USER MOD reduce.3.24.130724 H: found=0, std=0, add=1080, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1064 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 -7 HIS : no HE2:sc= 0 X(o=-0.15,f=-0.0089) USER MOD Set 1.2: B -9 HIS : no HD1:sc= -0.152 X(o=-0.15,f=-0.0089) USER MOD Set 2.1: B -8 HIS : no HE2:sc= -0.0912 K(o=-0.091,f=-0.73) USER MOD Set 2.2: B -12 HIS : no HD1:sc= 0 X(o=-0.091,f=-0.091) USER MOD Set 3.1: B 5 SER OG : rot -150:sc= 0.395 USER MOD Set 3.2: B 7 LYS NZ :NH3+ 165:sc= 1.57 (180deg=0.94) USER MOD Set 4.1: A 11 ASN : amide:sc= 0.16 K(o=1.3,f=-1.5!) USER MOD Set 4.2: A 12 SER OG : rot 40:sc= 1.13 USER MOD Set 5.1: A -8 HIS : no HE2:sc= -0.0323 K(o=-0.032,f=-0.65) USER MOD Set 5.2: A -12 HIS : no HD1:sc= 0 X(o=-0.032,f=-0.032) USER MOD Set 6.1: A -7 HIS : no HD1:sc= -0.0109 X(o=-0.49,f=-0.023) USER MOD Set 6.2: A -9 HIS : no HD1:sc= -0.483 X(o=-0.49,f=-0.0018) USER MOD Set 7.1: A 5 SER OG : rot -150:sc= 0.463 USER MOD Set 7.2: A 7 LYS NZ :NH3+ 171:sc= 1.79 (180deg=1.05) USER MOD Single : A 0 LYS NZ :NH3+ 164:sc= 2.28 (180deg=1.55) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.00085) USER MOD Single : A 4 SER OG : rot 16:sc= 0.667 USER MOD Single : A -5 SER OG : rot 180:sc= -0.0144 USER MOD Single : A -6 MET CE :methyl 160:sc= -0.118 (180deg=-0.697) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0.093 USER MOD Single : A 22 MET CE :methyl -170:sc= -1.56 (180deg=-1.74!) USER MOD Single : A 23 GLN : amide:sc= -0.0765 X(o=-0.077,f=0) USER MOD Single : A 26 ASN : amide:sc= -0.0776 X(o=-0.078,f=-0.0017) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ -129:sc= 0.497 (180deg=0.00019) USER MOD Single : A 41 LYS NZ :NH3+ 171:sc= 1.18 (180deg=1.14) USER MOD Single : A 49 LYS NZ :NH3+ -173:sc= 0.681 (180deg=0.526) USER MOD Single : A -10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -11 HIS : no HD1:sc=-0.00556 X(o=-0.0056,f=0) USER MOD Single : A -14 LYS NZ :NH3+ 167:sc= -0.0285 (180deg=-0.196) USER MOD Single : A -15 HIS : no HD1:sc= -0.68 K(o=-0.68,f=-1.5) USER MOD Single : A -16 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A -16 ASN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 0 LYS NZ :NH3+ 158:sc= 2.4 (180deg=1.94) USER MOD Single : B 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 4 SER OG : rot 7:sc= 0.483 USER MOD Single : B -5 SER OG : rot 180:sc= 0 USER MOD Single : B -6 MET CE :methyl 161:sc= -0.0878 (180deg=-0.483) USER MOD Single : B 11 ASN : amide:sc= 0.0996 K(o=0.1,f=-3.2!) USER MOD Single : B 12 SER OG : rot -90:sc= 1.05 USER MOD Single : B 20 THR OG1 : rot 180:sc= 0.081 USER MOD Single : B 22 MET CE :methyl -170:sc= -1.42 (180deg=-1.71!) USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 26 ASN : amide:sc= -0.012 K(o=-0.012,f=-0.56) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 34 LYS NZ :NH3+ -120:sc= 0.937 (180deg=-0.291) USER MOD Single : B 41 LYS NZ :NH3+ 173:sc= 1.24 (180deg=1.17) USER MOD Single : B 49 LYS NZ :NH3+ -174:sc= 0.486 (180deg=0.318) USER MOD Single : B -10 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : B -11 HIS : no HD1:sc= -0.0328 X(o=-0.033,f=-0.011) USER MOD Single : B -14 LYS NZ :NH3+ 168:sc= -0.0251 (180deg=-0.218) USER MOD Single : B -15 HIS : no HD1:sc= -0.0184 X(o=-0.018,f=-0.37) USER MOD Single : B -16 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : B -16 ASN N :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A -16 8.700 0.756 33.789 1.00 0.00 N ATOM 2 CA ASN A -16 7.794 0.696 34.931 1.00 0.00 C ATOM 3 C ASN A -16 6.465 1.297 34.575 1.00 0.00 C ATOM 4 O ASN A -16 6.372 2.504 34.326 1.00 0.00 O ATOM 5 CB ASN A -16 8.343 1.456 36.141 1.00 0.00 C ATOM 6 CG ASN A -16 7.379 1.387 37.325 1.00 0.00 C ATOM 7 OD1 ASN A -16 6.683 0.390 37.514 1.00 0.00 O ATOM 8 ND2 ASN A -16 7.296 2.440 38.092 1.00 0.00 N ATOM 0 H1 ASN A -16 9.615 0.337 34.050 1.00 0.00 H new ATOM 0 H2 ASN A -16 8.291 0.226 32.993 1.00 0.00 H new ATOM 0 H3 ASN A -16 8.841 1.748 33.509 1.00 0.00 H new ATOM 0 HA ASN A -16 7.688 -0.358 35.189 1.00 0.00 H new ATOM 0 HB2 ASN A -16 9.307 1.037 36.429 1.00 0.00 H new ATOM 0 HB3 ASN A -16 8.516 2.498 35.871 1.00 0.00 H new ATOM 0 HD21 ASN A -16 6.641 2.451 38.874 1.00 0.00 H new ATOM 0 HD22 ASN A -16 7.887 3.251 37.910 1.00 0.00 H new ATOM 17 N HIS A -15 5.445 0.481 34.538 1.00 0.00 N ATOM 18 CA HIS A -15 4.110 0.970 34.309 1.00 0.00 C ATOM 19 C HIS A -15 3.585 1.607 35.589 1.00 0.00 C ATOM 20 O HIS A -15 3.263 0.918 36.574 1.00 0.00 O ATOM 21 CB HIS A -15 3.187 -0.139 33.784 1.00 0.00 C ATOM 22 CG HIS A -15 3.549 -0.625 32.410 1.00 0.00 C ATOM 23 ND1 HIS A -15 4.203 -1.809 32.154 1.00 0.00 N ATOM 24 CD2 HIS A -15 3.332 -0.055 31.204 1.00 0.00 C ATOM 25 CE1 HIS A -15 4.366 -1.919 30.837 1.00 0.00 C ATOM 26 NE2 HIS A -15 3.854 -0.878 30.208 1.00 0.00 N ATOM 0 H HIS A -15 5.513 -0.529 34.664 1.00 0.00 H new ATOM 0 HA HIS A -15 4.132 1.732 33.530 1.00 0.00 H new ATOM 0 HB2 HIS A -15 3.214 -0.980 34.476 1.00 0.00 H new ATOM 0 HB3 HIS A -15 2.161 0.230 33.771 1.00 0.00 H new ATOM 0 HD2 HIS A -15 2.833 0.889 31.038 1.00 0.00 H new ATOM 0 HE1 HIS A -15 4.853 -2.750 30.348 1.00 0.00 H new ATOM 0 HE2 HIS A -15 3.843 -0.711 29.202 1.00 0.00 H new ATOM 34 N LYS A -14 3.587 2.923 35.598 1.00 0.00 N ATOM 35 CA LYS A -14 3.195 3.686 36.760 1.00 0.00 C ATOM 36 C LYS A -14 1.730 4.077 36.683 1.00 0.00 C ATOM 37 O LYS A -14 0.996 3.933 37.656 1.00 0.00 O ATOM 38 CB LYS A -14 4.085 4.938 36.913 1.00 0.00 C ATOM 39 CG LYS A -14 3.729 5.837 38.100 1.00 0.00 C ATOM 40 CD LYS A -14 3.916 5.133 39.439 1.00 0.00 C ATOM 41 CE LYS A -14 3.499 6.028 40.606 1.00 0.00 C ATOM 42 NZ LYS A -14 2.056 6.385 40.560 1.00 0.00 N ATOM 0 H LYS A -14 3.861 3.493 34.798 1.00 0.00 H new ATOM 0 HA LYS A -14 3.331 3.057 37.640 1.00 0.00 H new ATOM 0 HB2 LYS A -14 5.122 4.619 37.015 1.00 0.00 H new ATOM 0 HB3 LYS A -14 4.021 5.526 35.998 1.00 0.00 H new ATOM 0 HG2 LYS A -14 4.350 6.732 38.073 1.00 0.00 H new ATOM 0 HG3 LYS A -14 2.694 6.165 38.006 1.00 0.00 H new ATOM 0 HD2 LYS A -14 3.327 4.216 39.454 1.00 0.00 H new ATOM 0 HD3 LYS A -14 4.960 4.844 39.556 1.00 0.00 H new ATOM 0 HE2 LYS A -14 3.715 5.519 41.546 1.00 0.00 H new ATOM 0 HE3 LYS A -14 4.097 6.940 40.593 1.00 0.00 H new ATOM 0 HZ1 LYS A -14 1.772 6.800 41.470 1.00 0.00 H new ATOM 0 HZ2 LYS A -14 1.893 7.075 39.799 1.00 0.00 H new ATOM 0 HZ3 LYS A -14 1.492 5.530 40.378 1.00 0.00 H new ATOM 56 N VAL A -13 1.309 4.555 35.529 1.00 0.00 N ATOM 57 CA VAL A -13 -0.065 4.998 35.337 1.00 0.00 C ATOM 58 C VAL A -13 -0.963 3.787 35.296 1.00 0.00 C ATOM 59 O VAL A -13 -2.002 3.727 35.966 1.00 0.00 O ATOM 60 CB VAL A -13 -0.238 5.794 34.014 1.00 0.00 C ATOM 61 CG1 VAL A -13 -1.664 6.313 33.863 1.00 0.00 C ATOM 62 CG2 VAL A -13 0.752 6.934 33.939 1.00 0.00 C ATOM 0 H VAL A -13 1.900 4.648 34.703 1.00 0.00 H new ATOM 0 HA VAL A -13 -0.327 5.657 36.165 1.00 0.00 H new ATOM 0 HB VAL A -13 -0.040 5.110 33.189 1.00 0.00 H new ATOM 0 HG11 VAL A -13 -1.753 6.866 32.928 1.00 0.00 H new ATOM 0 HG12 VAL A -13 -2.358 5.473 33.855 1.00 0.00 H new ATOM 0 HG13 VAL A -13 -1.902 6.972 34.698 1.00 0.00 H new ATOM 0 HG21 VAL A -13 0.612 7.477 33.004 1.00 0.00 H new ATOM 0 HG22 VAL A -13 0.592 7.610 34.779 1.00 0.00 H new ATOM 0 HG23 VAL A -13 1.767 6.538 33.980 1.00 0.00 H new ATOM 72 N HIS A -12 -0.544 2.821 34.547 1.00 0.00 N ATOM 73 CA HIS A -12 -1.280 1.612 34.416 1.00 0.00 C ATOM 74 C HIS A -12 -0.654 0.590 35.309 1.00 0.00 C ATOM 75 O HIS A -12 0.527 0.332 35.215 1.00 0.00 O ATOM 76 CB HIS A -12 -1.277 1.101 32.961 1.00 0.00 C ATOM 77 CG HIS A -12 -1.867 2.053 31.956 1.00 0.00 C ATOM 78 ND1 HIS A -12 -3.207 2.109 31.640 1.00 0.00 N ATOM 79 CD2 HIS A -12 -1.263 2.989 31.183 1.00 0.00 C ATOM 80 CE1 HIS A -12 -3.373 3.049 30.708 1.00 0.00 C ATOM 81 NE2 HIS A -12 -2.222 3.618 30.392 1.00 0.00 N ATOM 0 H HIS A -12 0.321 2.850 34.008 1.00 0.00 H new ATOM 0 HA HIS A -12 -2.317 1.794 34.697 1.00 0.00 H new ATOM 0 HB2 HIS A -12 -0.250 0.879 32.671 1.00 0.00 H new ATOM 0 HB3 HIS A -12 -1.830 0.162 32.919 1.00 0.00 H new ATOM 0 HD2 HIS A -12 -0.206 3.212 31.181 1.00 0.00 H new ATOM 0 HE1 HIS A -12 -4.324 3.311 30.269 1.00 0.00 H new ATOM 0 HE2 HIS A -12 -2.068 4.362 29.711 1.00 0.00 H new ATOM 89 N HIS A -11 -1.429 0.002 36.168 1.00 0.00 N ATOM 90 CA HIS A -11 -0.939 -1.052 37.053 1.00 0.00 C ATOM 91 C HIS A -11 -1.053 -2.388 36.328 1.00 0.00 C ATOM 92 O HIS A -11 -1.409 -3.411 36.904 1.00 0.00 O ATOM 93 CB HIS A -11 -1.744 -1.068 38.369 1.00 0.00 C ATOM 94 CG HIS A -11 -1.507 0.119 39.271 1.00 0.00 C ATOM 95 ND1 HIS A -11 -1.081 0.013 40.577 1.00 0.00 N ATOM 96 CD2 HIS A -11 -1.682 1.445 39.047 1.00 0.00 C ATOM 97 CE1 HIS A -11 -1.016 1.234 41.097 1.00 0.00 C ATOM 98 NE2 HIS A -11 -1.369 2.151 40.211 1.00 0.00 N ATOM 0 H HIS A -11 -2.417 0.226 36.288 1.00 0.00 H new ATOM 0 HA HIS A -11 0.104 -0.867 37.309 1.00 0.00 H new ATOM 0 HB2 HIS A -11 -2.806 -1.117 38.128 1.00 0.00 H new ATOM 0 HB3 HIS A -11 -1.499 -1.978 38.917 1.00 0.00 H new ATOM 0 HD2 HIS A -11 -2.011 1.885 38.117 1.00 0.00 H new ATOM 0 HE1 HIS A -11 -0.714 1.450 42.111 1.00 0.00 H new ATOM 0 HE2 HIS A -11 -1.405 3.161 40.349 1.00 0.00 H new ATOM 106 N HIS A -10 -0.692 -2.357 35.071 1.00 0.00 N ATOM 107 CA HIS A -10 -0.795 -3.463 34.178 1.00 0.00 C ATOM 108 C HIS A -10 0.379 -3.429 33.231 1.00 0.00 C ATOM 109 O HIS A -10 0.692 -2.383 32.672 1.00 0.00 O ATOM 110 CB HIS A -10 -2.109 -3.354 33.371 1.00 0.00 C ATOM 111 CG HIS A -10 -2.289 -4.416 32.323 1.00 0.00 C ATOM 112 ND1 HIS A -10 -2.274 -4.162 30.967 1.00 0.00 N ATOM 113 CD2 HIS A -10 -2.493 -5.748 32.451 1.00 0.00 C ATOM 114 CE1 HIS A -10 -2.463 -5.316 30.332 1.00 0.00 C ATOM 115 NE2 HIS A -10 -2.602 -6.313 31.189 1.00 0.00 N ATOM 0 H HIS A -10 -0.303 -1.522 34.632 1.00 0.00 H new ATOM 0 HA HIS A -10 -0.795 -4.397 34.740 1.00 0.00 H new ATOM 0 HB2 HIS A -10 -2.950 -3.399 34.063 1.00 0.00 H new ATOM 0 HB3 HIS A -10 -2.144 -2.377 32.889 1.00 0.00 H new ATOM 0 HD2 HIS A -10 -2.560 -6.285 33.386 1.00 0.00 H new ATOM 0 HE1 HIS A -10 -2.498 -5.424 29.258 1.00 0.00 H new ATOM 0 HE2 HIS A -10 -2.758 -7.296 30.967 1.00 0.00 H new ATOM 123 N HIS A -9 1.026 -4.542 33.073 1.00 0.00 N ATOM 124 CA HIS A -9 2.090 -4.650 32.109 1.00 0.00 C ATOM 125 C HIS A -9 1.490 -4.964 30.744 1.00 0.00 C ATOM 126 O HIS A -9 0.813 -5.973 30.566 1.00 0.00 O ATOM 127 CB HIS A -9 3.160 -5.698 32.528 1.00 0.00 C ATOM 128 CG HIS A -9 2.658 -7.102 32.727 1.00 0.00 C ATOM 129 ND1 HIS A -9 2.948 -8.148 31.888 1.00 0.00 N ATOM 130 CD2 HIS A -9 1.894 -7.621 33.710 1.00 0.00 C ATOM 131 CE1 HIS A -9 2.366 -9.238 32.376 1.00 0.00 C ATOM 132 NE2 HIS A -9 1.712 -8.974 33.482 1.00 0.00 N ATOM 0 H HIS A -9 0.839 -5.395 33.599 1.00 0.00 H new ATOM 0 HA HIS A -9 2.617 -3.697 32.058 1.00 0.00 H new ATOM 0 HB2 HIS A -9 3.941 -5.716 31.768 1.00 0.00 H new ATOM 0 HB3 HIS A -9 3.625 -5.364 33.455 1.00 0.00 H new ATOM 0 HD2 HIS A -9 1.488 -7.068 34.544 1.00 0.00 H new ATOM 0 HE1 HIS A -9 2.424 -10.216 31.921 1.00 0.00 H new ATOM 0 HE2 HIS A -9 1.180 -9.629 34.055 1.00 0.00 H new ATOM 140 N HIS A -8 1.691 -4.071 29.812 1.00 0.00 N ATOM 141 CA HIS A -8 1.150 -4.229 28.476 1.00 0.00 C ATOM 142 C HIS A -8 1.874 -5.337 27.732 1.00 0.00 C ATOM 143 O HIS A -8 3.103 -5.454 27.802 1.00 0.00 O ATOM 144 CB HIS A -8 1.207 -2.905 27.688 1.00 0.00 C ATOM 145 CG HIS A -8 0.326 -1.812 28.249 1.00 0.00 C ATOM 146 ND1 HIS A -8 -0.730 -1.235 27.565 1.00 0.00 N ATOM 147 CD2 HIS A -8 0.374 -1.175 29.446 1.00 0.00 C ATOM 148 CE1 HIS A -8 -1.266 -0.299 28.348 1.00 0.00 C ATOM 149 NE2 HIS A -8 -0.635 -0.223 29.501 1.00 0.00 N ATOM 0 H HIS A -8 2.230 -3.216 29.950 1.00 0.00 H new ATOM 0 HA HIS A -8 0.101 -4.510 28.570 1.00 0.00 H new ATOM 0 HB2 HIS A -8 2.238 -2.551 27.668 1.00 0.00 H new ATOM 0 HB3 HIS A -8 0.916 -3.097 26.655 1.00 0.00 H new ATOM 0 HD1 HIS A -8 -1.043 -1.483 26.626 1.00 0.00 H new ATOM 0 HD2 HIS A -8 1.086 -1.377 30.233 1.00 0.00 H new ATOM 0 HE1 HIS A -8 -2.109 0.317 28.072 1.00 0.00 H new ATOM 157 N HIS A -7 1.118 -6.166 27.085 1.00 0.00 N ATOM 158 CA HIS A -7 1.647 -7.269 26.318 1.00 0.00 C ATOM 159 C HIS A -7 1.785 -6.851 24.879 1.00 0.00 C ATOM 160 O HIS A -7 0.981 -6.061 24.373 1.00 0.00 O ATOM 161 CB HIS A -7 0.728 -8.498 26.414 1.00 0.00 C ATOM 162 CG HIS A -7 0.594 -9.060 27.797 1.00 0.00 C ATOM 163 ND1 HIS A -7 -0.394 -8.696 28.685 1.00 0.00 N ATOM 164 CD2 HIS A -7 1.348 -9.985 28.437 1.00 0.00 C ATOM 165 CE1 HIS A -7 -0.220 -9.385 29.807 1.00 0.00 C ATOM 166 NE2 HIS A -7 0.833 -10.195 29.712 1.00 0.00 N ATOM 0 H HIS A -7 0.100 -6.102 27.069 1.00 0.00 H new ATOM 0 HA HIS A -7 2.622 -7.540 26.723 1.00 0.00 H new ATOM 0 HB2 HIS A -7 -0.262 -8.227 26.047 1.00 0.00 H new ATOM 0 HB3 HIS A -7 1.111 -9.276 25.754 1.00 0.00 H new ATOM 0 HD2 HIS A -7 2.213 -10.482 28.023 1.00 0.00 H new ATOM 0 HE1 HIS A -7 -0.849 -9.300 30.681 1.00 0.00 H new ATOM 0 HE2 HIS A -7 1.187 -10.834 30.424 1.00 0.00 H new ATOM 174 N MET A -6 2.792 -7.342 24.233 1.00 0.00 N ATOM 175 CA MET A -6 3.038 -7.026 22.859 1.00 0.00 C ATOM 176 C MET A -6 3.156 -8.305 22.078 1.00 0.00 C ATOM 177 O MET A -6 4.085 -9.076 22.278 1.00 0.00 O ATOM 178 CB MET A -6 4.314 -6.186 22.696 1.00 0.00 C ATOM 179 CG MET A -6 4.274 -4.830 23.386 1.00 0.00 C ATOM 180 SD MET A -6 5.752 -3.834 23.075 1.00 0.00 S ATOM 181 CE MET A -6 5.631 -3.599 21.293 1.00 0.00 C ATOM 0 H MET A -6 3.474 -7.979 24.645 1.00 0.00 H new ATOM 0 HA MET A -6 2.205 -6.433 22.481 1.00 0.00 H new ATOM 0 HB2 MET A -6 5.159 -6.753 23.087 1.00 0.00 H new ATOM 0 HB3 MET A -6 4.498 -6.032 21.633 1.00 0.00 H new ATOM 0 HG2 MET A -6 3.395 -4.282 23.047 1.00 0.00 H new ATOM 0 HG3 MET A -6 4.162 -4.978 24.460 1.00 0.00 H new ATOM 0 HE1 MET A -6 6.235 -2.741 20.997 1.00 0.00 H new ATOM 0 HE2 MET A -6 5.994 -4.491 20.783 1.00 0.00 H new ATOM 0 HE3 MET A -6 4.591 -3.422 21.019 1.00 0.00 H new ATOM 191 N SER A -5 2.170 -8.582 21.282 1.00 0.00 N ATOM 192 CA SER A -5 2.162 -9.738 20.407 1.00 0.00 C ATOM 193 C SER A -5 1.414 -9.376 19.105 1.00 0.00 C ATOM 194 O SER A -5 1.010 -10.226 18.325 1.00 0.00 O ATOM 195 CB SER A -5 1.487 -10.916 21.133 1.00 0.00 C ATOM 196 OG SER A -5 2.163 -11.188 22.369 1.00 0.00 O ATOM 0 H SER A -5 1.329 -8.009 21.213 1.00 0.00 H new ATOM 0 HA SER A -5 3.179 -10.034 20.150 1.00 0.00 H new ATOM 0 HB2 SER A -5 0.440 -10.682 21.326 1.00 0.00 H new ATOM 0 HB3 SER A -5 1.504 -11.802 20.498 1.00 0.00 H new ATOM 0 HG SER A -5 1.725 -11.938 22.823 1.00 0.00 H new ATOM 202 N ASP A -4 1.282 -8.091 18.883 1.00 0.00 N ATOM 203 CA ASP A -4 0.538 -7.544 17.743 1.00 0.00 C ATOM 204 C ASP A -4 1.409 -7.440 16.493 1.00 0.00 C ATOM 205 O ASP A -4 0.928 -7.510 15.371 1.00 0.00 O ATOM 206 CB ASP A -4 -0.032 -6.169 18.128 1.00 0.00 C ATOM 207 CG ASP A -4 -0.759 -5.458 17.010 1.00 0.00 C ATOM 208 OD1 ASP A -4 -1.952 -5.735 16.783 1.00 0.00 O ATOM 209 OD2 ASP A -4 -0.158 -4.558 16.369 1.00 0.00 O ATOM 0 H ASP A -4 1.688 -7.377 19.488 1.00 0.00 H new ATOM 0 HA ASP A -4 -0.278 -8.225 17.502 1.00 0.00 H new ATOM 0 HB2 ASP A -4 -0.716 -6.295 18.967 1.00 0.00 H new ATOM 0 HB3 ASP A -4 0.784 -5.535 18.475 1.00 0.00 H new ATOM 214 N ASP A -3 2.691 -7.346 16.713 1.00 0.00 N ATOM 215 CA ASP A -3 3.683 -7.068 15.654 1.00 0.00 C ATOM 216 C ASP A -3 3.915 -8.211 14.678 1.00 0.00 C ATOM 217 O ASP A -3 4.391 -7.976 13.561 1.00 0.00 O ATOM 218 CB ASP A -3 5.032 -6.622 16.244 1.00 0.00 C ATOM 219 CG ASP A -3 5.028 -5.215 16.806 1.00 0.00 C ATOM 220 OD1 ASP A -3 4.279 -4.938 17.767 1.00 0.00 O ATOM 221 OD2 ASP A -3 5.774 -4.353 16.283 1.00 0.00 O ATOM 0 H ASP A -3 3.105 -7.458 17.638 1.00 0.00 H new ATOM 0 HA ASP A -3 3.236 -6.256 15.081 1.00 0.00 H new ATOM 0 HB2 ASP A -3 5.318 -7.316 17.034 1.00 0.00 H new ATOM 0 HB3 ASP A -3 5.795 -6.690 15.469 1.00 0.00 H new ATOM 226 N ASP A -2 3.607 -9.429 15.070 1.00 0.00 N ATOM 227 CA ASP A -2 3.871 -10.581 14.197 1.00 0.00 C ATOM 228 C ASP A -2 2.930 -10.649 13.000 1.00 0.00 C ATOM 229 O ASP A -2 3.378 -10.596 11.847 1.00 0.00 O ATOM 230 CB ASP A -2 3.860 -11.907 14.950 1.00 0.00 C ATOM 231 CG ASP A -2 4.074 -13.098 14.019 1.00 0.00 C ATOM 232 OD1 ASP A -2 5.215 -13.306 13.531 1.00 0.00 O ATOM 233 OD2 ASP A -2 3.108 -13.842 13.755 1.00 0.00 O ATOM 0 H ASP A -2 3.181 -9.658 15.968 1.00 0.00 H new ATOM 0 HA ASP A -2 4.880 -10.418 13.818 1.00 0.00 H new ATOM 0 HB2 ASP A -2 4.640 -11.898 15.711 1.00 0.00 H new ATOM 0 HB3 ASP A -2 2.909 -12.020 15.470 1.00 0.00 H new ATOM 238 N ASP A -1 1.640 -10.745 13.256 1.00 0.00 N ATOM 239 CA ASP A -1 0.669 -10.887 12.178 1.00 0.00 C ATOM 240 C ASP A -1 0.332 -9.532 11.602 1.00 0.00 C ATOM 241 O ASP A -1 -0.453 -8.769 12.178 1.00 0.00 O ATOM 242 CB ASP A -1 -0.607 -11.603 12.644 1.00 0.00 C ATOM 243 CG ASP A -1 -1.570 -11.881 11.501 1.00 0.00 C ATOM 244 OD1 ASP A -1 -1.433 -12.941 10.828 1.00 0.00 O ATOM 245 OD2 ASP A -1 -2.484 -11.070 11.253 1.00 0.00 O ATOM 0 H ASP A -1 1.237 -10.728 14.193 1.00 0.00 H new ATOM 0 HA ASP A -1 1.123 -11.505 11.404 1.00 0.00 H new ATOM 0 HB2 ASP A -1 -0.337 -12.544 13.124 1.00 0.00 H new ATOM 0 HB3 ASP A -1 -1.108 -10.993 13.396 1.00 0.00 H new ATOM 250 N LYS A 0 0.954 -9.209 10.505 1.00 0.00 N ATOM 251 CA LYS A 0 0.769 -7.910 9.895 1.00 0.00 C ATOM 252 C LYS A 0 0.293 -8.036 8.449 1.00 0.00 C ATOM 253 O LYS A 0 0.099 -7.033 7.765 1.00 0.00 O ATOM 254 CB LYS A 0 2.084 -7.132 9.960 1.00 0.00 C ATOM 255 CG LYS A 0 3.192 -7.724 9.105 1.00 0.00 C ATOM 256 CD LYS A 0 4.498 -6.995 9.313 1.00 0.00 C ATOM 257 CE LYS A 0 5.527 -7.404 8.278 1.00 0.00 C ATOM 258 NZ LYS A 0 5.118 -7.004 6.905 1.00 0.00 N ATOM 0 H LYS A 0 1.597 -9.825 10.008 1.00 0.00 H new ATOM 0 HA LYS A 0 -0.003 -7.372 10.446 1.00 0.00 H new ATOM 0 HB2 LYS A 0 1.903 -6.105 9.643 1.00 0.00 H new ATOM 0 HB3 LYS A 0 2.420 -7.091 10.996 1.00 0.00 H new ATOM 0 HG2 LYS A 0 3.319 -8.778 9.350 1.00 0.00 H new ATOM 0 HG3 LYS A 0 2.909 -7.673 8.054 1.00 0.00 H new ATOM 0 HD2 LYS A 0 4.330 -5.920 9.257 1.00 0.00 H new ATOM 0 HD3 LYS A 0 4.880 -7.206 10.312 1.00 0.00 H new ATOM 0 HE2 LYS A 0 6.487 -6.947 8.519 1.00 0.00 H new ATOM 0 HE3 LYS A 0 5.670 -8.484 8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 0 5.941 -7.049 6.