.00 N ATOM 0 H ARG A 69 -18.954 11.188 -6.079 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.489 9.993 -5.223 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -16.529 9.865 -7.428 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -17.709 11.150 -7.589 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -15.894 12.826 -7.366 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -14.724 11.526 -7.249 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -15.409 10.681 -9.471 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -16.631 11.932 -9.586 1.00 0.00 H new ATOM 0 HE ARG A 69 -14.464 13.488 -9.307 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -14.786 10.457 -11.094 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -13.681 10.958 -12.378 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -13.090 14.151 -10.986 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -12.722 13.048 -12.316 1.00 0.00 H new ATOM 1072 N HIS A 70 -15.369 11.693 -3.981 1.00 0.00 N ATOM 1073 CA HIS A 70 -14.677 12.657 -3.148 1.00 0.00 C ATOM 1074 C HIS A 70 -13.332 12.107 -2.720 1.00 0.00 C ATOM 1075 O HIS A 70 -13.152 10.897 -2.583 1.00 0.00 O ATOM 1076 CB HIS A 70 -15.509 13.013 -1.910 1.00 0.00 C ATOM 1077 CG HIS A 70 -15.610 11.920 -0.881 1.00 0.00 C ATOM 1078 ND1 HIS A 70 -16.262 10.735 -0.903 1.00 0.00 N flip ATOM 1079 CD2 HIS A 70 -15.003 11.993 0.355 1.00 0.00 C flip ATOM 1080 CE1 HIS A 70 -16.047 10.120 0.307 1.00 0.00 C flip ATOM 1081 NE2 HIS A 70 -15.281 10.904 1.046 1.00 0.00 N flip ATOM 0 H HIS A 70 -15.133 10.722 -3.779 1.00 0.00 H new ATOM 0 HA HIS A 70 -14.527 13.563 -3.735 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -15.076 13.896 -1.440 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -16.515 13.284 -2.231 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -16.813 10.365 -1.677 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -14.394 12.814 0.703 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -16.438 9.158 0.604 1.00 0.00 H new ATOM 1090 N MET A 71 -12.403 12.999 -2.503 1.00 0.00 N ATOM 1091 CA MET A 71 -11.064 12.621 -2.128 1.00 0.00 C ATOM 1092 C MET A 71 -10.892 12.564 -0.618 1.00 0.00 C ATOM 1093 O MET A 71 -11.330 13.450 0.113 1.00 0.00 O ATOM 1094 CB MET A 71 -10.066 13.583 -2.758 1.00 0.00 C ATOM 1095 CG MET A 71 -8.722 13.606 -2.063 1.00 0.00 C ATOM 1096 SD MET A 71 -8.374 15.202 -1.284 1.00 0.00 S ATOM 1097 CE MET A 71 -8.339 14.747 0.450 1.00 0.00 C ATOM 0 H MET A 71 -12.551 14.005 -2.580 1.00 0.00 H new ATOM 0 HA MET A 71 -10.875 11.615 -2.503 1.00 0.00 H new ATOM 0 HB2 MET A 71 -9.920 13.309 -3.803 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.488 14.588 -2.748 1.00 0.00 H new ATOM 0 HG2 MET A 71 -8.694 12.822 -1.306 1.00 0.00 H new ATOM 0 HG3 MET A 71 -7.938 13.379 -2.786 1.00 0.00 H new ATOM 0 HE1 MET A 71 -7.684 15.429 0.992 1.00 0.00 H new ATOM 0 HE2 MET A 71 -9.346 14.806 0.862 1.00 0.00 H new ATOM 0 HE3 MET A 71 -7.965 13.728 0.551 1.00 0.00 H new ATOM 1107 N PHE A 72 -10.262 11.496 -0.171 1.00 0.00 N ATOM 1108 CA PHE A 72 -9.872 11.337 1.212 1.00 0.00 C ATOM 1109 C PHE A 72 -8.377 11.148 1.251 1.00 0.00 C ATOM 1110 O PHE A 72 -7.782 10.639 0.306 1.00 0.00 O ATOM 1111 CB PHE A 72 -10.616 10.151 1.865 1.00 0.00 C ATOM 1112 CG PHE A 72 -9.761 8.930 2.131 1.00 0.00 C ATOM 1113 CD1 PHE A 72 -9.011 8.851 3.300 1.00 0.00 C ATOM 1114 CD2 PHE A 72 -9.692 7.870 1.225 1.00 0.00 C ATOM 1115 CE1 PHE A 72 -8.221 7.754 3.562 1.00 0.00 C ATOM 1116 CE2 PHE A 72 -8.897 6.779 1.495 1.00 0.00 C ATOM 1117 CZ PHE A 72 -8.165 6.719 2.659 1.00 0.00 C ATOM 0 H PHE A 72 -10.005 10.708 -0.765 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.144 12.223 1.786 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.048 10.487 2.808 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -11.446 9.862 1.220 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -9.049 9.662 4.012 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -10.264 7.906 0.310 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.646 7.707 4.475 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.847 5.964 0.788 1.00 0.00 H new ATOM 0 HZ PHE A 72 -7.546 5.858 2.863 1.00 0.00 H new ATOM 1127 N VAL A 73 -7.770 11.570 2.324 1.00 0.00 N ATOM 1128 CA VAL A 73 -6.341 11.585 2.384 1.00 0.00 C ATOM 1129 C VAL A 73 -5.835 10.575 3.407 1.00 0.00 C ATOM 1130 O VAL A 73 -6.414 10.396 4.481 1.00 0.00 O ATOM 1131 CB VAL A 73 -5.834 13.009 2.647 1.00 0.00 C ATOM 1132 CG1 VAL A 73 -5.991 13.423 4.101 1.00 0.00 C ATOM 1133 CG2 VAL A 73 -4.414 13.153 2.164 1.00 0.00 C ATOM 0 H VAL A 73 -8.242 11.906 3.164 1.00 0.00 H new ATOM 0 HA VAL A 73 -5.936 11.278 1.420 1.00 0.00 H new ATOM 0 HB VAL A 73 -6.458 13.697 2.077 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -5.617 14.438 4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -7.044 13.385 4.378 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.424 12.742 4.736 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -4.065 14.168 2.356 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -3.776 12.444 2.692 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.372 12.951 1.094 1.00 0.00 H new ATOM 1143 N PHE A 74 -4.766 9.909 3.039 1.00 0.00 N ATOM 1144 CA PHE A 74 -4.320 8.704 3.707 1.00 0.00 C ATOM 1145 C PHE A 74 -2.858 8.828 4.106 1.00 0.00 C ATOM 1146 O PHE A 74 -1.994 8.985 3.255 1.00 0.00 O ATOM 1147 CB PHE A 74 -4.477 7.552 2.723 1.00 0.00 C ATOM 1148 CG PHE A 74 -4.645 6.190 3.324 1.00 0.00 C ATOM 1149 CD1 PHE A 74 -4.165 5.869 4.585 1.00 0.00 C ATOM 1150 CD2 PHE A 74 -5.296 5.223 2.598 1.00 0.00 C ATOM 1151 CE1 PHE A 74 -4.340 4.595 5.100 1.00 0.00 C ATOM 1152 CE2 PHE A 74 -5.473 3.961 3.095 1.00 0.00 C ATOM 1153 CZ PHE A 74 -4.996 3.634 4.349 1.00 0.00 C ATOM 0 H PHE A 74 -4.173 10.190 2.258 1.00 0.00 H new ATOM 0 HA PHE A 74 -4.908 8.536 4.609 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -5.341 7.757 2.090 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -3.602 7.535 2.073 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -3.651 6.618 5.170 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -5.675 5.464 1.616 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -3.966 4.352 6.084 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.988 3.218 2.504 1.00 0.00 H new ATOM 0 HZ PHE A 74 -5.133 2.637 4.741 1.00 0.00 H new ATOM 1163 N GLN A 75 -2.580 8.748 5.387 1.00 0.00 N ATOM 1164 CA GLN A 75 -1.203 8.795 5.856 1.00 0.00 C ATOM 1165 C GLN A 75 -0.975 7.703 6.881 1.00 0.00 C ATOM 1166 O GLN A 75 -1.909 7.268 7.557 1.00 0.00 O ATOM 1167 CB GLN A 75 -0.852 10.145 6.471 1.00 0.00 C ATOM 1168 CG GLN A 75 -1.107 11.324 5.546 1.00 0.00 C ATOM 1169 CD GLN A 75 -0.936 12.668 6.233 1.00 0.00 C ATOM 1170 OE1 GLN A 75 -1.196 12.716 7.532 1.00 0.00 O flip ATOM 1171 NE2 GLN A 75 -0.571 13.656 5.600 1.00 0.00 N flip ATOM 0 H GLN A 75 -3.279 8.651 6.123 1.00 0.00 H new ATOM 0 HA GLN A 75 -0.558 8.644 4.991 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -1.431 10.280 7.384 1.00 0.00 H new ATOM 0 HB3 GLN A 75 0.199 10.141 6.758 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -0.425 11.267 4.698 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -2.119 11.253 5.147 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -0.380 13.580 4.601 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.459 14.552 6.074 1.00 0.00 H new ATOM 1180 N ALA A 76 0.260 7.273 6.992 1.00 0.00 N ATOM 1181 CA ALA A 76 0.639 6.232 7.928 1.00 0.00 C ATOM 1182 C ALA A 76 2.147 6.201 8.045 1.00 0.00 C ATOM 1183 O ALA A 76 2.825 6.671 7.147 1.00 0.00 O ATOM 1184 CB ALA A 76 0.106 4.887 7.475 1.00 0.00 C ATOM 0 H ALA A 76 1.035 7.634 6.436 1.00 0.00 H new ATOM 0 HA ALA A 76 0.206 6.446 8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.401 4.119 8.190 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.982 4.928 7.415 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.515 4.645 6.494 1.00 0.00 H new ATOM 1190 N ASP A 77 2.672 5.648 9.122 1.00 0.00 N ATOM 1191 CA ASP A 77 4.109 5.712 9.388 1.00 0.00 C ATOM 1192 C ASP A 77 4.930 4.937 8.354 1.00 0.00 C ATOM 1193 O ASP A 77 4.410 4.442 7.356 1.00 0.00 O ATOM 1194 CB ASP A 77 4.412 5.182 10.790 1.00 0.00 C ATOM 1195 CG ASP A 77 3.790 6.036 11.872 1.00 0.00 C ATOM 1196 OD1 ASP A 77 4.412 7.046 12.264 1.00 0.00 O ATOM 1197 OD2 ASP A 77 2.676 5.713 12.328 1.00 0.00 O ATOM 0 H ASP A 77 2.132 5.149 9.829 1.00 0.00 H new ATOM 0 HA ASP A 77 4.399 6.760 9.318 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.041 4.161 10.878 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.491 5.143 10.936 1.00 0.00 H new ATOM 1202 N ALA A 78 6.229 4.869 8.592 1.00 0.00 N ATOM 1203 CA ALA A 78 7.128 4.105 7.770 1.00 0.00 C ATOM 1204 C ALA A 78 7.209 2.679 8.285 1.00 0.00 C ATOM 1205 O ALA A 78 7.004 2.424 9.474 1.00 0.00 O ATOM 1206 CB ALA A 78 8.503 4.751 7.774 1.00 0.00 C ATOM 0 H ALA A 78 6.684 5.349 9.368 1.00 0.00 H new ATOM 0 HA ALA A 78 6.755 4.086 6.746 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.181 4.168 7.150 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.430 5.765 7.381 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.887 4.784 8.794 1.00 0.00 H new ATOM 1212 N PRO A 79 7.491 1.739 7.386 1.00 0.00 N ATOM 1213 CA PRO A 79 7.612 0.313 7.711 1.00 0.00 C ATOM 1214 C PRO A 79 8.720 0.022 8.702 1.00 0.00 C ATOM 1215 O PRO A 79 9.514 0.893 9.057 1.00 0.00 O ATOM 1216 CB PRO A 79 7.938 -0.327 6.363 1.00 0.00 C ATOM 1217 CG PRO A 79 7.400 0.641 5.383 1.00 0.00 C ATOM 1218 CD PRO A 79 7.695 1.981 5.958 1.00 0.00 C ATOM 0 HA PRO A 79 6.706 -0.066 8.184 1.00 0.00 H new ATOM 0 HB2 PRO A 79 9.011 -0.472 6.236 1.00 0.00 H new ATOM 0 HB3 PRO A 79 7.469 -1.306 6.259 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.872 0.518 4.408 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.329 0.501 5.239 1.00 0.00 H new ATOM 0 HD2 PRO A 79 8.712 2.306 5.739 1.00 0.00 H new ATOM 0 HD3 PRO A 79 7.024 2.749 5.573 1.00 0.00 H new ATOM 1226 N ASN A 80 8.772 -1.225 9.123 1.00 0.00 N ATOM 1227 CA ASN A 80 9.737 -1.648 10.126 1.00 0.00 C ATOM 1228 C ASN A 80 11.036 -2.040 9.466 1.00 0.00 C ATOM 1229 O ASN A 80 11.095 -3.006 8.701 1.00 0.00 O ATOM 1230 CB ASN A 80 9.207 -2.826 10.943 1.00 0.00 C ATOM 1231 CG ASN A 80 7.931 -2.512 11.696 1.00 0.00 C ATOM 1232 OD1 ASN A 80 7.644 -1.359 12.017 1.00 0.00 O ATOM 1233 ND2 ASN A 80 7.172 -3.549 11.999 1.00 0.00 N ATOM 0 H ASN A 80 8.158 -1.967 8.788 1.00 0.00 H new ATOM 0 HA ASN A 80 9.907 -0.808 10.799 1.00 0.00 H new ATOM 0 HB2 ASN A 80 9.028 -3.669 10.276 1.00 0.00 H new ATOM 0 HB3 ASN A 80 9.972 -3.138 11.654 1.00 0.00 H new ATOM 0 HD21 ASN A 80 6.306 -3.412 12.521 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.451 -4.487 11.711 1.00 0.00 H new ATOM 1240 N PRO A 81 12.094 -1.287 9.766 1.00 0.00 N ATOM 1241 CA PRO A 81 13.424 -1.513 9.211 1.00 0.00 C ATOM 1242 C PRO A 81 13.974 -2.892 9.568 1.00 0.00 C ATOM 1243 O PRO A 81 14.826 -3.433 8.867 1.00 0.00 O ATOM 1244 CB PRO A 81 14.283 -0.410 9.836 1.00 0.00 C ATOM 1245 CG PRO A 81 13.501 0.103 10.989 1.00 0.00 C ATOM 1246 CD PRO A 81 12.060 -0.141 10.680 1.00 0.00 C ATOM 0 HA PRO A 81 13.414 -1.483 8.121 1.00 0.00 H new ATOM 0 HB2 PRO A 81 15.247 -0.801 10.160 1.00 0.00 H new ATOM 0 HB3 PRO A 81 14.486 0.383 9.117 1.00 0.00 H new ATOM 0 HG2 PRO A 81 13.790 -0.406 11.909 1.00 0.00 H new ATOM 0 HG3 PRO A 81 13.689 1.166 11.140 1.00 0.00 H new ATOM 0 HD2 PRO A 81 11.489 -0.363 11.581 1.00 0.00 H new ATOM 0 HD3 PRO A 81 11.596 0.729 10.215 1.00 0.00 H new ATOM 1254 N GLY A 82 13.461 -3.468 10.649 1.00 0.00 N ATOM 1255 CA GLY A 82 13.918 -4.773 11.078 1.00 0.00 C ATOM 1256 C GLY A 82 13.242 -5.904 10.326 1.00 0.00 C ATOM 1257 O GLY A 82 13.699 -7.048 10.368 1.00 0.00 O ATOM 0 H GLY A 82 12.737 -3.053 11.235 1.00 0.00 H new ATOM 0 HA2 GLY A 82 14.997 -4.841 10.936 1.00 0.00 H new ATOM 0 HA3 GLY A 82 13.729 -4.887 12.145 1.00 0.00 H new ATOM 1261 N LEU A 83 12.163 -5.588 9.622 1.00 0.00 N ATOM 1262 CA LEU A 83 11.414 -6.602 8.890 1.00 0.00 C ATOM 1263 C LEU A 83 11.946 -6.750 7.481 1.00 0.00 C ATOM 1264 O LEU A 83 11.876 -7.829 6.898 1.00 0.00 O ATOM 1265 CB LEU A 83 9.914 -6.267 8.866 1.00 0.00 C ATOM 1266 CG LEU A 83 9.200 -6.441 10.207 1.00 0.00 C ATOM 1267 CD1 LEU A 83 7.752 -6.840 10.003 1.00 0.00 C ATOM 1268 CD2 LEU A 83 9.910 -7.461 11.088 1.00 0.00 C ATOM 0 H LEU A 83 11.788 -4.643 9.542 1.00 0.00 H new