USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=69 USER MOD reduce.3.24.130724 removed 1514 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 66 MET CE :methyl 134:sc= -4.88 (180deg=-10.8!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.137 USER MOD Set 2.1: B 60 LYS NZ :NH3+ -122:sc= -0.355 (180deg=-2.8!) USER MOD Set 2.2: B 61 TYR OH : rot 180:sc= 0.104 USER MOD Set 3.1: B 51 ASN : amide:sc= -0.345 K(o=-2.3,f=-1.2) USER MOD Set 3.2: B 54 GLN : amide:sc= -1.92 K(o=-2.3,f=-1.2) USER MOD Set 4.1: A 66 MET CE :methyl 136:sc= -3.64 (180deg=-9.09!) USER MOD Set 4.2: A 67 THR OG1 : rot 180:sc= -0.286 USER MOD Set 5.1: A 60 LYS NZ :NH3+ -121:sc= -0.182 (180deg=-2.37!) USER MOD Set 5.2: A 61 TYR OH : rot 180:sc= 0.0172 USER MOD Set 6.1: A 51 ASN : amide:sc= -0.451 K(o=-2.6,f=-8.8!) USER MOD Set 6.2: A 54 GLN : amide:sc= -2.18 K(o=-2.6,f=-1.7) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= -0.0236 (180deg=-0.271) USER MOD Single : A 2 SER OG : rot 180:sc= 0.125 USER MOD Single : A 3 ASN : amide:sc= -0.39 X(o=-0.39,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.231 USER MOD Single : A 6 SER OG : rot 113:sc= 1.1 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl 161:sc= -5.61! (180deg=-6.24!) USER MOD Single : A 14 LYS NZ :NH3+ -130:sc= 0.00277 (180deg=-0.536) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -1.55 K(o=-1.5,f=-3.9!) USER MOD Single : A 22 GLN : amide:sc= -0.261 K(o=-0.26,f=-1.1!) USER MOD Single : A 27 THR OG1 : rot -150:sc= -0.0739 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 125:sc= 1.23 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -61:sc= 0.117 USER MOD Single : A 46 THR OG1 : rot -160:sc= 0 USER MOD Single : A 49 MET CE :methyl 161:sc= -2.09 (180deg=-3.74!) USER MOD Single : A 50 MET CE :methyl -164:sc= -0.642 (180deg=-1.4) USER MOD Single : A 55 THR OG1 : rot -160:sc= -0.422 USER MOD Single : A 57 GLN : amide:sc= -3.48 K(o=-3.5,f=-4.3) USER MOD Single : A 59 THR OG1 : rot 60:sc= 1.2 USER MOD Single : A 62 THR OG1 : rot -53:sc= -0.214 USER MOD Single : A 68 ASN : amide:sc= -0.215 K(o=-0.22,f=-2.3!) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 74 SER OG : rot -140:sc= -0.0162 USER MOD Single : A 76 GLN : amide:sc= -0.937 K(o=-0.94,f=-4.8) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 86 GLN : amide:sc=-0.00463 X(o=-0.0046,f=0) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 25:sc= 0.0278 USER MOD Single : A 91 SER OG : rot 41:sc= 0.0304 USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0734 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 154:sc= -0.0502 (180deg=-0.337) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.226 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.132 USER MOD Single : B 6 SER OG : rot 120:sc= -0.671 USER MOD Single : B 8 LYS NZ :NH3+ 152:sc= 0.947 (180deg=0.532) USER MOD Single : B 12 MET CE :methyl -103:sc= -2.61! (180deg=-4.07!) USER MOD Single : B 14 LYS NZ :NH3+ 163:sc= -0.0559 (180deg=-0.381) USER MOD Single : B 15 SER OG : rot -38:sc= -0.0332 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 GLN : amide:sc= -0.48 X(o=-0.48,f=-0.13) USER MOD Single : B 27 THR OG1 : rot -67:sc= 0.11 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot -160:sc= -0.922 USER MOD Single : B 35 SER OG : rot 180:sc= -0.1 USER MOD Single : B 36 TYR OH : rot -102:sc= 0.719 USER MOD Single : B 37 TYR OH : rot 180:sc=-0.00697 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.00747 USER MOD Single : B 46 THR OG1 : rot 60:sc= 0.0281 USER MOD Single : B 49 MET CE :methyl 150:sc= -3.01 (180deg=-5.76!) USER MOD Single : B 50 MET CE :methyl -163:sc= -0.419 (180deg=-1.4) USER MOD Single : B 55 THR OG1 : rot -88:sc= 0.0447 USER MOD Single : B 57 GLN : amide:sc= -2.48! C(o=-2.5!,f=-3.6!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot -150:sc=-0.00397 USER MOD Single : B 68 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.39) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot -120:sc= -0.209 USER MOD Single : B 76 GLN : amide:sc= -0.956 K(o=-0.96,f=-6.4!) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 87 ASN : amide:sc= -0.554 K(o=-0.55,f=-2.9!) USER MOD Single : B 89 THR OG1 : rot 180:sc= -0.0213 USER MOD Single : B 90 THR OG1 : rot 180:sc= 0 USER MOD Single : B 91 SER OG : rot 35:sc=0.000199 USER MOD Single : B 93 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.42) USER MOD Single : B 94 SER OG : rot 180:sc= 0 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.002 -1.974 -5.585 1.00 52.20 N ATOM 2 CA MET A 1 -0.697 -0.695 -5.628 1.00 50.55 C ATOM 3 C MET A 1 0.246 0.451 -5.273 1.00 74.40 C ATOM 4 O MET A 1 -0.182 1.477 -4.742 1.00 64.45 O ATOM 5 CB MET A 1 -1.888 -0.708 -4.667 1.00 3.44 C ATOM 6 CG MET A 1 -3.087 0.075 -5.177 1.00 12.32 C ATOM 7 SD MET A 1 -4.037 -0.835 -6.410 1.00 41.14 S ATOM 8 CE MET A 1 -5.632 -0.938 -5.601 1.00 21.33 C ATOM 0 H1 MET A 1 -0.691 -2.749 -5.610 1.00 52.20 H new ATOM 0 H2 MET A 1 0.637 -2.050 -6.405 1.00 52.20 H new ATOM 0 H3 MET A 1 0.559 -2.036 -4.709 1.00 52.20 H new ATOM 0 HA MET A 1 -1.061 -0.541 -6.644 1.00 50.55 H new ATOM 0 HB2 MET A 1 -2.188 -1.740 -4.487 1.00 3.44 H new ATOM 0 HB3 MET A 1 -1.575 -0.295 -3.708 1.00 3.44 H new ATOM 0 HG2 MET A 1 -3.735 0.327 -4.338 1.00 12.32 H new ATOM 0 HG3 MET A 1 -2.745 1.015 -5.609 1.00 12.32 H new ATOM 0 HE1 MET A 1 -6.331 -1.476 -6.242 1.00 21.33 H new ATOM 0 HE2 MET A 1 -5.526 -1.468 -4.654 1.00 21.33 H new ATOM 0 HE3 MET A 1 -6.011 0.067 -5.414 1.00 21.33 H new ATOM 18 N SER A 2 1.529 0.270 -5.567 1.00 63.31 N ATOM 19 CA SER A 2 2.532 1.287 -5.274 1.00 1.32 C ATOM 20 C SER A 2 2.267 2.557 -6.077 1.00 12.31 C ATOM 21 O SER A 2 1.853 2.498 -7.234 1.00 62.31 O ATOM 22 CB SER A 2 3.933 0.757 -5.585 1.00 41.23 C ATOM 23 OG SER A 2 3.881 -0.301 -6.526 1.00 50.11 O ATOM 0 H SER A 2 1.899 -0.572 -6.008 1.00 63.31 H new ATOM 0 HA SER A 2 2.470 1.528 -4.213 1.00 1.32 H new ATOM 0 HB2 SER A 2 4.552 1.565 -5.975 1.00 41.23 H new ATOM 0 HB3 SER A 2 4.405 0.408 -4.667 1.00 41.23 H new ATOM 0 HG SER A 2 4.789 -0.621 -6.709 1.00 50.11 H new ATOM 29 N ASN A 3 2.509 3.706 -5.453 1.00 52.21 N ATOM 30 CA ASN A 3 2.296 4.991 -6.108 1.00 14.51 C ATOM 31 C ASN A 3 3.562 5.841 -6.062 1.00 2.30 C ATOM 32 O ASN A 3 3.807 6.560 -5.092 1.00 44.20 O ATOM 33 CB ASN A 3 1.141 5.742 -5.443 1.00 31.41 C ATOM 34 CG ASN A 3 -0.175 4.998 -5.561 1.00 63.51 C ATOM 35 OD1 ASN A 3 -0.898 4.831 -4.578 1.00 34.44 O ATOM 36 ND2 ASN A 3 -0.494 4.545 -6.768 1.00 13.33 N ATOM 0 H ASN A 3 2.853 3.773 -4.495 1.00 52.21 H new ATOM 0 HA ASN A 3 2.044 4.801 -7.151 1.00 14.51 H new ATOM 0 HB2 ASN A 3 1.373 5.901 -4.390 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.041 6.727 -5.899 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -1.367 4.037 -6.908 1.00 13.33 H new ATOM 0 HD22 ASN A 3 0.134 4.706 -7.555 1.00 13.33 H new ATOM 43 N THR A 4 4.366 5.755 -7.118 1.00 55.11 N ATOM 44 CA THR A 4 5.607 6.515 -7.199 1.00 61.02 C ATOM 45 C THR A 4 5.335 8.015 -7.178 1.00 34.12 C ATOM 46 O THR A 4 4.202 8.447 -6.967 1.00 24.32 O ATOM 47 CB THR A 4 6.398 6.165 -8.473 1.00 65.03 C ATOM 48 OG1 THR A 4 7.767 6.558 -8.324 1.00 41.45 O ATOM 49 CG2 THR A 4 5.796 6.854 -9.690 1.00 24.23 C ATOM 0 H THR A 4 4.179 5.166 -7.929 1.00 55.11 H new ATOM 0 HA THR A 4 6.201 6.244 -6.326 1.00 61.02 H new ATOM 0 HB THR A 4 6.345 5.087 -8.622 1.00 65.03 H new ATOM 0 HG1 THR A 4 8.263 6.330 -9.138 1.00 41.45 H new ATOM 0 HG21 THR A 4 6.371 6.592 -10.578 1.00 24.23 H new ATOM 0 HG22 THR A 4 4.763 6.530 -9.818 1.00 24.23 H new ATOM 0 HG23 THR A 4 5.822 7.934 -9.546 1.00 24.23 H new ATOM 57 N ILE A 5 6.382 8.803 -7.399 1.00 21.33 N ATOM 58 CA ILE A 5 6.255 10.256 -7.406 1.00 1.35 C ATOM 59 C ILE A 5 5.129 10.704 -8.333 1.00 62.20 C ATOM 60 O ILE A 5 4.193 11.380 -7.906 1.00 53.40 O ATOM 61 CB ILE A 5 7.566 10.933 -7.847 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.734 10.433 -6.994 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.440 12.446 -7.747 1.00 34.15 C ATOM 64 CD1 ILE A 5 10.053 11.095 -7.329 1.00 64.05 C ATOM 0 H ILE A 5 7.327 8.461 -7.575 1.00 21.33 H new ATOM 0 HA ILE A 5 6.025 10.558 -6.384 1.00 1.35 H new ATOM 0 HB ILE A 5 7.761 10.672 -8.887 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.506 10.607 -5.942 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.834 9.355 -7.125 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.374 12.911 -8.062 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.630 12.787 -8.392 1.00 34.15 H new ATOM 0 HG23 ILE A 5 7.225 12.726 -6.716 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.836 10.693 -6.686 1.00 64.05 H new ATOM 0 HD12 ILE A 5 10.304 10.900 -8.372 1.00 64.05 H new ATOM 0 HD13 ILE A 5 9.971 12.170 -7.171 1.00 64.05 H new ATOM 76 N SER A 6 5.226 10.320 -9.601 1.00 63.44 N ATOM 77 CA SER A 6 4.216 10.684 -10.590 1.00 34.41 C ATOM 78 C SER A 6 2.819 10.327 -10.095 1.00 2.22 C ATOM 79 O SER A 6 1.885 11.121 -10.210 1.00 53.23 O ATOM 80 CB SER A 6 4.495 9.979 -11.918 1.00 71.40 C ATOM 81 OG SER A 6 3.623 8.878 -12.104 1.00 42.32 O ATOM 0 H SER A 6 5.993 9.757 -9.969 1.00 63.44 H new ATOM 0 HA SER A 6 4.264 11.762 -10.743 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.375 10.685 -12.740 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.529 9.636 -11.941 1.00 71.40 H new ATOM 0 HG SER A 6 3.015 9.065 -12.850 1.00 42.32 H new ATOM 87 N GLU A 7 2.682 9.125 -9.542 1.00 61.11 N ATOM 88 CA GLU A 7 1.398 8.661 -9.030 1.00 23.42 C ATOM 89 C GLU A 7 0.832 9.645 -8.010 1.00 40.04 C ATOM 90 O GLU A 7 -0.383 9.801 -7.887 1.00 33.31 O ATOM 91 CB GLU A 7 1.547 7.278 -8.392 1.00 72.32 C ATOM 92 CG GLU A 7 1.839 6.175 -9.395 1.00 53.22 C ATOM 93 CD GLU A 7 0.592 5.415 -9.806 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.287 6.025 -10.450 1.00 50.32 O ATOM 95 OE2 GLU A 7 0.496 4.213 -9.485 1.00 43.33 O ATOM 0 H GLU A 7 3.444 8.456 -9.437 1.00 61.11 H new ATOM 0 HA GLU A 7 0.705 8.593 -9.868 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.351 7.311 -7.656 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.631 