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 0 4.380 -7.650 6.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 0 4.747 -6.033 6.922 1.00 0.00 H new ATOM 272 N GLY A 1 0.110 -9.262 7.999 1.00 0.00 N ATOM 273 CA GLY A 1 -0.335 -9.498 6.649 1.00 0.00 C ATOM 274 C GLY A 1 -1.755 -9.980 6.646 1.00 0.00 C ATOM 275 O GLY A 1 -2.020 -11.151 6.938 1.00 0.00 O ATOM 0 H GLY A 1 0.264 -10.106 8.551 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.254 -8.580 6.066 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.308 -10.237 6.171 1.00 0.00 H new ATOM 279 N ILE A 2 -2.660 -9.097 6.357 1.00 0.00 N ATOM 280 CA ILE A 2 -4.071 -9.385 6.377 1.00 0.00 C ATOM 281 C ILE A 2 -4.543 -9.695 4.972 1.00 0.00 C ATOM 282 O ILE A 2 -4.196 -9.002 4.030 1.00 0.00 O ATOM 283 CB ILE A 2 -4.859 -8.172 6.951 1.00 0.00 C ATOM 284 CG1 ILE A 2 -4.329 -7.831 8.355 1.00 0.00 C ATOM 285 CG2 ILE A 2 -6.366 -8.456 6.993 1.00 0.00 C ATOM 286 CD1 ILE A 2 -4.945 -6.598 8.970 1.00 0.00 C ATOM 0 H ILE A 2 -2.440 -8.136 6.095 1.00 0.00 H new ATOM 0 HA ILE A 2 -4.251 -10.249 7.016 1.00 0.00 H new ATOM 0 HB ILE A 2 -4.707 -7.316 6.293 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -4.509 -8.680 9.014 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -3.249 -7.694 8.299 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -6.888 -7.590 7.399 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -6.727 -8.657 5.984 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -6.555 -9.323 7.626 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -4.515 -6.431 9.958 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -4.743 -5.735 8.335 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.022 -6.737 9.062 1.00 0.00 H new ATOM 298 N HIS A 3 -5.290 -10.744 4.830 1.00 0.00 N ATOM 299 CA HIS A 3 -5.816 -11.112 3.547 1.00 0.00 C ATOM 300 C HIS A 3 -7.270 -10.709 3.467 1.00 0.00 C ATOM 301 O HIS A 3 -8.022 -10.842 4.440 1.00 0.00 O ATOM 302 CB HIS A 3 -5.658 -12.615 3.302 1.00 0.00 C ATOM 303 CG HIS A 3 -4.234 -13.087 3.301 1.00 0.00 C ATOM 304 ND1 HIS A 3 -3.646 -13.776 4.344 1.00 0.00 N ATOM 305 CD2 HIS A 3 -3.277 -12.957 2.356 1.00 0.00 C ATOM 306 CE1 HIS A 3 -2.384 -14.038 4.009 1.00 0.00 C ATOM 307 NE2 HIS A 3 -2.102 -13.560 2.804 1.00 0.00 N ATOM 0 H HIS A 3 -5.553 -11.368 5.593 1.00 0.00 H new ATOM 0 HA HIS A 3 -5.255 -10.590 2.771 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -6.209 -13.158 4.070 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -6.114 -12.866 2.344 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -3.402 -12.464 1.403 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -1.683 -14.569 4.635 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -1.212 -13.621 2.309 1.00 0.00 H new ATOM 315 N SER A 4 -7.642 -10.173 2.357 1.00 0.00 N ATOM 316 CA SER A 4 -8.994 -9.762 2.075 1.00 0.00 C ATOM 317 C SER A 4 -9.195 -9.804 0.588 1.00 0.00 C ATOM 318 O SER A 4 -8.386 -10.365 -0.098 1.00 0.00 O ATOM 319 CB SER A 4 -9.255 -8.359 2.621 1.00 0.00 C ATOM 320 OG SER A 4 -9.378 -8.367 4.033 1.00 0.00 O ATOM 0 H SER A 4 -6.998 -9.998 1.586 1.00 0.00 H new ATOM 0 HA SER A 4 -9.699 -10.435 2.562 1.00 0.00 H new ATOM 0 HB2 SER A 4 -8.440 -7.696 2.329 1.00 0.00 H new ATOM 0 HB3 SER A 4 -10.166 -7.958 2.177 1.00 0.00 H new ATOM 0 HG SER A 4 -9.029 -9.212 4.387 1.00 0.00 H new ATOM 326 N SER A 5 -10.231 -9.211 0.096 1.00 0.00 N ATOM 327 CA SER A 5 -10.498 -9.221 -1.303 1.00 0.00 C ATOM 328 C SER A 5 -11.104 -7.905 -1.700 1.00 0.00 C ATOM 329 O SER A 5 -11.678 -7.198 -0.852 1.00 0.00 O ATOM 330 CB SER A 5 -11.423 -10.397 -1.662 1.00 0.00 C ATOM 331 OG SER A 5 -12.600 -10.396 -0.856 1.00 0.00 O ATOM 0 H SER A 5 -10.918 -8.704 0.654 1.00 0.00 H new ATOM 0 HA SER A 5 -9.568 -9.356 -1.855 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.700 -10.336 -2.714 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.888 -11.337 -1.527 1.00 0.00 H new ATOM 0 HG SER A 5 -12.915 -11.316 -0.737 1.00 0.00 H new ATOM 337 N VAL A 6 -10.942 -7.554 -2.943 1.00 0.00 N ATOM 338 CA VAL A 6 -11.515 -6.344 -3.469 1.00 0.00 C ATOM 339 C VAL A 6 -12.977 -6.581 -3.724 1.00 0.00 C ATOM 340 O VAL A 6 -13.343 -7.500 -4.446 1.00 0.00 O ATOM 341 CB VAL A 6 -10.845 -5.917 -4.792 1.00 0.00 C ATOM 342 CG1 VAL A 6 -11.406 -4.596 -5.284 1.00 0.00 C ATOM 343 CG2 VAL A 6 -9.359 -5.820 -4.617 1.00 0.00 C ATOM 0 H VAL A 6 -10.409 -8.097 -3.622 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.360 -5.548 -2.740 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.061 -6.678 -5.542 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.917 -4.318 -6.218 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.478 -4.696 -5.452 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -11.226 -3.823 -4.536 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -8.901 -5.518 -5.559 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -9.131 -5.081 -3.849 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.964 -6.790 -4.316 1.00 0.00 H new ATOM 353 N LYS A 7 -13.795 -5.804 -3.121 1.00 0.00 N ATOM 354 CA LYS A 7 -15.200 -5.922 -3.296 1.00 0.00 C ATOM 355 C LYS A 7 -15.725 -4.675 -4.005 1.00 0.00 C ATOM 356 O LYS A 7 -14.999 -3.689 -4.143 1.00 0.00 O ATOM 357 CB LYS A 7 -15.886 -6.200 -1.955 1.00 0.00 C ATOM 358 CG LYS A 7 -15.664 -7.601 -1.394 1.00 0.00 C ATOM 359 CD LYS A 7 -16.399 -8.610 -2.245 1.00 0.00 C ATOM 360 CE LYS A 7 -16.555 -9.959 -1.548 1.00 0.00 C ATOM 361 NZ LYS A 7 -15.303 -10.737 -1.484 1.00 0.00 N ATOM 0 H LYS A 7 -13.510 -5.059 -2.485 1.00 0.00 H new ATOM 0 HA LYS A 7 -15.435 -6.776 -3.932 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -15.531 -5.472 -1.225 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -16.957 -6.038 -2.072 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.599 -7.832 -1.376 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -16.018 -7.652 -0.364 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -17.385 -8.219 -2.497 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.862 -8.749 -3.183 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -16.924 -9.795 -0.535 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -17.311 -10.544 -2.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.440 -11.566 -0.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.042 -11.053 -2.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -14.544 -10.141 -1.097 1.00 0.00 H new ATOM 375 N ARG A 8 -16.943 -4.721 -4.464 1.00 0.00 N ATOM 376 CA ARG A 8 -17.487 -3.646 -5.272 1.00 0.00 C ATOM 377 C ARG A 8 -18.441 -2.758 -4.485 1.00 0.00 C ATOM 378 O ARG A 8 -19.503 -3.211 -4.021 1.00 0.00 O ATOM 379 CB ARG A 8 -18.185 -4.210 -6.490 1.00 0.00 C ATOM 380 CG ARG A 8 -18.475 -3.162 -7.539 1.00 0.00 C ATOM 381 CD ARG A 8 -19.213 -3.759 -8.694 1.00 0.00 C ATOM 382 NE ARG A 8 -18.428 -4.792 -9.399 1.00 0.00 N ATOM 383 CZ ARG A 8 -18.515 -5.079 -10.715 1.00 0.00 C ATOM 384 NH1 ARG A 8 -19.347 -4.396 -11.501 1.00 0.00 N ATOM 385 NH2 ARG A 8 -17.767 -6.056 -11.233 1.00 0.00 N ATOM 0 H ARG A 8 -17.588 -5.493 -4.296 1.00 0.00 H new ATOM 0 HA ARG A 8 -16.650 -3.023 -5.588 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -17.566 -4.993 -6.927 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -19.120 -4.678 -6.183 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -19.065 -2.356 -7.102 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -17.541 -2.721 -7.887 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -20.145 -4.197 -8.337 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -19.481 -2.969 -9.396 1.00 0.00 H new ATOM 0 HE ARG A 8 -17.765 -5.334 -8.845 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -19.923 -3.651 -11.109 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -19.408 -4.618 -12.495 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -17.132 -6.584 -10.635 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -17.831 -6.275 -12.227 1.00 0.00 H new ATOM 399 N TRP A 9 -18.064 -1.516 -4.344 1.00 0.00 N ATOM 400 CA TRP A 9 -18.834 -0.508 -3.644 1.00 0.00 C ATOM 401 C TRP A 9 -19.439 0.382 -4.724 1.00 0.00 C ATOM 402 O TRP A 9 -18.758 1.237 -5.303 1.00 0.00 O ATOM 403 CB TRP A 9 -17.882 0.286 -2.718 1.00 0.00 C ATOM 404 CG TRP A 9 -18.514 1.086 -1.612 1.00 0.00 C ATOM 405 CD1 TRP A 9 -19.832 1.134 -1.268 1.00 0.00 C ATOM 406 CD2 TRP A 9 -17.836 1.938 -0.657 1.00 0.00 C ATOM 407 NE1 TRP A 9 -20.000 1.921 -0.182 1.00 0.00 N ATOM 408 CE2 TRP A 9 -18.824 2.438 0.200 1.00 0.00 C ATOM 409 CE3 TRP A 9 -16.499 2.335 -0.427 1.00 0.00 C ATOM 410 CZ2 TRP A 9 -18.546 3.288 1.236 1.00 0.00 C ATOM 411 CZ3 TRP A 9 -16.248 3.172 0.610 1.00 0.00 C ATOM 412 CH2 TRP A 9 -17.269 3.639 1.423 1.00 0.00 C ATOM 0 H TRP A 9 -17.186 -1.161 -4.723 1.00 0.00 H new ATOM 0 HA TRP A 9 -19.622 -0.930 -3.021 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -17.181 -0.418 -2.269 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -17.297 0.967 -3.337 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -20.626 0.618 -1.787 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -20.892 2.096 0.280 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -15.699 1.981 -1.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -19.329 3.662 1.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -15.232 3.481 0.806 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -17.025 4.309 2.235 1.00 0.00 H new ATOM 423 N GLY A 10 -20.683 0.111 -5.060 1.00 0.00 N ATOM 424 CA GLY A 10 -21.305 0.782 -6.158 1.00 0.00 C ATOM 425 C GLY A 10 -20.755 0.205 -7.426 1.00 0.00 C ATOM 426 O GLY A 10 -20.708 -1.012 -7.574 1.00 0.00 O ATOM 0 H GLY A 10 -21.274 -0.570 -4.583 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -22.387 0.654 -6.119 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -21.109 1.853 -6.110 1.00 0.00 H new ATOM 430 N ASN A 11 -20.323 1.037 -8.318 1.00 0.00 N ATOM 431 CA ASN A 11 -19.638 0.568 -9.518 1.00 0.00 C ATOM 432 C ASN A 11 -18.111 0.667 -9.359 1.00 0.00 C ATOM 433 O ASN A 11 -17.363 0.581 -10.344 1.00 0.00 O ATOM 434 CB ASN A 11 -20.065 1.359 -10.782 1.00 0.00 C ATOM 435 CG ASN A 11 -19.845 2.880 -10.696 1.00 0.00 C ATOM 436 OD1 ASN A 11 -19.042 3.386 -9.899 1.00 0.00 O ATOM 437 ND2 ASN A 11 -20.513 3.609 -11.549 1.00 0.00 N ATOM 0 H ASN A 11 -20.424 2.050 -8.254 1.00 0.00 H new ATOM 0 HA ASN A 11 -19.927 -0.475 -9.647 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -19.512 0.974 -11.639 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -21.121 1.169 -10.973 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -20.380 4.620 -11.570 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -21.168 3.167 -12.194 1.00 0.00 H new ATOM 444 N SER A 12 -17.629 0.789 -8.137 1.00 0.00 N ATOM 445 CA SER A 12 -16.257 1.048 -7.921 1.00 0.00 C ATOM 446 C SER A 12 -15.661 0.032 -6.932 1.00 0.00 C ATOM 447 O SER A 12 -16.279 -0.304 -5.936 1.00 0.00 O ATOM 448 CB SER A 12 -16.110 2.454 -7.366 1.00 0.00 C ATOM 449 OG SER A 12 -16.754 3.433 -8.184 1.00 0.00 O ATOM 0 H SER A 12 -18.188 0.709 -7.287 1.00 0.00 H new ATOM 0 HA SER A 12 -15.720 0.958 -8.865 1.00 0.00 H new ATOM 0 HB2 SER A 12 -16.531 2.491 -6.361 1.00 0.00 H new ATOM 0 HB3 SER A 12 -15.051 2.698 -7.278 1.00 0.00 H new ATOM 0 HG SER A 12 -17.609 3.079 -8.505 1.00 0.00 H new ATOM 455 N PRO A 13 -14.503 -0.497 -7.241 1.00 0.00 N ATOM 456 CA PRO A 13 -13.782 -1.412 -6.358 1.00 0.00 C ATOM 457 C PRO A 13 -13.261 -0.715 -5.086 1.00 0.00 C ATOM 458 O PRO A 13 -12.707 0.403 -5.140 1.00 0.00 O ATOM 459 CB PRO A 13 -12.609 -1.895 -7.212 1.00 0.00 C ATOM 460 CG PRO A 13 -12.486 -0.921 -8.329 1.00 0.00 C ATOM 461 CD PRO A 13 -13.820 -0.280 -8.504 1.00 0.00 C ATOM 0 HA PRO A 13 -14.427 -2.216 -6.003 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -11.691 -1.935 -6.626 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -12.790 -2.901 -7.590 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -11.726 -0.173 -8.105 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -12.178 -1.424 -9.246 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -13.722 0.783 -8.724 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -14.369 -0.728 -9.333 1.00 0.00 H new ATOM 469 N ALA A 14 -13.453 -1.348 -3.953 1.00 0.00 N ATOM 470 CA ALA A 14 -12.978 -0.825 -2.714 1.00 0.00 C ATOM 471 C ALA A 14 -12.381 -1.942 -1.878 1.00 0.00 C ATOM 472 O ALA A 14 -12.855 -3.093 -1.914 1.00 0.00 O ATOM 473 CB ALA A 14 -14.099 -0.123 -1.963 1.00 0.00 C ATOM 0 H ALA A 14 -13.944 -2.239 -3.874 1.00 0.00 H new ATOM 0 HA ALA A 14 -12.201 -0.088 -2.916 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -13.716 0.269 -1.021 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -14.484 0.698 -2.568 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -14.902 -0.832 -1.762 1.00 0.00 H new ATOM 479 N VAL A 15 -11.334 -1.622 -1.172 1.00 0.00 N ATOM 480 CA VAL A 15 -10.689 -2.559 -0.292 1.00 0.00 C ATOM 481 C VAL A 15 -11.104 -2.229 1.125 1.00 0.00 C ATOM 482 O VAL A 15 -11.090 -1.061 1.526 1.00 0.00 O ATOM 483 CB VAL A 15 -9.131 -2.537 -0.437 1.00 0.00 C ATOM 484 CG1 VAL A 15 -8.462 -3.453 0.590 1.00 0.00 C ATOM 485 CG2 VAL A 15 -8.727 -2.975 -1.836 1.00 0.00 C ATOM 0 H VAL A 15 -10.900 -0.699 -1.190 1.00 0.00 H new ATOM 0 HA VAL A 15 -11.001 -3.569 -0.557 1.00 0.00 H new ATOM 0 HB VAL A 15 -8.799 -1.514 -0.260 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.380 -3.414 0.462 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.720 -3.122 1.596 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.808 -4.476 0.445 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.641 -2.955 -1.924 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.088 -3.987 -2.019 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -9.163 -2.297 -2.570 1.00 0.00 H new ATOM 495 N ARG A 16 -11.509 -3.239 1.851 1.00 0.00 N ATOM 496 CA ARG A 16 -11.974 -3.079 3.198 1.00 0.00 C ATOM 497 C ARG A 16 -10.777 -3.085 4.155 1.00 0.00 C ATOM 498 O ARG A 16 -9.915 -3.969 4.070 1.00 0.00 O ATOM 499 CB ARG A 16 -12.879 -4.244 3.529 1.00 0.00 C ATOM 500 CG ARG A 16 -13.667 -4.057 4.790 1.00 0.00 C ATOM 