ATOM 0 HA LEU A 83 11.543 -7.552 9.408 1.00 0.00 H new ATOM 0 HB2 LEU A 83 9.791 -5.236 8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 83 9.426 -6.900 8.125 1.00 0.00 H new ATOM 0 HG LEU A 83 9.226 -5.478 10.716 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.267 -6.957 10.972 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.239 -6.067 9.431 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.708 -7.783 9.459 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.376 -7.560 12.033 1.00 0.00 H new ATOM 0 HD22 LEU A 83 9.933 -8.426 10.581 1.00 0.00 H new ATOM 0 HD23 LEU A 83 10.930 -7.128 11.281 1.00 0.00 H new ATOM 1280 N ILE A 84 12.497 -5.674 6.943 1.00 0.00 N ATOM 1281 CA ILE A 84 12.964 -5.686 5.563 1.00 0.00 C ATOM 1282 C ILE A 84 14.273 -6.445 5.376 1.00 0.00 C ATOM 1283 O ILE A 84 15.272 -6.183 6.052 1.00 0.00 O ATOM 1284 CB ILE A 84 13.152 -4.285 4.992 1.00 0.00 C ATOM 1285 CG1 ILE A 84 11.871 -3.466 5.145 1.00 0.00 C ATOM 1286 CG2 ILE A 84 13.557 -4.398 3.528 1.00 0.00 C ATOM 1287 CD1 ILE A 84 11.956 -2.100 4.511 1.00 0.00 C ATOM 0 H ILE A 84 12.632 -4.790 7.433 1.00 0.00 H new ATOM 0 HA ILE A 84 12.170 -6.202 5.023 1.00 0.00 H new ATOM 0 HB ILE A 84 13.938 -3.768 5.542 1.00 0.00 H new ATOM 0 HG12 ILE A 84 11.042 -4.015 4.699 1.00 0.00 H new ATOM 0 HG13 ILE A 84 11.645 -3.353 6.205 1.00 0.00 H new ATOM 0 HG21 ILE A 84 13.694 -3.401 3.110 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.491 -4.955 3.451 1.00 0.00 H new ATOM 0 HG23 ILE A 84 12.777 -4.919 2.974 1.00 0.00 H new ATOM 0 HD11 ILE A 84 11.013 -1.572 4.656 1.00 0.00 H new ATOM 0 HD12 ILE A 84 12.764 -1.534 4.974 1.00 0.00 H new ATOM 0 HD13 ILE A 84 12.152 -2.206 3.444 1.00 0.00 H new ATOM 1299 N PRO A 85 14.257 -7.412 4.449 1.00 0.00 N ATOM 1300 CA PRO A 85 15.436 -8.129 4.004 1.00 0.00 C ATOM 1301 C PRO A 85 16.257 -7.365 2.965 1.00 0.00 C ATOM 1302 O PRO A 85 15.795 -6.399 2.356 1.00 0.00 O ATOM 1303 CB PRO A 85 14.860 -9.398 3.388 1.00 0.00 C ATOM 1304 CG PRO A 85 13.563 -8.958 2.819 1.00 0.00 C ATOM 1305 CD PRO A 85 13.052 -7.887 3.747 1.00 0.00 C ATOM 0 HA PRO A 85 16.129 -8.300 4.827 1.00 0.00 H new ATOM 0 HB2 PRO A 85 15.517 -9.803 2.619 1.00 0.00 H new ATOM 0 HB3 PRO A 85 14.724 -10.180 4.136 1.00 0.00 H new ATOM 0 HG2 PRO A 85 13.690 -8.572 1.808 1.00 0.00 H new ATOM 0 HG3 PRO A 85 12.861 -9.789 2.757 1.00 0.00 H new ATOM 0 HD2 PRO A 85 12.568 -7.080 3.196 1.00 0.00 H new ATOM 0 HD3 PRO A 85 12.315 -8.283 4.445 1.00 0.00 H new ATOM 1313 N ASP A 86 17.460 -7.848 2.782 1.00 0.00 N ATOM 1314 CA ASP A 86 18.386 -7.419 1.733 1.00 0.00 C ATOM 1315 C ASP A 86 17.682 -7.238 0.386 1.00 0.00 C ATOM 1316 O ASP A 86 17.807 -6.194 -0.257 1.00 0.00 O ATOM 1317 CB ASP A 86 19.435 -8.537 1.621 1.00 0.00 C ATOM 1318 CG ASP A 86 20.546 -8.299 0.618 1.00 0.00 C ATOM 1319 OD1 ASP A 86 20.254 -8.032 -0.563 1.00 0.00 O ATOM 1320 OD2 ASP A 86 21.718 -8.466 1.001 1.00 0.00 O ATOM 0 H ASP A 86 17.848 -8.580 3.377 1.00 0.00 H new ATOM 0 HA ASP A 86 18.825 -6.454 1.986 1.00 0.00 H new ATOM 0 HB2 ASP A 86 19.883 -8.689 2.603 1.00 0.00 H new ATOM 0 HB3 ASP A 86 18.925 -9.463 1.357 1.00 0.00 H new ATOM 1325 N ALA A 87 16.891 -8.223 -0.002 1.00 0.00 N ATOM 1326 CA ALA A 87 16.359 -8.277 -1.360 1.00 0.00 C ATOM 1327 C ALA A 87 15.188 -7.324 -1.561 1.00 0.00 C ATOM 1328 O ALA A 87 14.876 -6.952 -2.691 1.00 0.00 O ATOM 1329 CB ALA A 87 15.948 -9.697 -1.707 1.00 0.00 C ATOM 0 H ALA A 87 16.602 -8.995 0.598 1.00 0.00 H new ATOM 0 HA ALA A 87 17.155 -7.956 -2.032 1.00 0.00 H new ATOM 0 HB1 ALA A 87 15.553 -9.724 -2.723 1.00 0.00 H new ATOM 0 HB2 ALA A 87 16.815 -10.354 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 87 15.181 -10.034 -1.010 1.00 0.00 H new ATOM 1335 N ASP A 88 14.551 -6.930 -0.473 1.00 0.00 N ATOM 1336 CA ASP A 88 13.380 -6.059 -0.549 1.00 0.00 C ATOM 1337 C ASP A 88 13.783 -4.591 -0.498 1.00 0.00 C ATOM 1338 O ASP A 88 13.246 -3.760 -1.225 1.00 0.00 O ATOM 1339 CB ASP A 88 12.434 -6.366 0.613 1.00 0.00 C ATOM 1340 CG ASP A 88 11.134 -5.586 0.548 1.00 0.00 C ATOM 1341 OD1 ASP A 88 11.122 -4.394 0.918 1.00 0.00 O ATOM 1342 OD2 ASP A 88 10.119 -6.186 0.152 1.00 0.00 O ATOM 0 H ASP A 88 14.820 -7.196 0.474 1.00 0.00 H new ATOM 0 HA ASP A 88 12.878 -6.247 -1.498 1.00 0.00 H new ATOM 0 HB2 ASP A 88 12.210 -7.433 0.619 1.00 0.00 H new ATOM 0 HB3 ASP A 88 12.938 -6.141 1.553 1.00 0.00 H new ATOM 1347 N ALA A 89 14.778 -4.297 0.323 1.00 0.00 N ATOM 1348 CA ALA A 89 15.040 -2.930 0.734 1.00 0.00 C ATOM 1349 C ALA A 89 15.630 -2.077 -0.366 1.00 0.00 C ATOM 1350 O ALA A 89 15.299 -0.918 -0.497 1.00 0.00 O ATOM 1351 CB ALA A 89 15.977 -2.919 1.918 1.00 0.00 C ATOM 0 H ALA A 89 15.417 -4.988 0.717 1.00 0.00 H new ATOM 0 HA ALA A 89 14.074 -2.499 0.998 1.00 0.00 H new ATOM 0 HB1 ALA A 89 16.169 -1.890 2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 89 15.523 -3.462 2.747 1.00 0.00 H new ATOM 0 HB3 ALA A 89 16.917 -3.397 1.643 1.00 0.00 H new ATOM 1357 N VAL A 90 16.544 -2.628 -1.121 1.00 0.00 N ATOM 1358 CA VAL A 90 17.295 -1.847 -2.056 1.00 0.00 C ATOM 1359 C VAL A 90 16.809 -1.999 -3.493 1.00 0.00 C ATOM 1360 O VAL A 90 17.593 -2.207 -4.422 1.00 0.00 O ATOM 1361 CB VAL A 90 18.783 -2.110 -1.890 1.00 0.00 C ATOM 1362 CG1 VAL A 90 19.305 -1.056 -0.956 1.00 0.00 C ATOM 1363 CG2 VAL A 90 19.082 -3.490 -1.325 1.00 0.00 C ATOM 0 H VAL A 90 16.784 -3.619 -1.103 1.00 0.00 H new ATOM 0 HA VAL A 90 17.121 -0.796 -1.825 1.00 0.00 H new ATOM 0 HB VAL A 90 19.264 -2.074 -2.868 1.00 0.00 H new ATOM 0 HG11 VAL A 90 20.374 -1.202 -0.804 1.00 0.00 H new ATOM 0 HG12 VAL A 90 19.131 -0.070 -1.387 1.00 0.00 H new ATOM 0 HG13 VAL A 90 18.789 -1.130 0.001 1.00 0.00 H new ATOM 0 HG21 VAL A 90 20.160 -3.618 -1.230 1.00 0.00 H new ATOM 0 HG22 VAL A 90 18.617 -3.590 -0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.684 -4.252 -1.995 1.00 0.00 H new ATOM 1373 N GLY A 91 15.499 -1.894 -3.648 1.00 0.00 N ATOM 1374 CA GLY A 91 14.842 -2.183 -4.904 1.00 0.00 C ATOM 1375 C GLY A 91 13.375 -1.905 -4.824 1.00 0.00 C ATOM 1376 O GLY A 91 12.957 -0.821 -4.429 1.00 0.00 O ATOM 0 H GLY A 91 14.864 -1.605 -2.903 1.00 0.00 H new ATOM 0 HA2 GLY A 91 15.286 -1.581 -5.697 1.00 0.00 H new ATOM 0 HA3 GLY A 91 15.003 -3.228 -5.169 1.00 0.00 H new ATOM 1380 N VAL A 92 12.600 -2.890 -5.185 1.00 0.00 N ATOM 1381 CA VAL A 92 11.191 -2.745 -5.314 1.00 0.00 C ATOM 1382 C VAL A 92 10.431 -3.369 -4.182 1.00 0.00 C ATOM 1383 O VAL A 92 10.652 -4.517 -3.799 1.00 0.00 O ATOM 1384 CB VAL A 92 10.730 -3.368 -6.610 1.00 0.00 C ATOM 1385 CG1 VAL A 92 10.594 -2.304 -7.649 1.00 0.00 C ATOM 1386 CG2 VAL A 92 11.690 -4.445 -7.063 1.00 0.00 C ATOM 0 H VAL A 92 12.942 -3.827 -5.399 1.00 0.00 H new ATOM 0 HA VAL A 92 10.986 -1.675 -5.299 1.00 0.00 H new ATOM 0 HB VAL A 92 9.760 -3.840 -6.453 1.00 0.00 H new ATOM 0 HG11 VAL A 92 10.261 -2.751 -8.586 1.00 0.00 H new ATOM 0 HG12 VAL A 92 9.863 -1.565 -7.320 1.00 0.00 H new ATOM 0 HG13 VAL A 92 11.558 -1.818 -7.801 1.00 0.00 H new ATOM 0 HG21 VAL A 92 11.336 -4.878 -7.998 1.00 0.00 H new ATOM 0 HG22 VAL A 92 12.678 -4.011 -7.215 1.00 0.00 H new ATOM 0 HG23 VAL A 92 11.749 -5.223 -6.302 1.00 0.00 H new ATOM 1396 N THR A 93 9.513 -2.588 -3.695 1.00 0.00 N ATOM 1397 CA THR A 93 8.587 -2.999 -2.694 1.00 0.00 C ATOM 1398 C THR A 93 7.215 -2.548 -3.149 1.00 0.00 C ATOM 1399 O THR A 93 7.102 -1.790 -4.106 1.00 0.00 O ATOM 1400 CB THR A 93 8.931 -2.369 -1.346 1.00 0.00 C ATOM 1401 OG1 THR A 93 10.326 -2.534 -1.061 1.00 0.00 O ATOM 1402 CG2 THR A 93 8.107 -2.974 -0.235 1.00 0.00 C ATOM 0 H THR A 93 9.388 -1.621 -3.995 1.00 0.00 H new ATOM 0 HA THR A 93 8.620 -4.081 -2.563 1.00 0.00 H new ATOM 0 HB THR A 93 8.699 -1.306 -1.406 1.00 0.00 H new ATOM 0 HG1 THR A 93 10.439 -3.207 -0.358 1.00 0.00 H new ATOM 0 HG21 THR A 93 8.374 -2.506 0.712 1.00 0.00 H new ATOM 0 HG22 THR A 93 7.048 -2.809 -0.436 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.303 -4.045 -0.178 1.00 0.00 H new ATOM 1410 N VAL A 94 6.184 -3.032 -2.515 1.00 0.00 N ATOM 1411 CA VAL A 94 4.837 -2.621 -2.849 1.00 0.00 C ATOM 1412 C VAL A 94 4.043 -2.298 -1.609 1.00 0.00 C ATOM 1413 O VAL A 94 4.180 -2.962 -0.579 1.00 0.00 O ATOM 1414 CB VAL A 94 4.108 -3.685 -3.693 1.00 0.00 C ATOM 1415 CG1 VAL A 94 2.620 -3.439 -3.750 1.00 0.00 C ATOM 1416 CG2 VAL A 94 4.625 -3.619 -5.086 1.00 0.00 C ATOM 0 H VAL A 94 6.245 -3.715 -1.760 1.00 0.00 H new ATOM 0 HA VAL A 94 4.919 -1.716 -3.451 1.00 0.00 H new ATOM 0 HB VAL A 94 4.287 -4.656 -3.231 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.146 -4.212 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.208 -3.464 -2.741 1.00 0.00 H new ATOM 0 HG13 VAL A 94 2.429 -2.463 -4.195 1.00 0.00 H new ATOM 0 HG21 VAL A 94 4.119 -4.366 -5.698 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.438 -2.627 -5.497 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.697 -3.816 -5.086 1.00 0.00 H new ATOM 1426 N VAL A 95 3.230 -1.264 -1.711 1.00 0.00 N ATOM 1427 CA VAL A 95 2.345 -0.906 -0.635 1.00 0.00 C ATOM 1428 C VAL A 95 0.929 -0.877 -1.173 1.00 0.00 C ATOM 1429 O VAL A 95 0.544 0.003 -1.943 1.00 0.00 O ATOM 1430 CB VAL A 95 2.743 0.438 0.025 1.00 0.00 C ATOM 1431 CG1 VAL A 95 4.102 0.307 0.668 1.00 0.00 C ATOM 1432 CG2 VAL A 95 2.761 1.579 -0.976 1.00 0.00 C ATOM 0 H VAL A 95 3.169 -0.661 -2.531 1.00 0.00 H new ATOM 0 HA VAL A 95 2.418 -1.652 0.157 1.00 0.00 H new ATOM 0 HB VAL A 95 1.992 0.670 0.780 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.378 1.254 1.131 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.071 -0.473 1.429 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.840 0.045 -0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.045 2.502 -0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 95 3.482 1.360 -1.764 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.769 1.695 -1.413 1.00 0.00 H new ATOM 1442 N LEU A 96 0.170 -1.881 -0.798 1.00 0.00 N ATOM 1443 CA LEU A 96 -1.163 -2.056 -1.329 1.00 0.00 C ATOM 1444 C LEU A 96 -2.175 -1.446 -0.408 1.00 0.00 C ATOM 1445 O LEU A 96 -2.093 -1.595 0.806 1.00 0.00 O ATOM 1446 CB LEU A 96 -1.513 -3.528 -1.569 1.00 0.00 C ATOM 1447 CG LEU A 96 -0.700 -4.562 -0.786 1.00 0.00 C ATOM 1448 CD1 LEU A 96 -1.509 -5.825 -0.571 1.00 0.00 C ATOM 1449 CD2 LEU A 96 0.553 -4.901 -1.552 1.00 0.00 C ATOM 0 H LEU A 96 0.454 -2.592 -0.124 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.184 -1.550 -2.294 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.567 -3.671 -1.330 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.396 -3.737 -2.632 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.442 -4.139 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.914 -6.548 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.412 -5.587 -0.009 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.784 -6.250 -1.536 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.132 -5.637 -0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.285 -5.312 -2.525 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.150 -3.999 -1.691 1.00 0.00 H new ATOM 1461 N ILE A 97 -3.129 -0.758 -0.987 1.00 0.00 N ATOM 1462 CA ILE A 97 -4.167 -0.164 -0.209 1.00 0.00 C ATOM 1463 C ILE A 97 -5.435 -0.898 -0.458 1.00 0.00 C ATOM 1464 O ILE A 97 -6.177 -0.634 -1.406 1.00 0.00 O ATOM 1465 CB ILE A 97 -4.333 1.322 -0.473 1.00 0.00 C ATOM 1466 CG1 ILE A 97 -2.969 1.971 -0.353 1.00 0.00 C ATOM 1467 CG2 ILE A 97 -5.297 1.931 0.532 1.00 0.00 C ATOM 1468 CD1 ILE A 97 -3.030 3.474 -0.323 1.00 0.00 C ATOM 0 H ILE A 97 -3.201 -0.601 -1.992 1.00 0.00 H new ATOM 0 HA ILE A 97 -3.889 -0.245 0.842 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.742 1.485 -1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -2.483 1.615 0.555 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.348 1.655 -1.192 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -5.407 2.997 0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.268 1.444 0.446 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -4.908 1.790 1.541 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -2.021 3.877 -0.236 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -3.488 3.838 -1.243 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.625 3.797 0.531 1.00 0.00 H new ATOM 1480 N THR A 98 -5.620 -1.868 0.378 1.00 0.00 N ATOM 1481 CA THR A 98 -6.762 -2.709 0.314 1.00 0.00 C ATOM 1482 C THR A 98 -7.867 -2.160 1.154 1.00 0.00 C ATOM 1483 O THR A 98 -7.692 -1.839 2.329 1.00 0.00 O ATOM 1484 CB THR A 98 -6.459 -4.159 0.718 1.00 0.00 C ATOM 1485 OG1 THR A 98 -7.592 -4.753 1.361 1.00 0.00 O ATOM 1486 CG2 THR A 98 -5.245 -4.239 1.620 1.00 0.00 C ATOM 0 H THR A 98 -4.972 -2.098 1.132 1.00 0.00 H new ATOM 0 HA THR A 98 -7.075 -2.728 -0.730 1.00 0.00 H new ATOM 0 HB THR A 98 -6.241 -4.715 -0.194 1.00 0.00 H new ATOM 0 HG1 THR A 98 -7.469 -4.723 2.333 1.00 0.00 H new ATOM 0 HG21 THR A 98 -5.058 -5.279 1.887 1.00 0.00 H new ATOM 0 HG22 THR A 98 -4.377 -3.837 1.098 1.00 0.00 H new ATOM 0 HG23 THR A 98 -5.425 -3.659 2.525 1.00 0.00 H new ATOM 1494 N CYS A 99 -8.986 -1.999 0.516 1.00 0.00 N ATOM 1495 CA CYS A 99 -10.196 -1.676 1.228 1.00 0.00 C ATOM 1496 C CYS A 99 -10.880 -2.969 1.610 1.00 0.00 C ATOM 1497 O CYS A 99 -10.711 -3.979 0.943 1.00 0.00 O ATOM 1498 CB CYS A 99 -11.115 -0.799 0.400 1.00 0.00 C ATOM 1499 SG CYS A 99 -10.418 0.807 -0.034 1.00 0.00 S ATOM 0 H CYS A 99 -9.092 -2.085 -0.495 1.00 0.00 H new ATOM 0 HA CYS A 99 -9.947 -1.106 2.123 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -11.375 -1.329 -0.517 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -12.042 -0.642 0.951 1.00 0.00 H new ATOM 0 HG CYS A 99 -10.363 1.557 1.026 1.00 0.00 H new ATOM 1505 N THR A 100 -11.651 -2.933 2.665 1.00 0.00 N ATOM 1506 CA THR A 100 -12.160 -4.127 3.283 1.00 0.00 C ATOM 1507 C THR A 100 -13.496 -3.809 3.917 1.00 0.00 C ATOM 1508 O THR A 100 -13.578 -3.011 4.846 1.00 0.00 O ATOM 1509 CB THR A 100 -11.187 -4.645 4.363 1.00 0.00 C ATOM 1510 OG1 THR A 100 -9.852 -4.706 3.841 1.00 0.00 O ATOM 1511 CG2 THR A 100 -11.603 -6.019 4.862 1.00 0.00 C ATOM 0 H THR A 100 -11.945 -2.069 3.121 1.00 0.00 H new ATOM 0 HA THR A 100 -12.271 -4.902 2.525 1.00 0.00 H new ATOM 0 HB THR A 100 -11.217 -3.949 5.201 1.00 0.00 H new ATOM 0 HG1 THR A 100 -9.304 -4.012 4.263 1.00 0.00 H new ATOM 0 HG21 THR A 100 -10.899 -6.359 5.622 1.00 0.00 H new ATOM 0 HG22 THR A 100 -12.603 -5.962 5.293 1.00 0.00 H new ATOM 0 HG23 THR A 100 -11.606 -6.723 4.030 1.00 0.00 H new ATOM 1519 N TYR A 101 -14.540 -4.390 3.392 1.00 0.00 N ATOM 1520 CA TYR A 101 -15.862 -4.132 3.904 1.00 0.00 C ATOM 1521 C TYR A 101 -16.540 -5.460 4.203 1.00 0.00 C ATOM 1522 O TYR A 101 -16.595 -6.351 3.351 1.00 0.00 O ATOM 1523 CB TYR A 101 -16.621 -3.263 2.891 1.00 0.00 C ATOM 1524 CG TYR A 101 -17.988 -2.799 3.316 1.00 0.00 C ATOM 1525 CD1 TYR A 101 -19.111 -3.575 3.081 1.00 0.00 C ATOM 1526 CD2 TYR A 101 -18.159 -1.563 3.919 1.00 0.00 C ATOM 1527 CE1 TYR A 101 -20.366 -3.130 3.435 1.00 0.00 C ATOM 1528 CE2 TYR A 101 -19.411 -1.116 4.280 1.00 0.00 C ATOM 1529 CZ TYR A 101 -20.512 -1.904 4.032 1.00 0.00 C ATOM 1530 OH TYR A 101 -21.768 -1.464 4.378 1.00 0.00 O ATOM 0 H TYR A 101 -14.503 -5.045 2.611 1.00 0.00 H new ATOM 0 HA TYR A 101 -15.836 -3.575 4.841 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -16.014 -2.386 2.668 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -16.722 -3.825 1.963 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -19.001 -4.542 2.614 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.297 -0.940 4.109 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -21.233 -3.745 3.243 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -19.528 -0.153 4.755 1.00 0.00 H new ATOM 0 HH TYR A 101 -22.432 -2.141 4.129 1.00 0.00 H new ATOM 1540 N ARG A 102 -16.978 -5.604 5.446 1.00 0.00 N ATOM 1541 CA ARG A 102 -17.586 -6.834 5.938 1.00 0.00 C ATOM 1542 C ARG A 102 -16.598 -7.983 5.929 1.00 0.00 C ATOM 1543 O ARG A 102 -16.940 -9.131 5.637 1.00 0.00 O ATOM 1544 CB ARG A 102 -18.827 -7.165 5.143 1.00 0.00 C ATOM 1545 CG ARG A 102 -19.867 -6.091 5.286 1.00 0.00 C ATOM 1546 CD ARG A 102 -21.240 -6.622 4.985 1.00 0.00 C ATOM 1547 NE ARG A 102 -21.806 -7.288 6.156 1.00 0.00 N ATOM 1548 CZ ARG A 102 -22.556 -8.386 6.117 1.00 0.00 C ATOM 1549 NH1 ARG A 102 -22.860 -8.959 4.960 1.00 0.00 N ATOM 1550 NH2 ARG A 102 -23.005 -8.913 7.245 1.00 0.00 N ATOM 0 H ARG A 102 -16.921 -4.865 6.147 1.00 0.00 H new ATOM 0 HA ARG A 102 -17.881 -6.675 6.975 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -18.567 -7.285 4.091 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -19.235 -8.117 5.481 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.843 -5.690 6.299 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -19.637 -5.266 4.612 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -21.891 -5.805 4.675 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -21.189 -7.322 4.151 1.00 0.00 H new ATOM 0 HE ARG A 102 -21.612 -6.881 7.071 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -22.518 -8.558 4.087 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.436 -9.801 4.943 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -22.776 -8.477 8.138 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -23.580 -9.755 7.221 1.00 0.00 H new ATOM 1564 N GLY A 103 -15.360 -7.642 6.223 1.00 0.00 N ATOM 1565 CA GLY A 103 -14.325 -8.638 6.413 1.00 0.00 C ATOM 1566 C GLY A 103 -13.724 -9.103 5.111 1.00 0.00 C ATOM 1567 O GLY A 103 -12.804 -9.922 5.096 1.00 0.00 O ATOM 0 H GLY A 103 -15.045 -6.678 6.336 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.539 -8.224 7.045 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -14.742 -9.494 6.943 1.00 0.00 H new ATOM 1571 N GLN A 104 -14.241 -8.581 4.013 1.00 0.00 N ATOM 1572 CA GLN A 104 -13.771 -8.967 2.700 1.00 0.00 C ATOM 1573 C GLN A 104 -13.201 -7.761 1.980 1.00 0.00 C ATOM 1574 O GLN A 104 -13.814 -6.695 1.943 1.00 0.00 O ATOM 1575 CB GLN A 104 -14.908 -9.600 1.909 1.00 0.00 C ATOM 1576 CG GLN A 104 -15.342 -10.946 2.478 1.00 0.00 C ATOM 1577 CD GLN A 104 -16.649 -11.468 1.905 1.00 0.00 C ATOM 1578 OE1 GLN A 104 -17.588 -10.580 1.624 1.00 0.00 O flip ATOM 1579 NE2 GLN A 104 -16.828 -12.673 1.752 1.00 0.00 N flip ATOM 0 H GLN A 104 -14.988 -7.887 4.008 1.00 0.00 H new ATOM 0 HA GLN A 104 -12.976 -9.706 2.799 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -15.761 -8.922 1.901 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -14.595 -9.732 0.873 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -14.557 -11.678 2.290 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -15.442 -10.856 3.560 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -16.083 -13.332 1.978 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -17.722 -13.015 1.399 1.00 0.00 H new ATOM 1588 N GLU A 105 -12.020 -7.934 1.431 1.00 0.00 N ATOM 1589 CA GLU A 105 -11.288 -6.834 0.841 1.00 0.00 C ATOM 1590 C GLU A 105 -11.657 -6.682 -0.629 1.00 0.00 C ATOM 1591 O GLU A 105 -11.765 -7.672 -1.352 1.00 0.00 O ATOM 1592 CB GLU A 105 -9.792 -7.065 1.041 1.00 0.00 C ATOM 1593 CG GLU A 105 -9.461 -7.449 2.479 1.00 0.00 C ATOM 1594 CD GLU A 105 -7.982 -7.398 2.790 1.00 0.00 C ATOM 1595 OE1 GLU A 105 -7.230 -8.176 2.188 1.00 0.00 O ATOM 1596 OE2 GLU A 105 -7.576 -6.572 3.647 1.00 0.00 O ATOM 0 H GLU A 105 -11.542 -8.834 1.380 1.00 0.00 H new ATOM 0 HA GLU A 105 -11.555 -5.898 1.332 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.454 -7.853 0.368 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.246 -6.160 0.772 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.990 -6.779 3.157 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.831 -8.456 2.672 1.00 0.00 H new ATOM 1603 N PHE A 106 -11.871 -5.441 -1.061 1.00 0.00 N ATOM 1604 CA PHE A 106 -12.444 -5.192 -2.375 1.00 0.00 C ATOM 1605 C PHE A 106 -11.566 -4.311 -3.272 1.00 0.00 C ATOM 1606 O PHE A 106 -11.959 -3.985 -4.385 1.00 0.00 O ATOM 1607 CB PHE A 106 -13.840 -4.590 -2.246 1.00 0.00 C ATOM 1608 CG PHE A 106 -13.917 -3.297 -1.492 1.00 0.00 C ATOM 1609 CD1 PHE A 106 -14.082 -3.312 -0.122 1.00 0.00 C ATOM 1610 CD2 PHE A 106 -13.873 -2.078 -2.147 1.00 0.00 C ATOM 1611 CE1 PHE A 106 -14.197 -2.149 0.588 1.00 0.00 C ATOM 1612 CE2 PHE A 106 -13.991 -0.902 -1.438 1.00 0.00 C ATOM 1613 CZ PHE A 106 -14.157 -0.944 -0.068 1.00 0.00 C ATOM 0 H PHE A 106 -11.657 -4.601 -0.523 1.00 0.00 H new ATOM 0 HA PHE A 106 -12.507 -6.163 -2.865 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -14.242 -4.432 -3.247 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -14.486 -5.317 -1.754 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -14.121 -4.258 0.398 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -13.746 -2.048 -3.219 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -14.319 -2.178 1.661 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -13.954 0.047 -1.951 1.00 0.00 H new ATOM 0 HZ PHE A 106 -14.256 -0.025 0.490 1.00 0.00 H new ATOM 1623 N ILE A 107 -10.404 -3.889 -2.801 1.00 0.00 N ATOM 1624 CA ILE A 107 -9.464 -3.203 -3.668 1.00 0.00 C ATOM 1625 C ILE A 107 -8.071 -3.343 -3.102 1.00 0.00 C ATOM 1626 O ILE A 107 -7.920 -3.653 -1.932 1.00 0.00 O ATOM 1627 CB ILE A 107 -9.836 -1.729 -3.869 1.00 0.00 C ATOM 1628 CG1 ILE A 107 -8.992 -1.109 -4.972 1.00 0.00 C ATOM 1629 CG2 ILE A 107 -9.670 -0.950 -2.581 1.00 0.00 C ATOM 1630 CD1 ILE A 107 -9.378 0.319 -5.265 1.00 0.00 C ATOM 0 H ILE A 107 -10.093 -4.008 -1.837 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.502 -3.667 -4.654 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.884 -1.684 -4.165 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.941 -1.146 -4.684 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.095 -1.703 -5.880 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.940 0.093 -2.749 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -10.318 -1.373 -1.814 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -8.632 -1.008 -2.252 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -8.744 0.712 -6.060 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -10.421 0.357 -5.581 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -9.249 0.922 -4.366 1.00 0.00 H new ATOM 1642 N ARG A 108 -7.074 -3.163 -3.942 1.00 0.00 N ATOM 1643 CA ARG A 108 -5.693 -3.303 -3.548 1.00 0.00 C ATOM 1644 C ARG A 108 -4.821 -2.446 -4.436 1.00 0.00 C ATOM 1645 O ARG A 108 -4.368 -2.912 -5.476 1.00 0.00 O ATOM 1646 CB ARG A 108 -5.301 -4.760 -3.690 1.00 0.00 C ATOM 1647 CG ARG A 108 -4.228 -5.194 -2.732 1.00 0.00 C ATOM 1648 CD ARG A 108 -4.348 -6.674 -2.471 1.00 0.00 C ATOM 1649 NE ARG A 108 -5.701 -7.017 -2.013 1.00 0.00 N ATOM 1650 CZ ARG A 108 -6.130 -8.267 -1.815 1.00 0.00 C ATOM 1651 NH1 ARG A 108 -5.450 -9.293 -2.302 1.00 0.00 N ATOM 1652 NH2 ARG A 108 -7.273 -8.495 -1.180 1.00 0.00 N ATOM 0 H ARG A 108 -7.202 -2.914 -4.923 1.00 0.00 H new ATOM 0 HA ARG A 108 -5.562 -2.981 -2.515 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -6.184 -5.381 -3.538 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -4.958 -4.937 -4.710 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -3.245 -4.966 -3.144 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.317 -4.642 -1.797 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -4.116 -7.228 -3.381 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -3.618 -6.975 -1.720 1.00 0.00 H new ATOM 0 HE ARG A 108 -6.354 -6.254 -1.835 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -4.593 -9.132 -2.832 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -5.783 -10.245 -2.147 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -7.832 -7.713 -0.839 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.593 -9.452 -1.033 1.00 0.00 H new ATOM 1666 N VAL A 109 -4.599 -1.197 -4.067 1.00 0.00 N ATOM 1667 CA VAL A 109 -3.730 -0.364 -4.872 1.00 0.00 C ATOM 1668 C VAL A 109 -2.292 -0.580 -4.407 1.00 0.00 C ATOM 1669 O VAL A 109 -1.866 -0.115 -3.358 1.00 0.00 O ATOM 1670 CB VAL A 109 -4.151 1.144 -4.864 1.00 0.00 C ATOM 1671 CG1 VAL A 109 -3.527 1.941 -3.731 1.00 0.00 C ATOM 1672 CG2 VAL A 109 -3.825 1.791 -6.204 1.00 0.00 C ATOM 0 H VAL A 109 -4.995 -0.749 -3.241 1.00 0.00 H new ATOM 0 HA VAL A 109 -3.818 -0.662 -5.917 1.00 0.00 H new ATOM 0 HB VAL A 109 -5.228 1.161 -4.696 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -3.862 2.977 -3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -3.829 1.513 -2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -2.441 1.906 -3.817 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.123 2.839 -6.184 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.753 1.722 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -4.365 1.275 -6.998 1.00 0.00 H new ATOM 1682 N GLY A 110 -1.569 -1.376 -5.150 1.00 0.00 N ATOM 1683 CA GLY A 110 -0.210 -1.645 -4.794 1.00 0.00 C ATOM 1684 C GLY A 110 0.724 -0.677 -5.438 1.00 0.00 C ATOM 1685 O GLY A 110 1.222 -0.911 -6.540 1.00 0.00 O ATOM 0 H GLY A 110 -1.898 -1.843 -5.995 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -0.099 -1.594 -3.711 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.052 -2.660 -5.094 1.00 0.00 H new ATOM 1689 N TYR A 111 0.930 0.428 -4.767 1.00 0.00 N ATOM 1690 CA TYR A 111 1.891 1.394 -5.222 1.00 0.00 C ATOM 1691 C TYR A 111 3.271 0.878 -4.943 1.00 0.00 C ATOM 1692 O TYR A 111 3.642 0.629 -3.795 1.00 0.00 O ATOM 1693 CB TYR A 111 1.668 2.759 -4.585 1.00 0.00 C ATOM 1694 CG TYR A 111 0.834 3.635 -5.474 1.00 0.00 C ATOM 1695 CD1 TYR A 111 -0.544 3.508 -5.511 1.00 0.00 C ATOM 1696 CD2 TYR A 111 1.435 4.552 -6.313 1.00 0.00 C ATOM 1697 CE1 TYR A 111 -1.304 4.288 -6.362 1.00 0.00 C ATOM 1698 CE2 TYR A 111 0.688 5.328 -7.170 1.00 0.00 C ATOM 1699 CZ TYR A 111 -0.678 5.197 -7.194 1.00 0.00 C ATOM 1700 OH TYR A 111 -1.414 5.970 -8.061 1.00 0.00 O ATOM 0 H TYR A 111 0.445 0.679 -3.905 1.00 0.00 H new ATOM 0 HA TYR A 111 1.769 1.534 -6.296 1.00 0.00 H new ATOM 0 HB2 TYR A 111 1.175 2.638 -3.620 1.00 0.00 H new ATOM 0 HB3 TYR A 111 2.629 3.237 -4.394 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.031 2.791 -4.867 1.00 0.00 H new ATOM 0 HD2 TYR A 111 2.509 4.662 -6.297 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.379 4.188 -6.377 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.175 6.038 -7.822 1.00 0.00 H new ATOM 0 HH TYR A 111 -0.813 6.554 -8.569 1.00 0.00 H new ATOM 1710 N TYR A 112 4.006 0.663 -6.003 1.00 0.00 N ATOM 1711 CA TYR A 112 5.343 0.158 -5.885 1.00 0.00 C ATOM 1712 C TYR A 112 6.222 1.197 -5.227 1.00 0.00 C ATOM 1713 O TYR A 112 6.411 2.280 -5.760 1.00 0.00 O ATOM 1714 CB TYR A 112 5.902 -0.178 -7.264 1.00 0.00 C ATOM 1715 CG TYR A 112 5.656 -1.596 -7.692 1.00 0.00 C ATOM 1716 CD1 TYR A 112 4.372 -2.053 -7.971 1.00 0.00 C ATOM 1717 CD2 TYR A 112 6.713 -2.484 -7.797 1.00 0.00 C ATOM 1718 CE1 TYR A 112 4.150 -3.362 -8.344 1.00 0.00 C ATOM 1719 CE2 TYR A 112 6.510 -3.791 -8.168 1.00 0.00 C ATOM 1720 CZ TYR A 112 5.225 -4.234 -8.441 1.00 0.00 C ATOM 1721 OH TYR A 112 5.016 -5.544 -8.809 1.00 0.00 O ATOM 0 H TYR A 112 3.697 0.832 -6.960 1.00 0.00 H new ATOM 0 HA TYR A 112 5.326 -0.746 -5.277 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.459 0.495 -7.998 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.976 0.011 -7.266 1.00 0.00 H new ATOM 0 HD1 TYR A 112 3.537 -1.373 -7.894 1.00 0.00 H new ATOM 0 HD2 TYR A 112 7.715 -2.143 -7.583 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.149 -3.705 -8.559 1.00 0.00 H new ATOM 0 HE2 TYR A 112 7.347 -4.470 -8.247 1.00 0.00 H new ATOM 0 HH TYR A 112 5.873 -6.019 -8.830 1.00 0.00 H new ATOM 1731 N VAL A 113 6.767 0.876 -4.080 1.00 0.00 N ATOM 1732 CA VAL A 113 7.644 1.799 -3.425 1.00 0.00 C ATOM 1733 C VAL A 113 9.059 1.354 -3.730 1.00 0.00 C ATOM 1734 O VAL A 113 9.507 0.287 -3.319 1.00 0.00 O ATOM 1735 CB VAL A 113 7.371 1.935 -1.891 1.00 0.00 C ATOM 1736 CG1 VAL A 113 7.534 0.626 -1.126 1.00 0.00 C ATOM 1737 CG2 VAL A 113 8.257 3.011 -1.296 1.00 0.00 C ATOM 0 H VAL A 113 6.619 -0.006 -3.590 1.00 0.00 H new ATOM 0 HA VAL A 113 7.470 2.805 -3.806 1.00 0.00 H new ATOM 0 HB VAL A 113 6.324 2.220 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.330 0.795 -0.069 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.835 -0.114 -1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.554 0.260 -1.244 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.058 3.097 -0.228 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.303 2.747 -1.450 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.048 3.964 -1.782 1.00 0.00 H new ATOM 1747 N ASN A 114 9.724 2.149 -4.531 1.00 0.00 N ATOM 1748 CA ASN A 114 11.064 1.827 -4.971 1.00 0.00 C ATOM 1749 C ASN A 114 12.053 2.441 -4.012 1.00 0.00 C ATOM 1750 O ASN A 114 12.166 3.662 -3.917 1.00 0.00 O ATOM 1751 CB ASN A 114 11.310 2.332 -6.398 1.00 0.00 C ATOM 1752 CG ASN A 114 12.195 1.385 -7.180 1.00 0.00 C ATOM 1753 OD1 ASN A 114 12.012 0.104 -6.937 1.00 0.00 O flip ATOM 1754 ND2 ASN A 114 13.008 1.793 -8.007 1.00 0.00 N flip ATOM 0 H ASN A 114 9.359 3.029 -4.895 1.00 0.00 H new ATOM 0 HA ASN A 114 11.188 0.744 -4.982 1.00 0.00 H new ATOM 0 HB2 ASN A 114 10.356 2.448 -6.913 1.00 0.00 H new ATOM 0 HB3 ASN A 114 11.774 3.317 -6.361 1.00 0.00 H new ATOM 0 HD21 ASN A 114 13.117 2.795 -8.163 1.00 0.00 H new ATOM 0 HD22 ASN A 114 13.573 1.130 -8.537 1.00 0.00 H new ATOM 1761 N ASN A 115 12.775 1.595 -3.314 1.00 0.00 N ATOM 1762 CA ASN A 115 13.596 2.037 -2.233 1.00 0.00 C ATOM 1763 C ASN A 115 15.002 2.140 -2.737 1.00 0.00 C ATOM 1764 O ASN A 115 15.685 1.143 -2.977 1.00 0.00 O ATOM 1765 CB ASN A 115 13.507 1.073 -1.060 1.00 0.00 C ATOM 1766 CG ASN A 115 12.113 0.967 -0.479 1.00 0.00 C ATOM 1767 OD1 ASN A 115 11.362 1.943 -0.437 1.00 0.00 O ATOM 1768 ND2 ASN A 115 11.757 -0.227 -0.040 1.00 0.00 N ATOM 0 H ASN A 115 12.804 0.590 -3.485 1.00 0.00 H new ATOM 0 HA ASN A 115 13.257 3.009 -1.875 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.834 0.085 -1.384 1.00 0.00 H new ATOM 0 HB3 ASN A 115 14.195 1.397 -0.279 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.827 -0.369 0.354 1.00 0.00 H new ATOM 0 HD22 ASN A 115 12.412 -1.007 -0.095 1.00 0.00 H new ATOM 1775 N GLU A 116 15.413 3.357 -2.913 1.00 0.00 N ATOM 1776 CA GLU A 116 16.671 3.661 -3.508 1.00 0.00 C ATOM 1777 C GLU A 116 17.416 4.590 -2.591 1.00 0.00 C ATOM 1778 O GLU A 116 16.884 5.613 -2.184 1.00 0.00 O ATOM 1779 CB GLU A 116 16.435 4.310 -4.865 1.00 0.00 C ATOM 1780 CG GLU A 116 16.000 3.344 -5.950 1.00 0.00 C ATOM 1781 CD GLU A 116 15.971 3.999 -7.317 1.00 0.00 C ATOM 1782 OE1 GLU A 116 15.059 4.811 -7.575 1.00 0.00 O ATOM 1783 OE2 GLU A 116 16.869 3.711 -8.138 1.00 0.00 O ATOM 0 H GLU A 116 14.873 4.179 -2.642 1.00 0.00 H new ATOM 0 HA GLU A 116 17.261 2.757 -3.657 1.00 0.00 H new ATOM 0 HB2 GLU A 116 15.675 5.084 -4.758 1.00 0.00 H new ATOM 0 HB3 GLU A 116 17.352 4.806 -5.182 1.00 0.00 H new ATOM 0 HG2 GLU A 116 16.680 2.492 -5.971 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.009 2.955 -5.713 1.00 0.00 H new ATOM 1790 N TYR A 117 18.615 4.185 -2.228 1.00 0.00 N ATOM 1791 CA TYR A 117 19.488 4.990 -1.378 1.00 0.00 C ATOM 1792 C TYR A 117 19.466 6.482 -1.704 1.00 0.00 C ATOM 1793 O TYR A 117 19.285 6.888 -2.848 1.00 0.00 O ATOM 1794 CB TYR A 117 20.897 4.474 -1.483 1.00 0.00 C ATOM 1795 CG TYR A 117 21.101 3.216 -0.691 1.00 0.00 C ATOM 1796 CD1 TYR A 117 20.829 3.207 0.663 1.00 0.00 C ATOM 1797 CD2 TYR A 117 21.572 2.052 -1.278 1.00 0.00 C ATOM 1798 CE1 TYR A 117 21.017 2.084 1.417 1.00 0.00 C ATOM 1799 CE2 TYR A 117 21.765 0.913 -0.527 1.00 0.00 C ATOM 1800 CZ TYR A 117 21.484 0.935 0.822 1.00 0.00 C ATOM 1801 OH TYR A 117 21.666 -0.194 1.578 1.00 0.00 O ATOM 0 H TYR A 117 19.018 3.291 -2.510 1.00 0.00 H new ATOM 0 HA TYR A 117 19.107 4.893 -0.361 1.00 0.00 H new ATOM 0 HB2 TYR A 117 21.136 4.285 -2.530 1.00 0.00 H new ATOM 0 HB3 TYR A 117 21.589 5.239 -1.131 1.00 0.00 H new ATOM 0 HD1 TYR A 117 20.460 4.106 1.135 1.00 0.00 H new ATOM 0 HD2 TYR A 117 21.790 2.038 -2.336 1.00 0.00 H new ATOM 0 HE1 TYR A 117 20.800 2.098 2.475 1.00 0.00 H new ATOM 0 HE2 TYR A 117 22.133 0.010 -0.992 1.00 0.00 H new ATOM 0 HH TYR A 117 22.000 -0.919 1.009 1.00 0.00 H new ATOM 1811 N THR A 118 19.685 7.286 -0.671 1.00 0.00 N ATOM 1812 CA THR A 118 19.594 8.727 -0.782 1.00 0.00 C ATOM 1813 C THR A 118 20.928 9.264 -1.224 1.00 0.00 C ATOM 1814 O THR A 118 21.023 10.245 -1.964 1.00 0.00 O ATOM 1815 CB THR A 118 19.222 9.366 0.570 1.00 0.00 C ATOM 1816 OG1 THR A 118 20.046 8.819 1.609 1.00 0.00 O ATOM 1817 CG2 THR A 118 17.761 9.134 0.910 1.00 0.00 C ATOM 0 H THR A 118 19.930 6.954 0.262 1.00 0.00 H new ATOM 0 HA THR A 118 18.817 8.972 -1.506 1.00 0.00 H new ATOM 0 HB THR A 118 19.388 10.440 0.490 1.00 0.00 H new ATOM 0 HG1 THR A 118 19.807 9.229 2.466 1.00 0.00 H new ATOM 0 HG21 THR A 118 17.533 9.598 1.870 1.00 0.00 H new ATOM 0 HG22 THR A 118 17.133 9.574 0.136 1.00 0.00 H new ATOM 0 HG23 THR A 118 17.567 8.063 0.969 1.00 0.00 H new ATOM 1825 N GLU A 119 21.960 8.587 -0.765 1.00 0.00 N ATOM 1826 CA GLU A 119 23.309 8.966 -1.066 1.00 0.00 C ATOM 1827 C GLU A 119 23.737 8.337 -2.383 1.00 0.00 C ATOM 1828 O GLU A 119 23.504 7.149 -2.615 1.00 0.00 O ATOM 1829 CB GLU A 119 24.222 8.517 0.068 1.00 0.00 C ATOM 1830 CG GLU A 119 23.652 8.810 1.445 1.00 0.00 C ATOM 1831 CD GLU A 119 24.699 8.823 2.537 1.00 0.00 C ATOM 1832 OE1 GLU A 119 25.563 7.922 2.557 1.00 0.00 O ATOM 1833 OE2 GLU A 119 24.645 9.730 3.397 1.00 0.00 O ATOM 0 H GLU A 119 21.879 7.760 -0.174 1.00 0.00 H new ATOM 0 HA GLU A 119 23.376 10.049 -1.165 1.00 0.00 H new ATOM 0 HB2 GLU A 119 24.404 7.446 -0.023 1.00 0.00 H new ATOM 0 HB3 GLU A 119 25.187 9.014 -0.032 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.148 9.776 1.424 1.00 0.00 H new ATOM 0 HG3 GLU A 119 22.897 8.061 1.685 1.00 0.00 H new ATOM 1840 N THR A 120 24.362 9.141 -3.238 1.00 0.00 N ATOM 1841 CA THR A 120 24.815 8.678 -4.540 1.00 0.00 C ATOM 1842 C THR A 120 25.751 7.500 -4.395 1.00 0.00 C ATOM 1843 O THR A 120 25.668 6.553 -5.162 1.00 0.00 O ATOM 1844 CB THR A 120 25.537 9.786 -5.320 1.00 0.00 C ATOM 1845 OG1 THR A 120 24.646 10.892 -5.504 1.00 0.00 O ATOM 1846 CG2 THR A 120 26.025 9.261 -6.669 1.00 0.00 C ATOM 0 H THR A 120 24.566 10.122 -3.048 1.00 0.00 H new ATOM 0 HA THR A 120 23.924 8.380 -5.093 1.00 0.00 H new ATOM 0 HB THR A 120 26.407 10.116 -4.753 1.00 0.00 H new ATOM 0 HG1 THR A 120 25.104 11.602 -6.000 1.00 0.00 H new ATOM 0 HG21 THR A 120 26.534 10.060 -7.208 1.00 0.00 H new ATOM 0 HG22 THR A 120 26.716 8.433 -6.509 1.00 0.00 H new ATOM 0 HG23 THR A 120 25.173 8.914 -7.254 1.00 0.00 H new ATOM 1854 N GLU A 121 26.604 7.555 -3.378 1.00 0.00 N ATOM 1855 CA GLU A 121 27.574 6.496 -3.116 1.00 0.00 C ATOM 1856 C GLU A 121 26.865 5.155 -3.069 1.00 0.00 C ATOM 1857 O GLU A 121 27.328 4.157 -3.603 1.00 0.00 O ATOM 1858 CB GLU A 121 28.266 6.763 -1.773 1.00 0.00 C ATOM 1859 CG GLU A 121 29.227 5.671 -1.329 1.00 0.00 C ATOM 1860 CD GLU A 121 29.634 5.817 0.125 1.00 0.00 C ATOM 1861 OE1 GLU A 121 30.542 6.623 0.419 1.00 0.00 O ATOM 1862 OE2 GLU A 121 29.041 5.135 0.986 1.00 0.00 O ATOM 0 H GLU A 121 26.644 8.329 -2.715 1.00 0.00 H new ATOM 0 HA GLU A 121 28.319 6.479 -3.912 1.00 0.00 H new ATOM 0 HB2 GLU A 121 28.812 7.704 -1.841 1.00 0.00 H new ATOM 0 HB3 GLU A 121 27.503 6.892 -1.005 1.00 0.00 H new ATOM 0 HG2 GLU A 121 28.760 4.697 -1.477 1.00 0.00 H new ATOM 0 HG3 GLU A 121 30.117 5.696 -1.957 1.00 0.00 H new ATOM 1869 N LEU A 122 25.701 5.179 -2.472 1.00 0.00 N ATOM 1870 CA LEU A 122 24.948 3.984 -2.200 1.00 0.00 C ATOM 1871 C LEU A 122 24.114 3.548 -3.405 1.00 0.00 C ATOM 1872 O LEU A 122 23.838 2.368 -3.577 1.00 0.00 O ATOM 1873 CB LEU A 122 24.048 4.273 -1.025 1.00 0.00 C ATOM 1874 CG LEU A 122 24.748 4.792 0.230 1.00 0.00 C ATOM 1875 CD1 LEU A 122 23.740 5.049 1.332 1.00 0.00 C ATOM 1876 CD2 LEU A 122 25.808 3.812 0.694 1.00 0.00 C ATOM 0 H LEU A 122 25.246 6.037 -2.159 1.00 0.00 H new ATOM 0 HA LEU A 122 25.634 3.166 -1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 122 23.302 5.006 -1.333 1.00 0.00 H new ATOM 0 HB3 LEU A 122 23.511 3.360 -0.768 1.00 0.00 H new ATOM 0 HG LEU A 122 25.238 5.735 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 122 24.256 5.418 2.218 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.017 5.792 0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.221 4.121 1.574 1.00 0.00 H new ATOM 0 HD21 LEU A 122 26.295 4.200 1.589 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.342 2.853 0.921 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.549 3.678 -0.094 1.00 0.00 H new ATOM 1888 N ARG A 123 23.685 4.504 -4.222 1.00 0.00 N ATOM 1889 CA ARG A 123 22.912 4.186 -5.422 1.00 0.00 C ATOM 1890 C ARG A 123 23.832 3.679 -6.512 1.00 0.00 C ATOM 1891 O ARG A 123 23.519 2.723 -7.221 1.00 0.00 O ATOM 1892 CB ARG A 123 22.181 5.418 -5.954 1.00 0.00 C ATOM 1893 CG ARG A 123 21.447 6.207 -4.895 1.00 0.00 C ATOM 1894 CD ARG A 123 20.674 7.366 -5.502 1.00 0.00 C ATOM 1895 NE ARG A 123 19.565 6.917 -6.345 1.00 0.00 N ATOM 1896 CZ ARG A 123 18.472 7.642 -6.575 1.00 0.00 C ATOM 1897 NH1 ARG A 123 18.358 8.863 -6.064 1.00 0.00 N ATOM 1898 NH2 ARG A 123 17.496 7.148 -7.324 1.00 0.00 N ATOM 0 H ARG A 123 23.857 5.499 -4.079 1.00 0.00 H new ATOM 0 HA ARG A 123 22.183 3.423 -5.148 