7.035 -7.853 1.00 72.32 H new ATOM 0 HG2 GLU A 7 2.304 6.608 -10.280 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.559 5.479 -8.965 1.00 53.22 H new ATOM 102 N LYS A 8 1.722 10.308 -7.278 1.00 33.13 N ATOM 103 CA LYS A 8 1.313 11.277 -6.269 1.00 4.14 C ATOM 104 C LYS A 8 0.646 12.488 -6.915 1.00 74.14 C ATOM 105 O LYS A 8 -0.238 13.109 -6.326 1.00 64.53 O ATOM 106 CB LYS A 8 2.522 11.727 -5.447 1.00 75.53 C ATOM 107 CG LYS A 8 3.438 10.586 -5.036 1.00 22.34 C ATOM 108 CD LYS A 8 4.223 10.926 -3.781 1.00 11.10 C ATOM 109 CE LYS A 8 3.965 9.917 -2.671 1.00 11.21 C ATOM 110 NZ LYS A 8 5.232 9.441 -2.049 1.00 5.33 N ATOM 0 H LYS A 8 2.732 10.191 -7.365 1.00 33.13 H new ATOM 0 HA LYS A 8 0.591 10.795 -5.610 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.095 12.451 -6.026 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.171 12.241 -4.552 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.846 9.687 -4.864 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.129 10.362 -5.849 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.288 10.950 -4.012 1.00 11.10 H new ATOM 0 HD3 LYS A 8 3.949 11.924 -3.438 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.333 10.371 -1.907 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.416 9.066 -3.074 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 5.014 8.756 -1.298 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.824 8.985 -2.772 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.744 10.249 -1.642 1.00 5.33 H new ATOM 124 N ILE A 9 1.075 12.815 -8.130 1.00 15.20 N ATOM 125 CA ILE A 9 0.517 13.949 -8.856 1.00 41.10 C ATOM 126 C ILE A 9 -0.577 13.500 -9.819 1.00 71.21 C ATOM 127 O ILE A 9 -1.094 14.297 -10.603 1.00 5.21 O ATOM 128 CB ILE A 9 1.603 14.701 -9.646 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.863 14.868 -8.792 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.084 16.056 -10.103 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.008 15.529 -9.528 1.00 55.24 C ATOM 0 H ILE A 9 1.806 12.311 -8.631 1.00 15.20 H new ATOM 0 HA ILE A 9 0.090 14.621 -8.112 1.00 41.10 H new ATOM 0 HB ILE A 9 1.860 14.115 -10.529 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.619 15.460 -7.910 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.186 13.888 -8.439 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.864 16.575 -10.660 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.213 15.915 -10.743 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.803 16.650 -9.233 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.867 15.615 -8.863 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.279 14.927 -10.395 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.704 16.522 -9.857 1.00 55.24 H new ATOM 143 N VAL A 10 -0.928 12.220 -9.753 1.00 4.30 N ATOM 144 CA VAL A 10 -1.963 11.665 -10.616 1.00 43.34 C ATOM 145 C VAL A 10 -3.261 11.447 -9.848 1.00 34.04 C ATOM 146 O VAL A 10 -4.330 11.885 -10.276 1.00 71.51 O ATOM 147 CB VAL A 10 -1.518 10.329 -11.240 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.633 9.737 -12.087 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.254 10.521 -12.065 1.00 51.14 C ATOM 0 H VAL A 10 -0.510 11.547 -9.110 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.133 12.390 -11.412 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.296 9.628 -10.435 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.300 8.794 -12.519 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.509 9.561 -11.463 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -2.891 10.432 -12.887 1.00 23.30 H new ATOM 0 HG21 VAL A 10 0.046 9.567 -12.498 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.446 11.238 -12.863 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.545 10.896 -11.425 1.00 51.14 H new ATOM 159 N LEU A 11 -3.162 10.770 -8.710 1.00 33.50 N ATOM 160 CA LEU A 11 -4.329 10.493 -7.880 1.00 22.11 C ATOM 161 C LEU A 11 -5.042 11.786 -7.494 1.00 23.40 C ATOM 162 O LEU A 11 -6.249 11.924 -7.692 1.00 73.14 O ATOM 163 CB LEU A 11 -3.914 9.731 -6.620 1.00 73.11 C ATOM 164 CG LEU A 11 -2.684 10.265 -5.887 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.099 11.112 -4.693 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.787 9.119 -5.443 1.00 62.13 C ATOM 0 H LEU A 11 -2.285 10.402 -8.340 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.018 9.878 -8.459 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.754 9.732 -5.926 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.727 8.692 -6.893 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.121 10.895 -6.576 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.210 11.483 -4.184 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.699 11.955 -5.036 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.686 10.505 -4.003 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.916 9.519 -4.923 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.341 8.462 -4.772 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.460 8.554 -6.316 