501 CD ARG A 16 -14.451 -5.304 5.136 1.00 0.00 C ATOM 502 NE ARG A 16 -15.250 -5.113 6.349 1.00 0.00 N ATOM 503 CZ ARG A 16 -15.319 -5.958 7.393 1.00 0.00 C ATOM 504 NH1 ARG A 16 -14.720 -7.148 7.344 1.00 0.00 N ATOM 505 NH2 ARG A 16 -16.016 -5.615 8.473 1.00 0.00 N ATOM 0 H ARG A 16 -11.524 -4.203 1.518 1.00 0.00 H new ATOM 0 HA ARG A 16 -12.513 -2.137 3.300 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.569 -4.403 2.700 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -12.275 -5.147 3.619 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -12.993 -3.809 5.610 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -14.350 -3.216 4.674 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -15.105 -5.567 4.305 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.765 -6.139 5.278 1.00 0.00 H new ATOM 0 HE ARG A 16 -15.806 -4.260 6.407 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -14.203 -7.425 6.509 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -14.778 -7.782 8.141 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -16.495 -4.715 8.506 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -16.072 -6.252 9.268 1.00 0.00 H new ATOM 519 N ILE A 17 -10.724 -2.126 5.033 1.00 0.00 N ATOM 520 CA ILE A 17 -9.661 -2.011 6.015 1.00 0.00 C ATOM 521 C ILE A 17 -10.221 -2.264 7.426 1.00 0.00 C ATOM 522 O ILE A 17 -11.296 -1.772 7.763 1.00 0.00 O ATOM 523 CB ILE A 17 -8.931 -0.601 5.943 1.00 0.00 C ATOM 524 CG1 ILE A 17 -7.976 -0.499 4.761 1.00 0.00 C ATOM 525 CG2 ILE A 17 -8.187 -0.240 7.197 1.00 0.00 C ATOM 526 CD1 ILE A 17 -8.625 -0.316 3.447 1.00 0.00 C ATOM 0 H ILE A 17 -11.423 -1.386 5.096 1.00 0.00 H new ATOM 0 HA ILE A 17 -8.912 -2.768 5.785 1.00 0.00 H new ATOM 0 HB ILE A 17 -9.746 0.112 5.815 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -7.297 0.336 4.933 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -7.368 -1.403 4.726 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.715 0.735 7.072 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.883 -0.202 8.035 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.422 -0.991 7.395 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -7.863 -0.254 2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -9.282 -1.162 3.245 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.210 0.604 3.455 1.00 0.00 H new ATOM 538 N PRO A 18 -9.528 -3.071 8.256 1.00 0.00 N ATOM 539 CA PRO A 18 -9.960 -3.320 9.621 1.00 0.00 C ATOM 540 C PRO A 18 -9.834 -2.066 10.481 1.00 0.00 C ATOM 541 O PRO A 18 -8.813 -1.347 10.420 1.00 0.00 O ATOM 542 CB PRO A 18 -9.004 -4.395 10.157 1.00 0.00 C ATOM 543 CG PRO A 18 -8.146 -4.812 9.008 1.00 0.00 C ATOM 544 CD PRO A 18 -8.294 -3.791 7.918 1.00 0.00 C ATOM 0 HA PRO A 18 -11.006 -3.626 9.649 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -8.396 -4.002 10.972 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -9.559 -5.244 10.555 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -7.104 -4.888 9.319 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.444 -5.797 8.649 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -7.437 -3.118 7.886 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -8.365 -4.263 6.938 1.00 0.00 H new ATOM 552 N ALA A 19 -10.842 -1.824 11.311 1.00 0.00 N ATOM 553 CA ALA A 19 -10.873 -0.668 12.209 1.00 0.00 C ATOM 554 C ALA A 19 -9.677 -0.680 13.160 1.00 0.00 C ATOM 555 O ALA A 19 -9.227 0.356 13.623 1.00 0.00 O ATOM 556 CB ALA A 19 -12.172 -0.646 12.994 1.00 0.00 C ATOM 0 H ALA A 19 -11.664 -2.423 11.383 1.00 0.00 H new ATOM 0 HA ALA A 19 -10.813 0.235 11.602 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -12.181 0.219 13.658 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -13.013 -0.583 12.304 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -12.255 -1.558 13.585 1.00 0.00 H new ATOM 562 N THR A 20 -9.161 -1.863 13.420 1.00 0.00 N ATOM 563 CA THR A 20 -8.009 -2.061 14.260 1.00 0.00 C ATOM 564 C THR A 20 -6.785 -1.309 13.701 1.00 0.00 C ATOM 565 O THR A 20 -6.036 -0.692 14.445 1.00 0.00 O ATOM 566 CB THR A 20 -7.706 -3.551 14.300 1.00 0.00 C ATOM 567 OG1 THR A 20 -8.965 -4.248 14.311 1.00 0.00 O ATOM 568 CG2 THR A 20 -6.929 -3.901 15.558 1.00 0.00 C ATOM 0 H THR A 20 -9.543 -2.730 13.042 1.00 0.00 H new ATOM 0 HA THR A 20 -8.218 -1.677 15.258 1.00 0.00 H new ATOM 0 HB THR A 20 -7.105 -3.834 13.436 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.804 -5.214 14.335 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.720 -4.971 15.571 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.990 -3.348 15.571 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.519 -3.636 16.435 1.00 0.00 H new ATOM 576 N LEU A 21 -6.627 -1.332 12.382 1.00 0.00 N ATOM 577 CA LEU A 21 -5.493 -0.669 11.728 1.00 0.00 C ATOM 578 C LEU A 21 -5.708 0.794 11.662 1.00 0.00 C ATOM 579 O LEU A 21 -4.777 1.574 11.773 1.00 0.00 O ATOM 580 CB LEU A 21 -5.242 -1.239 10.346 1.00 0.00 C ATOM 581 CG LEU A 21 -4.390 -2.494 10.285 1.00 0.00 C ATOM 582 CD1 LEU A 21 -2.937 -2.160 10.606 1.00 0.00 C ATOM 583 CD2 LEU A 21 -4.890 -3.551 11.250 1.00 0.00 C ATOM 0 H LEU A 21 -7.267 -1.801 11.741 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.605 -0.859 12.331 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.205 -1.456 9.884 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.764 -0.470 9.740 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.460 -2.892 9.273 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.336 -3.068 10.559 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.561 -1.438 9.881 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.874 -1.735 11.608 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.257 -4.436 11.180 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.857 -3.160 12.267 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.916 -3.818 10.998 1.00 0.00 H new ATOM 595 N MET A 22 -6.934 1.147 11.488 1.00 0.00 N ATOM 596 CA MET A 22 -7.361 2.546 11.523 1.00 0.00 C ATOM 597 C MET A 22 -6.947 3.171 12.832 1.00 0.00 C ATOM 598 O MET A 22 -6.373 4.252 12.872 1.00 0.00 O ATOM 599 CB MET A 22 -8.862 2.627 11.364 1.00 0.00 C ATOM 600 CG MET A 22 -9.369 2.160 10.023 1.00 0.00 C ATOM 601 SD MET A 22 -9.028 3.308 8.707 1.00 0.00 S ATOM 602 CE MET A 22 -10.017 4.683 9.274 1.00 0.00 C ATOM 0 H MET A 22 -7.691 0.486 11.315 1.00 0.00 H new ATOM 0 HA MET A 22 -6.888 3.087 10.704 1.00 0.00 H new ATOM 0 HB2 MET A 22 -9.331 2.029 12.145 1.00 0.00 H new ATOM 0 HB3 MET A 22 -9.177 3.659 11.519 1.00 0.00 H new ATOM 0 HG2 MET A 22 -8.914 1.198 9.785 1.00 0.00 H new ATOM 0 HG3 MET A 22 -10.445 1.997 10.085 1.00 0.00 H new ATOM 0 HE1 MET A 22 -10.074 5.438 8.490 1.00 0.00 H new ATOM 0 HE2 MET A 22 -11.021 4.334 9.515 1.00 0.00 H new ATOM 0 HE3 MET A 22 -9.561 5.117 10.164 1.00 0.00 H new ATOM 612 N GLN A 23 -7.233 2.466 13.883 1.00 0.00 N ATOM 613 CA GLN A 23 -6.823 2.841 15.221 1.00 0.00 C ATOM 614 C GLN A 23 -5.310 2.792 15.385 1.00 0.00 C ATOM 615 O GLN A 23 -4.730 3.600 16.106 1.00 0.00 O ATOM 616 CB GLN A 23 -7.443 1.918 16.239 1.00 0.00 C ATOM 617 CG GLN A 23 -8.937 1.993 16.283 1.00 0.00 C ATOM 618 CD GLN A 23 -9.535 1.102 17.345 1.00 0.00 C ATOM 619 OE1 GLN A 23 -9.725 1.511 18.483 1.00 0.00 O ATOM 620 NE2 GLN A 23 -9.849 -0.112 16.986 1.00 0.00 N ATOM 0 H GLN A 23 -7.766 1.597 13.845 1.00 0.00 H new ATOM 0 HA GLN A 23 -7.162 3.865 15.380 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -7.145 0.893 16.017 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -7.046 2.159 17.225 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -9.239 3.024 16.467 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -9.339 1.712 15.310 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -9.677 -0.421 16.029 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.266 -0.752 17.662 1.00 0.00 H new ATOM 629 N ALA A 24 -4.677 1.856 14.709 1.00 0.00 N ATOM 630 CA ALA A 24 -3.224 1.663 14.856 1.00 0.00 C ATOM 631 C ALA A 24 -2.445 2.801 14.210 1.00 0.00 C ATOM 632 O ALA A 24 -1.450 3.290 14.749 1.00 0.00 O ATOM 633 CB ALA A 24 -2.793 0.321 14.273 1.00 0.00 C ATOM 0 H ALA A 24 -5.128 1.216 14.055 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.998 1.665 15.922 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -1.716 0.201 14.393 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.308 -0.485 14.795 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.046 0.287 13.213 1.00 0.00 H new ATOM 639 N LEU A 25 -2.931 3.237 13.086 1.00 0.00 N ATOM 640 CA LEU A 25 -2.293 4.288 12.319 1.00 0.00 C ATOM 641 C LEU A 25 -2.871 5.651 12.674 1.00 0.00 C ATOM 642 O LEU A 25 -2.384 6.687 12.224 1.00 0.00 O ATOM 643 CB LEU A 25 -2.479 3.998 10.850 1.00 0.00 C ATOM 644 CG LEU A 25 -1.835 2.708 10.362 1.00 0.00 C ATOM 645 CD1 LEU A 25 -2.319 2.398 8.982 1.00 0.00 C ATOM 646 CD2 LEU A 25 -0.320 2.837 10.362 1.00 0.00 C ATOM 0 H LEU A 25 -3.787 2.877 12.665 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.230 4.313 12.557 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.547 3.957 10.636 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.070 4.830 10.276 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.114 1.898 11.036 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.857 1.474 8.633 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.403 2.280 8.994 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.051 3.214 8.311 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.124 1.906 10.010 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.024 3.652 9.702 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.027 3.045 11.374 1.00 0.00 H new ATOM 658 N ASN A 26 -3.919 5.618 13.475 1.00 0.00 N ATOM 659 CA ASN A 26 -4.622 6.795 13.977 1.00 0.00 C ATOM 660 C ASN A 26 -5.237 7.648 12.859 1.00 0.00 C ATOM 661 O ASN A 26 -4.737 8.724 12.508 1.00 0.00 O ATOM 662 CB ASN A 26 -3.760 7.618 14.979 1.00 0.00 C ATOM 663 CG ASN A 26 -4.487 8.825 15.567 1.00 0.00 C ATOM 664 OD1 ASN A 26 -5.217 8.706 16.548 1.00 0.00 O ATOM 665 ND2 ASN A 26 -4.237 9.996 15.027 1.00 0.00 N ATOM 0 H ASN A 26 -4.322 4.743 13.809 1.00 0.00 H new ATOM 0 HA ASN A 26 -5.471 6.423 14.551 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.442 6.965 15.792 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -2.857 7.960 14.473 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -4.653 10.839 15.422 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.626 10.062 14.213 1.00 0.00 H new ATOM 672 N LEU A 27 -6.211 7.070 12.195 1.00 0.00 N ATOM 673 CA LEU A 27 -7.027 7.742 11.258 1.00 0.00 C ATOM 674 C LEU A 27 -8.480 7.358 11.500 1.00 0.00 C ATOM 675 O LEU A 27 -8.756 6.360 12.194 1.00 0.00 O ATOM 676 CB LEU A 27 -6.635 7.426 9.837 1.00 0.00 C ATOM 677 CG LEU A 27 -6.687 5.977 9.387 1.00 0.00 C ATOM 678 CD1 LEU A 27 -6.910 5.949 7.913 1.00 0.00 C ATOM 679 CD2 LEU A 27 -5.391 5.268 9.700 1.00 0.00 C ATOM 0 H LEU A 27 -6.451 6.085 12.309 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.893 8.815 11.396 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.281 8.004 9.176 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.618 7.787 9.683 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.495 5.470 9.914 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -6.950 4.915 7.571 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -7.851 6.446 7.678 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -6.092 6.466 7.411 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.454 4.232 9.368 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.570 5.766 9.183 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -5.212 5.294 10.775 1.00 0.00 H new ATOM 691 N ASN A 28 -9.397 8.113 10.940 1.00 0.00 N ATOM 692 CA ASN A 28 -10.822 7.849 11.072 1.00 0.00 C ATOM 693 C ASN A 28 -11.473 7.992 9.704 1.00 0.00 C ATOM 694 O ASN A 28 -10.775 8.073 8.683 1.00 0.00 O ATOM 695 CB ASN A 28 -11.496 8.812 12.083 1.00 0.00 C ATOM 696 CG ASN A 28 -11.025 8.638 13.524 1.00 0.00 C ATOM 697 OD1 ASN A 28 -11.559 7.814 14.275 1.00 0.00 O ATOM 698 ND2 ASN A 28 -10.066 9.421 13.934 1.00 0.00 N ATOM 0 H ASN A 28 -9.180 8.934 10.375 1.00 0.00 H new ATOM 0 HA ASN A 28 -10.954 6.836 11.453 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -11.305 9.839 11.772 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -12.575 8.663 12.045 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -9.737 9.363 14.898 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -9.645 10.091 13.291 1.00 0.00 H new ATOM 705 N ILE A 29 -12.788 7.991 9.661 1.00 0.00 N ATOM 706 CA ILE A 29 -13.495 8.152 8.407 1.00 0.00 C ATOM 707 C ILE A 29 -13.343 9.599 7.930 1.00 0.00 C ATOM 708 O ILE A 29 -13.378 10.534 8.747 1.00 0.00 O ATOM 709 CB ILE A 29 -15.007 7.763 8.539 1.00 0.00 C ATOM 710 CG1 ILE A 29 -15.156 6.303 9.017 1.00 0.00 C ATOM 711 CG2 ILE A 29 -15.764 7.964 7.223 1.00 0.00 C ATOM 712 CD1 ILE A 29 -14.543 5.268 8.094 1.00 0.00 C ATOM 0 H ILE A 29 -13.389 7.881 10.478 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.059 7.477 7.671 1.00 0.00 H new ATOM 0 HB ILE A 29 -15.446 8.428 9.283 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -14.698 6.209 10.001 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -16.216 6.081 9.137 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -16.808 7.683 7.357 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -15.705 9.011 6.926 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -15.318 7.341 6.448 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.696 4.273 8.511 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -15.017 5.328 7.114 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -13.475 5.458 7.993 1.00 0.00 H new ATOM 724 N ASP A 30 -13.124 9.747 6.632 1.00 0.00 N ATOM 725 CA ASP A 30 -12.924 11.019 5.929 1.00 0.00 C ATOM 726 C ASP A 30 -11.531 11.543 5.983 1.00 0.00 C ATOM 727 O ASP A 30 -11.268 12.647 5.516 1.00 0.00 O ATOM 728 CB ASP A 30 -13.965 12.110 6.213 1.00 0.00 C ATOM 729 CG ASP A 30 -15.162 11.988 5.313 1.00 0.00 C ATOM 730 OD1 ASP A 30 -15.038 12.284 4.105 1.00 0.00 O ATOM 731 OD2 ASP A 30 -16.247 11.589 5.779 1.00 0.00 O ATOM 0 H ASP A 30 -13.077 8.946 6.002 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.102 10.730 4.893 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.284 12.045 7.253 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.509 13.091 6.080 1.00 0.00 H new ATOM 736 N ASP A 31 -10.615 10.750 6.499 1.00 0.00 N ATOM 737 CA ASP A 31 -9.226 11.117 6.456 1.00 0.00 C ATOM 738 C ASP A 31 -8.714 10.863 5.080 1.00 0.00 C ATOM 739 O ASP A 31 -8.910 9.766 4.524 1.00 0.00 O ATOM 740 CB ASP A 31 -8.359 10.371 7.490 1.00 0.00 C ATOM 741 CG ASP A 31 -8.453 10.948 8.881 1.00 0.00 C ATOM 742 OD1 ASP A 31 -7.666 11.854 9.215 1.00 0.00 O ATOM 743 OD2 ASP A 31 -9.316 10.523 9.661 1.00 0.00 O ATOM 0 H ASP A 31 -10.811 9.855 6.948 1.00 0.00 H new ATOM 0 HA ASP A 31 -9.156 12.173 6.715 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.661 9.324 7.518 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -7.319 10.394 7.165 1.00 0.00 H new ATOM 748 N GLU A 32 -8.160 11.883 4.504 1.00 0.00 N ATOM 749 CA GLU A 32 -7.578 11.820 3.215 1.00 0.00 C ATOM 750 C GLU A 32 -6.343 10.934 3.260 1.00 0.00 C ATOM 751 O GLU A 32 -5.568 10.976 4.226 1.00 0.00 O ATOM 752 CB GLU A 32 -7.265 13.241 2.714 1.00 0.00 C ATOM 753 CG GLU A 32 -6.507 13.294 1.405 1.00 0.00 C ATOM 754 CD GLU A 32 -6.309 14.697 0.902 1.00 0.00 C ATOM 755 OE1 GLU A 32 -5.313 15.351 1.270 1.00 0.00 O ATOM 756 OE2 GLU A 32 -7.160 15.185 0.134 1.00 0.00 O ATOM 0 H GLU A 32 -8.102 12.805 4.936 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.276 11.375 2.506 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -8.202 13.786 2.599 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.685 13.761 3.476 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -5.535 12.819 1.534 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -7.047 12.717 0.654 1.00 0.00 H new ATOM 763 N VAL A 33 -6.195 10.093 2.263 1.00 0.00 N ATOM 764 CA VAL A 33 -5.088 9.190 2.223 1.00 0.00 C ATOM 765 C VAL A 33 -4.374 9.279 0.900 1.00 0.00 C ATOM 766 O VAL A 33 -4.963 9.668 -0.128 1.00 0.00 O ATOM 767 CB VAL A 33 -5.477 7.697 2.521 1.00 0.00 C ATOM 768 CG1 VAL A 33 -6.339 7.606 3.727 1.00 0.00 C ATOM 769 CG2 VAL A 33 -6.174 7.031 1.366 1.00 0.00 C ATOM 0 H VAL A 33 -6.834 10.022 1.471 1.00 0.00 H new ATOM 0 HA VAL A 33 -4.422 9.505 3.026 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.538 7.171 2.692 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -6.595 6.563 3.913 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -5.804 8.007 4.588 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -7.251 8.181 3.566 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -6.417 6.002 1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -7.091 7.572 1.133 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.519 7.035 0.495 1.00 0.00 H new ATOM 779 N LYS A 34 -3.124 8.965 0.946 1.00 0.00 N ATOM 780 CA LYS A 34 -2.284 8.900 -0.217 1.00 0.00 C ATOM 781 C LYS A 34 -2.191 7.483 -0.733 1.00 0.00 C ATOM 782 O LYS A 34 -1.658 6.604 -0.050 1.00 0.00 O ATOM 783 CB LYS A 34 -0.885 9.394 0.117 1.00 0.00 C ATOM 784 CG LYS A 34 -0.716 10.900 0.109 1.00 0.00 C ATOM 785 CD LYS A 34 0.630 11.323 0.705 1.00 0.00 C ATOM 786 CE LYS A 34 1.817 10.511 0.170 1.00 0.00 C ATOM 787 NZ LYS A 34 2.002 10.610 -1.307 1.00 0.00 N ATOM 0 H LYS A 34 -2.638 8.739 1.814 1.00 0.00 H new ATOM 0 HA LYS A 34 -2.727 9.534 -0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -0.609 9.018 1.102 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.184 8.961 -0.597 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -0.793 11.269 -0.914 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.525 11.360 0.676 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.797 12.379 0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.587 11.219 1.789 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.728 10.850 0.664 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.679 9.464 0.