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.903 6.072 -6.444 1.00 0.00 H new ATOM 0 HB3 ARG A 123 21.468 5.103 -6.716 1.00 0.00 H new ATOM 0 HG2 ARG A 123 20.761 5.550 -4.361 1.00 0.00 H new ATOM 0 HG3 ARG A 123 22.160 6.587 -4.163 1.00 0.00 H new ATOM 0 HD2 ARG A 123 20.287 7.999 -4.703 1.00 0.00 H new ATOM 0 HD3 ARG A 123 21.352 7.980 -6.095 1.00 0.00 H new ATOM 0 HE ARG A 123 19.633 5.997 -6.781 1.00 0.00 H new ATOM 0 HH11 ARG A 123 19.110 9.249 -5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 123 17.519 9.414 -6.243 1.00 0.00 H new ATOM 0 HH21 ARG A 123 17.583 6.213 -7.723 1.00 0.00 H new ATOM 0 HH22 ARG A 123 16.658 7.702 -7.501 1.00 0.00 H new ATOM 1912 N GLU A 124 24.972 4.338 -6.627 1.00 0.00 N ATOM 1913 CA GLU A 124 25.911 4.071 -7.696 1.00 0.00 C ATOM 1914 C GLU A 124 26.732 2.827 -7.402 1.00 0.00 C ATOM 1915 O GLU A 124 27.296 2.211 -8.307 1.00 0.00 O ATOM 1916 CB GLU A 124 26.775 5.297 -7.929 1.00 0.00 C ATOM 1917 CG GLU A 124 27.803 5.530 -6.881 1.00 0.00 C ATOM 1918 CD GLU A 124 29.043 6.210 -7.419 1.00 0.00 C ATOM 1919 OE1 GLU A 124 29.768 5.574 -8.216 1.00 0.00 O ATOM 1920 OE2 GLU A 124 29.285 7.382 -7.070 1.00 0.00 O ATOM 0 H GLU A 124 25.270 5.071 -5.983 1.00 0.00 H new ATOM 0 HA GLU A 124 25.365 3.866 -8.617 1.00 0.00 H new ATOM 0 HB2 GLU A 124 27.273 5.198 -8.894 1.00 0.00 H new ATOM 0 HB3 GLU A 124 26.131 6.174 -7.991 1.00 0.00 H new ATOM 0 HG2 GLU A 124 27.374 6.141 -6.087 1.00 0.00 H new ATOM 0 HG3 GLU A 124 28.082 4.576 -6.433 1.00 0.00 H new ATOM 1927 N ASN A 125 26.787 2.467 -6.136 1.00 0.00 N ATOM 1928 CA ASN A 125 27.347 1.177 -5.726 1.00 0.00 C ATOM 1929 C ASN A 125 26.670 0.698 -4.453 1.00 0.00 C ATOM 1930 O ASN A 125 27.167 0.890 -3.345 1.00 0.00 O ATOM 1931 CB ASN A 125 28.881 1.216 -5.578 1.00 0.00 C ATOM 1932 CG ASN A 125 29.409 2.543 -5.077 1.00 0.00 C ATOM 1933 OD1 ASN A 125 29.613 3.468 -6.004 1.00 0.00 O flip ATOM 1934 ND2 ASN A 125 29.644 2.732 -3.884 1.00 0.00 N flip ATOM 0 H ASN A 125 26.452 3.045 -5.365 1.00 0.00 H new ATOM 0 HA ASN A 125 27.144 0.459 -6.521 1.00 0.00 H new ATOM 0 HB2 ASN A 125 29.191 0.429 -4.891 1.00 0.00 H new ATOM 0 HB3 ASN A 125 29.336 0.995 -6.543 1.00 0.00 H new ATOM 0 HD21 ASN A 125 29.471 1.990 -3.206 1.00 0.00 H new ATOM 0 HD22 ASN A 125 30.012 3.631 -3.573 1.00 0.00 H new ATOM 1941 N PRO A 126 25.492 0.078 -4.623 1.00 0.00 N ATOM 1942 CA PRO A 126 24.667 -0.422 -3.519 1.00 0.00 C ATOM 1943 C PRO A 126 25.407 -1.394 -2.614 1.00 0.00 C ATOM 1944 O PRO A 126 25.910 -2.428 -3.065 1.00 0.00 O ATOM 1945 CB PRO A 126 23.506 -1.140 -4.223 1.00 0.00 C ATOM 1946 CG PRO A 126 23.974 -1.346 -5.624 1.00 0.00 C ATOM 1947 CD PRO A 126 24.862 -0.178 -5.922 1.00 0.00 C ATOM 0 HA PRO A 126 24.355 0.392 -2.864 1.00 0.00 H new ATOM 0 HB2 PRO A 126 23.278 -2.090 -3.739 1.00 0.00 H new ATOM 0 HB3 PRO A 126 22.596 -0.541 -4.195 1.00 0.00 H new ATOM 0 HG2 PRO A 126 24.516 -2.287 -5.723 1.00 0.00 H new ATOM 0 HG3 PRO A 126 23.134 -1.388 -6.317 1.00 0.00 H new ATOM 0 HD2 PRO A 126 25.598 -0.413 -6.691 1.00 0.00 H new ATOM 0 HD3 PRO A 126 24.295 0.683 -6.275 1.00 0.00 H new ATOM 1955 N PRO A 127 25.495 -1.060 -1.326 1.00 0.00 N ATOM 1956 CA PRO A 127 26.055 -1.949 -0.315 1.00 0.00 C ATOM 1957 C PRO A 127 25.143 -3.148 -0.092 1.00 0.00 C ATOM 1958 O PRO A 127 23.920 -3.046 -0.216 1.00 0.00 O ATOM 1959 CB PRO A 127 26.129 -1.068 0.942 1.00 0.00 C ATOM 1960 CG PRO A 127 25.946 0.328 0.451 1.00 0.00 C ATOM 1961 CD PRO A 127 25.064 0.215 -0.749 1.00 0.00 C ATOM 0 HA PRO A 127 27.025 -2.359 -0.596 1.00 0.00 H new ATOM 0 HB2 PRO A 127 25.354 -1.338 1.659 1.00 0.00 H new ATOM 0 HB3 PRO A 127 27.087 -1.185 1.449 1.00 0.00 H new ATOM 0 HG2 PRO A 127 25.490 0.957 1.216 1.00 0.00 H new ATOM 0 HG3 PRO A 127 26.903 0.782 0.194 1.00 0.00 H new ATOM 0 HD2 PRO A 127 24.008 0.204 -0.479 1.00 0.00 H new ATOM 0 HD3 PRO A 127 25.208 1.045 -1.441 1.00 0.00 H new ATOM 1969 N VAL A 128 25.760 -4.281 0.220 1.00 0.00 N ATOM 1970 CA VAL A 128 25.062 -5.551 0.344 1.00 0.00 C ATOM 1971 C VAL A 128 24.016 -5.511 1.452 1.00 0.00 C ATOM 1972 O VAL A 128 23.015 -6.208 1.387 1.00 0.00 O ATOM 1973 CB VAL A 128 26.056 -6.713 0.592 1.00 0.00 C ATOM 1974 CG1 VAL A 128 26.801 -6.531 1.905 1.00 0.00 C ATOM 1975 CG2 VAL A 128 25.350 -8.060 0.559 1.00 0.00 C ATOM 0 H VAL A 128 26.763 -4.343 0.395 1.00 0.00 H new ATOM 0 HA VAL A 128 24.549 -5.727 -0.601 1.00 0.00 H new ATOM 0 HB VAL A 128 26.787 -6.694 -0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 128 27.491 -7.362 2.050 1.00 0.00 H new ATOM 0 HG12 VAL A 128 27.360 -5.596 1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 128 26.087 -6.504 2.728 1.00 0.00 H new ATOM 0 HG21 VAL A 128 26.074 -8.855 0.736 1.00 0.00 H new ATOM 0 HG22 VAL A 128 24.584 -8.088 1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 128 24.885 -8.203 -0.417 1.00 0.00 H new ATOM 1985 N LYS A 129 24.239 -4.698 2.470 1.00 0.00 N ATOM 1986 CA LYS A 129 23.243 -4.550 3.506 1.00 0.00 C ATOM 1987 C LYS A 129 22.492 -3.243 3.362 1.00 0.00 C ATOM 1988 O LYS A 129 23.082 -2.177 3.175 1.00 0.00 O ATOM 1989 CB LYS A 129 23.839 -4.689 4.900 1.00 0.00 C ATOM 1990 CG LYS A 129 23.983 -6.128 5.333 1.00 0.00 C ATOM 1991 CD LYS A 129 22.849 -6.986 4.802 1.00 0.00 C ATOM 1992 CE LYS A 129 23.381 -8.296 4.261 1.00 0.00 C ATOM 1993 NZ LYS A 129 22.343 -9.051 3.511 1.00 0.00 N ATOM 0 H LYS A 129 25.085 -4.142 2.597 1.00 0.00 H new ATOM 0 HA LYS A 129 22.531 -5.365 3.380 1.00 0.00 H new ATOM 0 HB2 LYS A 129 24.817 -4.208 4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 129 23.208 -4.161 5.615 1.00 0.00 H new ATOM 0 HG2 LYS A 129 24.935 -6.522 4.978 1.00 0.00 H new ATOM 0 HG3 LYS A 129 24.002 -6.181 6.422 1.00 0.00 H new ATOM 0 HD2 LYS A 129 22.129 -7.180 5.597 1.00 0.00 H new ATOM 0 HD3 LYS A 129 22.318 -6.450 4.015 1.00 0.00 H new ATOM 0 HE2 LYS A 129 24.230 -8.100 3.607 1.00 0.00 H new ATOM 0 HE3 LYS A 129 23.748 -8.907 5.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 22.609 -10.055 3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 21.427 -8.956 3.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 22.266 -8.670 2.546 1.00 0.00 H new ATOM 2007 N PRO A 130 21.166 -3.342 3.431 1.00 0.00 N ATOM 2008 CA PRO A 130 20.263 -2.213 3.240 1.00 0.00 C ATOM 2009 C PRO A 130 20.315 -1.208 4.378 1.00 0.00 C ATOM 2010 O PRO A 130 20.404 -1.579 5.549 1.00 0.00 O ATOM 2011 CB PRO A 130 18.872 -2.840 3.196 1.00 0.00 C ATOM 2012 CG PRO A 130 19.059 -4.319 3.210 1.00 0.00 C ATOM 2013 CD PRO A 130 20.451 -4.591 3.698 1.00 0.00 C ATOM 0 HA PRO A 130 20.535 -1.660 2.341 1.00 0.00 H new ATOM 0 HB2 PRO A 130 18.277 -2.519 4.051 1.00 0.00 H new ATOM 0 HB3 PRO A 130 18.337 -2.528 2.299 1.00 0.00 H new ATOM 0 HG2 PRO A 130 18.325 -4.792 3.862 1.00 0.00 H new ATOM 0 HG3 PRO A 130 18.914 -4.734 2.212 1.00 0.00 H new ATOM 0 HD2 PRO A 130 20.461 -4.839 4.759 1.00 0.00 H new ATOM 0 HD3 PRO A 130 20.903 -5.431 3.170 1.00 0.00 H new ATOM 2021 N ASP A 131 20.243 0.064 4.031 1.00 0.00 N ATOM 2022 CA ASP A 131 20.145 1.111 5.030 1.00 0.00 C ATOM 2023 C ASP A 131 18.851 1.878 4.822 1.00 0.00 C ATOM 2024 O ASP A 131 18.687 2.584 3.830 1.00 0.00 O ATOM 2025 CB ASP A 131 21.336 2.063 4.967 1.00 0.00 C ATOM 2026 CG ASP A 131 21.518 2.835 6.260 1.00 0.00 C ATOM 2027 OD1 ASP A 131 20.531 3.411 6.764 1.00 0.00 O ATOM 2028 OD2 ASP A 131 22.647 2.852 6.790 1.00 0.00 O ATOM 0 H ASP A 131 20.251 0.396 3.067 1.00 0.00 H new ATOM 0 HA ASP A 131 20.150 0.648 6.017 1.00 0.00 H new ATOM 0 HB2 ASP A 131 22.242 1.496 4.753 1.00 0.00 H new ATOM 0 HB3 ASP A 131 21.197 2.763 4.144 1.00 0.00 H new ATOM 2033 N PHE A 132 17.940 1.721 5.764 1.00 0.00 N ATOM 2034 CA PHE A 132 16.588 2.261 5.658 1.00 0.00 C ATOM 2035 C PHE A 132 16.588 3.751 5.974 1.00 0.00 C ATOM 2036 O PHE A 132 15.710 4.504 5.561 1.00 0.00 O ATOM 2037 CB PHE A 132 15.684 1.483 6.611 1.00 0.00 C ATOM 2038 CG PHE A 132 15.922 0.002 6.517 1.00 0.00 C ATOM 2039 CD1 PHE A 132 15.287 -0.754 5.550 1.00 0.00 C ATOM 2040 CD2 PHE A 132 16.817 -0.622 7.370 1.00 0.00 C ATOM 2041 CE1 PHE A 132 15.533 -2.107 5.438 1.00 0.00 C ATOM 2042 CE2 PHE A 132 17.072 -1.974 7.260 1.00 0.00 C ATOM 2043 CZ PHE A 132 16.429 -2.719 6.291 1.00 0.00 C ATOM 0 H PHE A 132 18.113 1.213 6.631 1.00 0.00 H new ATOM 0 HA PHE A 132 16.212 2.150 4.641 1.00 0.00 H new ATOM 0 HB2 PHE A 132 15.861 1.816 7.634 1.00 0.00 H new ATOM 0 HB3 PHE A 132 14.641 1.699 6.381 1.00 0.00 H new ATOM 0 HD1 PHE A 132 14.590 -0.280 4.874 1.00 0.00 H new ATOM 0 HD2 PHE A 132 17.321 -0.044 8.130 1.00 0.00 H new ATOM 0 HE1 PHE A 132 15.024 -2.687 4.683 1.00 0.00 H new ATOM 0 HE2 PHE A 132 17.773 -2.449 7.931 1.00 0.00 H new ATOM 0 HZ PHE A 132 16.627 -3.777 6.201 1.00 0.00 H new ATOM 2053 N SER A 133 17.601 4.152 6.703 1.00 0.00 N ATOM 2054 CA SER A 133 17.847 5.550 7.024 1.00 0.00 C ATOM 2055 C SER A 133 18.527 6.250 5.848 1.00 0.00 C ATOM 2056 O SER A 133 18.530 7.476 5.753 1.00 0.00 O ATOM 2057 CB SER A 133 18.715 5.654 8.282 1.00 0.00 C ATOM 2058 OG SER A 133 18.927 7.005 8.666 1.00 0.00 O ATOM 0 H SER A 133 18.291 3.513 7.099 1.00 0.00 H new ATOM 0 HA SER A 133 16.893 6.042 7.215 1.00 0.00 H new ATOM 0 HB2 SER A 133 18.237 5.115 9.099 1.00 0.00 H new ATOM 0 HB3 SER A 133 19.676 5.172 8.101 1.00 0.00 H new ATOM 0 HG SER A 133 19.483 7.032 9.472 1.00 0.00 H new ATOM 2064 N LYS A 134 19.094 5.464 4.943 1.00 0.00 N ATOM 2065 CA LYS A 134 19.689 6.003 3.738 1.00 0.00 C ATOM 2066 C LYS A 134 18.797 5.677 2.586 1.00 0.00 C ATOM 2067 O LYS A 134 19.205 5.710 1.438 1.00 0.00 O ATOM 2068 CB LYS A 134 21.045 5.385 3.460 1.00 0.00 C ATOM 2069 CG LYS A 134 22.086 5.668 4.509 1.00 0.00 C ATOM 2070 CD LYS A 134 22.430 7.141 4.597 1.00 0.00 C ATOM 2071 CE LYS A 134 23.469 7.387 5.674 1.00 0.00 C ATOM 2072 NZ LYS A 134 23.820 8.825 5.798 1.00 0.00 N ATOM 0 H LYS A 134 19.152 4.449 5.025 1.00 0.00 H new ATOM 0 HA LYS A 134 19.812 7.078 3.870 1.00 0.00 H new ATOM 0 HB2 LYS A 134 20.926 4.306 3.366 1.00 0.00 H new ATOM 0 HB3 LYS A 134 21.407 5.751 2.499 1.00 0.00 H new ATOM 0 HG2 LYS A 134 21.725 5.323 5.478 1.00 0.00 H new ATOM 0 HG3 LYS A 134 22.988 5.099 4.284 1.00 0.00 H new ATOM 0 HD2 LYS A 134 22.807 7.489 3.635 1.00 0.00 H new ATOM 0 HD3 LYS A 134 21.531 7.717 4.815 1.00 0.00 H new ATOM 0 HE2 LYS A 134 23.092 7.023 6.630 1.00 0.00 H new ATOM 0 HE3 LYS A 134 24.368 6.814 5.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 24.775 8.916 6.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 23.794 9.271 4.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 23.136 9.297 6.424 1.00 0.00 H new ATOM 2086 N LEU A 135 17.592 5.317 2.906 1.00 0.00 N ATOM 2087 CA LEU A 135 16.698 4.794 1.928 1.00 0.00 C ATOM 2088 C LEU A 135 15.702 5.851 1.514 1.00 0.00 C ATOM 2089 O LEU A 135 15.066 6.479 2.350 1.00 0.00 O ATOM 2090 CB LEU A 135 16.028 3.570 2.520 1.00 0.00 C ATOM 2091 CG LEU A 135 15.395 2.616 1.532 1.00 0.00 C ATOM 2092 CD1 LEU A 135 16.452 2.102 0.562 1.00 0.00 C ATOM 2093 CD2 LEU A 135 14.723 1.459 2.258 1.00 0.00 C ATOM 0 H LEU A 135 17.205 5.378 3.848 1.00 0.00 H new ATOM 0 HA LEU A 135 17.232 4.502 1.024 1.00 0.00 H new ATOM 0 HB2 LEU A 135 16.769 3.021 3.101 1.00 0.00 H new ATOM 0 HB3 LEU A 135 15.259 3.903 3.217 1.00 0.00 H new ATOM 0 HG LEU A 135 14.629 3.149 0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 135 15.991 1.415 -0.148 1.00 0.00 H new ATOM 0 HD12 LEU A 135 16.890 2.942 0.022 1.00 0.00 H new ATOM 0 HD13 LEU A 135 17.232 1.581 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 135 14.274 0.784 1.529 1.00 0.00 H new ATOM 0 HD22 LEU A 135 15.465 0.918 2.845 1.00 0.00 H new ATOM 0 HD23 LEU A 135 13.948 1.846 2.920 1.00 0.00 H new ATOM 2105 N GLN A 136 15.614 6.079 0.224 1.00 0.00 N ATOM 2106 CA GLN A 136 14.677 7.039 -0.317 1.00 0.00 C ATOM 2107 C GLN A 136 13.618 6.303 -1.104 1.00 0.00 C ATOM 2108 O GLN A 136 13.914 5.639 -2.098 1.00 0.00 O ATOM 2109 CB GLN A 136 15.383 8.045 -1.214 1.00 0.00 C ATOM 2110 CG GLN A 136 14.787 9.429 -1.131 1.00 0.00 C ATOM 2111 CD GLN A 136 15.068 10.260 -2.362 1.00 0.00 C ATOM 2112 OE1 GLN A 136 14.226 10.093 -3.366 1.00 0.00 O flip ATOM 2113 NE2 GLN A 136 16.036 11.016 -2.422 1.00 0.00 N flip ATOM 0 H GLN A 136 16.186 5.608 -0.477 1.00 0.00 H new ATOM 0 HA GLN A 136 14.218 7.586 0.506 1.00 0.00 H new ATOM 0 HB2 GLN A 136 16.437 8.092 -0.939 1.00 0.00 H new ATOM 0 HB3 GLN A 136 15.338 7.697 -2.246 1.00 0.00 H new ATOM 0 HG2 GLN A 136 13.709 9.348 -0.991 