1.00 62.13 H new ATOM 178 N MET A 12 -4.285 12.731 -6.946 1.00 51.31 N ATOM 179 CA MET A 12 -4.843 14.014 -6.536 1.00 35.35 C ATOM 180 C MET A 12 -5.424 14.761 -7.732 1.00 14.33 C ATOM 181 O MET A 12 -6.543 15.272 -7.674 1.00 15.55 O ATOM 182 CB MET A 12 -3.771 14.869 -5.858 1.00 43.44 C ATOM 183 CG MET A 12 -2.475 14.955 -6.646 1.00 42.04 C ATOM 184 SD MET A 12 -2.272 16.543 -7.478 1.00 23.34 S ATOM 185 CE MET A 12 -0.564 16.914 -7.086 1.00 1.34 C ATOM 0 H MET A 12 -3.284 12.632 -6.776 1.00 51.31 H new ATOM 0 HA MET A 12 -5.646 13.821 -5.825 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.162 15.875 -5.707 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.560 14.457 -4.871 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.633 14.792 -5.973 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.451 14.155 -7.386 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.186 17.663 -7.781 1.00 1.34 H new ATOM 0 HE2 MET A 12 -0.500 17.298 -6.068 1.00 1.34 H new ATOM 0 HE3 MET A 12 0.034 16.006 -7.170 1.00 1.34 H new ATOM 195 N ARG A 13 -4.656 14.821 -8.816 1.00 72.22 N ATOM 196 CA ARG A 13 -5.095 15.508 -10.025 1.00 43.34 C ATOM 197 C ARG A 13 -6.454 14.989 -10.482 1.00 25.20 C ATOM 198 O ARG A 13 -7.340 15.767 -10.839 1.00 32.00 O ATOM 199 CB ARG A 13 -4.065 15.324 -11.142 1.00 43.40 C ATOM 200 CG ARG A 13 -4.171 16.366 -12.245 1.00 23.54 C ATOM 201 CD ARG A 13 -4.379 15.716 -13.605 1.00 1.24 C ATOM 202 NE ARG A 13 -3.413 16.193 -14.592 1.00 13.15 N ATOM 203 CZ ARG A 13 -2.114 15.918 -14.540 1.00 62.43 C ATOM 204 NH1 ARG A 13 -1.629 15.174 -13.556 1.00 34.04 N ATOM 205 NH2 ARG A 13 -1.298 16.388 -15.476 1.00 3.12 N ATOM 0 H ARG A 13 -3.728 14.403 -8.881 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.189 16.570 -9.797 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.064 15.363 -10.712 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.187 14.332 -11.578 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.000 17.041 -12.032 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -3.265 16.971 -12.264 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -4.293 14.634 -13.507 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -5.390 15.925 -13.956 1.00 1.24 H new ATOM 0 HE ARG A 13 -3.754 16.768 -15.362 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -2.253 14.811 -12.836 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -0.631 14.965 -13.519 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -1.668 16.960 -16.235 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -0.301 16.177 -15.436 1.00 3.12 H new ATOM 219 N LYS A 14 -6.614 13.670 -10.470 1.00 43.14 N ATOM 220 CA LYS A 14 -7.866 13.046 -10.882 1.00 24.33 C ATOM 221 C LYS A 14 -9.001 13.429 -9.938 1.00 14.43 C ATOM 222 O LYS A 14 -10.176 13.320 -10.289 1.00 20.12 O ATOM 223 CB LYS A 14 -7.712 11.524 -10.920 1.00 73.54 C ATOM 224 CG LYS A 14 -7.624 10.957 -12.326 1.00 21.53 C ATOM 225 CD LYS A 14 -6.186 10.657 -12.717 1.00 2.42 C ATOM 226 CE LYS A 14 -5.530 11.854 -13.390 1.00 1.21 C ATOM 227 NZ LYS A 14 -4.784 11.461 -14.616 1.00 3.32 N ATOM 0 H LYS A 14 -5.891 13.012 -10.179 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.111 13.406 -11.881 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -6.815 11.244 -10.367 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.558 11.069 -10.406 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.217 10.045 -12.389 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -8.054 11.666 -13.033 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -5.617 10.380 -11.830 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.162 9.801 -13.391 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -6.293 12.588 -13.649 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -4.848 12.336 -12.689 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -3.825 11.862 -14.582 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -4.724 10.424 -14.668 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.281 11.822 -15.455 1.00 3.32 H new ATOM 241 N SER A 15 -8.642 13.880 -8.741 1.00 0.52 N ATOM 242 CA SER A 15 -9.632 14.277 -7.745 1.00 34.52 C ATOM 243 C SER A 15 -10.290 15.599 -8.131 1.00 4.13 C ATOM 244 O SER A 15 -11.445 15.851 -7.789 1.00 42.32 O ATOM 245 CB SER A 15 -8.979 14.403 -6.368 1.00 23.33 C ATOM 246 OG SER A 15 -9.941 14.292 -5.334 1.00 1.04 O ATOM 0 H SER A 15 -7.674 13.980 -8.436 1.00 0.52 H new ATOM 0 HA SER A 15 -10.401 13.506 -7.705 1.00 34.52 H new ATOM 0 HB2 SER A 15 -8.222 13.628 -6.249 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.468 15.362 -6.291 1.00 23.33 H new ATOM 0 HG SER A 15 -9.497 14.374 -4.464 1.00 1.04 H new ATOM 252 N GLU A 16 -9.546 16.436 -8.847 1.00 24.43 N ATOM 253 CA GLU A 16 -10.057 17.731 -9.279 1.00 22.34 C ATOM 254 C GLU A 16 -10.980 17.578 -10.485 1.00 32.11 C ATOM 255 O GLU A 16 -11.609 18.540 -10.926 1.00 43.32 O ATOM 256 CB GLU A 16 -8.901 18.672 -9.625 1.00 13.35 C ATOM 257 CG GLU A 16 -9.322 20.123 -9.786 1.00 62.31 C ATOM 258 CD GLU A 16 -9.948 