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.077 9.655 -1.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 1.187 11.101 -1.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.871 11.143 -1.513 1.00 0.00 H new ATOM 801 N ILE A 35 -2.738 7.258 -1.897 1.00 0.00 N ATOM 802 CA ILE A 35 -2.588 6.001 -2.578 1.00 0.00 C ATOM 803 C ILE A 35 -1.467 6.209 -3.581 1.00 0.00 C ATOM 804 O ILE A 35 -1.678 6.795 -4.644 1.00 0.00 O ATOM 805 CB ILE A 35 -3.883 5.522 -3.353 1.00 0.00 C ATOM 806 CG1 ILE A 35 -5.121 5.364 -2.448 1.00 0.00 C ATOM 807 CG2 ILE A 35 -3.626 4.215 -4.075 1.00 0.00 C ATOM 808 CD1 ILE A 35 -5.804 6.649 -2.057 1.00 0.00 C ATOM 0 H ILE A 35 -3.301 7.943 -2.401 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.387 5.226 -1.839 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.103 6.313 -4.070 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -5.845 4.729 -2.959 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.822 4.840 -1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.530 3.906 -4.600 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.817 4.349 -4.793 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.346 3.449 -3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.661 6.427 -1.421 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.103 7.282 -1.513 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.142 7.169 -2.953 1.00 0.00 H new ATOM 820 N ASP A 36 -0.285 5.811 -3.221 1.00 0.00 N ATOM 821 CA ASP A 36 0.884 6.049 -4.062 1.00 0.00 C ATOM 822 C ASP A 36 1.319 4.714 -4.627 1.00 0.00 C ATOM 823 O ASP A 36 1.402 3.739 -3.887 1.00 0.00 O ATOM 824 CB ASP A 36 2.022 6.641 -3.202 1.00 0.00 C ATOM 825 CG ASP A 36 2.801 7.763 -3.875 1.00 0.00 C ATOM 826 OD1 ASP A 36 3.650 7.492 -4.745 1.00 0.00 O ATOM 827 OD2 ASP A 36 2.618 8.944 -3.490 1.00 0.00 O ATOM 0 H ASP A 36 -0.088 5.317 -2.351 1.00 0.00 H new ATOM 0 HA ASP A 36 0.648 6.748 -4.864 1.00 0.00 H new ATOM 0 HB2 ASP A 36 1.599 7.017 -2.270 1.00 0.00 H new ATOM 0 HB3 ASP A 36 2.715 5.842 -2.938 1.00 0.00 H new ATOM 832 N LEU A 37 1.541 4.630 -5.910 1.00 0.00 N ATOM 833 CA LEU A 37 1.985 3.448 -6.500 1.00 0.00 C ATOM 834 C LEU A 37 3.488 3.452 -6.377 1.00 0.00 C ATOM 835 O LEU A 37 4.160 4.398 -6.787 1.00 0.00 O ATOM 836 CB LEU A 37 1.542 3.424 -7.967 1.00 0.00 C ATOM 837 CG LEU A 37 1.617 2.095 -8.728 1.00 0.00 C ATOM 838 CD1 LEU A 37 3.021 1.609 -8.865 1.00 0.00 C ATOM 839 CD2 LEU A 37 0.735 1.061 -8.089 1.00 0.00 C ATOM 0 H LEU A 37 1.410 5.403 -6.562 1.00 0.00 H new ATOM 0 HA LEU A 37 1.572 2.561 -6.020 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.510 3.773 -8.008 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.146 4.152 -8.509 1.00 0.00 H new ATOM 0 HG LEU A 37 1.246 2.274 -9.737 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.028 0.665 -9.410 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.610 2.347 -9.410 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.452 1.459 -7.875 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.806 0.127 -8.647 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.056 0.894 -7.061 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.298 1.410 -8.095 1.00 0.00 H new ATOM 851 N VAL A 38 3.985 2.422 -5.814 1.00 0.00 N ATOM 852 CA VAL A 38 5.409 2.278 -5.528 1.00 0.00 C ATOM 853 C VAL A 38 5.829 0.823 -5.696 1.00 0.00 C ATOM 854 O VAL A 38 5.239 -0.078 -5.077 1.00 0.00 O ATOM 855 CB VAL A 38 5.782 2.741 -4.066 1.00 0.00 C ATOM 856 CG1 VAL A 38 7.264 2.551 -3.770 1.00 0.00 C ATOM 857 CG2 VAL A 38 5.386 4.189 -3.791 1.00 0.00 C ATOM 0 H VAL A 38 3.425 1.621 -5.521 1.00 0.00 H new ATOM 0 HA VAL A 38 5.937 2.919 -6.234 1.00 0.00 H new ATOM 0 HB VAL A 38 5.205 2.100 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.477 2.882 -2.754 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.523 1.497 -3.870 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.854 3.138 -4.474 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.665 4.455 -2.772 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.901 4.846 -4.492 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.309 4.301 -3.913 1.00 0.00 H new ATOM 867 N ASP A 39 6.795 0.601 -6.580 1.00 0.00 N ATOM 868 CA ASP A 39 7.437 -0.710 -6.806 1.00 0.00 C ATOM 869 C ASP A 39 6.408 -1.766 -7.244 1.00 0.00 C ATOM 870 O ASP A 39 6.516 -2.958 -6.950 1.00 0.00 O ATOM 871 CB ASP A 39 8.214 -1.133 -5.541 1.00 0.00 C ATOM 872 CG ASP A 39 9.127 -2.316 -5.745 1.00 0.00 C ATOM 873 OD1 ASP A 39 10.158 -2.163 -6.422 1.00 0.00 O ATOM 874 OD2 ASP A 39 8.874 -3.392 -5.155 1.00 0.00 O ATOM 0 H ASP A 39 7.170 1.337 -7.178 1.00 0.00 H new ATOM 0 HA ASP A 39 8.151 -0.623 -7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 39 8.806 -0.287 -5.192 1.00 0.00 H new ATOM 0 HB3 ASP A 39 7.500 -1.370 -4.752 1.00 0.00 H new ATOM 879 N GLY A 40 5.417 -1.308 -7.964 1.00 0.00 N ATOM 880 CA GLY A 40 4.410 -2.189 -8.491 1.00 0.00 C ATOM 881 C GLY A 40 3.277 -2.482 -7.528 1.00 0.00 C ATOM 882 O GLY A 40 2.393 -3.270 -7.849 1.00 0.00 O ATOM 0 H GLY A 40 5.286 -0.324 -8.199 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.996 -1.749 -9.398 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.880 -3.129 -8.779 1.00 0.00 H new ATOM 886 N LYS A 41 3.288 -1.886 -6.354 1.00 0.00 N ATOM 887 CA LYS A 41 2.196 -2.098 -5.428 1.00 0.00 C ATOM 888 C LYS A 41 1.604 -0.786 -4.976 1.00 0.00 C ATOM 889 O LYS A 41 2.213 0.277 -5.165 1.00 0.00 O ATOM 890 CB LYS A 41 2.567 -2.987 -4.216 1.00 0.00 C ATOM 891 CG LYS A 41 3.763 -2.551 -3.367 1.00 0.00 C ATOM 892 CD LYS A 41 5.050 -3.269 -3.761 1.00 0.00 C ATOM 893 CE LYS A 41 6.177 -2.949 -2.783 1.00 0.00 C ATOM 894 NZ LYS A 41 7.378 -3.787 -3.014 1.00 0.00 N ATOM 0 H LYS A 41 4.025 -1.263 -6.023 1.00 0.00 H new ATOM 0 HA LYS A 41 1.440 -2.653 -5.984 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.696 -3.050 -3.564 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.763 -3.994 -4.584 1.00 0.00 H new ATOM 0 HG2 LYS A 41 3.905 -1.475 -3.470 1.00 0.00 H new ATOM 0 HG3 LYS A 41 3.549 -2.746 -2.316 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.878 -4.345 -3.783 1.00 0.00 H new ATOM 0 HD3 LYS A 41 5.343 -2.972 -4.768 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.447 -1.897 -2.876 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.823 -3.099 -1.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.165 -3.434 -2.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 7.170 -4.772 -2.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 7.643 -3.744 -4.019 1.00 0.00 H new ATOM 908 N LEU A 42 0.427 -0.847 -4.402 1.00 0.00 N ATOM 909 CA LEU A 42 -0.244 0.339 -3.932 1.00 0.00 C ATOM 910 C LEU A 42 0.078 0.549 -2.501 1.00 0.00 C ATOM 911 O LEU A 42 -0.088 -0.338 -1.665 1.00 0.00 O ATOM 912 CB LEU A 42 -1.759 0.270 -4.147 1.00 0.00 C ATOM 913 CG LEU A 42 -2.243 0.292 -5.592 1.00 0.00 C ATOM 914 CD1 LEU A 42 -3.644 -0.295 -5.678 1.00 0.00 C ATOM 915 CD2 LEU A 42 -2.280 1.713 -6.158 1.00 0.00 C ATOM 0 H LEU A 42 -0.089 -1.713 -4.249 1.00 0.00 H new ATOM 0 HA LEU A 42 0.114 1.187 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.129 -0.641 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.217 1.108 -3.621 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.540 -0.301 -6.177 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.983 -0.276 -6.714 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.630 -1.324 -5.320 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.324 0.294 -5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.630 1.685 -7.190 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.957 2.325 -5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.279 2.143 -6.126 1.00 0.00 H new ATOM 927 N ILE A 43 0.571 1.679 -2.235 1.00 0.00 N ATOM 928 CA ILE A 43 0.957 2.039 -0.912 1.00 0.00 C ATOM 929 C ILE A 43 -0.090 2.952 -0.358 1.00 0.00 C ATOM 930 O ILE A 43 -0.410 3.984 -0.956 1.00 0.00 O ATOM 931 CB ILE A 43 2.298 2.780 -0.895 1.00 0.00 C ATOM 932 CG1 ILE A 43 3.337 2.064 -1.755 1.00 0.00 C ATOM 933 CG2 ILE A 43 2.804 2.955 0.525 1.00 0.00 C ATOM 934 CD1 ILE A 43 3.694 0.656 -1.336 1.00 0.00 C ATOM 0 H ILE A 43 0.729 2.408 -2.931 1.00 0.00 H new ATOM 0 HA ILE A 43 1.061 1.129 -0.320 1.00 0.00 H new ATOM 0 HB ILE A 43 2.134 3.769 -1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.970 2.034 -2.781 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.249 2.662 -1.760 1.00 0.00 H new ATOM 0 HG21 ILE A 43 3.757 3.484 0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.079 3.530 1.101 1.00 0.00 H new ATOM 0 HG23 ILE A 43 2.939 1.977 0.986 1.00 0.00 H new ATOM 0 HD11 ILE A 43 4.440 0.251 -2.020 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.099 0.669 -0.324 1.00 0.00 H new ATOM 0 HD13 ILE A 43 2.801 0.031 -1.361 1.00 0.00 H new ATOM 946 N ILE A 44 -0.627 2.566 0.736 1.00 0.00 N ATOM 947 CA ILE A 44 -1.627 3.334 1.408 1.00 0.00 C ATOM 948 C ILE A 44 -0.992 4.010 2.601 1.00 0.00 C ATOM 949 O ILE A 44 -0.664 3.362 3.616 1.00 0.00 O ATOM 950 CB ILE A 44 -2.834 2.462 1.870 1.00 0.00 C ATOM 951 CG1 ILE A 44 -3.487 1.737 0.680 1.00 0.00 C ATOM 952 CG2 ILE A 44 -3.869 3.296 2.634 1.00 0.00 C ATOM 953 CD1 ILE A 44 -4.049 2.647 -0.391 1.00 0.00 C ATOM 0 H ILE A 44 -0.386 1.693 1.206 1.00 0.00 H new ATOM 0 HA ILE A 44 -2.020 4.072 0.709 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.445 1.706 2.553 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.748 1.078 0.225 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -4.290 1.103 1.056 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.697 2.657 2.941 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.403 3.735 3.516 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.244 4.090 1.989 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.488 2.045 -1.187 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.816 3.289 0.043 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -3.249 3.263 -0.801 1.00 0.00 H new ATOM 965 N GLU A 45 -0.782 5.279 2.468 1.00 0.00 N ATOM 966 CA GLU A 45 -0.198 6.070 3.516 1.00 0.00 C ATOM 967 C GLU A 45 -1.229 7.069 3.939 1.00 0.00 C ATOM 968 O GLU A 45 -2.025 7.518 3.105 1.00 0.00 O ATOM 969 CB GLU A 45 1.053 6.819 3.036 1.00 0.00 C ATOM 970 CG GLU A 45 2.263 5.963 2.705 1.00 0.00 C ATOM 971 CD GLU A 45 3.437 6.804 2.316 1.00 0.00 C ATOM 972 OE1 GLU A 45 3.535 7.207 1.142 1.00 0.00 O ATOM 973 OE2 GLU A 45 4.284 7.087 3.181 1.00 0.00 O ATOM 0 H GLU A 45 -1.011 5.805 1.625 1.00 0.00 H new ATOM 0 HA GLU A 45 0.104 5.417 4.335 1.00 0.00 H new ATOM 0 HB2 GLU A 45 0.788 7.395 2.149 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.340 7.535 3.806 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.523 5.349 3.567 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.016 5.281 1.891 1.00 0.00 H new ATOM 980 N PRO A 46 -1.273 7.456 5.198 1.00 0.00 N ATOM 981 CA PRO A 46 -2.223 8.389 5.633 1.00 0.00 C ATOM 982 C PRO A 46 -1.680 9.783 5.499 1.00 0.00 C ATOM 983 O PRO A 46 -0.462 10.007 5.335 1.00 0.00 O ATOM 984 CB PRO A 46 -2.450 8.038 7.102 1.00 0.00 C ATOM 985 CG PRO A 46 -1.373 7.070 7.454 1.00 0.00 C ATOM 986 CD PRO A 46 -0.400 7.068 6.296 1.00 0.00 C ATOM 0 HA PRO A 46 -3.144 8.356 5.052 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.398 8.927 7.730 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.436 7.599 7.252 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -0.875 7.363 8.378 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -1.785 6.074 7.616 1.00 0.00 H new ATOM 0 HD2 PRO A 46 0.417 7.775 6.443 1.00 0.00 H new ATOM 0 HD3 PRO A 46 0.051 6.088 6.138 1.00 0.00 H new ATOM 994 N VAL A 47 -2.535 10.697 5.559 1.00 0.00 N ATOM 995 CA VAL A 47 -2.148 12.062 5.486 1.00 0.00 C ATOM 996 C VAL A 47 -2.467 12.641 6.834 1.00 0.00 C ATOM 997 O VAL A 47 -3.633 12.740 7.209 1.00 0.00 O ATOM 998 CB VAL A 47 -2.891 12.860 4.394 1.00 0.00 C ATOM 999 CG1 VAL A 47 -2.257 14.189 4.229 1.00 0.00 C ATOM 1000 CG2 VAL A 47 -2.875 12.149 3.077 1.00 0.00 C ATOM 0 H VAL A 47 -3.538 10.542 5.661 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.092 12.125 5.222 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.928 12.967 4.714 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.784 14.750 3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -2.305 14.735 5.171 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -1.215 14.061 3.937 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.408 12.744 2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.844 12.006 2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.361 11.179 3.181 1.00 0.00 H new ATOM 1010 N ARG A 48 -1.455 12.954 7.575 1.00 0.00 N ATOM 1011 CA ARG A 48 -1.630 13.376 8.934 1.00 0.00 C ATOM 1012 C ARG A 48 -2.176 14.777 9.057 1.00 0.00 C ATOM 1013 O ARG A 48 -1.738 15.690 8.368 1.00 0.00 O ATOM 1014 CB ARG A 48 -0.357 13.195 9.753 1.00 0.00 C ATOM 1015 CG ARG A 48 0.024 11.742 9.980 1.00 0.00 C ATOM 1016 CD ARG A 48 1.287 11.631 10.809 1.00 0.00 C ATOM 1017 NE ARG A 48 1.615 10.235 11.145 1.00 0.00 N ATOM 1018 CZ ARG A 48 2.789 9.824 11.650 1.00 0.00 C ATOM 1019 NH1 ARG A 48 3.779 10.693 11.814 1.00 0.00 N ATOM 1020 NH2 ARG A 48 2.970 8.541 11.973 1.00 0.00 N ATOM 0 H ARG A 48 -0.485 12.926 7.261 1.00 0.00 H new ATOM 0 HA ARG A 48 -2.390 12.718 9.354 1.00 0.00 H new ATOM 0 HB2 ARG A 48 0.465 13.702 9.247 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -0.485 13.683 10.719 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -0.792 11.224 10.484 1.00 0.00 H new ATOM 0 HG3 ARG A 48 0.171 11.247 9.020 1.00 0.00 H new ATOM 0 HD2 ARG A 48 2.118 12.075 10.262 1.00 0.00 H new ATOM 0 HD3 ARG A 48 1.167 12.205 11.728 1.00 0.00 H new ATOM 0 HE ARG A 48 0.897 9.529 10.982 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.647 11.671 11.556 1.00 0.00 H new ATOM 0 HH12 ARG A 48 4.672 10.383 12.198 1.00 0.00 H new ATOM 0 HH21 ARG A 48 2.215 7.869 11.836 1.00 0.00 H new ATOM 0 HH22 ARG A 48 3.864 8.233 12.356 1.00 0.00 H new ATOM 1034 N LYS A 49 -3.147 14.923 9.924 1.00 0.00 N ATOM 1035 CA LYS A 49 -3.766 16.190 10.203 1.00 0.00 C ATOM 1036 C LYS A 49 -2.978 16.897 11.242 1.00 0.00 C ATOM 1037 O LYS A 49 -3.089 16.609 12.449 1.00 0.00 O ATOM 1038 CB LYS A 49 -5.232 16.035 10.656 1.00 0.00 C ATOM 1039 CG LYS A 49 -6.253 15.868 9.535 1.00 0.00 C ATOM 1040 CD LYS A 49 -5.927 14.724 8.601 1.00 0.00 C ATOM 1041 CE LYS A 49 -6.988 14.569 7.537 1.00 0.00 C ATOM 1042 NZ LYS A 49 -8.301 14.236 8.117 1.00 0.00 N ATOM 0 H LYS A 49 -3.535 14.149 10.464 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.779 16.772 9.281 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -5.300 15.171 11.317 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.506 16.910 11.246 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.239 15.704 9.971 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.308 16.793 8.961 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.959 14.899 8.131 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -5.842 13.799 9.171 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -7.067 15.494 6.965 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.690 13.787 6.