1.00 0.00 H new ATOM 0 HG3 GLN A 136 15.185 9.940 -0.254 1.00 0.00 H new ATOM 0 HE21 GLN A 136 16.659 11.112 -1.620 1.00 0.00 H new ATOM 0 HE22 GLN A 136 16.216 11.547 -3.274 1.00 0.00 H new ATOM 2122 N ARG A 137 12.388 6.421 -0.664 1.00 0.00 N ATOM 2123 CA ARG A 137 11.319 5.647 -1.240 1.00 0.00 C ATOM 2124 C ARG A 137 10.587 6.438 -2.310 1.00 0.00 C ATOM 2125 O ARG A 137 9.864 7.392 -2.023 1.00 0.00 O ATOM 2126 CB ARG A 137 10.377 5.180 -0.139 1.00 0.00 C ATOM 2127 CG ARG A 137 9.957 6.276 0.816 1.00 0.00 C ATOM 2128 CD ARG A 137 9.270 5.695 2.031 1.00 0.00 C ATOM 2129 NE ARG A 137 7.914 6.183 2.167 1.00 0.00 N ATOM 2130 CZ ARG A 137 7.140 5.906 3.198 1.00 0.00 C ATOM 2131 NH1 ARG A 137 7.592 5.168 4.205 1.00 0.00 N ATOM 2132 NH2 ARG A 137 5.926 6.389 3.232 1.00 0.00 N ATOM 0 H ARG A 137 12.104 7.046 0.091 1.00 0.00 H new ATOM 0 HA ARG A 137 11.738 4.768 -1.730 1.00 0.00 H new ATOM 0 HB2 ARG A 137 9.486 4.749 -0.596 1.00 0.00 H new ATOM 0 HB3 ARG A 137 10.862 4.385 0.427 1.00 0.00 H new ATOM 0 HG2 ARG A 137 10.831 6.849 1.126 1.00 0.00 H new ATOM 0 HG3 ARG A 137 9.285 6.969 0.309 1.00 0.00 H new ATOM 0 HD2 ARG A 137 9.259 4.608 1.957 1.00 0.00 H new ATOM 0 HD3 ARG A 137 9.839 5.948 2.926 1.00 0.00 H new ATOM 0 HE ARG A 137 7.537 6.773 1.425 1.00 0.00 H new ATOM 0 HH11 ARG A 137 8.547 4.809 4.186 1.00 0.00 H new ATOM 0 HH12 ARG A 137 6.985 4.960 4.998 1.00 0.00 H new ATOM 0 HH21 ARG A 137 5.588 6.973 2.467 1.00 0.00 H new ATOM 0 HH22 ARG A 137 5.317 6.182 4.024 1.00 0.00 H new ATOM 2146 N ASN A 138 10.828 6.046 -3.549 1.00 0.00 N ATOM 2147 CA ASN A 138 10.152 6.613 -4.701 1.00 0.00 C ATOM 2148 C ASN A 138 8.912 5.799 -4.992 1.00 0.00 C ATOM 2149 O ASN A 138 8.994 4.676 -5.497 1.00 0.00 O ATOM 2150 CB ASN A 138 11.099 6.625 -5.911 1.00 0.00 C ATOM 2151 CG ASN A 138 10.414 7.001 -7.214 1.00 0.00 C ATOM 2152 OD1 ASN A 138 10.301 8.174 -7.556 1.00 0.00 O ATOM 2153 ND2 ASN A 138 9.975 6.006 -7.963 1.00 0.00 N ATOM 0 H ASN A 138 11.504 5.319 -3.785 1.00 0.00 H new ATOM 0 HA ASN A 138 9.860 7.642 -4.493 1.00 0.00 H new ATOM 0 HB2 ASN A 138 11.910 7.328 -5.720 1.00 0.00 H new ATOM 0 HB3 ASN A 138 11.550 5.639 -6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 138 9.525 6.201 -8.857 1.00 0.00 H new ATOM 0 HD22 ASN A 138 10.086 5.042 -7.647 1.00 0.00 H new ATOM 2160 N ILE A 139 7.767 6.351 -4.647 1.00 0.00 N ATOM 2161 CA ILE A 139 6.519 5.654 -4.820 1.00 0.00 C ATOM 2162 C ILE A 139 6.061 5.786 -6.268 1.00 0.00 C ATOM 2163 O ILE A 139 5.698 6.872 -6.724 1.00 0.00 O ATOM 2164 CB ILE A 139 5.451 6.171 -3.824 1.00 0.00 C ATOM 2165 CG1 ILE A 139 5.799 5.709 -2.397 1.00 0.00 C ATOM 2166 CG2 ILE A 139 4.055 5.700 -4.210 1.00 0.00 C ATOM 2167 CD1 ILE A 139 6.646 6.673 -1.599 1.00 0.00 C ATOM 0 H ILE A 139 7.680 7.284 -4.244 1.00 0.00 H new ATOM 0 HA ILE A 139 6.663 4.596 -4.601 1.00 0.00 H new ATOM 0 HB ILE A 139 5.452 7.260 -3.859 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.871 5.529 -1.854 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.322 4.755 -2.458 1.00 0.00 H new ATOM 0 HG21 ILE A 139 3.331 6.081 -3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 139 3.808 6.071 -5.205 1.00 0.00 H new ATOM 0 HG23 ILE A 139 4.026 4.610 -4.212 1.00 0.00 H new ATOM 0 HD11 ILE A 139 6.836 6.257 -0.610 1.00 0.00 H new ATOM 0 HD12 ILE A 139 7.594 6.836 -2.113 1.00 0.00 H new ATOM 0 HD13 ILE A 139 6.120 7.622 -1.498 1.00 0.00 H new ATOM 2179 N LEU A 140 6.142 4.669 -6.987 1.00 0.00 N ATOM 2180 CA LEU A 140 5.838 4.615 -8.408 1.00 0.00 C ATOM 2181 C LEU A 140 4.383 4.924 -8.666 1.00 0.00 C ATOM 2182 O LEU A 140 3.534 4.035 -8.706 1.00 0.00 O ATOM 2183 CB LEU A 140 6.176 3.241 -8.984 1.00 0.00 C ATOM 2184 CG LEU A 140 7.655 2.861 -8.929 1.00 0.00 C ATOM 2185 CD1 LEU A 140 7.880 1.476 -9.507 1.00 0.00 C ATOM 2186 CD2 LEU A 140 8.484 3.883 -9.681 1.00 0.00 C ATOM 0 H LEU A 140 6.423 3.771 -6.593 1.00 0.00 H new ATOM 0 HA LEU A 140 6.451 5.370 -8.901 1.00 0.00 H new ATOM 0 HB2 LEU A 140 5.603 2.487 -8.444 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.847 3.209 -10.023 1.00 0.00 H new ATOM 0 HG LEU A 140 7.967 2.849 -7.885 1.00 0.00 H new ATOM 0 HD11 LEU A 140 8.940 1.229 -9.457 1.00 0.00 H new ATOM 0 HD12 LEU A 140 7.309 0.745 -8.934 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.552 1.458 -10.546 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.536 3.603 -9.635 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.162 3.918 -10.722 1.00 0.00 H new ATOM 0 HD23 LEU A 140 8.350 4.865 -9.227 1.00 0.00 H new ATOM 2198 N ALA A 141 4.110 6.191 -8.860 1.00 0.00 N ATOM 2199 CA ALA A 141 2.771 6.649 -9.137 1.00 0.00 C ATOM 2200 C ALA A 141 2.426 6.413 -10.597 1.00 0.00 C ATOM 2201 O ALA A 141 1.287 6.598 -11.026 1.00 0.00 O ATOM 2202 CB ALA A 141 2.654 8.108 -8.762 1.00 0.00 C ATOM 0 H ALA A 141 4.809 6.933 -8.830 1.00 0.00 H new ATOM 0 HA ALA A 141 2.055 6.084 -8.539 1.00 0.00 H new ATOM 0 HB1 ALA A 141 1.643 8.457 -8.970 1.00 0.00 H new ATOM 0 HB2 ALA A 141 2.868 8.229 -7.700 1.00 0.00 H new ATOM 0 HB3 ALA A 141 3.367 8.692 -9.345 1.00 0.00 H new ATOM 2208 N SER A 142 3.429 5.990 -11.348 1.00 0.00 N ATOM 2209 CA SER A 142 3.263 5.624 -12.740 1.00 0.00 C ATOM 2210 C SER A 142 3.002 4.124 -12.878 1.00 0.00 C ATOM 2211 O SER A 142 2.789 3.619 -13.983 1.00 0.00 O ATOM 2212 CB SER A 142 4.510 6.035 -13.521 1.00 0.00 C ATOM 2213 OG SER A 142 5.682 5.751 -12.777 1.00 0.00 O ATOM 0 H SER A 142 4.385 5.891 -11.005 1.00 0.00 H new ATOM 0 HA SER A 142 2.398 6.147 -13.149 1.00 0.00 H new ATOM 0 HB2 SER A 142 4.540 5.505 -14.473 1.00 0.00 H new ATOM 0 HB3 SER A 142 4.467 7.100 -13.750 1.00 0.00 H new ATOM 0 HG SER A 142 6.470 6.019 -13.294 1.00 0.00 H new ATOM 2219 N ASN A 143 3.008 3.414 -11.752 1.00 0.00 N ATOM 2220 CA ASN A 143 2.723 1.982 -11.750 1.00 0.00 C ATOM 2221 C ASN A 143 1.895 1.605 -10.521 1.00 0.00 C ATOM 2222 O ASN A 143 2.417 1.052 -9.553 1.00 0.00 O ATOM 2223 CB ASN A 143 4.022 1.166 -11.768 1.00 0.00 C ATOM 2224 CG ASN A 143 3.795 -0.288 -12.144 1.00 0.00 C ATOM 2225 OD1 ASN A 143 3.520 -1.135 -11.295 1.00 0.00 O ATOM 2226 ND2 ASN A 143 3.914 -0.590 -13.422 1.00 0.00 N ATOM 0 H ASN A 143 3.207 3.806 -10.832 1.00 0.00 H new ATOM 0 HA ASN A 143 2.153 1.752 -12.650 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.719 1.615 -12.475 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.490 1.214 -10.785 1.00 0.00 H new ATOM 0 HD21 ASN A 143 3.777 -1.551 -13.734 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.143 0.138 -14.099 1.00 0.00 H new ATOM 2233 N PRO A 144 0.590 1.925 -10.526 1.00 0.00 N ATOM 2234 CA PRO A 144 -0.307 1.544 -9.452 1.00 0.00 C ATOM 2235 C PRO A 144 -0.912 0.167 -9.691 1.00 0.00 C ATOM 2236 O PRO A 144 -1.782 -0.005 -10.547 1.00 0.00 O ATOM 2237 CB PRO A 144 -1.386 2.623 -9.498 1.00 0.00 C ATOM 2238 CG PRO A 144 -1.403 3.120 -10.911 1.00 0.00 C ATOM 2239 CD PRO A 144 -0.114 2.681 -11.573 1.00 0.00 C ATOM 0 HA PRO A 144 0.197 1.476 -8.488 1.00 0.00 H new ATOM 0 HB2 PRO A 144 -2.357 2.218 -9.214 1.00 0.00 H new ATOM 0 HB3 PRO A 144 -1.162 3.431 -8.802 1.00 0.00 H new ATOM 0 HG2 PRO A 144 -2.263 2.718 -11.447 1.00 0.00 H new ATOM 0 HG3 PRO A 144 -1.493 4.206 -10.933 1.00 0.00 H new ATOM 0 HD2 PRO A 144 -0.307 2.062 -12.449 1.00 0.00 H new ATOM 0 HD3 PRO A 144 0.472 3.536 -11.909 1.00 0.00 H new ATOM 2247 N ARG A 145 -0.448 -0.815 -8.942 1.00 0.00 N ATOM 2248 CA ARG A 145 -0.935 -2.170 -9.100 1.00 0.00 C ATOM 2249 C ARG A 145 -2.262 -2.350 -8.375 1.00 0.00 C ATOM 2250 O ARG A 145 -2.314 -2.902 -7.283 1.00 0.00 O ATOM 2251 CB ARG A 145 0.090 -3.159 -8.580 1.00 0.00 C ATOM 2252 CG ARG A 145 -0.248 -4.578 -8.960 1.00 0.00 C ATOM 2253 CD ARG A 145 -0.685 -4.667 -10.415 1.00 0.00 C ATOM 2254 NE ARG A 145 0.374 -4.200 -11.315 1.00 0.00 N ATOM 2255 CZ ARG A 145 0.238 -4.052 -12.632 1.00 0.00 C ATOM 2256 NH1 ARG A 145 -0.889 -4.400 -13.242 1.00 0.00 N ATOM 2257 NH2 ARG A 145 1.248 -3.563 -13.347 1.00 0.00 N ATOM 0 H ARG A 145 0.264 -0.700 -8.220 1.00 0.00 H new ATOM 0 HA ARG A 145 -1.096 -2.359 -10.161 1.00 0.00 H new ATOM 0 HB2 ARG A 145 1.073 -2.903 -8.975 1.00 0.00 H new ATOM 0 HB3 ARG A 145 0.152 -3.080 -7.495 1.00 0.00 H new ATOM 0 HG2 ARG A 145 0.620 -5.217 -8.798 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -1.044 -4.951 -8.315 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -0.944 -5.698 -10.657 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.584 -4.069 -10.565 1.00 0.00 H new ATOM 0 HE ARG A 145 1.279 -3.972 -10.904 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -1.663 -4.786 -12.702 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -0.980 -4.282 -14.251 1.00 0.00 H new ATOM 0 HH21 ARG A 145 2.120 -3.304 -12.886 1.00 0.00 H new ATOM 0 HH22 ARG A 145 1.150 -3.447 -14.356 1.00 0.00 H new ATOM 2271 N VAL A 146 -3.334 -1.905 -9.007 1.00 0.00 N ATOM 2272 CA VAL A 146 -4.642 -1.888 -8.374 1.00 0.00 C ATOM 2273 C VAL A 146 -5.457 -3.144 -8.709 1.00 0.00 C ATOM 2274 O VAL A 146 -5.862 -3.361 -9.852 1.00 0.00 O ATOM 2275 CB VAL A 146 -5.423 -0.608 -8.764 1.00 0.00 C ATOM 2276 CG1 VAL A 146 -5.504 -0.444 -10.275 1.00 0.00 C ATOM 2277 CG2 VAL A 146 -6.811 -0.609 -8.143 1.00 0.00 C ATOM 0 H VAL A 146 -3.324 -1.549 -9.963 1.00 0.00 H new ATOM 0 HA VAL A 146 -4.481 -1.883 -7.296 1.00 0.00 H new ATOM 0 HB VAL A 146 -4.874 0.247 -8.369 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -6.058 0.464 -10.513 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -4.498 -0.373 -10.688 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -6.014 -1.305 -10.708 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -7.339 0.300 -8.432 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -7.366 -1.479 -8.494 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -6.724 -0.649 -7.057 1.00 0.00 H new ATOM 2287 N THR A 147 -5.665 -3.981 -7.706 1.00 0.00 N ATOM 2288 CA THR A 147 -6.534 -5.136 -7.839 1.00 0.00 C ATOM 2289 C THR A 147 -7.808 -4.905 -7.045 1.00 0.00 C ATOM 2290 O THR A 147 -7.803 -4.969 -5.826 1.00 0.00 O ATOM 2291 CB THR A 147 -5.837 -6.413 -7.320 1.00 0.00 C ATOM 2292 OG1 THR A 147 -4.537 -6.538 -7.904 1.00 0.00 O ATOM 2293 CG2 THR A 147 -6.656 -7.653 -7.636 1.00 0.00 C ATOM 0 H THR A 147 -5.240 -3.880 -6.784 1.00 0.00 H new ATOM 0 HA THR A 147 -6.769 -5.271 -8.895 1.00 0.00 H new ATOM 0 HB THR A 147 -5.744 -6.326 -6.237 1.00 0.00 H new ATOM 0 HG1 THR A 147 -3.933 -6.974 -7.267 1.00 0.00 H new ATOM 0 HG21 THR A 147 -6.140 -8.536 -7.259 1.00 0.00 H new ATOM 0 HG22 THR A 147 -7.634 -7.574 -7.161 1.00 0.00 H new ATOM 0 HG23 THR A 147 -6.782 -7.740 -8.715 1.00 0.00 H new ATOM 2301 N ARG A 148 -8.897 -4.646 -7.734 1.00 0.00 N ATOM 2302 CA ARG A 148 -10.152 -4.371 -7.064 1.00 0.00 C ATOM 2303 C ARG A 148 -11.158 -5.471 -7.336 1.00 0.00 C ATOM 2304 O ARG A 148 -11.379 -5.880 -8.475 1.00 0.00 O ATOM 2305 CB ARG A 148 -10.707 -3.002 -7.465 1.00 0.00 C ATOM 2306 CG ARG A 148 -10.400 -2.626 -8.896 1.00 0.00 C ATOM 2307 CD ARG A 148 -10.884 -1.223 -9.230 1.00 0.00 C ATOM 2308 NE ARG A 148 -10.620 -0.882 -10.625 1.00 0.00 N ATOM 2309 CZ ARG A 148 -10.192 0.309 -11.042 1.00 0.00 C ATOM 2310 NH1 ARG A 148 -9.998 1.299 -10.175 1.00 0.00 N ATOM 2311 NH2 ARG A 148 -9.968 0.505 -12.331 1.00 0.00 N ATOM 0 H ARG A 148 -8.941 -4.620 -8.753 1.00 0.00 H new ATOM 0 HA ARG A 148 -9.962 -4.346 -5.991 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -11.787 -3.000 -7.320 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -10.295 -2.242 -6.801 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -9.325 -2.689 -9.065 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -10.871 -3.342 -9.569 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -11.954 -1.150 -9.033 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -10.390 -0.502 -8.579 1.00 0.00 H new ATOM 0 HE ARG A 148 -10.774 -1.605 -11.328 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -10.177 1.150 -9.182 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -9.670 2.207 -10.503 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -10.123 -0.252 -12.997 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -9.640 1.413 -12.659 1.00 0.00 H new ATOM 2325 N PHE A 149 -11.759 -5.927 -6.269 1.00 0.00 N ATOM 2326 CA PHE A 149 -12.677 -7.051 -6.297 1.00 0.00 C ATOM 2327 C PHE A 149 -14.051 -6.572 -5.832 1.00 0.00 C ATOM 2328 O PHE A 149 -14.181 -5.457 -5.331 1.00 0.00 O ATOM 2329 CB PHE A 149 -12.195 -8.191 -5.372 1.00 