20.691 -8.527 1.00 2.34 C ATOM 259 OE1 GLU A 16 -9.453 20.379 -7.425 1.00 14.23 O ATOM 260 OE2 GLU A 16 -10.935 21.448 -8.646 1.00 72.53 O ATOM 0 H GLU A 16 -8.589 16.241 -9.140 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.630 18.158 -8.456 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.145 18.607 -8.843 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.433 18.334 -10.550 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.453 20.722 -10.057 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.033 20.202 -10.609 1.00 62.31 H new ATOM 267 N TYR A 17 -11.055 16.362 -11.013 1.00 34.24 N ATOM 268 CA TYR A 17 -11.898 16.081 -12.170 1.00 3.21 C ATOM 269 C TYR A 17 -11.480 16.930 -13.366 1.00 63.52 C ATOM 270 O TYR A 17 -12.286 17.208 -14.257 1.00 30.34 O ATOM 271 CB TYR A 17 -13.367 16.343 -11.832 1.00 21.42 C ATOM 272 CG TYR A 17 -14.069 15.153 -11.219 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.722 14.692 -9.955 1.00 22.22 C ATOM 274 CD2 TYR A 17 -15.080 14.489 -11.903 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.361 13.604 -9.391 1.00 21.13 C ATOM 276 CE2 TYR A 17 -15.725 13.401 -11.347 1.00 50.43 C ATOM 277 CZ TYR A 17 -15.361 12.963 -10.091 1.00 22.22 C ATOM 278 OH TYR A 17 -16.001 11.879 -9.532 1.00 41.24 O ATOM 0 H TYR A 17 -10.542 15.554 -10.659 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.774 15.030 -12.432 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.428 17.185 -11.142 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.893 16.636 -12.740 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -12.940 15.192 -9.404 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -15.367 14.830 -12.887 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -14.079 13.258 -8.408 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -16.509 12.897 -11.892 1.00 50.43 H new ATOM 0 HH TYR A 17 -16.680 11.544 -10.154 1.00 41.24 H new ATOM 288 N LEU A 18 -10.216 17.337 -13.382 1.00 50.01 N ATOM 289 CA LEU A 18 -9.689 18.154 -14.470 1.00 55.21 C ATOM 290 C LEU A 18 -8.891 17.303 -15.453 1.00 11.42 C ATOM 291 O LEU A 18 -8.564 16.150 -15.168 1.00 23.51 O ATOM 292 CB LEU A 18 -8.806 19.272 -13.913 1.00 71.45 C ATOM 293 CG LEU A 18 -7.495 18.831 -13.263 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.402 18.684 -14.310 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.074 19.821 -12.186 1.00 52.43 C ATOM 0 H LEU A 18 -9.537 17.115 -12.654 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.532 18.595 -15.001 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.572 19.961 -14.724 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.383 19.831 -13.177 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.654 17.860 -12.794 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.476 18.369 -13.828 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.700 17.937 -15.045 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.245 19.640 -14.808 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.139 19.491 -11.734 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.934 20.806 -12.632 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -7.848 19.876 -11.420 1.00 52.43 H new ATOM 307 N SER A 19 -8.580 17.878 -16.609 1.00 75.14 N ATOM 308 CA SER A 19 -7.821 17.172 -17.635 1.00 42.32 C ATOM 309 C SER A 19 -6.385 17.684 -17.698 1.00 72.22 C ATOM 310 O SER A 19 -6.075 18.760 -17.185 1.00 2.13 O ATOM 311 CB SER A 19 -8.493 17.336 -18.999 1.00 3.34 C ATOM 312 OG SER A 19 -9.445 16.312 -19.226 1.00 61.02 O ATOM 0 H SER A 19 -8.842 18.831 -16.860 1.00 75.14 H new ATOM 0 HA SER A 19 -7.800 16.114 -17.373 1.00 42.32 H new ATOM 0 HB2 SER A 19 -8.981 18.309 -19.052 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.738 17.315 -19.785 1.00 3.34 H new ATOM 0 HG SER A 19 -9.861 16.441 -20.104 1.00 61.02 H new ATOM 318 N ARG A 20 -5.513 16.905 -18.328 1.00 71.01 N ATOM 319 CA ARG A 20 -4.109 17.277 -18.458 1.00 24.20 C ATOM 320 C ARG A 20 -3.971 18.688 -19.021 1.00 73.30 C ATOM 321 O ARG A 20 -3.006 19.393 -18.726 1.00 23.14 O ATOM 322 CB ARG A 20 -3.376 16.282 -19.359 1.00 14.35 C ATOM 323 CG ARG A 20 -2.507 15.296 -18.597 1.00 64.12 C ATOM 324 CD ARG A 20 -1.477 14.643 -19.506 1.00 52.12 C ATOM 325 NE ARG A 20 -2.062 13.584 -20.324 1.00 31.03 N ATOM 326 CZ ARG A 20 -2.475 12.420 -19.836 1.00 33.21 C ATOM 327 NH1 ARG A 20 -2.368 12.167 -18.538 1.00 13.10 N ATOM 328 NH2 ARG A 20 -2.997 11.507 -20.644 1.00 51.12 N ATOM 0 H ARG A 20 -5.754 16.011 -18.757 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.660 17.255 -17.465 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -4.109 15.729 -19.947 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.753 16.833 -20.063 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -2.000 15.811 -17.781 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -3.136 14.528 -18.147 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.034 15.399 -20.154 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.670 14.230 -18.901 1.00 52.12 H new ATOM 0 HE ARG