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.974 14.022 7.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.206 13.407 8.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.651 15.044 8.670 1.00 0.00 H new ATOM 1056 N GLU A 50 -2.150 17.749 10.783 1.00 0.00 N ATOM 1057 CA GLU A 50 -1.326 18.530 11.624 1.00 0.00 C ATOM 1058 C GLU A 50 -1.174 19.888 10.968 1.00 0.00 C ATOM 1059 O GLU A 50 -0.123 20.174 10.348 1.00 0.00 O ATOM 1060 CB GLU A 50 0.022 17.833 11.793 1.00 0.00 C ATOM 1061 CG GLU A 50 0.896 18.410 12.875 1.00 0.00 C ATOM 1062 CD GLU A 50 2.204 17.697 12.962 1.00 0.00 C ATOM 1063 OE1 GLU A 50 2.266 16.609 13.575 1.00 0.00 O ATOM 1064 OE2 GLU A 50 3.206 18.210 12.424 1.00 0.00 O ATOM 1065 OXT GLU A 50 -2.148 20.653 10.977 1.00 0.00 O ATOM 0 H GLU A 50 -2.020 17.930 9.788 1.00 0.00 H new ATOM 0 HA GLU A 50 -1.759 18.653 12.617 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -0.154 16.779 12.010 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.561 17.878 10.846 1.00 0.00 H new ATOM 0 HG2 GLU A 50 1.070 19.468 12.678 1.00 0.00 H new ATOM 0 HG3 GLU A 50 0.381 18.345 13.833 1.00 0.00 H new TER 1072 GLU A 50 ATOM 1073 N ASN B -16 9.176 -1.026 -33.189 1.00 0.00 N ATOM 1074 CA ASN B -16 8.255 -0.885 -34.315 1.00 0.00 C ATOM 1075 C ASN B -16 6.904 -1.445 -33.954 1.00 0.00 C ATOM 1076 O ASN B -16 6.773 -2.651 -33.701 1.00 0.00 O ATOM 1077 CB ASN B -16 8.768 -1.621 -35.557 1.00 0.00 C ATOM 1078 CG ASN B -16 7.838 -1.431 -36.745 1.00 0.00 C ATOM 1079 OD1 ASN B -16 7.203 -0.390 -36.879 1.00 0.00 O ATOM 1080 ND2 ASN B -16 7.748 -2.414 -37.605 1.00 0.00 N ATOM 0 H1 ASN B -16 10.105 -0.637 -33.449 1.00 0.00 H new ATOM 0 H2 ASN B -16 8.802 -0.510 -32.368 1.00 0.00 H new ATOM 0 H3 ASN B -16 9.278 -2.033 -32.948 1.00 0.00 H new ATOM 0 HA ASN B -16 8.179 0.179 -34.539 1.00 0.00 H new ATOM 0 HB2 ASN B -16 9.763 -1.256 -35.811 1.00 0.00 H new ATOM 0 HB3 ASN B -16 8.865 -2.684 -35.336 1.00 0.00 H new ATOM 0 HD21 ASN B -16 7.136 -2.327 -38.416 1.00 0.00 H new ATOM 0 HD22 ASN B -16 8.290 -3.266 -37.464 1.00 0.00 H new ATOM 1089 N HIS B -15 5.905 -0.593 -33.906 1.00 0.00 N ATOM 1090 CA HIS B -15 4.556 -1.038 -33.656 1.00 0.00 C ATOM 1091 C HIS B -15 3.999 -1.642 -34.936 1.00 0.00 C ATOM 1092 O HIS B -15 3.640 -0.938 -35.875 1.00 0.00 O ATOM 1093 CB HIS B -15 3.671 0.102 -33.113 1.00 0.00 C ATOM 1094 CG HIS B -15 4.029 0.540 -31.713 1.00 0.00 C ATOM 1095 ND1 HIS B -15 4.708 1.705 -31.406 1.00 0.00 N ATOM 1096 CD2 HIS B -15 3.775 -0.060 -30.523 1.00 0.00 C ATOM 1097 CE1 HIS B -15 4.843 1.771 -30.077 1.00 0.00 C ATOM 1098 NE2 HIS B -15 4.294 0.724 -29.492 1.00 0.00 N ATOM 0 H HIS B -15 6.003 0.414 -34.037 1.00 0.00 H new ATOM 0 HA HIS B -15 4.562 -1.802 -32.878 1.00 0.00 H new ATOM 0 HB2 HIS B -15 3.748 0.959 -33.782 1.00 0.00 H new ATOM 0 HB3 HIS B -15 2.630 -0.221 -33.127 1.00 0.00 H new ATOM 0 HD2 HIS B -15 3.253 -0.997 -30.394 1.00 0.00 H new ATOM 0 HE1 HIS B -15 5.336 2.576 -29.552 1.00 0.00 H new ATOM 0 HE2 HIS B -15 4.257 0.528 -28.492 1.00 0.00 H new ATOM 1106 N LYS B -14 4.007 -2.951 -34.981 1.00 0.00 N ATOM 1107 CA LYS B -14 3.619 -3.697 -36.156 1.00 0.00 C ATOM 1108 C LYS B -14 2.144 -4.060 -36.115 1.00 0.00 C ATOM 1109 O LYS B -14 1.426 -3.903 -37.110 1.00 0.00 O ATOM 1110 CB LYS B -14 4.497 -4.962 -36.275 1.00 0.00 C ATOM 1111 CG LYS B -14 4.151 -5.897 -37.435 1.00 0.00 C ATOM 1112 CD LYS B -14 4.269 -5.210 -38.789 1.00 0.00 C ATOM 1113 CE LYS B -14 3.951 -6.174 -39.927 1.00 0.00 C ATOM 1114 NZ LYS B -14 2.597 -6.771 -39.812 1.00 0.00 N ATOM 0 H LYS B -14 4.286 -3.537 -34.194 1.00 0.00 H new ATOM 0 HA LYS B -14 3.773 -3.072 -37.036 1.00 0.00 H new ATOM 0 HB2 LYS B -14 5.537 -4.653 -36.378 1.00 0.00 H new ATOM 0 HB3 LYS B -14 4.422 -5.524 -35.344 1.00 0.00 H new ATOM 0 HG2 LYS B -14 4.813 -6.762 -37.411 1.00 0.00 H new ATOM 0 HG3 LYS B -14 3.135 -6.270 -37.307 1.00 0.00 H new ATOM 0 HD2 LYS B -14 3.588 -4.360 -38.829 1.00 0.00 H new ATOM 0 HD3 LYS B -14 5.278 -4.817 -38.913 1.00 0.00 H new ATOM 0 HE2 LYS B -14 4.031 -5.646 -40.877 1.00 0.00 H new ATOM 0 HE3 LYS B -14 4.695 -6.971 -39.941 1.00 0.00 H new ATOM 0 HZ1 LYS B -14 2.353 -7.252 -40.701 1.00 0.00 H new ATOM 0 HZ2 LYS B -14 2.586 -7.459 -39.032 1.00 0.00 H new ATOM 0 HZ3 LYS B -14 1.902 -6.021 -39.622 1.00 0.00 H new ATOM 1128 N VAL B -13 1.692 -4.524 -34.972 1.00 0.00 N ATOM 1129 CA VAL B -13 0.314 -4.960 -34.811 1.00 0.00 C ATOM 1130 C VAL B -13 -0.584 -3.750 -34.742 1.00 0.00 C ATOM 1131 O VAL B -13 -1.641 -3.691 -35.389 1.00 0.00 O ATOM 1132 CB VAL B -13 0.128 -5.807 -33.529 1.00 0.00 C ATOM 1133 CG1 VAL B -13 -1.290 -6.357 -33.431 1.00 0.00 C ATOM 1134 CG2 VAL B -13 1.146 -6.930 -33.481 1.00 0.00 C ATOM 0 H VAL B -13 2.261 -4.611 -34.130 1.00 0.00 H new ATOM 0 HA VAL B -13 0.054 -5.582 -35.667 1.00 0.00 H new ATOM 0 HB VAL B -13 0.291 -5.157 -32.670 1.00 0.00 H new ATOM 0 HG11 VAL B -13 -1.389 -6.947 -32.520 1.00 0.00 H new ATOM 0 HG12 VAL B -13 -2.000 -5.530 -33.407 1.00 0.00 H new ATOM 0 HG13 VAL B -13 -1.496 -6.987 -34.296 1.00 0.00 H new ATOM 0 HG21 VAL B -13 1.000 -7.515 -32.573 1.00 0.00 H new ATOM 0 HG22 VAL B -13 1.019 -7.574 -34.351 1.00 0.00 H new ATOM 0 HG23 VAL B -13 2.152 -6.510 -33.484 1.00 0.00 H new ATOM 1144 N HIS B -12 -0.143 -2.780 -33.993 1.00 0.00 N ATOM 1145 CA HIS B -12 -0.874 -1.557 -33.825 1.00 0.00 C ATOM 1146 C HIS B -12 -0.251 -0.503 -34.693 1.00 0.00 C ATOM 1147 O HIS B -12 0.919 -0.205 -34.553 1.00 0.00 O ATOM 1148 CB HIS B -12 -0.845 -1.080 -32.361 1.00 0.00 C ATOM 1149 CG HIS B -12 -1.457 -2.025 -31.366 1.00 0.00 C ATOM 1150 ND1 HIS B -12 -2.764 -1.959 -30.948 1.00 0.00 N ATOM 1151 CD2 HIS B -12 -0.899 -3.057 -30.685 1.00 0.00 C ATOM 1152 CE1 HIS B -12 -2.962 -2.923 -30.046 1.00 0.00 C ATOM 1153 NE2 HIS B -12 -1.856 -3.624 -29.848 1.00 0.00 N ATOM 0 H HIS B -12 0.738 -2.816 -33.480 1.00 0.00 H new ATOM 0 HA HIS B -12 -1.912 -1.733 -34.106 1.00 0.00 H new ATOM 0 HB2 HIS B -12 0.191 -0.899 -32.076 1.00 0.00 H new ATOM 0 HB3 HIS B -12 -1.365 -0.124 -32.297 1.00 0.00 H new ATOM 0 HD2 HIS B -12 0.125 -3.387 -30.778 1.00 0.00 H new ATOM 0 HE1 HIS B -12 -3.900 -3.107 -29.544 1.00 0.00 H new ATOM 0 HE2 HIS B -12 -1.731 -4.414 -29.215 1.00 0.00 H new ATOM 1161 N HIS B -11 -1.011 0.054 -35.589 1.00 0.00 N ATOM 1162 CA HIS B -11 -0.526 1.137 -36.433 1.00 0.00 C ATOM 1163 C HIS B -11 -0.742 2.450 -35.697 1.00 0.00 C ATOM 1164 O HIS B -11 -1.457 3.344 -36.163 1.00 0.00 O ATOM 1165 CB HIS B -11 -1.237 1.153 -37.798 1.00 0.00 C ATOM 1166 CG HIS B -11 -0.926 -0.022 -38.681 1.00 0.00 C ATOM 1167 ND1 HIS B -11 -0.417 0.090 -39.950 1.00 0.00 N ATOM 1168 CD2 HIS B -11 -1.093 -1.351 -38.465 1.00 0.00 C ATOM 1169 CE1 HIS B -11 -0.295 -1.126 -40.457 1.00 0.00 C ATOM 1170 NE2 HIS B -11 -0.691 -2.048 -39.594 1.00 0.00 N ATOM 0 H HIS B -11 -1.978 -0.217 -35.765 1.00 0.00 H new ATOM 0 HA HIS B -11 0.535 0.990 -36.633 1.00 0.00 H new ATOM 0 HB2 HIS B -11 -2.314 1.190 -37.631 1.00 0.00 H new ATOM 0 HB3 HIS B -11 -0.964 2.068 -38.324 1.00 0.00 H new ATOM 0 HD2 HIS B -11 -1.478 -1.795 -37.559 1.00 0.00 H new ATOM 0 HE1 HIS B -11 0.079 -1.339 -41.447 1.00 0.00 H new ATOM 0 HE2 HIS B -11 -0.699 -3.059 -39.731 1.00 0.00 H new ATOM 1178 N HIS B -10 -0.154 2.524 -34.534 1.00 0.00 N ATOM 1179 CA HIS B -10 -0.278 3.627 -33.627 1.00 0.00 C ATOM 1180 C HIS B -10 0.907 3.588 -32.699 1.00 0.00 C ATOM 1181 O HIS B -10 1.302 2.516 -32.253 1.00 0.00 O ATOM 1182 CB HIS B -10 -1.588 3.470 -32.808 1.00 0.00 C ATOM 1183 CG HIS B -10 -1.792 4.477 -31.703 1.00 0.00 C ATOM 1184 ND1 HIS B -10 -1.779 4.158 -30.356 1.00 0.00 N ATOM 1185 CD2 HIS B -10 -2.041 5.800 -31.766 1.00 0.00 C ATOM 1186 CE1 HIS B -10 -2.016 5.274 -29.667 1.00 0.00 C ATOM 1187 NE2 HIS B -10 -2.183 6.305 -30.478 1.00 0.00 N ATOM 0 H HIS B -10 0.451 1.783 -34.179 1.00 0.00 H new ATOM 0 HA HIS B -10 -0.310 4.574 -34.167 1.00 0.00 H new ATOM 0 HB2 HIS B -10 -2.433 3.533 -33.493 1.00 0.00 H new ATOM 0 HB3 HIS B -10 -1.605 2.471 -32.372 1.00 0.00 H new ATOM 0 HD2 HIS B -10 -2.118 6.378 -32.675 1.00 0.00 H new ATOM 0 HE1 HIS B -10 -2.065 5.329 -28.590 1.00 0.00 H new ATOM 0 HE2 HIS B -10 -2.376 7.271 -30.214 1.00 0.00 H new ATOM 1195 N HIS B -9 1.486 4.719 -32.433 1.00 0.00 N ATOM 1196 CA HIS B -9 2.559 4.772 -31.481 1.00 0.00 C ATOM 1197 C HIS B -9 1.992 5.100 -30.120 1.00 0.00 C ATOM 1198 O HIS B -9 1.349 6.129 -29.926 1.00 0.00 O ATOM 1199 CB HIS B -9 3.702 5.725 -31.900 1.00 0.00 C ATOM 1200 CG HIS B -9 3.315 7.148 -32.176 1.00 0.00 C ATOM 1201 ND1 HIS B -9 3.596 8.203 -31.340 1.00 0.00 N ATOM 1202 CD2 HIS B -9 2.716 7.685 -33.257 1.00 0.00 C ATOM 1203 CE1 HIS B -9 3.171 9.318 -31.927 1.00 0.00 C ATOM 1204 NE2 HIS B -9 2.629 9.060 -33.101 1.00 0.00 N ATOM 0 H HIS B -9 1.238 5.613 -32.857 1.00 0.00 H new ATOM 0 HA HIS B -9 3.032 3.791 -31.440 1.00 0.00 H new ATOM 0 HB2 HIS B -9 4.455 5.722 -31.112 1.00 0.00 H new ATOM 0 HB3 HIS B -9 4.175 5.320 -32.795 1.00 0.00 H new ATOM 0 HD2 HIS B -9 2.359 7.130 -34.112 1.00 0.00 H new ATOM 0 HE1 HIS B -9 3.258 10.305 -31.498 1.00 0.00 H new ATOM 0 HE2 HIS B -9 2.229 9.731 -33.757 1.00 0.00 H new ATOM 1212 N HIS B -8 2.180 4.194 -29.205 1.00 0.00 N ATOM 1213 CA HIS B -8 1.636 4.319 -27.873 1.00 0.00 C ATOM 1214 C HIS B -8 2.362 5.384 -27.072 1.00 0.00 C ATOM 1215 O HIS B -8 3.598 5.461 -27.073 1.00 0.00 O ATOM 1216 CB HIS B -8 1.630 2.957 -27.152 1.00 0.00 C ATOM 1217 CG HIS B -8 0.701 1.948 -27.787 1.00 0.00 C ATOM 1218 ND1 HIS B -8 -0.391 1.401 -27.158 1.00 0.00 N ATOM 1219 CD2 HIS B -8 0.719 1.401 -29.028 1.00 0.00 C ATOM 1220 CE1 HIS B -8 -0.988 0.565 -28.011 1.00 0.00 C ATOM 1221 NE2 HIS B -8 -0.352 0.531 -29.164 1.00 0.00 N ATOM 0 H HIS B -8 2.717 3.341 -29.357 1.00 0.00 H new ATOM 0 HA HIS B -8 0.600 4.646 -27.962 1.00 0.00 H new ATOM 0 HB2 HIS B -8 2.643 2.554 -27.144 1.00 0.00 H new ATOM 0 HB3 HIS B -8 1.338 3.105 -26.112 1.00 0.00 H new ATOM 0 HD1 HIS B -8 -0.693 1.599 -26.204 1.00 0.00 H new ATOM 0 HD2 HIS B -8 1.453 1.611 -29.792 1.00 0.00 H new ATOM 0 HE1 HIS B -8 -1.875 -0.008 -27.785 1.00 0.00 H new ATOM 1229 N HIS B -7 1.593 6.211 -26.413 1.00 0.00 N ATOM 1230 CA HIS B -7 2.116 7.320 -25.646 1.00 0.00 C ATOM 1231 C HIS B -7 2.193 6.937 -24.186 1.00 0.00 C ATOM 1232 O HIS B -7 1.284 6.275 -23.662 1.00 0.00 O ATOM 1233 CB HIS B -7 1.222 8.560 -25.817 1.00 0.00 C ATOM 1234 CG HIS B -7 1.080 9.023 -27.238 1.00 0.00 C ATOM 1235 ND1 HIS B -7 -0.013 8.752 -28.034 1.00 0.00 N ATOM 1236 CD2 HIS B -7 1.917 9.758 -27.997 1.00 0.00 C ATOM 1237 CE1 HIS B -7 0.195 9.316 -29.224 1.00 0.00 C ATOM 1238 NE2 HIS B -7 1.354 9.944 -29.253 1.00 0.00 N ATOM 0 H HIS B -7 0.576 6.136 -26.391 1.00 0.00 H new ATOM 0 HA HIS B -7 3.115 7.560 -26.010 1.00 0.00 H new ATOM 0 HB2 HIS B -7 0.232 8.339 -25.418 1.00 0.00 H new ATOM 0 HB3 HIS B -7 1.632 9.375 -25.220 1.00 0.00 H new ATOM 0 HD1 HIS B -7 -0.836 8.215 -27.760 1.00 0.00 H new ATOM 0 HD2 HIS B -7 2.875 10.142 -27.679 1.00 0.00 H new ATOM 0 HE1 HIS B -7 -0.494 9.265 -30.054 1.00 0.00 H new ATOM 1246 N MET B -6 3.266 7.319 -23.541 1.00 0.00 N ATOM 1247 CA MET B -6 3.479 7.022 -22.142 1.00 0.00 C ATOM 1248 C MET B -6 3.603 8.303 -21.358 1.00 0.00 C ATOM 1249 O MET B -6 4.565 9.050 -21.523 1.00 0.00 O ATOM 1250 CB MET B -6 4.740 6.171 -21.925 1.00 0.00 C ATOM 1251 CG MET B -6 4.726 4.808 -22.599 1.00 0.00 C ATOM 1252 SD MET B -6 6.233 3.860 -22.274 1.00 0.00 S ATOM 1253 CE MET B -6 6.107 3.599 -20.497 1.00 0.00 C ATOM 0 H MET B -6 4.023 7.849 -23.972 1.00 0.00 H new ATOM 0 HA MET B -6 2.619 6.451 -21.793 1.00 0.00 H new ATOM 0 HB2 MET B -6 5.603 6.729 -22.289 1.00 0.00 H new ATOM 0 HB3 MET B -6 4.882 6.027 -20.854 1.00 0.00 H new ATOM 0 HG2 MET B -6 3.862 4.242 -22.250 1.00 0.00 H new ATOM 0 HG3 MET B -6 4.608 4.939 -23.675 1.00 0.00 H new ATOM 0 HE1 MET B -6 6.752 2.771 -20.204 1.00 0.00 H new ATOM 0 HE2 MET B -6 6.417 4.503 -19.974 1.00 0.00 H new ATOM 0 HE3 MET B -6 5.075 3.365 -20.236 1.00 0.00 H new ATOM 1263 N SER B -5 2.600 8.603 -20.580 1.00 0.00 N ATOM 1264 CA SER B -5 2.624 9.762 -19.702 1.00 0.00 C ATOM 1265 C SER B -5 1.901 9.412 -18.391 1.00 0.00 C ATOM 1266 O SER B -5 1.583 10.281 -17.571 1.00 0.00 O ATOM 1267 CB SER B -5 1.914 10.929 -20.388 1.00 0.00 C ATOM 1268 OG SER B -5 2.452 11.182 -21.685 1.00 0.00 O ATOM 0 H SER B -5 1.739 8.058 -20.530 1.00 0.00 H new ATOM 0 HA SER B -5 3.654 10.045 -19.486 1.00 0.00 H new ATOM 0 HB2 SER B -5 0.850 10.710 -20.471 1.00 0.00 H new ATOM 0 HB3 SER B -5 2.008 11.824 -19.774 1.00 0.00 H new ATOM 0 HG SER B -5 1.975 11.933 -22.096 1.00 0.00 H new ATOM 1274 N ASP B -4 1.649 8.125 -18.209 1.00 0.00 N ATOM 1275 CA ASP B -4 0.885 7.626 -17.060 1.00 0.00 C ATOM 1276 C ASP B -4 1.766 7.397 -15.829 1.00 0.00 C ATOM 1277 O ASP B -4 1.284 7.287 -14.705 1.00 0.00 O ATOM 1278 CB ASP B -4 0.160 6.328 -17.436 1.00 0.00 C ATOM 1279 CG ASP B -4 -0.712 5.805 -16.320 1.00 0.00 C ATOM 1280 OD1 ASP B -4 -1.869 6.256 -16.199 1.00 0.00 O ATOM 1281 OD2 ASP B -4 -0.261 4.948 -15.539 1.00 0.00 O ATOM 0 H ASP B -4 1.964 7.394 -18.847 1.00 0.00 H new ATOM 0 HA ASP B -4 0.156 8.393 -16.798 1.00 0.00 H new ATOM 0 HB2 ASP B -4 -0.453 6.502 -18.320 1.00 0.00 H new ATOM 0 HB3 ASP B -4 0.896 5.569 -17.703 1.00 0.00 H new ATOM 1286 N ASP B -3 3.054 7.365 -16.050 1.00 0.00 N ATOM 1287 CA ASP B -3 4.019 7.018 -14.999 1.00 0.00 C ATOM 1288 C ASP B -3 4.252 8.158 -14.042 1.00 0.00 C ATOM 1289 O ASP B -3 4.718 7.946 -12.916 1.00 0.00 O ATOM 1290 CB ASP B -3 5.368 6.614 -15.598 1.00 0.00 C ATOM 1291 CG ASP B -3 5.311 5.381 -16.456 1.00 0.00 C ATOM 1292 OD1 ASP B -3 4.891 5.478 -17.638 1.00 0.00 O ATOM 1293 OD2 ASP B -3 5.687 4.289 -15.973 1.00 0.00 O ATOM 0 H ASP B -3 3.478 7.575 -16.953 1.00 0.00 H new ATOM 0 HA ASP B -3 3.583 6.179 -14.456 1.00 0.00 H new ATOM 0 HB2 ASP B -3 5.752 7.442 -16.194 1.00 0.00 H new ATOM 0 HB3 ASP B -3 6.079 6.448 -14.788 1.00 0.00 H new ATOM 1298 N ASP B -2 3.950 9.352 -14.490 1.00 0.00 N ATOM 1299 CA ASP B -2 4.221 10.561 -13.728 1.00 0.00 C ATOM 1300 C ASP B -2 3.306 10.704 -12.524 1.00 0.00 C ATOM 1301 O ASP B -2 3.781 10.784 -11.383 1.00 0.00 O ATOM 1302 CB ASP B -2 4.123 11.791 -14.628 1.00 0.00 C ATOM 1303 CG ASP B -2 4.617 13.044 -13.958 1.00 0.00 C ATOM 1304 OD1 ASP B -2 5.851 13.243 -13.904 1.00 0.00 O ATOM 1305 OD2 ASP B -2 3.799 13.863 -13.503 1.00 0.00 O ATOM 0 H ASP B -2 3.508 9.520 -15.394 1.00 0.00 H new ATOM 0 HA ASP B -2 5.238 10.479 -13.346 1.00 0.00 H new ATOM 0 HB2 ASP B -2 4.701 11.618 -15.536 1.00 0.00 H new ATOM 0 HB3 ASP B -2 3.086 11.932 -14.932 1.00 0.00 H new ATOM 1310 N ASP B -1 2.013 10.727 -12.755 1.00 0.00 N ATOM 1311 CA ASP B -1 1.063 10.868 -11.664 1.00 0.00 C ATOM 1312 C ASP B -1 0.733 9.501 -11.107 1.00 0.00 C ATOM 1313 O ASP B -1 0.077 8.680 -11.763 1.00 0.00 O ATOM 1314 CB ASP B -1 -0.207 11.614 -12.110 1.00 0.00 C ATOM 1315 CG ASP B -1 -1.231 11.780 -11.002 1.00 0.00 C ATOM 1316 OD1 ASP B -1 -1.002 12.588 -10.071 1.00 0.00 O ATOM 1317 OD2 ASP B -1 -2.309 11.138 -11.071 1.00 0.00 O ATOM 0 H ASP B -1 1.592 10.651 -13.681 1.00 0.00 H new ATOM 0 HA ASP B -1 1.519 11.471 -10.879 1.00 0.00 H new ATOM 0 HB2 ASP B -1 0.072 12.598 -12.486 1.00 0.00 H new ATOM 0 HB3 ASP B -1 -0.664 11.074 -12.939 1.00 0.00 H new ATOM 1322 N LYS B 0 1.223 9.231 -9.924 1.00 0.00 N ATOM 1323 CA LYS B 0 1.037 7.929 -9.314 1.00 0.00 C ATOM 1324 C LYS B 0 0.569 8.064 -7.872 1.00 0.00 C ATOM 1325 O LYS B 0 0.440 7.069 -7.152 1.00 0.00 O ATOM 1326 CB LYS B 0 2.344 7.127 -9.385 1.00 0.00 C ATOM 1327 CG LYS B 0 3.473 7.662 -8.508 1.00 0.00 C ATOM 1328 CD LYS B 0 4.763 6.919 -8.780 1.00 0.00 C ATOM 1329 CE LYS B 0 5.838 7.249 -7.760 1.00 0.00 C ATOM 1330 NZ LYS B 0 5.514 6.712 -6.418 1.00 0.00 N ATOM 0 H LYS B 0 1.755 9.893 -9.359 1.00 0.00 H new ATOM 0 HA LYS B 0 0.264 7.395 -9.867 1.00 0.00 H new ATOM 0 HB2 LYS B 0 2.137 6.096 -9.097 1.00 0.00 H new ATOM 0 HB3 LYS B 0 2.685 7.107 -10.420 1.00 0.00 H new ATOM 0 HG2 LYS B 0 3.614 8.726 -8.698 1.00 0.00 H new ATOM 0 HG3 LYS B 0 3.203 7.559 -7.457 1.00 0.00 H new ATOM 0 HD2 LYS B 0 4.572 5.846 -8.770 1.00 0.00 H new ATOM 0 HD3 LYS B 0 5.122 7.170 -9.778 1.00 0.00 H new ATOM 0 HE2 LYS B 0 6.792 6.840 -8.093 1.00 0.00 H new ATOM 0 HE3 LYS B 0 5.959 8.330 -7.698 1.00 0.00 H new ATOM 0 HZ1 LYS B 0 6.387 6.620 -5.