0.00 C ATOM 2330 CG PHE A 149 -10.749 -8.113 -4.934 1.00 0.00 C ATOM 2331 CD1 PHE A 149 -10.322 -7.085 -4.115 1.00 0.00 C ATOM 2332 CD2 PHE A 149 -9.826 -9.078 -5.314 1.00 0.00 C ATOM 2333 CE1 PHE A 149 -9.025 -7.005 -3.685 1.00 0.00 C ATOM 2334 CE2 PHE A 149 -8.513 -9.006 -4.875 1.00 0.00 C ATOM 2335 CZ PHE A 149 -8.121 -7.961 -4.059 1.00 0.00 C ATOM 0 H PHE A 149 -11.627 -5.527 -5.340 1.00 0.00 H new ATOM 0 HA PHE A 149 -12.727 -7.437 -7.315 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -12.825 -8.203 -4.482 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -12.349 -9.140 -5.885 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -11.028 -6.328 -3.807 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -10.133 -9.890 -5.956 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -8.716 -6.187 -3.051 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -7.800 -9.762 -5.169 1.00 0.00 H new ATOM 0 HZ PHE A 149 -7.099 -7.899 -3.716 1.00 0.00 H new ATOM 2345 N HIS A 150 -15.075 -7.391 -6.006 1.00 0.00 N ATOM 2346 CA HIS A 150 -16.402 -7.034 -5.514 1.00 0.00 C ATOM 2347 C HIS A 150 -16.714 -7.812 -4.236 1.00 0.00 C ATOM 2348 O HIS A 150 -16.185 -8.904 -4.025 1.00 0.00 O ATOM 2349 CB HIS A 150 -17.489 -7.260 -6.590 1.00 0.00 C ATOM 2350 CG HIS A 150 -17.729 -8.690 -6.994 1.00 0.00 C ATOM 2351 ND1 HIS A 150 -17.177 -9.842 -6.557 1.00 0.00 N flip ATOM 2352 CD2 HIS A 150 -18.639 -9.054 -7.963 1.00 0.00 C flip ATOM 2353 CE1 HIS A 150 -17.754 -10.869 -7.254 1.00 0.00 C flip ATOM 2354 NE2 HIS A 150 -18.635 -10.367 -8.097 1.00 0.00 N flip ATOM 0 H HIS A 150 -15.019 -8.294 -6.476 1.00 0.00 H new ATOM 0 HA HIS A 150 -16.404 -5.969 -5.281 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -18.427 -6.844 -6.223 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -17.215 -6.693 -7.480 1.00 0.00 H new ATOM 0 HD1 HIS A 150 -16.460 -9.931 -5.837 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -19.259 -8.371 -8.525 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -17.525 -11.918 -7.133 1.00 0.00 H new ATOM 2363 N ILE A 151 -17.560 -7.249 -3.384 1.00 0.00 N ATOM 2364 CA ILE A 151 -17.935 -7.888 -2.142 1.00 0.00 C ATOM 2365 C ILE A 151 -19.391 -7.609 -1.857 1.00 0.00 C ATOM 2366 O ILE A 151 -20.049 -6.863 -2.582 1.00 0.00 O ATOM 2367 CB ILE A 151 -17.078 -7.415 -0.940 1.00 0.00 C ATOM 2368 CG1 ILE A 151 -17.081 -5.890 -0.814 1.00 0.00 C ATOM 2369 CG2 ILE A 151 -15.658 -7.932 -1.068 1.00 0.00 C ATOM 2370 CD1 ILE A 151 -16.288 -5.380 0.376 1.00 0.00 C ATOM 0 H ILE A 151 -18.000 -6.342 -3.538 1.00 0.00 H new ATOM 0 HA ILE A 151 -17.760 -8.957 -2.263 1.00 0.00 H new ATOM 0 HB ILE A 151 -17.523 -7.824 -0.033 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -16.671 -5.457 -1.726 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -18.111 -5.542 -0.731 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -15.069 -7.591 -0.217 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -15.668 -9.022 -1.090 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -15.215 -7.555 -1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -16.333 -4.291 0.404 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -16.711 -5.784 1.296 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -15.249 -5.698 0.284 1.00 0.00 H new ATOM 2382 N ASN A 152 -19.882 -8.225 -0.811 1.00 0.00 N ATOM 2383 CA ASN A 152 -21.253 -8.058 -0.394 1.00 0.00 C ATOM 2384 C ASN A 152 -21.364 -6.932 0.627 1.00 0.00 C ATOM 2385 O ASN A 152 -21.120 -7.108 1.819 1.00 0.00 O ATOM 2386 CB ASN A 152 -21.809 -9.383 0.141 1.00 0.00 C ATOM 2387 CG ASN A 152 -20.896 -10.109 1.102 1.00 0.00 C ATOM 2388 OD1 ASN A 152 -20.054 -9.383 1.786 1.00 0.00 O flip ATOM 2389 ND2 ASN A 152 -20.936 -11.333 1.208 1.00 0.00 N flip ATOM 0 H ASN A 152 -19.341 -8.859 -0.222 1.00 0.00 H new ATOM 0 HA ASN A 152 -21.860 -7.774 -1.254 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -22.758 -9.188 0.640 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -22.022 -10.039 -0.703 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -21.606 -11.871 0.659 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -20.299 -11.811 1.845 1.00 0.00 H new ATOM 2396 N TRP A 153 -21.705 -5.756 0.147 1.00 0.00 N ATOM 2397 CA TRP A 153 -21.834 -4.597 1.004 1.00 0.00 C ATOM 2398 C TRP A 153 -23.111 -4.699 1.827 1.00 0.00 C ATOM 2399 O TRP A 153 -23.370 -3.888 2.716 1.00 0.00 O ATOM 2400 CB TRP A 153 -21.834 -3.334 0.160 1.00 0.00 C ATOM 2401 CG TRP A 153 -20.687 -3.271 -0.798 1.00 0.00 C ATOM 2402 CD1 TRP A 153 -20.514 -4.043 -1.903 1.00 0.00 C ATOM 2403 CD2 TRP A 153 -19.575 -2.375 -0.759 1.00 0.00 C ATOM 2404 NE1 TRP A 153 -19.344 -3.724 -2.524 1.00 0.00 N ATOM 2405 CE2 TRP A 153 -18.751 -2.689 -1.853 1.00 0.00 C ATOM 2406 CE3 TRP A 153 -19.193 -1.342 0.098 1.00 0.00 C ATOM 2407 CZ2 TRP A 153 -17.566 -2.009 -2.111 1.00 0.00 C ATOM 2408 CZ3 TRP A 153 -18.022 -0.661 -0.162 1.00 0.00 C ATOM 2409 CH2 TRP A 153 -17.218 -0.997 -1.257 1.00 0.00 C ATOM 0 H TRP A 153 -21.899 -5.576 -0.838 1.00 0.00 H new ATOM 0 HA TRP A 153 -20.988 -4.556 1.690 1.00 0.00 H new ATOM 0 HB2 TRP A 153 -22.769 -3.276 -0.397 1.00 0.00 H new ATOM 0 HB3 TRP A 153 -21.800 -2.465 0.817 1.00 0.00 H new ATOM 0 HD1 TRP A 153 -21.205 -4.801 -2.241 1.00 0.00 H new ATOM 0 HE1 TRP A 153 -18.970 -4.183 -3.355 1.00 0.00 H new ATOM 0 HE3 TRP A 153 -19.803 -1.080 0.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 153 -16.943 -2.269 -2.954 1.00 0.00 H new ATOM 0 HZ3 TRP A 153 -17.721 0.145 0.490 1.00 0.00 H new ATOM 0 HH2 TRP A 153 -16.305 -0.447 -1.432 1.00 0.00 H new ATOM 2420 N GLU A 154 -23.894 -5.716 1.511 1.00 0.00 N ATOM 2421 CA GLU A 154 -25.099 -6.035 2.234 1.00 0.00 C ATOM 2422 C GLU A 154 -24.974 -7.441 2.757 1.00 0.00 C ATOM 2423 O GLU A 154 -23.980 -8.126 2.511 1.00 0.00 O ATOM 2424 CB GLU A 154 -26.318 -5.967 1.316 1.00 0.00 C ATOM 2425 CG GLU A 154 -26.582 -4.592 0.754 1.00 0.00 C ATOM 2426 CD GLU A 154 -27.096 -3.627 1.794 1.00 0.00 C ATOM 2427 OE1 GLU A 154 -27.866 -4.054 2.678 1.00 0.00 O ATOM 2428 OE2 GLU A 154 -26.768 -2.428 1.707 1.00 0.00 O ATOM 0 H GLU A 154 -23.702 -6.348 0.734 1.00 0.00 H new ATOM 0 HA GLU A 154 -25.229 -5.318 3.045 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -26.179 -6.666 0.491 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -27.197 -6.298 1.870 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -25.662 -4.198 0.322 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -27.308 -4.668 -0.056 1.00 0.00 H new ATOM 2435 N ASP A 155 -25.984 -7.875 3.456 1.00 0.00 N ATOM 2436 CA ASP A 155 -26.067 -9.263 3.858 1.00 0.00 C ATOM 2437 C ASP A 155 -27.262 -9.893 3.170 1.00 0.00 C ATOM 2438 O ASP A 155 -28.253 -10.251 3.808 1.00 0.00 O ATOM 2439 CB ASP A 155 -26.187 -9.382 5.370 1.00 0.00 C ATOM 2440 CG ASP A 155 -25.814 -10.762 5.883 1.00 0.00 C ATOM 2441 OD1 ASP A 155 -24.613 -10.991 6.153 1.00 0.00 O ATOM 2442 OD2 ASP A 155 -26.714 -11.613 6.038 1.00 0.00 O ATOM 0 H ASP A 155 -26.764 -7.294 3.762 1.00 0.00 H new ATOM 0 HA ASP A 155 -25.157 -9.786 3.563 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -25.544 -8.638 5.841 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -27.210 -9.153 5.668 1.00 0.00 H new ATOM 2447 N ASN A 156 -27.143 -10.023 1.852 1.00 0.00 N ATOM 2448 CA ASN A 156 -28.213 -10.542 1.006 1.00 0.00 C ATOM 2449 C ASN A 156 -27.615 -11.098 -0.277 1.00 0.00 C ATOM 2450 O ASN A 156 -27.583 -10.361 -1.287 1.00 0.00 O ATOM 2451 CB ASN A 156 -29.233 -9.447 0.643 1.00 0.00 C ATOM 2452 CG ASN A 156 -30.065 -8.956 1.815 1.00 0.00 C ATOM 2453 OD1 ASN A 156 -31.082 -9.557 2.167 1.00 0.00 O ATOM 2454 ND2 ASN A 156 -29.665 -7.837 2.400 1.00 0.00 N ATOM 2455 OXT ASN A 156 -27.139 -12.247 -0.266 1.00 0.00 O ATOM 0 H ASN A 156 -26.299 -9.770 1.339 1.00 0.00 H new ATOM 0 HA ASN A 156 -28.730 -11.323 1.563 1.00 0.00 H new ATOM 0 HB2 ASN A 156 -28.701 -8.600 0.210 1.00 0.00 H new ATOM 0 HB3 ASN A 156 -29.902 -9.831 -0.127 1.00 0.00 H new ATOM 0 HD21 ASN A 156 -30.205 -7.443 3.171 1.00 0.00 H new ATOM 0 HD22 ASN A 156 -28.817 -7.369 2.080 1.00 0.00 H new TER 2462 ASN A 156 ATOM 2463 N GLY B 118 15.663 -16.774 -1.882 1.00 0.00 N ATOM 2464 CA GLY B 118 14.665 -17.871 -1.914 1.00 0.00 C ATOM 2465 C GLY B 118 13.799 -17.804 -3.152 1.00 0.00 C ATOM 2466 O GLY B 118 13.665 -18.785 -3.884 1.00 0.00 O ATOM 0 HA2 GLY B 118 15.179 -18.832 -1.881 1.00 0.00 H new ATOM 0 HA3 GLY B 118 14.035 -17.816 -1.026 1.00 0.00 H new ATOM 2470 N ALA B 119 13.209 -16.645 -3.388 1.00 0.00 N ATOM 2471 CA ALA B 119 12.422 -16.411 -4.582 1.00 0.00 C ATOM 2472 C ALA B 119 13.172 -15.459 -5.499 1.00 0.00 C ATOM 2473 O ALA B 119 13.511 -15.815 -6.630 1.00 0.00 O ATOM 2474 CB ALA B 119 11.058 -15.846 -4.213 1.00 0.00 C ATOM 0 H ALA B 119 13.263 -15.844 -2.759 1.00 0.00 H new ATOM 0 HA ALA B 119 12.264 -17.354 -5.104 1.00 0.00 H new ATOM 0 HB1 ALA B 119 10.478 -15.675 -5.120 1.00 0.00 H new ATOM 0 HB2 ALA B 119 10.532 -16.554 -3.573 1.00 0.00 H new ATOM 0 HB3 ALA B 119 11.186 -14.903 -3.681 1.00 0.00 H new ATOM 2480 N MET B 120 13.463 -14.266 -4.978 1.00 0.00 N ATOM 2481 CA MET B 120 14.201 -13.232 -5.707 1.00 0.00 C ATOM 2482 C MET B 120 13.438 -12.736 -6.941 1.00 0.00 C ATOM 2483 O MET B 120 12.667 -13.465 -7.565 1.00 0.00 O ATOM 2484 CB MET B 120 15.583 -13.734 -6.090 1.00 0.00 C ATOM 2485 CG MET B 120 16.540 -12.603 -6.395 1.00 0.00 C ATOM 2486 SD MET B 120 16.468 -11.281 -5.171 1.00 0.00 S ATOM 2487 CE MET B 120 17.788 -10.218 -5.750 1.00 0.00 C ATOM 0 H MET B 120 13.192 -13.988 -4.035 1.00 0.00 H new ATOM 0 HA MET B 120 14.311 -12.379 -5.038 1.00 0.00 H new ATOM 0 HB2 MET B 120 15.986 -14.339 -5.277 1.00 0.00 H new ATOM 0 HB3 MET B 120 15.503 -14.384 -6.961 1.00 0.00 H new ATOM 0 HG2 MET B 120 17.556 -12.995 -6.441 1.00 0.00 H new ATOM 0 HG3 MET B 120 16.311 -12.194 -7.379 1.00 0.00 H new ATOM 0 HE1 MET B 120 17.871 -9.351 -5.095 1.00 0.00 H new ATOM 0 HE2 MET B 120 18.728 -10.769 -5.743 1.00 0.00 H new ATOM 0 HE3 MET B 120 17.569 -9.886 -6.765 1.00 0.00 H new ATOM 2497 N GLY B 121 13.652 -11.476 -7.284 1.00 0.00 N ATOM 2498 CA GLY B 121 12.948 -10.880 -8.401 1.00 0.00 C ATOM 2499 C GLY B 121 11.973 -9.825 -7.935 1.00 0.00 C ATOM 2500 O GLY B 121 11.759 -8.824 -8.614 1.00 0.00 O ATOM 0 H GLY B 121 14.303 -10.852 -6.807 1.00 0.00 H new ATOM 0 HA2 GLY B 121 13.666 -10.436 -9.091 1.00 0.00 H new ATOM 0 HA3 GLY B 121 12.414 -11.654 -8.952 1.00 0.00 H new ATOM 2504 N LYS B 122 11.397 -10.061 -6.756 1.00 0.00 N ATOM 2505 CA LYS B 122 10.473 -9.130 -6.098 1.00 0.00 C ATOM 2506 C LYS B 122 9.110 -9.060 -6.786 1.00 0.00 C ATOM 2507 O LYS B 122 8.103 -9.356 -6.161 1.00 0.00 O ATOM 2508 CB LYS B 122 11.061 -7.720 -5.971 1.00 0.00 C ATOM 2509 CG LYS B 122 12.110 -7.605 -4.882 1.00 0.00 C ATOM 2510 CD LYS B 122 13.482 -8.024 -5.366 1.00 0.00 C ATOM 2511 CE LYS B 122 14.238 -6.837 -5.943 1.00 0.00 C ATOM 2512 NZ LYS B 122 15.625 -7.182 -6.358 1.00 0.00 N ATOM 0 H LYS B 122 11.560 -10.915 -6.222 1.00 0.00 H new ATOM 0 HA LYS B 122 10.324 -9.536 -5.098 1.00 0.00 H new ATOM 0 HB2 LYS B 122 11.503 -7.431 -6.924 1.00 0.00 H new ATOM 0 HB3 LYS B 122 10.256 -7.015 -5.766 1.00 0.00 H new ATOM 0 HG2 LYS B 122 12.151 -6.576 -4.526 1.00 0.00 H new ATOM 0 HG3 LYS B 122 11.820 -8.225 -4.033 1.00 0.00 H new ATOM 0 HD2 LYS B 122 14.048 -8.454 -4.540 1.00 0.00 H new ATOM 0 HD3 LYS B 122 13.383 -8.801 -6.124 1.00 0.00 H new ATOM 0 HE2 LYS B 122 13.693 -6.448 -6.803 1.00 0.00 H new ATOM 0 HE3 LYS B 122 14.274 -6.039 -5.