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 0 4.860 7.360 -5.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 0 5.066 5.778 -6.516 1.00 0.00 H new ATOM 1344 N GLY B 1 0.336 9.285 -7.462 1.00 0.00 N ATOM 1345 CA GLY B 1 -0.133 9.559 -6.139 1.00 0.00 C ATOM 1346 C GLY B 1 -1.560 10.015 -6.196 1.00 0.00 C ATOM 1347 O GLY B 1 -1.856 11.129 -6.655 1.00 0.00 O ATOM 0 H GLY B 1 0.468 10.114 -8.041 1.00 0.00 H new ATOM 0 HA2 GLY B 1 -0.051 8.665 -5.521 1.00 0.00 H new ATOM 0 HA3 GLY B 1 0.486 10.326 -5.674 1.00 0.00 H new ATOM 1351 N ILE B 2 -2.441 9.167 -5.790 1.00 0.00 N ATOM 1352 CA ILE B 2 -3.846 9.448 -5.837 1.00 0.00 C ATOM 1353 C ILE B 2 -4.345 9.792 -4.443 1.00 0.00 C ATOM 1354 O ILE B 2 -4.046 9.091 -3.478 1.00 0.00 O ATOM 1355 CB ILE B 2 -4.627 8.228 -6.392 1.00 0.00 C ATOM 1356 CG1 ILE B 2 -4.066 7.835 -7.773 1.00 0.00 C ATOM 1357 CG2 ILE B 2 -6.127 8.532 -6.481 1.00 0.00 C ATOM 1358 CD1 ILE B 2 -4.696 6.607 -8.376 1.00 0.00 C ATOM 0 H ILE B 2 -2.211 8.248 -5.411 1.00 0.00 H new ATOM 0 HA ILE B 2 -4.012 10.296 -6.501 1.00 0.00 H new ATOM 0 HB ILE B 2 -4.499 7.390 -5.707 1.00 0.00 H new ATOM 0 HG12 ILE B 2 -4.202 8.672 -8.458 1.00 0.00 H new ATOM 0 HG13 ILE B 2 -2.993 7.670 -7.682 1.00 0.00 H new ATOM 0 HG21 ILE B 2 -6.652 7.661 -6.873 1.00 0.00 H new ATOM 0 HG22 ILE B 2 -6.509 8.770 -5.488 1.00 0.00 H new ATOM 0 HG23 ILE B 2 -6.287 9.381 -7.145 1.00 0.00 H new ATOM 0 HD11 ILE B 2 -4.242 6.404 -9.346 1.00 0.00 H new ATOM 0 HD12 ILE B 2 -4.537 5.755 -7.715 1.00 0.00 H new ATOM 0 HD13 ILE B 2 -5.766 6.772 -8.504 1.00 0.00 H new ATOM 1370 N HIS B 3 -5.052 10.881 -4.331 1.00 0.00 N ATOM 1371 CA HIS B 3 -5.633 11.278 -3.079 1.00 0.00 C ATOM 1372 C HIS B 3 -7.079 10.848 -3.014 1.00 0.00 C ATOM 1373 O HIS B 3 -7.812 10.949 -3.991 1.00 0.00 O ATOM 1374 CB HIS B 3 -5.520 12.786 -2.858 1.00 0.00 C ATOM 1375 CG HIS B 3 -4.126 13.259 -2.614 1.00 0.00 C ATOM 1376 ND1 HIS B 3 -3.395 14.022 -3.495 1.00 0.00 N ATOM 1377 CD2 HIS B 3 -3.349 13.098 -1.526 1.00 0.00 C ATOM 1378 CE1 HIS B 3 -2.225 14.300 -2.928 1.00 0.00 C ATOM 1379 NE2 HIS B 3 -2.143 13.762 -1.717 1.00 0.00 N ATOM 0 H HIS B 3 -5.242 11.518 -5.104 1.00 0.00 H new ATOM 0 HA HIS B 3 -5.076 10.783 -2.284 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -5.921 13.302 -3.730 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -6.142 13.066 -2.008 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -3.621 12.540 -0.642 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -1.445 14.886 -3.391 1.00 0.00 H new ATOM 0 HE2 HIS B 3 -1.361 13.823 -1.065 1.00 0.00 H new ATOM 1387 N SER B 4 -7.458 10.334 -1.895 1.00 0.00 N ATOM 1388 CA SER B 4 -8.804 9.901 -1.624 1.00 0.00 C ATOM 1389 C SER B 4 -9.024 9.993 -0.140 1.00 0.00 C ATOM 1390 O SER B 4 -8.225 10.593 0.548 1.00 0.00 O ATOM 1391 CB SER B 4 -8.998 8.465 -2.097 1.00 0.00 C ATOM 1392 OG SER B 4 -8.939 8.373 -3.513 1.00 0.00 O ATOM 0 H SER B 4 -6.823 10.195 -1.109 1.00 0.00 H new ATOM 0 HA SER B 4 -9.520 10.529 -2.153 1.00 0.00 H new ATOM 0 HB2 SER B 4 -8.230 7.829 -1.657 1.00 0.00 H new ATOM 0 HB3 SER B 4 -9.960 8.092 -1.746 1.00 0.00 H new ATOM 0 HG SER B 4 -8.670 9.238 -3.886 1.00 0.00 H new ATOM 1398 N SER B 5 -10.058 9.396 0.350 1.00 0.00 N ATOM 1399 CA SER B 5 -10.357 9.440 1.745 1.00 0.00 C ATOM 1400 C SER B 5 -11.020 8.156 2.157 1.00 0.00 C ATOM 1401 O SER B 5 -11.672 7.492 1.332 1.00 0.00 O ATOM 1402 CB SER B 5 -11.234 10.659 2.063 1.00 0.00 C ATOM 1403 OG SER B 5 -12.364 10.718 1.196 1.00 0.00 O ATOM 0 H SER B 5 -10.724 8.861 -0.207 1.00 0.00 H new ATOM 0 HA SER B 5 -9.434 9.545 2.315 1.00 0.00 H new ATOM 0 HB2 SER B 5 -11.569 10.610 3.099 1.00 0.00 H new ATOM 0 HB3 SER B 5 -10.646 11.571 1.961 1.00 0.00 H new ATOM 0 HG SER B 5 -12.626 11.653 1.064 1.00 0.00 H new ATOM 1409 N VAL B 6 -10.819 7.775 3.385 1.00 0.00 N ATOM 1410 CA VAL B 6 -11.423 6.582 3.911 1.00 0.00 C ATOM 1411 C VAL B 6 -12.885 6.846 4.147 1.00 0.00 C ATOM 1412 O VAL B 6 -13.240 7.735 4.906 1.00 0.00 O ATOM 1413 CB VAL B 6 -10.773 6.144 5.236 1.00 0.00 C ATOM 1414 CG1 VAL B 6 -11.386 4.850 5.737 1.00 0.00 C ATOM 1415 CG2 VAL B 6 -9.293 5.983 5.058 1.00 0.00 C ATOM 0 H VAL B 6 -10.233 8.280 4.050 1.00 0.00 H new ATOM 0 HA VAL B 6 -11.279 5.780 3.187 1.00 0.00 H new ATOM 0 HB VAL B 6 -10.957 6.919 5.980 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -10.910 4.561 6.674 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -12.454 4.993 5.901 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -11.235 4.065 4.996 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -8.845 5.673 6.002 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -9.098 5.226 4.298 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -8.859 6.932 4.745 1.00 0.00 H new ATOM 1425 N LYS B 7 -13.711 6.123 3.487 1.00 0.00 N ATOM 1426 CA LYS B 7 -15.114 6.271 3.646 1.00 0.00 C ATOM 1427 C LYS B 7 -15.668 5.034 4.349 1.00 0.00 C ATOM 1428 O LYS B 7 -14.960 4.028 4.492 1.00 0.00 O ATOM 1429 CB LYS B 7 -15.785 6.556 2.297 1.00 0.00 C ATOM 1430 CG LYS B 7 -15.527 7.946 1.725 1.00 0.00 C ATOM 1431 CD LYS B 7 -16.223 8.991 2.572 1.00 0.00 C ATOM 1432 CE LYS B 7 -16.343 10.335 1.859 1.00 0.00 C ATOM 1433 NZ LYS B 7 -15.060 11.049 1.750 1.00 0.00 N ATOM 0 H LYS B 7 -13.434 5.406 2.816 1.00 0.00 H new ATOM 0 HA LYS B 7 -15.336 7.133 4.275 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -15.443 5.814 1.575 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -16.861 6.420 2.408 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -14.455 8.144 1.697 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -15.888 7.999 0.698 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -17.218 8.634 2.838 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -15.672 9.125 3.503 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -16.748 10.174 0.860 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -17.056 10.961 2.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -15.147 11.814 1.051 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -14.807 11.452 2.675 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -14.318 10.386 1.447 1.00 0.00 H new ATOM 1447 N ARG B 8 -16.891 5.101 4.792 1.00 0.00 N ATOM 1448 CA ARG B 8 -17.463 4.040 5.601 1.00 0.00 C ATOM 1449 C ARG B 8 -18.408 3.148 4.793 1.00 0.00 C ATOM 1450 O ARG B 8 -19.446 3.600 4.315 1.00 0.00 O ATOM 1451 CB ARG B 8 -18.196 4.639 6.798 1.00 0.00 C ATOM 1452 CG ARG B 8 -18.701 3.603 7.776 1.00 0.00 C ATOM 1453 CD ARG B 8 -19.449 4.235 8.934 1.00 0.00 C ATOM 1454 NE ARG B 8 -18.616 5.133 9.745 1.00 0.00 N ATOM 1455 CZ ARG B 8 -18.724 5.279 11.084 1.00 0.00 C ATOM 1456 NH1 ARG B 8 -19.627 4.570 11.767 1.00 0.00 N ATOM 1457 NH2 ARG B 8 -17.926 6.131 11.731 1.00 0.00 N ATOM 0 H ARG B 8 -17.522 5.881 4.610 1.00 0.00 H new ATOM 0 HA ARG B 8 -16.644 3.411 5.951 1.00 0.00 H new ATOM 0 HB2 ARG B 8 -17.526 5.323 7.319 1.00 0.00 H new ATOM 0 HB3 ARG B 8 -19.039 5.230 6.439 1.00 0.00 H new ATOM 0 HG2 ARG B 8 -19.358 2.904 7.258 1.00 0.00 H new ATOM 0 HG3 ARG B 8 -17.860 3.025 8.159 1.00 0.00 H new ATOM 0 HD2 ARG B 8 -20.301 4.793 8.545 1.00 0.00 H new ATOM 0 HD3 ARG B 8 -19.849 3.447 9.572 1.00 0.00 H new ATOM 0 HE ARG B 8 -17.906 5.685 9.264 1.00 0.00 H new ATOM 0 HH11 ARG B 8 -20.238 3.916 11.278 1.00 0.00 H new ATOM 0 HH12 ARG B 8 -19.706 4.683 12.778 1.00 0.00 H new ATOM 0 HH21 ARG B 8 -17.233 6.673 11.215 1.00 0.00 H new ATOM 0 HH22 ARG B 8 -18.009 6.240 12.742 1.00 0.00 H new ATOM 1471 N TRP B 9 -18.047 1.898 4.671 1.00 0.00 N ATOM 1472 CA TRP B 9 -18.820 0.901 3.950 1.00 0.00 C ATOM 1473 C TRP B 9 -19.460 0.012 4.994 1.00 0.00 C ATOM 1474 O TRP B 9 -18.814 -0.899 5.550 1.00 0.00 O ATOM 1475 CB TRP B 9 -17.873 0.091 3.052 1.00 0.00 C ATOM 1476 CG TRP B 9 -18.501 -0.703 1.940 1.00 0.00 C ATOM 1477 CD1 TRP B 9 -19.816 -0.749 1.587 1.00 0.00 C ATOM 1478 CD2 TRP B 9 -17.821 -1.557 0.994 1.00 0.00 C ATOM 1479 NE1 TRP B 9 -19.979 -1.528 0.499 1.00 0.00 N ATOM 1480 CE2 TRP B 9 -18.800 -2.045 0.125 1.00 0.00 C ATOM 1481 CE3 TRP B 9 -16.485 -1.961 0.777 1.00 0.00 C ATOM 1482 CZ2 TRP B 9 -18.516 -2.887 -0.910 1.00 0.00 C ATOM 1483 CZ3 TRP B 9 -16.232 -2.796 -0.263 1.00 0.00 C ATOM 1484 CH2 TRP B 9 -17.245 -3.247 -1.088 1.00 0.00 C ATOM 0 H TRP B 9 -17.188 1.528 5.077 1.00 0.00 H new ATOM 0 HA TRP B 9 -19.584 1.352 3.317 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -17.152 0.780 2.611 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -17.312 -0.597 3.684 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -20.613 -0.235 2.104 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -20.868 -1.699 0.030 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -15.688 -1.616 1.419 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -19.295 -3.250 -1.564 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -15.217 -3.115 -0.450 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -16.999 -3.912 -1.903 1.00 0.00 H new ATOM 1495 N GLY B 10 -20.689 0.319 5.323 1.00 0.00 N ATOM 1496 CA GLY B 10 -21.354 -0.384 6.367 1.00 0.00 C ATOM 1497 C GLY B 10 -20.884 0.155 7.684 1.00 0.00 C ATOM 1498 O GLY B 10 -20.949 1.363 7.910 1.00 0.00 O ATOM 0 H GLY B 10 -21.241 1.052 4.878 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -22.434 -0.266 6.274 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -21.143 -1.451 6.298 1.00 0.00 H new ATOM 1502 N ASN B 11 -20.410 -0.693 8.535 1.00 0.00 N ATOM 1503 CA ASN B 11 -19.827 -0.253 9.796 1.00 0.00 C ATOM 1504 C ASN B 11 -18.312 -0.461 9.766 1.00 0.00 C ATOM 1505 O ASN B 11 -17.672 -0.629 10.809 1.00 0.00 O ATOM 1506 CB ASN B 11 -20.470 -1.008 10.983 1.00 0.00 C ATOM 1507 CG ASN B 11 -20.177 -2.504 11.025 1.00 0.00 C ATOM 1508 OD1 ASN B 11 -19.898 -3.136 10.007 1.00 0.00 O ATOM 1509 ND2 ASN B 11 -20.290 -3.083 12.188 1.00 0.00 N ATOM 0 H ASN B 11 -20.407 -1.703 8.395 1.00 0.00 H new ATOM 0 HA ASN B 11 -20.028 0.810 9.931 1.00 0.00 H new ATOM 0 HB2 ASN B 11 -20.122 -0.558 11.913 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -21.550 -0.865 10.944 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -20.146 -4.089 12.273 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -20.523 -2.530 13.013 1.00 0.00 H new ATOM 1516 N SER B 12 -17.720 -0.405 8.576 1.00 0.00 N ATOM 1517 CA SER B 12 -16.343 -0.662 8.420 1.00 0.00 C ATOM 1518 C SER B 12 -15.746 0.303 7.387 1.00 0.00 C ATOM 1519 O SER B 12 -16.400 0.664 6.416 1.00 0.00 O ATOM 1520 CB SER B 12 -16.154 -2.103 7.982 1.00 0.00 C ATOM 1521 OG SER B 12 -16.756 -2.999 8.912 1.00 0.00 O ATOM 0 H SER B 12 -18.206 -0.177 7.709 1.00 0.00 H new ATOM 0 HA SER B 12 -15.827 -0.508 9.368 1.00 0.00 H new ATOM 0 HB2 SER B 12 -16.593 -2.248 6.995 1.00 0.00 H new ATOM 0 HB3 SER B 12 -15.090 -2.324 7.894 1.00 0.00 H new ATOM 0 HG SER B 12 -16.102 -3.246 9.599 1.00 0.00 H new ATOM 1527 N PRO B 13 -14.545 0.769 7.633 1.00 0.00 N ATOM 1528 CA PRO B 13 -13.832 1.671 6.734 1.00 0.00 C ATOM 1529 C PRO B 13 -13.319 0.970 5.465 1.00 0.00 C ATOM 1530 O PRO B 13 -12.776 -0.150 5.520 1.00 0.00 O ATOM 1531 CB PRO B 13 -12.656 2.161 7.579 1.00 0.00 C ATOM 1532 CG PRO B 13 -12.484 1.151 8.657 1.00 0.00 C ATOM 1533 CD PRO B 13 -13.798 0.474 8.844 1.00 0.00 C ATOM 0 HA PRO B 13 -14.481 2.467 6.371 1.00 0.00 H new ATOM 0 HB2 PRO B 13 -11.751 2.249 6.977 1.00 0.00 H new ATOM 0 HB3 PRO B 13 -12.858 3.148 7.996 1.00 0.00 H new ATOM 0 HG2 PRO B 13 -11.714 0.428 8.387 1.00 0.00 H new ATOM 0 HG3 PRO B 13 -12.162 1.628 9.583 1.00 0.00 H new ATOM 0 HD2 PRO B 13 -13.673 -0.600 8.980 1.00 0.00 H new ATOM 0 HD3 PRO B 13 -14.314 0.849 9.728 1.00 0.00 H new ATOM 1541 N ALA B 14 -13.495 1.610 4.334 1.00 0.00 N ATOM 1542 CA ALA B 14 -13.020 1.082 3.097 1.00 0.00 C ATOM 1543 C ALA B 14 -12.370 2.180 2.279 1.00 0.00 C ATOM 1544 O ALA B 14 -12.819 3.341 2.294 1.00 0.00 O ATOM 1545 CB ALA B 14 -14.155 0.431 2.322 1.00 0.00 C ATOM 0 H ALA B 14 -13.971 2.508 4.255 1.00 0.00 H new ATOM 0 HA ALA B 14 -12.273 0.316 3.306 1.00 0.00 H new ATOM 0 HB1 ALA B 14 -13.773 0.034 1.381 1.00 0.00 H new ATOM 0 HB2 ALA B 14 -14.580 -0.381 2.912 1.00 0.00 H new ATOM 0 HB3 ALA B 14 -14.927 1.172 2.116 1.00 0.00 H new ATOM 1551 N VAL B 15 -11.308 1.836 1.610 1.00 0.00 N ATOM 1552 CA VAL B 15 -10.618 2.756 0.747 1.00 0.00 C ATOM 1553 C VAL B 15 -11.023 2.454 -0.674 1.00 0.00 C ATOM 1554 O VAL B 15 -11.051 1.286 -1.089 1.00 0.00 O ATOM 1555 CB VAL B 15 -9.064 2.689 0.917 1.00 0.00 C ATOM 1556 CG1 VAL B 15 -8.351 3.574 -0.107 1.00 0.00 C ATOM 1557 CG2 VAL B 15 -8.674 3.136 2.318 1.00 0.00 C ATOM 0 H VAL B 15 -10.893 0.905 1.647 1.00 0.00 H new ATOM 0 HA VAL B 15 -10.900 3.774 1.016 1.00 0.00 H new ATOM 0 HB VAL B 15 -8.758 1.655 0.756 1.00 0.00 H new ATOM 0 HG11 VAL B 15 -7.273 3.504 0.039 1.00 0.00 H new ATOM 0 HG12 VAL B 15 -8.603 3.241 -1.114 1.00 0.00 H new ATOM 0 HG13 VAL B 15 -8.668 4.609 0.023 1.00 0.00 H new ATOM 0 HG21 VAL B 15 -7.591 3.086 2.427 1.00 0.00 H new ATOM 0 HG22 VAL B 15 -9.008 4.161 2.479 1.00 0.00 H new ATOM 0 HG23 VAL B 15 -9.143 2.482 3.053 1.00 0.00 H new ATOM 1567 N ARG B 16 -11.381 3.481 -1.390 1.00 0.00 N ATOM 1568 CA ARG B 16 -11.842 3.348 -2.732 1.00 0.00 C ATOM 1569 C ARG B 16 -10.650 3.329 -3.693 1.00 0.00 C ATOM 1570 O ARG B 16 -9.782 4.202 -3.630 1.00 0.00 O ATOM 1571 CB ARG B 16 -12.720 4.525 -3.057 1.00 0.00 C ATOM 1572 CG ARG B 16 -13.493 4.344 -4.313 1.00 0.00 C ATOM 1573 CD ARG B 16 -14.281 5.581 -4.659 1.00 0.00 C ATOM 1574 NE ARG B 16 -15.017 5.414 -5.917 1.00 0.00 N ATOM 1575 CZ ARG B 16 -14.961 6.254 -6.955 1.00 0.00 C ATOM 1576 NH1 ARG B 16 -14.264 7.394 -6.860 1.00 0.00 N ATOM 1577 NH2 ARG B 16 -15.617 5.955 -8.079 1.00 0.00 N ATOM 0 H ARG B 16 -11.359 4.442 -1.050 1.00 0.00 H new ATOM 0 HA ARG B 16 -12.400 2.418 -2.838 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -13.412 4.694 -2.232 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -12.102 5.419 -3.143 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -12.812 4.105 -5.130 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -14.171 3.497 -4.205 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -14.981 5.805 -3.854 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -13.606 6.433 -4.741 1.00 0.00 H new ATOM 0 HE ARG B 16 -15.617 4.594 -6.006 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -13.775 7.622 -5.994 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -14.222 8.034 -7.653 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -16.156 5.091 -8.141 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -15.580 6.591 -8.876 1.00 0.00 H new ATOM 1591 N ILE B 17 -10.615 2.355 -4.555 1.00 0.00 N ATOM 1592 CA ILE B 17 -9.561 2.211 -5.533 1.00 0.00 C ATOM 1593 C ILE B 17 -10.112 2.501 -6.944 1.00 0.00 C ATOM 1594 O ILE B 17 -11.239 2.103 -7.273 1.00 0.00 O ATOM 1595 CB ILE B 17 -8.882 0.773 -5.466 1.00 0.00 C ATOM 1596 CG1 ILE B 17 -7.924 0.639 -4.286 1.00 0.00 C ATOM 1597 CG2 ILE B 17 -8.157 0.387 -6.722 1.00 0.00 C ATOM 1598 CD1 ILE B 17 -8.573 0.485 -2.966 1.00 0.00 C ATOM 0 H ILE B 17 -11.325 1.625 -4.604 1.00 0.00 H new ATOM 0 HA ILE B 17 -8.782 2.938 -5.302 1.00 0.00 H new ATOM 0 HB ILE B 17 -9.721 0.089 -5.337 1.00 0.00 H new ATOM 0 HG12 ILE B 17 -7.278 -0.222 -4.459 1.00 0.00 H new ATOM 0 HG13 ILE B 17 -7.282 1.519 -4.257 1.00 0.00 H new ATOM 0 HG21 ILE B 17 -7.721 -0.605 -6.600 1.00 0.00 H new ATOM 0 HG22 ILE B 17 -8.857 0.375 -7.557 1.00 0.00 H new ATOM 0 HG23 ILE B 17 -7.366 1.109 -6.922 1.00 0.00 H new ATOM 0 HD11 ILE B 17 -7.809 0.398 -2.193 1.00 0.00 H new ATOM 0 HD12 ILE B 17 -9.196 1.356 -2.763 1.00 0.00 H new ATOM 0 HD13 ILE B 17 -9.192 -0.412 -2.967 1.00 0.00 H new ATOM 1610 N PRO B 18 -9.370 3.256 -7.774 1.00 0.00 N ATOM 1611 CA PRO B 18 -9.774 3.520 -9.142 1.00 0.00 C ATOM 1612 C PRO B 18 -9.668 2.262 -10.000 1.00 0.00 C ATOM 1613 O PRO B 18 -8.684 1.499 -9.895 1.00 0.00 O ATOM 1614 CB PRO B 18 -8.784 4.571 -9.659 1.00 0.00 C ATOM 1615 CG PRO B 18 -7.957 4.978 -8.490 1.00 0.00 C ATOM 1616 CD PRO B 18 -8.103 3.922 -7.434 1.00 0.00 C ATOM 0 HA PRO B 18 -10.810 3.855 -9.188 1.00 0.00 H new ATOM 0 HB2 PRO B 18 -8.160 4.160 -10.452 1.00 0.00 H new ATOM 0 HB3 PRO B 18 -9.311 5.428 -10.079 1.00 0.00 H new ATOM 0 HG2 PRO B 18 -6.912 5.086 -8.781 1.00 0.00 H new ATOM 0 HG3 PRO B 18 -8.283 5.946 -8.110 1.00 0.00 H new ATOM 0 HD2 PRO B 18 -7.267 3.223 -7.450 1.00 0.00 H new ATOM 0 HD3 PRO B 18 -8.136 4.357 -6.435 1.00 0.00 H new ATOM 1624 N ALA B 19 -10.648 2.058 -10.867 1.00 0.00 N ATOM 1625 CA ALA B 19 -10.675 0.903 -11.754 1.00 0.00 C ATOM 1626 C ALA B 19 -9.472 0.915 -12.705 1.00 0.00 C ATOM 1627 O ALA B 19 -9.040 -0.132 -13.189 1.00 0.00 O ATOM 1628 CB ALA B 19 -11.992 0.826 -12.515 1.00 0.00 C ATOM 0 H ALA B 19 -11.445 2.685 -10.976 1.00 0.00 H new ATOM 0 HA ALA B 19 -10.601 0.004 -11.142 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -11.984 -0.046 -13.169 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -12.817 0.741 -11.807 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -12.119 1.728 -13.114 1.00 0.00 H new ATOM 1634 N THR B 20 -8.932 2.103 -12.943 1.00 0.00 N ATOM 1635 CA THR B 20 -7.754 2.298 -13.760 1.00 0.00 C ATOM 1636 C THR B 20 -6.571 1.472 -13.194 1.00 0.00 C ATOM 1637 O THR B 20 -5.867 0.800 -13.928 1.00 0.00 O ATOM 1638 CB THR B 20 -7.383 3.785 -13.726 1.00 0.00 C ATOM 1639 OG1 THR B 20 -8.598 4.550 -13.672 1.00 0.00 O ATOM 1640 CG2 THR B 20 -6.615 4.176 -14.980 1.00 0.00 C ATOM 0 H THR B 20 -9.312 2.971 -12.564 1.00 0.00 H new ATOM 0 HA THR B 20 -7.959 1.974 -14.780 1.00 0.00 H new ATOM 0 HB THR B 20 -6.756 3.979 -12.856 1.00 0.00 H new ATOM 0 HG1 THR B 20 -8.382 5.506 -13.648 1.00 0.00 H new ATOM 0 HG21 THR B 20 -6.361 5.235 -14.936 1.00 0.00 H new ATOM 0 HG22 THR B 20 -5.701 3.586 -15.045 1.00 0.00 H new ATOM 0 HG23 THR B 20 -7.232 3.987 -15.858 1.00 0.00 H new ATOM 1648 N LEU B 21 -6.417 1.491 -11.872 1.00 0.00 N ATOM 1649 CA LEU B 21 -5.320 0.772 -11.205 1.00 0.00 C ATOM 1650 C LEU B 21 -5.595 -0.681 -11.151 1.00 0.00 C ATOM 1651 O LEU B 21 -4.691 -1.504 -11.215 1.00 0.00 O ATOM 1652 CB LEU B 21 -5.071 1.313 -9.808 1.00 0.00 C ATOM 1653 CG LEU B 21 -4.201 2.550 -9.713 1.00 0.00 C ATOM 1654 CD1 LEU B 21 -2.756 2.210 -10.060 1.00 0.00 C ATOM 1655 CD2 LEU B 21 -4.702 3.640 -10.628 1.00 0.00 C ATOM 0 H LEU B 21 -7.035 1.995 -11.236 1.00 0.00 H new ATOM 0 HA LEU B 21 -4.418 0.933 -11.796 1.00 0.00 H new ATOM 0 HB2 LEU B 21 -6.035 1.537 -9.351 1.00 0.00 H new ATOM 0 HB3 LEU B 21 -4.611 0.524 -9.213 1.00 0.00 H new ATOM 0 HG LEU B 21 -4.249 2.913 -8.686 1.00 0.00 H new ATOM 0 HD11 LEU B 21 -2.143 3.109 -9.987 1.00 0.00 H new ATOM 0 HD12 LEU B 21 -2.382 1.459 -9.365 1.00 0.00 H new ATOM 0 HD13 LEU B 21 -2.708 1.819 -11.077 1.00 0.00 H new ATOM 0 HD21 LEU B 21 -4.058 4.515 -10.538 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -4.690 3.284 -11.658 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -5.721 3.909 -10.349 1.00 0.00 H new ATOM 1667 N MET B 22 -6.839 -0.984 -11.025 1.00 0.00 N ATOM 1668 CA MET B 22 -7.318 -2.365 -11.074 1.00 0.00 C ATOM 1669 C MET B 22 -6.894 -3.006 -12.377 1.00 0.00 C ATOM 1670 O MET B 22 -6.364 -4.113 -12.401 1.00 0.00 O ATOM 1671 CB MET B 22 -8.821 -2.399 -10.930 1.00 0.00 C ATOM 1672 CG MET B 22 -9.318 -1.926 -9.584 1.00 0.00 C ATOM 1673 SD MET B 22 -8.990 -3.080 -8.270 1.00 0.00 S ATOM 1674 CE MET B 22 -9.988 -4.442 -8.848 1.00 0.00 C ATOM 0 H MET B 22 -7.576 -0.293 -10.883 1.00 0.00 H new ATOM 0 HA MET B 22 -6.881 -2.926 -10.248 1.00 0.00 H new ATOM 0 HB2 MET B 22 -9.265 -1.779 -11.709 1.00 0.00 H new ATOM 0 HB3 MET B 22 -9.169 -3.418 -11.097 1.00 0.00 H new ATOM 0 HG2 MET B 22 -8.849 -0.971 -9.346 1.00 0.00 H new ATOM 0 HG3 MET B 22 -10.392 -1.748 -9.643 1.00 0.00 H new ATOM 0 HE1 MET B 22 -10.055 -5.201 -8.068 1.00 0.00 H new ATOM 0 HE2 MET B 22 -10.988 -4.083 -9.092 1.00 0.00 H new ATOM 0 HE3 MET B 22 -9.531 -4.876 -9.738 1.00 0.00 H new ATOM 1684 N GLN B 23 -7.117 -2.288 -13.441 1.00 0.00 N ATOM 1685 CA GLN B 23 -6.659 -2.682 -14.761 1.00 0.00 C ATOM 1686 C GLN B 23 -5.146 -2.696 -14.836 1.00 0.00 C ATOM 1687 O GLN B 23 -4.561 -3.579 -15.452 1.00 0.00 O ATOM 1688 CB GLN B 23 -7.179 -1.732 -15.823 1.00 0.00 C ATOM 1689 CG GLN B 23 -8.662 -1.786 -16.031 1.00 0.00 C ATOM 1690 CD GLN B 23 -9.114 -0.869 -17.154 1.00 0.00 C ATOM 1691 OE1 GLN B 23 -9.153 -1.259 -18.327 1.00 0.00 O ATOM 1692 NE2 GLN B 23 -9.473 0.335 -16.820 1.00 0.00 N ATOM 0 H GLN B 23 -7.625 -1.404 -13.426 1.00 0.00 H new ATOM 0 HA GLN B 23 -7.044 -3.686 -14.941 1.00 0.00 H new ATOM 0 HB2 GLN B 23 -6.900 -0.714 -15.551 1.00 0.00 H new ATOM 0 HB3 GLN B 23 -6.684 -1.957 -16.768 1.00 0.00 H new ATOM 0 HG2 GLN B 23 -8.959 -2.810 -16.258 1.00 0.00 H new ATOM 0 HG3 GLN B 23 -9.168 -1.504 -15.107 1.00 0.00 H new ATOM 0 HE21 GLN B 23 -9.430 0.628 -15.844 1.00 0.00 H new ATOM 0 HE22 GLN B 23 -9.798 0.987 -17.534 1.00 0.00 H new ATOM 1701 N ALA B 24 -4.522 -1.744 -14.175 1.00 0.00 N ATOM 1702 CA ALA B 24 -3.061 -1.571 -14.262 1.00 0.00 C ATOM 1703 C ALA B 24 -2.311 -2.710 -13.612 1.00 0.00 C ATOM 1704 O ALA B 24 -1.265 -3.137 -14.095 1.00 0.00 O ATOM 1705 CB ALA B 24 -2.636 -0.255 -13.646 1.00 0.00 C ATOM 0 H ALA B 24 -4.990 -1.071 -13.568 1.00 0.00 H new ATOM 0 HA ALA B 24 -2.808 -1.569 -15.322 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -1.554 -0.150 -13.722 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -3.118 0.567 -14.175 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -2.930 -0.233 -12.597 1.00 0.00 H new ATOM 1711 N LEU B 25 -2.842 -3.183 -12.524 1.00 0.00 N ATOM 1712 CA LEU B 25 -2.236 -4.257 -11.774 1.00 0.00 C ATOM 1713 C LEU B 25 -2.851 -5.596 -12.158 1.00 0.00 C ATOM 1714 O LEU B 25 -2.397 -6.652 -11.735 1.00 0.00 O ATOM 1715 CB LEU B 25 -2.427 -3.980 -10.306 1.00 0.00 C ATOM 1716 CG LEU B 25 -1.772 -2.701 -9.803 1.00 0.00 C ATOM 1717 CD1 LEU B 25 -2.279 -2.384 -8.436 1.00 0.00 C ATOM 1718 CD2 LEU B 25 -0.262 -2.850 -9.775 1.00 0.00 C ATOM 0 H LEU B 25 -3.714 -2.836 -12.124 1.00 0.00 H new ATOM 0 HA LEU B 25 -1.171 -4.312 -12.001 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -3.496 -3.930 -10.097 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -2.030 -4.821 -9.738 1.00 0.00 H new ATOM 0 HG LEU B 25 -2.025 -1.886 -10.481 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.809 -1.468 -8.077 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -3.360 -2.248 -8.471 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -2.039 -3.204 -7.760 1.00 0.00 H new ATOM 0 HD21 LEU B 25 0.188 -1.926 -9.413 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.010 -3.671 -9.111 1.00 0.00 H new ATOM 0 HD23 LEU B 25 0.102 -3.061 -10.781 1.00 0.00 H new ATOM 1730 N ASN B 26 -3.894 -5.516 -12.958 1.00 0.00 N ATOM 1731 CA ASN B 26 -4.642 -6.661 -13.490 1.00 0.00 C ATOM 1732 C ASN B 26 -5.302 -7.516 -12.396 1.00 0.00 C ATOM 1733 O ASN B 26 -4.876 -8.649 -12.108 1.00 0.00 O ATOM 1734 CB ASN B 26 -3.817 -7.534 -14.462 1.00 0.00 C ATOM 1735 CG ASN B 26 -4.659 -8.633 -15.108 1.00 0.00 C ATOM 1736 OD1 ASN B 26 -5.850 -8.457 -15.358 1.00 0.00 O ATOM 1737 ND2 ASN B 26 -4.063 -9.766 -15.349 1.00 0.00 N ATOM 0 H ASN B 26 -4.267 -4.621 -13.274 1.00 0.00 H new ATOM 0 HA ASN B 26 -5.447 -6.214 -14.073 1.00 0.00 H new ATOM 0 HB2 ASN B 26 -3.388 -6.902 -15.240 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -2.984 -7.986 -13.924 1.00 0.00 H new ATOM 0 HD21 ASN B 26 -4.586 -10.541 -15.757 1.00 0.00 H new ATOM 0 HD22 ASN B 26 -3.073 -9.878 -15.129 1.00 0.00 H new ATOM 1744 N LEU B 27 -6.251 -6.923 -11.725 1.00 0.00 N ATOM 1745 CA LEU B 27 -7.080 -7.585 -10.798 1.00 0.00 C ATOM 1746 C LEU B 27 -8.518 -7.164 -11.046 1.00 0.00 C ATOM 1747 O LEU B 27 -8.762 -6.167 -11.752 1.00 0.00 O ATOM 1748 CB LEU B 27 -6.690 -7.280 -9.371 1.00 0.00 C ATOM 1749 CG LEU B 27 -6.702 -5.830 -8.923 1.00 0.00 C ATOM 1750 CD1 LEU B 27 -6.943 -5.792 -7.452 1.00 0.00 C ATOM 1751 CD2 LEU B 27 -5.379 -5.169 -9.215 1.00 0.00 C ATOM 0 H LEU B 27 -6.463 -5.930 -11.824 1.00 0.00 H new ATOM 0 HA LEU B 27 -6.966 -8.660 -10.938 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.359 -7.837 -8.716 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -5.686 -7.671 -9.208 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.486 -5.298 -9.462 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.955 -4.756 -7.112 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -7.902 -6.258 -7.228 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.148 -6.333 -6.939 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -5.411 -4.130 -8.886 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -4.585 -5.694 -8.684 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -5.184 -5.204 -10.287 1.00 0.00 H new ATOM 1763 N ASN B 28 -9.453 -7.888 -10.495 1.00 0.00 N ATOM 1764 CA ASN B 28 -10.864 -7.585 -10.623 1.00 0.00 C ATOM 1765 C ASN B 28 -11.512 -7.703 -9.249 1.00 0.00 C ATOM 1766 O ASN B 28 -10.811 -7.734 -8.225 1.00 0.00 O ATOM 1767 CB ASN B 28 -11.561 -8.539 -11.623 1.00 0.00 C ATOM 1768 CG ASN B 28 -11.073 -8.400 -13.059 1.00 0.00 C ATOM 1769 OD1 ASN B 28 -11.572 -7.564 -13.821 1.00 0.00 O ATOM 1770 ND2 ASN B 28 -10.138 -9.226 -13.461 1.00 0.00 N ATOM 0 H ASN B 28 -9.260 -8.718 -9.935 1.00 0.00 H new ATOM 0 HA ASN B 28 -10.974 -6.572 -11.009 1.00 0.00 H new ATOM 0 HB2 ASN B 28 -11.406 -9.567 -11.296 1.00 0.00 H new ATOM 0 HB3 ASN B 28 -12.635 -8.355 -11.596 1.00 0.00 H new ATOM 0 HD21 ASN B 28 -9.804 -9.189 -14.424 1.00 0.00 H new ATOM 0 HD22 ASN B 28 -9.744 -9.906 -12.811 1.00 0.00 H new ATOM 1777 N ILE B 29 -12.826 -7.737 -9.204 1.00 0.00 N ATOM 1778 CA ILE B 29 -13.525 -7.879 -7.949 1.00 0.00 C ATOM 1779 C ILE B 29 -13.397 -9.331 -7.490 1.00 0.00 C ATOM 1780 O ILE B 29 -13.423 -10.245 -8.313 1.00 0.00 O ATOM 1781 CB ILE B 29 -15.030 -7.458 -8.074 1.00 0.00 C ATOM 1782 CG1 ILE B 29 -15.152 -6.000 -8.571 1.00 0.00 C ATOM 1783 CG2 ILE B 29 -15.785 -7.628 -6.753 1.00 0.00 C ATOM 1784 CD1 ILE B 29 -14.507 -4.967 -7.671 1.00 0.00 C ATOM 0 H ILE B 29 -13.430 -7.668 -10.023 1.00 0.00 H new ATOM 0 HA ILE B 29 -13.078 -7.214 -7.210 1.00 0.00 H new ATOM 0 HB ILE B 29 -15.487 -8.123 -8.806 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -14.703 -5.930 -9.562 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -16.208 -5.756 -8.682 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -16.823 -7.325 -6.886 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -15.749 -8.673 -6.445 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -15.321 -7.008 -5.986 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -14.643 -3.974 -8.100 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -14.971 -5.003 -6.685 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -13.442 -5.179 -7.579 1.00 0.00 H new ATOM 1796 N ASP B 30 -13.206 -9.511 -6.192 1.00 0.00 N ATOM 1797 CA ASP B 30 -13.009 -10.809 -5.528 1.00 0.00 C ATOM 1798 C ASP B 30 -11.607 -11.319 -5.584 1.00 0.00 C ATOM 1799 O ASP B 30 -11.322 -12.430 -5.120 1.00 0.00 O ATOM 1800 CB ASP B 30 -14.034 -11.901 -5.872 1.00 0.00 C ATOM 1801 CG ASP B 30 -15.280 -11.770 -5.060 1.00 0.00 C ATOM 1802 OD1 ASP B 30 -15.204 -11.932 -3.824 1.00 0.00 O ATOM 1803 OD2 ASP B 30 -16.355 -11.479 -5.627 1.00 0.00 O ATOM 0 H ASP B 30 -13.181 -8.729 -5.537 1.00 0.00 H new ATOM 0 HA ASP B 30 -13.211 -10.561 -4.486 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -14.283 -11.844 -6.932 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -13.591 -12.882 -5.701 1.00 0.00 H new ATOM 1808 N ASP B 31 -10.705 -10.527 -6.114 1.00 0.00 N ATOM 1809 CA ASP B 31 -9.318 -10.882 -6.059 1.00 0.00 C ATOM 1810 C ASP B 31 -8.834 -10.636 -4.672 1.00 0.00 C ATOM 1811 O ASP B 31 -9.017 -9.544 -4.121 1.00 0.00 O ATOM 1812 CB ASP B 31 -8.445 -10.147 -7.094 1.00 0.00 C ATOM 1813 CG ASP B 31 -8.574 -10.718 -8.494 1.00 0.00 C ATOM 1814 OD1 ASP B 31 -7.823 -11.657 -8.836 1.00 0.00 O ATOM 1815 OD2 ASP B 31 -9.429 -10.274 -9.255 1.00 0.00 O ATOM 0 H ASP B 31 -10.909 -9.644 -6.582 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.227 -11.936 -6.321 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -8.722 -9.093 -7.111 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -7.402 -10.198 -6.782 1.00 0.00 H new ATOM 1820 N GLU B 32 -8.330 -11.673 -4.082 1.00 0.00 N ATOM 1821 CA GLU B 32 -7.813 -11.637 -2.764 1.00 0.00 C ATOM 1822 C GLU B 32 -6.526 -10.843 -2.770 1.00 0.00 C ATOM 1823 O GLU B 32 -5.725 -10.958 -3.707 1.00 0.00 O ATOM 1824 CB GLU B 32 -7.654 -13.076 -2.244 1.00 0.00 C ATOM 1825 CG GLU B 32 -7.087 -13.187 -0.854 1.00 0.00 C ATOM 1826 CD GLU B 32 -7.305 -14.550 -0.252 1.00 0.00 C ATOM 1827 OE1 GLU B 32 -8.413 -14.793 0.289 1.00 0.00 O ATOM 1828 OE2 GLU B 32 -6.399 -15.398 -0.282 1.00 0.00 O ATOM 0 H GLU B 32 -8.268 -12.591 -4.522 1.00 0.00 H new ATOM 0 HA GLU B 32 -8.493 -11.134 -2.076 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -8.628 -13.564 -2.264 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -7.009 -13.626 -2.929 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -6.019 -12.972 -0.882 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -7.547 -12.433 -0.216 1.00 0.00 H new ATOM 1835 N VAL B 33 -6.368 -9.986 -1.794 1.00 0.00 N ATOM 1836 CA VAL B 33 -5.237 -9.115 -1.744 1.00 0.00 C ATOM 1837 C VAL B 33 -4.566 -9.182 -0.385 1.00 0.00 C ATOM 1838 O VAL B 33 -5.210 -9.502 0.637 1.00 0.00 O ATOM 1839 CB VAL B 33 -5.588 -7.616 -2.099 1.00 0.00 C ATOM 1840 CG1 VAL B 33 -6.463 -7.530 -3.319 1.00 0.00 C ATOM 1841 CG2 VAL B 33 -6.263 -6.890 -0.962 1.00 0.00 C ATOM 0 H VAL B 33 -7.021 -9.877 -1.018 1.00 0.00 H new ATOM 0 HA VAL B 33 -4.548 -9.470 -2.510 1.00 0.00 H new ATOM 0 HB VAL B 33 -4.632 -7.130 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -6.685 -6.485 -3.535 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -5.946 -7.974 -4.170 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -7.393 -8.069 -3.138 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -6.481 -5.865 -1.263 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -7.193 -7.398 -0.707 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -5.604 -6.881 -0.094 1.00 0.00 H new ATOM 1851 N LYS B 34 -3.290 -8.929 -0.393 1.00 0.00 N ATOM 1852 CA LYS B 34 -2.494 -8.851 0.791 1.00 0.00 C ATOM 1853 C LYS B 34 -2.413 -7.420 1.281 1.00 0.00 C ATOM 1854 O LYS B 34 -1.897 -6.543 0.579 1.00 0.00 O ATOM 1855 CB LYS B 34 -1.088 -9.357 0.499 1.00 0.00 C ATOM 1856 CG LYS B 34 -0.954 -10.866 0.449 1.00 0.00 C ATOM 1857 CD LYS B 34 0.380 -11.301 -0.158 1.00 0.00 C ATOM 1858 CE LYS B 34 1.594 -10.585 0.453 1.00 0.00 C ATOM 1859 NZ LYS B 34 1.722 -10.780 1.931 1.00 0.00 N ATOM 0 H LYS B 34 -2.761 -8.767 -1.250 1.00 0.00 H new ATOM 0 HA LYS B 34 -2.958 -9.467 1.561 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -0.760 -8.945 -0.455 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -0.412 -8.971 1.262 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -1.044 -11.272 1.457 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -1.773 -11.284 -0.137 1.00 0.00 H new ATOM 0 HD2 LYS B 34 0.497 -12.376 -0.024 1.00 0.00 H new ATOM 0 HD3 LYS B 34 0.360 -11.113 -1.232 1.00 0.00 H new ATOM 0 HE2 LYS B 