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 16.093 -6.337 -6.743 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 16.158 -7.527 -5.534 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 15.595 -7.923 -7.087 1.00 0.00 H new ATOM 2526 N ASP B 123 9.093 -8.676 -8.063 1.00 0.00 N ATOM 2527 CA ASP B 123 7.846 -8.426 -8.809 1.00 0.00 C ATOM 2528 C ASP B 123 6.783 -9.504 -8.576 1.00 0.00 C ATOM 2529 O ASP B 123 5.646 -9.192 -8.222 1.00 0.00 O ATOM 2530 CB ASP B 123 8.125 -8.305 -10.311 1.00 0.00 C ATOM 2531 CG ASP B 123 8.801 -7.000 -10.687 1.00 0.00 C ATOM 2532 OD1 ASP B 123 10.046 -6.932 -10.633 1.00 0.00 O ATOM 2533 OD2 ASP B 123 8.090 -6.040 -11.056 1.00 0.00 O ATOM 0 H ASP B 123 9.939 -8.528 -8.614 1.00 0.00 H new ATOM 0 HA ASP B 123 7.450 -7.485 -8.427 1.00 0.00 H new ATOM 0 HB2 ASP B 123 8.754 -9.137 -10.626 1.00 0.00 H new ATOM 0 HB3 ASP B 123 7.186 -8.391 -10.857 1.00 0.00 H new ATOM 2538 N ILE B 124 7.145 -10.767 -8.776 1.00 0.00 N ATOM 2539 CA ILE B 124 6.199 -11.870 -8.588 1.00 0.00 C ATOM 2540 C ILE B 124 5.703 -11.948 -7.140 1.00 0.00 C ATOM 2541 O ILE B 124 4.539 -12.251 -6.882 1.00 0.00 O ATOM 2542 CB ILE B 124 6.820 -13.229 -8.991 1.00 0.00 C ATOM 2543 CG1 ILE B 124 5.827 -14.365 -8.711 1.00 0.00 C ATOM 2544 CG2 ILE B 124 8.142 -13.462 -8.266 1.00 0.00 C ATOM 2545 CD1 ILE B 124 6.386 -15.748 -8.973 1.00 0.00 C ATOM 0 H ILE B 124 8.079 -11.055 -9.066 1.00 0.00 H new ATOM 0 HA ILE B 124 5.351 -11.663 -9.240 1.00 0.00 H new ATOM 0 HB ILE B 124 7.032 -13.212 -10.060 1.00 0.00 H new ATOM 0 HG12 ILE B 124 5.505 -14.305 -7.671 1.00 0.00 H new ATOM 0 HG13 ILE B 124 4.940 -14.219 -9.328 1.00 0.00 H new ATOM 0 HG21 ILE B 124 8.557 -14.424 -8.567 1.00 0.00 H new ATOM 0 HG22 ILE B 124 8.843 -12.668 -8.523 1.00 0.00 H new ATOM 0 HG23 ILE B 124 7.972 -13.461 -7.189 1.00 0.00 H new ATOM 0 HD11 ILE B 124 5.625 -16.496 -8.752 1.00 0.00 H new ATOM 0 HD12 ILE B 124 6.681 -15.829 -10.019 1.00 0.00 H new ATOM 0 HD13 ILE B 124 7.255 -15.916 -8.337 1.00 0.00 H new ATOM 2557 N GLN B 125 6.588 -11.647 -6.209 1.00 0.00 N ATOM 2558 CA GLN B 125 6.293 -11.740 -4.784 1.00 0.00 C ATOM 2559 C GLN B 125 5.402 -10.585 -4.335 1.00 0.00 C ATOM 2560 O GLN B 125 4.486 -10.752 -3.522 1.00 0.00 O ATOM 2561 CB GLN B 125 7.612 -11.731 -4.018 1.00 0.00 C ATOM 2562 CG GLN B 125 8.359 -13.050 -4.104 1.00 0.00 C ATOM 2563 CD GLN B 125 7.758 -14.112 -3.208 1.00 0.00 C ATOM 2564 OE1 GLN B 125 7.227 -13.689 -2.074 1.00 0.00 O flip ATOM 2565 NE2 GLN B 125 7.783 -15.299 -3.524 1.00 0.00 N flip ATOM 0 H GLN B 125 7.535 -11.330 -6.416 1.00 0.00 H new ATOM 0 HA GLN B 125 5.752 -12.665 -4.582 1.00 0.00 H new ATOM 0 HB2 GLN B 125 8.246 -10.935 -4.408 1.00 0.00 H new ATOM 0 HB3 GLN B 125 7.416 -11.499 -2.971 1.00 0.00 H new ATOM 0 HG2 GLN B 125 8.352 -13.402 -5.136 1.00 0.00 H new ATOM 0 HG3 GLN B 125 9.402 -12.893 -3.828 1.00 0.00 H new ATOM 0 HE21 GLN B 125 8.203 -15.582 -4.409 1.00 0.00 H new ATOM 0 HE22 GLN B 125 7.384 -16.001 -2.901 1.00 0.00 H new ATOM 2574 N LEU B 126 5.674 -9.416 -4.879 1.00 0.00 N ATOM 2575 CA LEU B 126 4.855 -8.250 -4.643 1.00 0.00 C ATOM 2576 C LEU B 126 3.462 -8.510 -5.197 1.00 0.00 C ATOM 2577 O LEU B 126 2.456 -8.123 -4.599 1.00 0.00 O ATOM 2578 CB LEU B 126 5.508 -7.039 -5.311 1.00 0.00 C ATOM 2579 CG LEU B 126 6.959 -6.785 -4.882 1.00 0.00 C ATOM 2580 CD1 LEU B 126 7.647 -5.808 -5.820 1.00 0.00 C ATOM 2581 CD2 LEU B 126 7.005 -6.272 -3.455 1.00 0.00 C ATOM 0 H LEU B 126 6.469 -9.250 -5.496 1.00 0.00 H new ATOM 0 HA LEU B 126 4.768 -8.044 -3.576 1.00 0.00 H new ATOM 0 HB2 LEU B 126 5.480 -7.177 -6.392 1.00 0.00 H new ATOM 0 HB3 LEU B 126 4.915 -6.152 -5.087 1.00 0.00 H new ATOM 0 HG LEU B 126 7.496 -7.732 -4.933 1.00 0.00 H new ATOM 0 HD11 LEU B 126 8.673 -5.648 -5.490 1.00 0.00 H new ATOM 0 HD12 LEU B 126 7.650 -6.215 -6.831 1.00 0.00 H new ATOM 0 HD13 LEU B 126 7.112 -4.859 -5.813 1.00 0.00 H new ATOM 0 HD21 LEU B 126 8.041 -6.096 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU B 126 6.446 -5.339 -3.386 1.00 0.00 H new ATOM 0 HD23 LEU B 126 6.562 -7.011 -2.788 1.00 0.00 H new ATOM 2593 N ALA B 127 3.420 -9.213 -6.324 1.00 0.00 N ATOM 2594 CA ALA B 127 2.166 -9.629 -6.933 1.00 0.00 C ATOM 2595 C ALA B 127 1.468 -10.680 -6.081 1.00 0.00 C ATOM 2596 O ALA B 127 0.244 -10.712 -6.035 1.00 0.00 O ATOM 2597 CB ALA B 127 2.394 -10.150 -8.342 1.00 0.00 C ATOM 0 H ALA B 127 4.251 -9.508 -6.837 1.00 0.00 H new ATOM 0 HA ALA B 127 1.518 -8.754 -6.993 1.00 0.00 H new ATOM 0 HB1 ALA B 127 1.442 -10.455 -8.776 1.00 0.00 H new ATOM 0 HB2 ALA B 127 2.836 -9.364 -8.954 1.00 0.00 H new ATOM 0 HB3 ALA B 127 3.068 -11.006 -8.309 1.00 0.00 H new ATOM 2603 N ARG B 128 2.238 -11.541 -5.409 1.00 0.00 N ATOM 2604 CA ARG B 128 1.651 -12.474 -4.444 1.00 0.00 C ATOM 2605 C ARG B 128 0.719 -11.716 -3.509 1.00 0.00 C ATOM 2606 O ARG B 128 -0.419 -12.123 -3.270 1.00 0.00 O ATOM 2607 CB ARG B 128 2.715 -13.181 -3.590 1.00 0.00 C ATOM 2608 CG ARG B 128 3.762 -13.961 -4.365 1.00 0.00 C ATOM 2609 CD ARG B 128 3.145 -14.890 -5.394 1.00 0.00 C ATOM 2610 NE ARG B 128 2.043 -15.685 -4.842 1.00 0.00 N ATOM 2611 CZ ARG B 128 1.698 -16.894 -5.281 1.00 0.00 C ATOM 2612 NH1 ARG B 128 2.432 -17.503 -6.206 1.00 0.00 N ATOM 2613 NH2 ARG B 128 0.630 -17.500 -4.775 1.00 0.00 N ATOM 0 H ARG B 128 3.250 -11.611 -5.512 1.00 0.00 H new ATOM 0 HA ARG B 128 1.113 -13.229 -5.016 1.00 0.00 H new ATOM 0 HB2 ARG B 128 3.222 -12.433 -2.980 1.00 0.00 H new ATOM 0 HB3 ARG B 128 2.212 -13.863 -2.905 1.00 0.00 H new ATOM 0 HG2 ARG B 128 4.434 -13.264 -4.865 1.00 0.00 H new ATOM 0 HG3 ARG B 128 4.366 -14.543 -3.669 1.00 0.00 H new ATOM 0 HD2 ARG B 128 2.779 -14.303 -6.236 1.00 0.00 H new ATOM 0 HD3 ARG B 128 3.913 -15.559 -5.782 1.00 0.00 H new ATOM 0 HE ARG B 128 1.506 -15.286 -4.072 1.00 0.00 H new ATOM 0 HH11 ARG B 128 3.262 -17.045 -6.582 1.00 0.00 H new ATOM 0 HH12 ARG B 128 2.165 -18.429 -6.540 1.00 0.00 H new ATOM 0 HH21 ARG B 128 0.077 -17.039 -4.052 1.00 0.00 H new ATOM 0 HH22 ARG B 128 0.363 -18.426 -5.109 1.00 0.00 H new ATOM 2627 N ARG B 129 1.211 -10.596 -2.999 1.00 0.00 N ATOM 2628 CA ARG B 129 0.439 -9.780 -2.076 1.00 0.00 C ATOM 2629 C ARG B 129 -0.674 -9.013 -2.794 1.00 0.00 C ATOM 2630 O ARG B 129 -1.827 -9.048 -2.372 1.00 0.00 O ATOM 2631 CB ARG B 129 1.355 -8.812 -1.329 1.00 0.00 C ATOM 2632 CG ARG B 129 2.383 -9.500 -0.439 1.00 0.00 C ATOM 2633 CD ARG B 129 1.733 -10.324 0.662 1.00 0.00 C ATOM 2634 NE ARG B 129 1.528 -11.718 0.272 1.00 0.00 N ATOM 2635 CZ ARG B 129 1.193 -12.687 1.125 1.00 0.00 C ATOM 2636 NH1 ARG B 129 1.069 -12.431 2.424 1.00 0.00 N ATOM 2637 NH2 ARG B 129 1.011 -13.923 0.681 1.00 0.00 N ATOM 0 H ARG B 129 2.141 -10.233 -3.209 1.00 0.00 H new ATOM 0 HA ARG B 129 -0.032 -10.450 -1.357 1.00 0.00 H new ATOM 0 HB2 ARG B 129 1.876 -8.187 -2.054 1.00 0.00 H new ATOM 0 HB3 ARG B 129 0.745 -8.148 -0.717 1.00 0.00 H new ATOM 0 HG2 ARG B 129 3.014 -10.146 -1.049 1.00 0.00 H new ATOM 0 HG3 ARG B 129 3.034 -8.749 0.008 1.00 0.00 H new ATOM 0 HD2 ARG B 129 2.357 -10.288 1.555 1.00 0.00 H new ATOM 0 HD3 ARG B 129 0.774 -9.879 0.926 1.00 0.00 H new ATOM 0 HE ARG B 129 1.648 -11.964 -0.711 1.00 0.00 H new ATOM 0 HH11 ARG B 129 1.230 -11.487 2.775 1.00 0.00 H new ATOM 0 HH12 ARG B 129 0.812 -13.178 3.069 1.00 0.00 H new ATOM 0 HH21 ARG B 129 1.127 -14.131 -0.311 1.00 0.00 H new ATOM 0 HH22 ARG B 129 0.755 -14.666 1.331 1.00 0.00 H new ATOM 2651 N ILE B 130 -0.340 -8.343 -3.893 1.00 0.00 N ATOM 2652 CA ILE B 130 -1.324 -7.518 -4.599 1.00 0.00 C ATOM 2653 C ILE B 130 -2.445 -8.345 -5.237 1.00 0.00 C ATOM 2654 O ILE B 130 -3.496 -7.807 -5.580 1.00 0.00 O ATOM 2655 CB ILE B 130 -0.682 -6.591 -5.661 1.00 0.00 C ATOM 2656 CG1 ILE B 130 0.257 -7.326 -6.598 1.00 0.00 C ATOM 2657 CG2 ILE B 130 0.030 -5.426 -5.003 1.00 0.00 C ATOM 2658 CD1 ILE B 130 -0.430 -7.861 -7.832 1.00 0.00 C ATOM 0 H ILE B 130 0.590 -8.352 -4.312 1.00 0.00 H new ATOM 0 HA ILE B 130 -1.766 -6.889 -3.826 1.00 0.00 H new ATOM 0 HB ILE B 130 -1.501 -6.209 -6.270 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.059 -6.652 -6.900 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.721 -8.153 -6.061 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.472 -4.790 -5.770 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.684 -4.846 -4.418 1.00 0.00 H new ATOM 0 HG23 ILE B 130 0.815 -5.803 -4.347 1.00 0.00 H new ATOM 0 HD11 ILE B 130 0.298 -8.375 -8.459 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -1.214 -8.559 -7.538 1.00 0.00 H new ATOM 0 HD13 ILE B 130 -0.871 -7.035 -8.390 1.00 0.00 H new ATOM 2670 N ARG B 131 -2.224 -9.642 -5.400 1.00 0.00 N ATOM 2671 CA ARG B 131 -3.267 -10.536 -5.904 1.00 0.00 C ATOM 2672 C ARG B 131 -3.997 -11.225 -4.755 1.00 0.00 C ATOM 2673 O ARG B 131 -5.144 -11.643 -4.903 1.00 0.00 O ATOM 2674 CB ARG B 131 -2.684 -11.595 -6.847 1.00 0.00 C ATOM 2675 CG ARG B 131 -2.058 -11.028 -8.110 1.00 0.00 C ATOM 2676 CD ARG B 131 -3.060 -10.234 -8.934 1.00 0.00 C ATOM 2677 NE ARG B 131 -2.435 -9.602 -10.095 1.00 0.00 N ATOM 2678 CZ ARG B 131 -2.946 -8.555 -10.739 1.00 0.00 C ATOM 2679 NH1 ARG B 131 -4.103 -8.034 -10.349 1.00 0.00 N ATOM 2680 NH2 ARG B 131 -2.301 -8.025 -11.770 1.00 0.00 N ATOM 0 H ARG B 131 -1.337 -10.101 -5.193 1.00 0.00 H new ATOM 0 HA ARG B 131 -3.976 -9.923 -6.461 1.00 0.00 H new ATOM 0 HB2 ARG B 131 -1.931 -12.170 -6.308 1.00 0.00 H new ATOM 0 HB3 ARG B 131 -3.475 -12.290 -7.128 1.00 0.00 H new ATOM 0 HG2 ARG B 131 -1.219 -10.386 -7.842 1.00 0.00 H new ATOM 0 HG3 ARG B 131 -1.657 -11.842 -8.713 1.00 0.00 H new ATOM 0 HD2 ARG B 131 -3.860 -10.895 -9.268 1.00 0.00 H new ATOM 0 HD3 ARG B 131 -3.519 -9.469 -8.308 1.00 0.00 H new ATOM 0 HE ARG B 131 -1.553 -9.987 -10.432 1.00 0.00 H new ATOM 0 HH11 ARG B 131 -4.601 -8.436 -9.555 1.00 0.00 H new ATOM 0 HH12 ARG B 131 -4.493 -7.232 -10.843 1.00 0.00 H new ATOM 0 HH21 ARG B 131 -1.410 -8.420 -12.072 1.00 0.00 H new ATOM 0 HH22 ARG B 131 -2.696 -7.223 -12.261 1.00 0.00 H new ATOM 2694 N GLY B 132 -3.332 -11.332 -3.607 1.00 0.00 N ATOM 2695 CA GLY B 132 -3.911 -12.030 -2.476 1.00 0.00 C ATOM 2696 C GLY B 132 -2.958 -12.119 -1.301 1.00 0.00 C ATOM 2697 O GLY B 132 -2.368 -13.173 -1.047 1.00 0.00 O ATOM 0 H GLY B 132 -2.402 -10.947 -3.442 1.00 0.00 H new ATOM 0 HA2 GLY B 132 -4.821 -11.518 -2.164 1.00 0.00 H new ATOM 0 HA3 GLY B 132 -4.200 -13.035 -2.782 1.00 0.00 H new ATOM 2701 N GLU B 133 -2.792 -11.009 -0.598 1.00 0.00 N ATOM 2702 CA GLU B 133 -1.963 -10.974 0.591 1.00 0.00 C ATOM 2703 C GLU B 133 -2.753 -11.476 1.786 1.00 0.00 C ATOM 2704 O GLU B 133 -2.367 -12.423 2.468 1.00 0.00 O ATOM 2705 CB GLU B 133 -1.426 -9.545 0.861 1.00 0.00 C ATOM 2706 CG GLU B 133 -2.379 -8.518 1.494 1.00 0.00 C ATOM 2707 CD GLU B 133 -3.589 -8.150 0.656 1.00 0.00 C ATOM 2708 OE1 GLU B 133 -4.255 -9.059 0.144 1.00 0.00 O ATOM 2709 OE2 GLU B 133 -3.894 -6.949 0.546 1.00 0.00 O ATOM 0 H GLU B 133 -3.225 -10.116 -0.835 1.00 0.00 H new ATOM 0 HA GLU B 133 -1.105 -11.626 0.428 1.00 0.00 H new ATOM 0 HB2 GLU B 133 -0.554 -9.634 1.509 1.00 0.00 H new ATOM 0 HB3 GLU B 133 -1.078 -9.136 -0.087 1.00 0.00 H new ATOM 0 HG2 GLU B 133 -2.726 -8.911 2.450 1.00 0.00 H new ATOM 0 HG3 GLU B 133 -1.816 -7.609 1.708 1.00 0.00 H new ATOM 2716 N ARG B 134 -3.863 -10.821 1.997 1.00 0.00 N ATOM 2717 CA ARG B 134 -4.726 -11.064 3.109 1.00 0.00 C ATOM 2718 C ARG B 134 -5.989 -11.779 2.653 1.00 0.00 C ATOM 2719 O ARG B 134 -6.413 -12.768 3.258 1.00 0.00 O ATOM 2720 CB ARG B 134 -5.068 -9.728 3.753 1.00 0.00 C ATOM 2721 CG ARG B 134 -5.759 -9.826 5.098 1.00 0.00 C ATOM 2722 CD ARG B 134 -6.080 -8.439 5.622 1.00 0.00 C ATOM 2723 NE ARG B 134 -6.787 -8.471 6.897 1.00 0.00 N ATOM 2724 CZ ARG B 134 -7.858 -7.728 7.165 1.00 0.00 C ATOM 2725 NH1 ARG B 134 -8.410 -6.973 6.217 1.00 0.00 N ATOM 2726 NH2 ARG B 134 -8.395 -7.756 8.376 1.00 0.00 N ATOM 0 H ARG B 134 -4.197 -10.082 1.378 1.00 0.00 H new ATOM 0 HA ARG B 134 -4.226 -11.705 3.835 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.149 -9.154 3.874 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.708 -9.166 3.072 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -6.675 -10.408 5.003 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -5.119 -10.352 5.807 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -5.154 -7.875 5.738 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -6.686 -7.909 4.888 1.00 0.00 H new ATOM 0 HE ARG B 134 -6.441 -9.098 7.624 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -8.012 -6.962 5.278 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -9.231 -6.406 6.430 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -7.987 -8.346 9.101 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -9.216 -7.187 8.583 1.00 0.00 H new ATOM 2740 N ALA B 135 -6.588 -11.266 1.582 1.00 0.00 N ATOM 2741 CA ALA B 135 -7.787 -11.858 1.013 1.00 0.00 C ATOM 2742 C ALA B 135 -7.575 -12.197 -0.459 1.00 0.00 C ATOM 2743 O ALA B 135 -7.537 -11.265 -1.292 1.00 0.00 O ATOM 2744 CB ALA B 135 -8.975 -10.922 1.178 1.00 0.00 C ATOM 2745 OXT ALA B 135 -7.469 -13.399 -0.781 1.00 0.00 O ATOM 0 H ALA B 135 -6.257 -10.436 1.090 1.00 0.00 H new ATOM 0 HA ALA B 135 -7.999 -12.783 1.550 1.00 0.00 H new ATOM 0 HB1 ALA B 135 -9.864 -11.382 0.746 1.00 0.00 H new ATOM 0 HB2 ALA B 135 -9.144 -10.732 2.238 1.00 0.00 H new ATOM 0 HB3 ALA B 135 -8.770 -9.980 0.668 1.00 0.00 H new TER 2751 ALA B 135