34 2.501 -10.946 -0.033 1.00 0.00 H new ATOM 0 HE3 LYS B 34 1.521 -9.518 0.240 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 1.681 -9.857 2.408 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 0.943 -11.380 2.271 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 2.631 -11.240 2.143 1.00 0.00 H new ATOM 1873 N ILE B 35 -2.956 -7.185 2.443 1.00 0.00 N ATOM 1874 CA ILE B 35 -2.823 -5.919 3.109 1.00 0.00 C ATOM 1875 C ILE B 35 -1.732 -6.121 4.134 1.00 0.00 C ATOM 1876 O ILE B 35 -1.966 -6.702 5.200 1.00 0.00 O ATOM 1877 CB ILE B 35 -4.131 -5.427 3.846 1.00 0.00 C ATOM 1878 CG1 ILE B 35 -5.333 -5.264 2.900 1.00 0.00 C ATOM 1879 CG2 ILE B 35 -3.880 -4.121 4.579 1.00 0.00 C ATOM 1880 CD1 ILE B 35 -6.019 -6.546 2.516 1.00 0.00 C ATOM 0 H ILE B 35 -3.507 -7.871 2.958 1.00 0.00 H new ATOM 0 HA ILE B 35 -2.607 -5.152 2.366 1.00 0.00 H new ATOM 0 HB ILE B 35 -4.384 -6.209 4.562 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -6.062 -4.607 3.374 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -4.996 -4.764 1.992 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -4.795 -3.802 5.079 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -3.093 -4.265 5.320 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -3.571 -3.357 3.866 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -6.852 -6.327 1.848 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -5.310 -7.200 2.009 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -6.393 -7.041 3.412 1.00 0.00 H new ATOM 1892 N ASP B 36 -0.551 -5.732 3.793 1.00 0.00 N ATOM 1893 CA ASP B 36 0.586 -5.966 4.653 1.00 0.00 C ATOM 1894 C ASP B 36 1.058 -4.666 5.231 1.00 0.00 C ATOM 1895 O ASP B 36 1.169 -3.683 4.518 1.00 0.00 O ATOM 1896 CB ASP B 36 1.719 -6.633 3.866 1.00 0.00 C ATOM 1897 CG ASP B 36 2.236 -7.901 4.527 1.00 0.00 C ATOM 1898 OD1 ASP B 36 3.015 -7.815 5.515 1.00 0.00 O ATOM 1899 OD2 ASP B 36 1.886 -9.016 4.054 1.00 0.00 O ATOM 0 H ASP B 36 -0.335 -5.247 2.922 1.00 0.00 H new ATOM 0 HA ASP B 36 0.287 -6.631 5.463 1.00 0.00 H new ATOM 0 HB2 ASP B 36 1.366 -6.871 2.863 1.00 0.00 H new ATOM 0 HB3 ASP B 36 2.542 -5.927 3.755 1.00 0.00 H new ATOM 1904 N LEU B 37 1.287 -4.623 6.515 1.00 0.00 N ATOM 1905 CA LEU B 37 1.777 -3.480 7.127 1.00 0.00 C ATOM 1906 C LEU B 37 3.274 -3.538 6.993 1.00 0.00 C ATOM 1907 O LEU B 37 3.923 -4.522 7.375 1.00 0.00 O ATOM 1908 CB LEU B 37 1.337 -3.469 8.591 1.00 0.00 C ATOM 1909 CG LEU B 37 1.467 -2.161 9.378 1.00 0.00 C ATOM 1910 CD1 LEU B 37 2.896 -1.746 9.535 1.00 0.00 C ATOM 1911 CD2 LEU B 37 0.645 -1.074 8.743 1.00 0.00 C ATOM 0 H LEU B 37 1.127 -5.406 7.149 1.00 0.00 H new ATOM 0 HA LEU B 37 1.399 -2.565 6.671 1.00 0.00 H new ATOM 0 HB2 LEU B 37 0.292 -3.776 8.626 1.00 0.00 H new ATOM 0 HB3 LEU B 37 1.911 -4.232 9.117 1.00 0.00 H new ATOM 0 HG LEU B 37 1.077 -2.338 10.380 1.00 0.00 H new ATOM 0 HD11 LEU B 37 2.944 -0.814 10.099 1.00 0.00 H new ATOM 0 HD12 LEU B 37 3.444 -2.522 10.069 1.00 0.00 H new ATOM 0 HD13 LEU B 37 3.342 -1.599 8.552 1.00 0.00 H new ATOM 0 HD21 LEU B 37 0.752 -0.154 9.318 1.00 0.00 H new ATOM 0 HD22 LEU B 37 0.990 -0.906 7.723 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -0.403 -1.372 8.728 1.00 0.00 H new ATOM 1923 N VAL B 38 3.800 -2.516 6.446 1.00 0.00 N ATOM 1924 CA VAL B 38 5.222 -2.411 6.155 1.00 0.00 C ATOM 1925 C VAL B 38 5.662 -0.972 6.325 1.00 0.00 C ATOM 1926 O VAL B 38 5.072 -0.064 5.739 1.00 0.00 O ATOM 1927 CB VAL B 38 5.574 -2.873 4.693 1.00 0.00 C ATOM 1928 CG1 VAL B 38 7.065 -2.760 4.408 1.00 0.00 C ATOM 1929 CG2 VAL B 38 5.097 -4.290 4.404 1.00 0.00 C ATOM 0 H VAL B 38 3.264 -1.693 6.170 1.00 0.00 H new ATOM 0 HA VAL B 38 5.743 -3.069 6.850 1.00 0.00 H new ATOM 0 HB VAL B 38 5.041 -2.195 4.027 1.00 0.00 H new ATOM 0 HG11 VAL B 38 7.266 -3.089 3.388 1.00 0.00 H new ATOM 0 HG12 VAL B 38 7.380 -1.723 4.524 1.00 0.00 H new ATOM 0 HG13 VAL B 38 7.618 -3.387 5.107 1.00 0.00 H new ATOM 0 HG21 VAL B 38 5.364 -4.562 3.383 1.00 0.00 H new ATOM 0 HG22 VAL B 38 5.571 -4.982 5.100 1.00 0.00 H new ATOM 0 HG23 VAL B 38 4.015 -4.341 4.522 1.00 0.00 H new ATOM 1939 N ASP B 39 6.638 -0.773 7.196 1.00 0.00 N ATOM 1940 CA ASP B 39 7.284 0.532 7.449 1.00 0.00 C ATOM 1941 C ASP B 39 6.258 1.575 7.938 1.00 0.00 C ATOM 1942 O ASP B 39 6.408 2.772 7.763 1.00 0.00 O ATOM 1943 CB ASP B 39 8.039 1.006 6.181 1.00 0.00 C ATOM 1944 CG ASP B 39 9.001 2.154 6.424 1.00 0.00 C ATOM 1945 OD1 ASP B 39 10.125 1.889 6.883 1.00 0.00 O ATOM 1946 OD2 ASP B 39 8.669 3.324 6.105 1.00 0.00 O ATOM 0 H ASP B 39 7.022 -1.525 7.768 1.00 0.00 H new ATOM 0 HA ASP B 39 8.016 0.414 8.248 1.00 0.00 H new ATOM 0 HB2 ASP B 39 8.593 0.164 5.765 1.00 0.00 H new ATOM 0 HB3 ASP B 39 7.310 1.310 5.430 1.00 0.00 H new ATOM 1951 N GLY B 40 5.222 1.096 8.573 1.00 0.00 N ATOM 1952 CA GLY B 40 4.227 1.986 9.122 1.00 0.00 C ATOM 1953 C GLY B 40 3.149 2.377 8.135 1.00 0.00 C ATOM 1954 O GLY B 40 2.359 3.272 8.407 1.00 0.00 O ATOM 0 H GLY B 40 5.043 0.103 8.724 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.762 1.509 9.984 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.720 2.888 9.484 1.00 0.00 H new ATOM 1958 N LYS B 41 3.127 1.760 6.983 1.00 0.00 N ATOM 1959 CA LYS B 41 2.072 2.017 6.034 1.00 0.00 C ATOM 1960 C LYS B 41 1.461 0.723 5.564 1.00 0.00 C ATOM 1961 O LYS B 41 2.040 -0.359 5.769 1.00 0.00 O ATOM 1962 CB LYS B 41 2.504 2.899 4.837 1.00 0.00 C ATOM 1963 CG LYS B 41 3.698 2.417 4.017 1.00 0.00 C ATOM 1964 CD LYS B 41 4.997 3.090 4.435 1.00 0.00 C ATOM 1965 CE LYS B 41 6.136 2.689 3.508 1.00 0.00 C ATOM 1966 NZ LYS B 41 7.368 3.474 3.758 1.00 0.00 N ATOM 0 H LYS B 41 3.823 1.079 6.679 1.00 0.00 H new ATOM 0 HA LYS B 41 1.319 2.599 6.566 1.00 0.00 H new ATOM 0 HB2 LYS B 41 1.651 3.001 4.166 1.00 0.00 H new ATOM 0 HB3 LYS B 41 2.733 3.895 5.215 1.00 0.00 H new ATOM 0 HG2 LYS B 41 3.799 1.337 4.127 1.00 0.00 H new ATOM 0 HG3 LYS B 41 3.513 2.614 2.961 1.00 0.00 H new ATOM 0 HD2 LYS B 41 4.873 4.173 4.418 1.00 0.00 H new ATOM 0 HD3 LYS B 41 5.242 2.813 5.460 1.00 0.00 H new ATOM 0 HE2 LYS B 41 6.351 1.628 3.638 1.00 0.00 H new ATOM 0 HE3 LYS B 41 5.824 2.826 2.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.147 3.088 3.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 7.206 4.467 3.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.616 3.419 4.766 1.00 0.00 H new ATOM 1980 N LEU B 42 0.304 0.815 4.960 1.00 0.00 N ATOM 1981 CA LEU B 42 -0.389 -0.345 4.478 1.00 0.00 C ATOM 1982 C LEU B 42 -0.043 -0.576 3.056 1.00 0.00 C ATOM 1983 O LEU B 42 -0.203 0.295 2.205 1.00 0.00 O ATOM 1984 CB LEU B 42 -1.890 -0.208 4.659 1.00 0.00 C ATOM 1985 CG LEU B 42 -2.363 -0.251 6.092 1.00 0.00 C ATOM 1986 CD1 LEU B 42 -3.796 0.244 6.195 1.00 0.00 C ATOM 1987 CD2 LEU B 42 -2.267 -1.662 6.645 1.00 0.00 C ATOM 0 H LEU B 42 -0.181 1.696 4.790 1.00 0.00 H new ATOM 0 HA LEU B 42 -0.073 -1.208 5.064 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -2.211 0.734 4.214 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -2.383 -1.007 4.105 1.00 0.00 H new ATOM 0 HG LEU B 42 -1.719 0.403 6.680 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -4.120 0.206 7.235 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -3.853 1.271 5.834 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -4.444 -0.390 5.590 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -2.612 -1.672 7.679 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -2.888 -2.330 6.048 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -1.231 -1.999 6.605 1.00 0.00 H new ATOM 1999 N ILE B 43 0.461 -1.706 2.815 1.00 0.00 N ATOM 2000 CA ILE B 43 0.873 -2.082 1.504 1.00 0.00 C ATOM 2001 C ILE B 43 -0.173 -2.974 0.924 1.00 0.00 C ATOM 2002 O ILE B 43 -0.516 -4.010 1.501 1.00 0.00 O ATOM 2003 CB ILE B 43 2.207 -2.840 1.520 1.00 0.00 C ATOM 2004 CG1 ILE B 43 3.240 -2.103 2.362 1.00 0.00 C ATOM 2005 CG2 ILE B 43 2.727 -3.046 0.106 1.00 0.00 C ATOM 2006 CD1 ILE B 43 3.591 -0.707 1.909 1.00 0.00 C ATOM 0 H ILE B 43 0.610 -2.424 3.524 1.00 0.00 H new ATOM 0 HA ILE B 43 1.005 -1.177 0.911 1.00 0.00 H new ATOM 0 HB ILE B 43 2.032 -3.817 1.969 1.00 0.00 H new ATOM 0 HG12 ILE B 43 2.872 -2.049 3.387 1.00 0.00 H new ATOM 0 HG13 ILE B 43 4.154 -2.697 2.382 1.00 0.00 H new ATOM 0 HG21 ILE B 43 3.674 -3.585 0.141 1.00 0.00 H new ATOM 0 HG22 ILE B 43 2.002 -3.623 -0.468 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.879 -2.078 -0.371 1.00 0.00 H new ATOM 0 HD11 ILE B 43 4.335 -0.282 2.583 1.00 0.00 H new ATOM 0 HD12 ILE B 43 3.997 -0.744 0.898 1.00 0.00 H new ATOM 0 HD13 ILE B 43 2.696 -0.086 1.918 1.00 0.00 H new ATOM 2018 N ILE B 44 -0.688 -2.568 -0.172 1.00 0.00 N ATOM 2019 CA ILE B 44 -1.691 -3.312 -0.864 1.00 0.00 C ATOM 2020 C ILE B 44 -1.042 -4.017 -2.029 1.00 0.00 C ATOM 2021 O ILE B 44 -0.661 -3.386 -3.036 1.00 0.00 O ATOM 2022 CB ILE B 44 -2.847 -2.405 -1.378 1.00 0.00 C ATOM 2023 CG1 ILE B 44 -3.517 -1.646 -0.217 1.00 0.00 C ATOM 2024 CG2 ILE B 44 -3.887 -3.215 -2.160 1.00 0.00 C ATOM 2025 CD1 ILE B 44 -4.143 -2.529 0.847 1.00 0.00 C ATOM 0 H ILE B 44 -0.426 -1.695 -0.630 1.00 0.00 H new ATOM 0 HA ILE B 44 -2.130 -4.028 -0.169 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.408 -1.673 -2.057 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -2.773 -1.004 0.256 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -4.288 -0.993 -0.626 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.680 -2.552 -2.505 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.410 -3.687 -3.019 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -4.311 -3.983 -1.513 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -4.589 -1.905 1.621 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -4.914 -3.153 0.395 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.376 -3.164 1.290 1.00 0.00 H new ATOM 2037 N GLU B 45 -0.876 -5.288 -1.884 1.00 0.00 N ATOM 2038 CA GLU B 45 -0.306 -6.097 -2.918 1.00 0.00 C ATOM 2039 C GLU B 45 -1.350 -7.080 -3.344 1.00 0.00 C ATOM 2040 O GLU B 45 -2.145 -7.528 -2.511 1.00 0.00 O ATOM 2041 CB GLU B 45 0.943 -6.857 -2.452 1.00 0.00 C ATOM 2042 CG GLU B 45 2.150 -5.999 -2.146 1.00 0.00 C ATOM 2043 CD GLU B 45 3.362 -6.825 -1.875 1.00 0.00 C ATOM 2044 OE1 GLU B 45 3.589 -7.208 -0.723 1.00 0.00 O ATOM 2045 OE2 GLU B 45 4.128 -7.101 -2.823 1.00 0.00 O ATOM 0 H GLU B 45 -1.132 -5.802 -1.041 1.00 0.00 H new ATOM 0 HA GLU B 45 0.006 -5.448 -3.737 1.00 0.00 H new ATOM 0 HB2 GLU B 45 0.688 -7.427 -1.559 1.00 0.00 H new ATOM 0 HB3 GLU B 45 1.217 -7.578 -3.222 1.00 0.00 H new ATOM 0 HG2 GLU B 45 2.345 -5.333 -2.986 1.00 0.00 H new ATOM 0 HG3 GLU B 45 1.939 -5.369 -1.282 1.00 0.00 H new ATOM 2052 N PRO B 46 -1.402 -7.455 -4.604 1.00 0.00 N ATOM 2053 CA PRO B 46 -2.368 -8.371 -5.045 1.00 0.00 C ATOM 2054 C PRO B 46 -1.855 -9.779 -4.871 1.00 0.00 C ATOM 2055 O PRO B 46 -0.666 -10.009 -4.592 1.00 0.00 O ATOM 2056 CB PRO B 46 -2.552 -8.038 -6.531 1.00 0.00 C ATOM 2057 CG PRO B 46 -1.462 -7.080 -6.865 1.00 0.00 C ATOM 2058 CD PRO B 46 -0.509 -7.088 -5.694 1.00 0.00 C ATOM 0 HA PRO B 46 -3.304 -8.306 -4.490 1.00 0.00 H new ATOM 0 HB2 PRO B 46 -2.486 -8.936 -7.145 1.00 0.00 H new ATOM 0 HB3 PRO B 46 -3.532 -7.597 -6.715 1.00 0.00 H new ATOM 0 HG2 PRO B 46 -0.952 -7.377 -7.782 1.00 0.00 H new ATOM 0 HG3 PRO B 46 -1.862 -6.080 -7.032 1.00 0.00 H new ATOM 0 HD2 PRO B 46 0.298 -7.809 -5.825 1.00 0.00 H new ATOM 0 HD3 PRO B 46 -0.044 -6.115 -5.535 1.00 0.00 H new ATOM 2066 N VAL B 47 -2.703 -10.696 -5.017 1.00 0.00 N ATOM 2067 CA VAL B 47 -2.319 -12.068 -4.925 1.00 0.00 C ATOM 2068 C VAL B 47 -2.612 -12.647 -6.277 1.00 0.00 C ATOM 2069 O VAL B 47 -3.768 -12.673 -6.706 1.00 0.00 O ATOM 2070 CB VAL B 47 -3.100 -12.858 -3.839 1.00 0.00 C ATOM 2071 CG1 VAL B 47 -2.497 -14.203 -3.652 1.00 0.00 C ATOM 2072 CG2 VAL B 47 -3.093 -12.143 -2.520 1.00 0.00 C ATOM 0 H VAL B 47 -3.693 -10.540 -5.205 1.00 0.00 H new ATOM 0 HA VAL B 47 -1.271 -12.140 -4.636 1.00 0.00 H new ATOM 0 HB VAL B 47 -4.130 -12.948 -4.184 1.00 0.00 H new ATOM 0 HG11 VAL B 47 -3.052 -14.748 -2.889 1.00 0.00 H new ATOM 0 HG12 VAL B 47 -2.537 -14.753 -4.592 1.00 0.00 H new ATOM 0 HG13 VAL B 47 -1.459 -14.096 -3.338 1.00 0.00 H new ATOM 0 HG21 VAL B 47 -3.649 -12.727 -1.787 1.00 0.00 H new ATOM 0 HG22 VAL B 47 -2.065 -12.017 -2.180 1.00 0.00 H new ATOM 0 HG23 VAL B 47 -3.560 -11.165 -2.634 1.00 0.00 H new ATOM 2082 N ARG B 48 -1.603 -13.063 -6.959 1.00 0.00 N ATOM 2083 CA ARG B 48 -1.764 -13.480 -8.316 1.00 0.00 C ATOM 2084 C ARG B 48 -2.348 -14.873 -8.441 1.00 0.00 C ATOM 2085 O ARG B 48 -1.941 -15.817 -7.739 1.00 0.00 O ATOM 2086 CB ARG B 48 -0.472 -13.322 -9.119 1.00 0.00 C ATOM 2087 CG ARG B 48 -0.076 -11.869 -9.393 1.00 0.00 C ATOM 2088 CD ARG B 48 1.198 -11.798 -10.217 1.00 0.00 C ATOM 2089 NE ARG B 48 1.580 -10.417 -10.585 1.00 0.00 N ATOM 2090 CZ ARG B 48 2.823 -10.039 -10.951 1.00 0.00 C ATOM 2091 NH1 ARG B 48 3.816 -10.916 -10.928 1.00 0.00 N ATOM 2092 NH2 ARG B 48 3.069 -8.787 -11.319 1.00 0.00 N ATOM 0 H ARG B 48 -0.650 -13.125 -6.601 1.00 0.00 H new ATOM 0 HA ARG B 48 -2.499 -12.807 -8.756 1.00 0.00 H new ATOM 0 HB2 ARG B 48 0.339 -13.812 -8.581 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -0.583 -13.842 -10.071 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -0.883 -11.362 -9.921 1.00 0.00 H new ATOM 0 HG3 ARG B 48 0.067 -11.343 -8.449 1.00 0.00 H new ATOM 0 HD2 ARG B 48 2.012 -12.255 -9.655 1.00 0.00 H new ATOM 0 HD3 ARG B 48 1.068 -12.386 -11.125 1.00 0.00 H new ATOM 0 HE ARG B 48 0.854 -9.701 -10.560 1.00 0.00 H new ATOM 0 HH11 ARG B 48 3.641 -11.877 -10.634 1.00 0.00 H new ATOM 0 HH12 ARG B 48 4.755 -10.630 -11.205 1.00 0.00 H new ATOM 0 HH21 ARG B 48 2.315 -8.100 -11.327 1.00 0.00 H new ATOM 0 HH22 ARG B 48 4.012 -8.512 -11.594 1.00 0.00 H new ATOM 2106 N LYS B 49 -3.320 -14.980 -9.311 1.00 0.00 N ATOM 2107 CA LYS B 49 -3.971 -16.217 -9.615 1.00 0.00 C ATOM 2108 C LYS B 49 -3.205 -16.908 -10.682 1.00 0.00 C ATOM 2109 O LYS B 49 -3.305 -16.580 -11.873 1.00 0.00 O ATOM 2110 CB LYS B 49 -5.432 -16.026 -10.055 1.00 0.00 C ATOM 2111 CG LYS B 49 -6.447 -15.823 -8.932 1.00 0.00 C ATOM 2112 CD LYS B 49 -6.143 -14.624 -8.059 1.00 0.00 C ATOM 2113 CE LYS B 49 -7.284 -14.351 -7.100 1.00 0.00 C ATOM 2114 NZ LYS B 49 -8.524 -13.995 -7.825 1.00 0.00 N ATOM 0 H LYS B 49 -3.685 -14.186 -9.837 1.00 0.00 H new ATOM 0 HA LYS B 49 -3.995 -16.817 -8.706 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -5.480 -15.165 -10.722 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.733 -16.897 -10.637 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -7.440 -15.705 -9.366 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -6.475 -16.718 -8.311 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -5.225 -14.801 -7.498 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -5.971 -13.748 -8.684 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.461 -15.232 -6.483 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.009 -13.540 -6.426 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -9.257 -13.716 -7.142 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -8.333 -13.203 -8.471 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -8.855 -14.816 -8.371 1.00 0.00 H new ATOM 2128 N GLU B 50 -2.405 -17.791 -10.258 1.00 0.00 N ATOM 2129 CA GLU B 50 -1.590 -18.559 -11.122 1.00 0.00 C ATOM 2130 C GLU B 50 -1.606 -19.982 -10.601 1.00 0.00 C ATOM 2131 O GLU B 50 -0.816 -20.314 -9.687 1.00 0.00 O ATOM 2132 CB GLU B 50 -0.182 -17.948 -11.154 1.00 0.00 C ATOM 2133 CG GLU B 50 0.769 -18.541 -12.173 1.00 0.00 C ATOM 2134 CD GLU B 50 2.076 -17.797 -12.198 1.00 0.00 C ATOM 2135 OE1 GLU B 50 2.932 -18.047 -11.322 1.00 0.00 O ATOM 2136 OE2 GLU B 50 2.262 -16.929 -13.077 1.00 0.00 O ATOM 2137 OXT GLU B 50 -2.486 -20.754 -11.028 1.00 0.00 O ATOM 0 H GLU B 50 -2.287 -18.015 -9.270 1.00 0.00 H new ATOM 0 HA GLU B 50 -1.954 -18.561 -12.150 1.00 0.00 H new ATOM 0 HB2 GLU B 50 -0.274 -16.880 -11.349 1.00 0.00 H new ATOM 0 HB3 GLU B 50 0.263 -18.054 -10.165 1.00 0.00 H new ATOM 0 HG2 GLU B 50 0.950 -19.590 -11.938 1.00 0.00 H new ATOM 0 HG3 GLU B 50 0.311 -18.510 -13.162 1.00 0.00 H new TER 2144 GLU B 50