A 20 -2.159 13.748 -21.326 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -1.968 12.867 -17.913 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -2.686 11.272 -18.165 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -3.082 11.698 -21.642 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -3.314 10.614 -20.267 1.00 51.12 H new ATOM 342 N GLN A 21 -4.941 19.093 -19.835 1.00 33.24 N ATOM 343 CA GLN A 21 -4.926 20.418 -20.441 1.00 62.13 C ATOM 344 C GLN A 21 -5.310 21.487 -19.422 1.00 32.54 C ATOM 345 O GLN A 21 -4.730 22.572 -19.398 1.00 15.25 O ATOM 346 CB GLN A 21 -5.881 20.468 -21.635 1.00 31.45 C ATOM 347 CG GLN A 21 -7.323 20.150 -21.273 1.00 12.41 C ATOM 348 CD GLN A 21 -8.118 21.386 -20.901 1.00 73.14 C ATOM 349 OE1 GLN A 21 -7.610 22.507 -20.962 1.00 3.42 O ATOM 350 NE2 GLN A 21 -9.373 21.189 -20.512 1.00 2.12 N ATOM 0 H GLN A 21 -5.747 18.522 -20.090 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.912 20.619 -20.788 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.838 21.461 -22.083 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -5.541 19.761 -22.392 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -7.804 19.653 -22.116 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -7.338 19.449 -20.439 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -9.753 20.243 -20.476 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -9.956 21.984 -20.249 1.00 2.12 H new ATOM 359 N GLN A 22 -6.292 21.172 -18.583 1.00 51.23 N ATOM 360 CA GLN A 22 -6.755 22.106 -17.564 1.00 0.45 C ATOM 361 C GLN A 22 -5.615 22.497 -16.628 1.00 51.31 C ATOM 362 O GLN A 22 -5.354 23.681 -16.412 1.00 43.21 O ATOM 363 CB GLN A 22 -7.902 21.491 -16.762 1.00 11.44 C ATOM 364 CG GLN A 22 -8.386 22.371 -15.620 1.00 2.14 C ATOM 365 CD GLN A 22 -8.773 23.763 -16.080 1.00 62.24 C ATOM 366 OE1 GLN A 22 -7.921 24.640 -16.226 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.064 23.973 -16.311 1.00 62.52 N ATOM 0 H GLN A 22 -6.782 20.277 -18.589 1.00 51.23 H new ATOM 0 HA GLN A 22 -7.114 23.005 -18.065 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.737 21.290 -17.433 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.579 20.531 -16.358 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -9.244 21.899 -15.141 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -7.602 22.446 -14.867 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -10.736 23.217 -16.177 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -10.384 24.890 -16.622 1.00 62.52 H new ATOM 376 N LEU A 23 -4.942 21.495 -16.073 1.00 1.25 N ATOM 377 CA LEU A 23 -3.831 21.734 -15.158 1.00 22.42 C ATOM 378 C LEU A 23 -2.646 22.354 -15.892 1.00 63.10 C ATOM 379 O LEU A 23 -2.021 23.294 -15.399 1.00 73.44 O ATOM 380 CB LEU A 23 -3.403 20.425 -14.492 1.00 64.12 C ATOM 381 CG LEU A 23 -1.998 20.406 -13.891 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.791 21.605 -12.978 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.760 19.109 -13.131 1.00 24.14 C ATOM 0 H LEU A 23 -5.146 20.510 -16.240 1.00 1.25 H new ATOM 0 HA LEU A 23 -4.167 22.432 -14.392 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -4.117 20.192 -13.702 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.472 19.626 -15.230 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.276 20.465 -14.705 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.785 21.574 -12.559 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -1.918 22.524 -13.550 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.521 21.577 -12.169 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.755 19.113 -12.710 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -2.490 19.020 -12.326 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -1.865 18.264 -13.812 1.00 24.14 H new ATOM 395 N ALA A 24 -2.344 21.825 -17.073 1.00 40.14 N ATOM 396 CA ALA A 24 -1.237 22.330 -17.876 1.00 33.11 C ATOM 397 C ALA A 24 -1.356 23.836 -18.089 1.00 23.23 C ATOM 398 O ALA A 24 -0.353 24.526 -18.271 1.00 34.43 O ATOM 399 CB ALA A 24 -1.185 21.608 -19.215 1.00 43.12 C ATOM 0 H ALA A 24 -2.851 21.047 -17.495 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.310 22.138 -17.335 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.354 21.995 -19.805 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -1.045 20.540 -19.047 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -2.119 21.772 -19.753 1.00 43.12 H new ATOM 405 N ASP A 25 -2.585 24.337 -18.063 1.00 0.02 N ATOM 406 CA ASP A 25 -2.834 25.762 -18.253 1.00 72.22 C ATOM 407 C ASP A 25 -2.862 26.491 -16.914 1.00 62.10 C ATOM 408 O ASP A 25 -2.621 27.697 -16.846 1.00 11.21 O ATOM 409 CB ASP A 25 -4.155 25.976 -18.993 1.00 75.11 C ATOM 410 CG ASP A 25 -3.951 26.488 -20.406 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.234 25.821 -21.181 1.00 73.30 O ATOM 412 OD2 ASP A 25 -4.510 27.554 -20.737 1.00 32.35 O ATOM 0 H ASP A 25 -3.425 23.778 -17.912 1.00 0.02 H new ATOM 0 HA ASP A 25 -2.021 26.172 -18.852 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.706 25.036 -19.026 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.768 26.685 -18.438 1.00 75.11 H new ATOM 417 N LEU A 26 -3.160 25.753 -15.850 1.00 11.45 N ATOM 418 CA LEU A 26 -3.221 26.330 -14.511 1.00 42.33 C ATOM 419 C LEU A 26 -1.847 26.817 -14.065 1.00 31.40 C ATOM 420 O LEU A 26 -1.731 27.802 -13.336 1.00 63.25 O ATOM 421 CB LEU A 26 -3.758 25.300 -13.516 1.00 5.25 C ATOM 422 CG LEU A 26 -5.162 25.564 -12.969 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.127 24.485 -13.435 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.136 25.639 -11.450 1.00 64.15 C ATOM 0 H LEU A 26 -3.363 24.754 -15.888 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.896 27.185 -14.540 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.756 24.323 -13.998 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.067 25.242 -12.675 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.508 26.523 -13.354 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.121 24.689 -13.036 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.167 24.479 -14.524 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.786 23.513 -13.079 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.143 25.827 -11.078 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -4.770 24.695 -11.045 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.476 26.448 -11.137 1.00 64.15 H new ATOM 436 N THR A 27 -0.805 26.121 -14.509 1.00 4.14 N ATOM 437 CA THR A 27 0.562 26.482 -14.157 1.00 54.35 C ATOM 438 C THR A 27 1.323 27.008 -15.368 1.00 0.33 C ATOM 439 O THR A 27 2.339 27.686 -15.230 1.00 41.53 O ATOM 440 CB THR A 27 1.327 25.281 -13.567 1.00 71.31 C ATOM 441 OG1 THR A 27 2.725 25.583 -13.485 1.00 70.12 O ATOM 442 CG2 THR A 27 1.122 24.038 -14.419 1.00 31.12 C ATOM 0 H THR A 27 -0.882 25.303 -15.114 1.00 4.14 H new ATOM 0 HA THR A 27 0.496 27.267 -13.404 1.00 54.35 H new ATOM 0 HB THR A 27 0.938 25.086 -12.568 1.00 71.31 H new ATOM 0 HG1 THR A 27 3.244 24.757 -13.581 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.671 23.203 -13.983 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.060 23.794 -14.457 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.487 24.225 -15.429 1.00 31.12 H new ATOM 450 N GLY A 28 0.821 26.691 -16.558 1.00 71.14 N ATOM 451 CA GLY A 28 1.465 27.141 -17.778 1.00 55.42 C ATOM 452 C GLY A 28 2.512 26.164 -18.276 1.00 63.01 C ATOM 453 O GLY A 28 3.327 26.501 -19.135 1.00 24.43 O ATOM 0 H GLY A 28 -0.020 26.131 -16.699 1.00 71.14 H new ATOM 0 HA2 GLY A 28 0.711 27.286 -18.551 1.00 55.42 H new ATOM 0 HA3 GLY A 28 1.931 28.110 -17.603 1.00 55.42 H new ATOM 457 N VAL A 29 2.491 24.950 -17.735 1.00 50.12 N ATOM 458 CA VAL A 29 3.446 23.921 -18.129 1.00 54.03 C ATOM 459 C VAL A 29 3.122 23.372 -19.514 1.00 24.12 C ATOM 460 O VAL A 29 1.967 23.332 -19.938 1.00 11.23 O ATOM 461 CB VAL A 29 3.464 22.758 -17.120 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.176 21.439 -17.820 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.800 22.705 -16.394 1.00 50.23 C ATOM 0 H VAL A 29 1.823 24.655 -17.023 1.00 50.12 H new ATOM 0 HA VAL A 29 4.429 24.392 -18.149 1.00 54.03 H new ATOM 0 HB VAL A 29 2.681 22.928 -16.381 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.193 20.629 -17.091 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.194 21.484 -18.290 1.00 14.34 H new ATOM 0 HG13 VAL A 29 3.935 21.258 -18.581 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.796 21.877 -15.685 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.602 22.559 -17.118 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.961 23.641 -15.859 1.00 50.23 H new ATOM 473 N PRO A 30 4.165 22.939 -20.238 1.00 5.34 N ATOM 474 CA PRO A 30 4.018 22.384 -21.586 1.00 54.13 C ATOM 475 C PRO A 30 3.331 21.023 -21.580 1.00 3.43 C ATOM 476 O PRO A 30 3.867 20.048 -21.052 1.00 5.21 O ATOM 477 CB PRO A 30 5.462 22.253 -22.075 1.00 44.23 C ATOM 478 CG PRO A 30 6.273 22.129 -20.832 1.00 71.13 C ATOM 479 CD PRO A 30 5.570 22.958 -19.794 1.00 14.15 C ATOM 0 HA PRO A 30 3.395 23.014 -22.221 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.585 21.381 -22.717 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.763 23.123 -22.659 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.346 21.088 -20.516 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.290 22.486 -20.993 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.682 22.533 -18.797 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.966 23.973 -19.755 1.00 14.15 H new ATOM 487 N TYR A 31 2.143 20.962 -22.172 1.00 25.44 N ATOM 488 CA TYR A 31 1.383 19.719 -22.233 1.00 32.30 C ATOM 489 C TYR A 31 2.228 18.591 -22.816 1.00 14.22 C ATOM 490 O TYR A 31 2.200 17.462 -22.328 1.00 34.33 O ATOM 491 CB TYR A 31 0.119 19.911 -23.072 1.00 63.02 C ATOM 492 CG TYR A 31 -0.673 18.640 -23.274 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.356 17.755 -24.298 1.00 32.10 C ATOM 494 CD2 TYR A 31 -1.738 18.321 -22.440 1.00 12.33 C ATOM 495 CE1 TYR A 31 -1.078 16.592 -24.486 1.00 35.12 C ATOM 496 CE2 TYR A 31 -2.464 17.160 -22.620 1.00 62.12 C ATOM 497 CZ TYR A 31 -2.130 16.299 -23.645 1.00 32.41 C ATOM 498 OH TYR A 31 -2.851 15.141 -23.828 1.00 11.03 O ATOM 0 H TYR A 31 1.686 21.758 -22.616 1.00 25.44 H new ATOM 0 HA TYR A 31 1.099 19.446 -21.217 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.518 20.653 -22.590 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.397 20.314 -24.046 1.00 63.02 H new ATOM 0 HD1 TYR A 31 0.469 17.980 -24.958 1.00 32.10 H new ATOM 0 HD2 TYR A 31 -2.003 18.993 -21.637 1.00 12.33 H new ATOM 0 HE1 TYR A 31 -0.819 15.916 -25.288 1.00 35.12 H new ATOM 0 HE2 TYR A 31 -3.288 16.927 -21.962 1.00 62.12 H new ATOM 0 HH TYR A 31 -3.557 15.085 -23.151 1.00 11.03 H new ATOM 508 N GLY A 32 2.982 18.907 -23.864 1.00 2.44 N ATOM 509 CA GLY A 32 3.826 17.910 -24.498 1.00 73.33 C ATOM 510 C GLY A 32 4.721 17.194 -23.507 1.00 15.40 C ATOM 511 O GLY A 32 5.012 16.008 -23.664 1.00 5.33 O ATOM 0 H GLY A 32 3.024 19.835 -24.286 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.199 17.180 -25.010 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.442 18.390 -25.258 1.00 73.33 H new ATOM 515 N THR A 33 5.161 17.915 -22.479 1.00 2.10 N ATOM 516 CA THR A 33 6.031 17.342 -21.460 1.00 33.22 C ATOM 517 C THR A 33 5.222 16.823 -20.276 1.00 41.20 C ATOM 518 O THR A 33 5.557 15.797 -19.684 1.00 25.30 O ATOM 519 CB THR A 33 7.057 18.372 -20.954 1.00 51.23 C ATOM 520 OG1 THR A 33 7.312 19.349 -21.969 1.00 63.51 O ATOM 521 CG2 THR A 33 8.360 17.690 -20.561 1.00 43.02 C ATOM 0 H THR A 33 4.928 18.897 -22.331 1.00 2.10 H new ATOM 0 HA THR A 33 6.561 16.512 -21.927 1.00 33.22 H new ATOM 0 HB THR A 33 6.642 18.863 -20.074 1.00 51.23 H new ATOM 0 HG1 THR A 33 7.964 20.001 -21.639 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.070 18.438 -20.207 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.168 16.968 -19.768 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.777 17.176 -21.427 1.00 43.02 H new ATOM 529 N LEU A 34 4.156 17.539 -19.934 1.00 24.43 N ATOM 530 CA LEU A 34 3.299 17.150 -18.821 1.00 43.23 C ATOM 531 C LEU A 34 2.857 15.697 -18.955 1.00 50.10 C ATOM 532 O LEU A 34 2.829 14.953 -17.974 1.00 64.13 O ATOM 533 CB LEU A 34 2.073 18.063 -18.752 1.00 34.41 C ATOM 534 CG LEU A 34 1.018 17.694 -17.708 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.474 18.110 -16.319 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.317 18.340 -18.049 1.00 12.32 C ATOM 0 H LEU A 34 3.865 18.392 -20.412 1.00 24.43 H new ATOM 0 HA LEU A 34 3.873 17.252 -17.900 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.413 19.079 -18.552 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.597 18.073 -19.732 1.00 34.41 H new ATOM 0 HG LEU A 34 0.888 16.612 -17.716 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.711 17.840 -15.589 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.406 17.601 -16.075 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.632 19.188 -16.296 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -1.056 18.067 -17.296 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.202 19.424 -18.069 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.650 17.993 -19.027 1.00 12.32 H new ATOM 548 N SER A 35 2.515 15.297 -20.176 1.00 63.13 N ATOM 549 CA SER A 35 2.074 13.933 -20.438 1.00 73.31 C ATOM 550 C SER A 35 3.077 12.922 -19.890 1.00 51.22 C ATOM 551 O SER A 35 2.706 11.824 -19.475 1.00 50.40 O ATOM 552 CB SER A 35 1.884 13.716 -21.940 1.00 42.24 C ATOM 553 OG SER A 35 1.607 12.356 -22.228 1.00 24.01 O ATOM 0 H SER A 35 2.535 15.899 -20.999 1.00 63.13 H new ATOM 0 HA SER A 35 1.120 13.783 -19.932 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.067 14.341 -22.300 1.00 42.24 H new ATOM 0 HB3 SER A 35 2.783 14.028 -22.472 1.00 42.24 H new ATOM 0 HG SER A 35 1.488 12.244 -23.194 1.00 24.01 H new ATOM 559 N TYR A 36 4.350 13.302 -19.891 1.00 24.31 N ATOM 560 CA TYR A 36 5.408 12.429 -19.396 1.00 24.32 C ATOM 561 C TYR A 36 5.676 12.683 -17.916 1.00 10.31 C ATOM 562 O TYR A 36 6.213 11.825 -17.214 1.00 72.52 O ATOM 563 CB TYR A 36 6.691 12.642 -20.201 1.00 60.32 C ATOM 564 CG TYR A 36 6.467 12.695 -21.696 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.656 11.762 -22.329 1.00 33.34 C ATOM 566 CD2 TYR A 36 7.065 13.679 -22.473 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.448 11.806 -23.695 1.00 14.13 C ATOM 568 CE2 TYR A 36 6.861 13.732 -23.838 1.00 11.33 C ATOM 569 CZ TYR A 36 6.053 12.794 -24.444 1.00 3.04 C ATOM 570 OH TYR A 36 5.849 12.842 -25.805 1.00 45.51 O ATOM 0 H TYR A 36 4.674 14.208 -20.229 1.00 24.31 H new ATOM 0 HA TYR A 36 5.078 11.397 -19.515 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.161 13.571 -19.880 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.390 11.836 -19.975 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.180 10.989 -21.744 1.00 33.34 H new ATOM 0 HD2 TYR A 36 7.700 14.415 -22.002 1.00 21.51 H new ATOM 0 HE1 TYR A 36 4.816 11.072 -24.173 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.332 14.505 -24.428 1.00 11.33 H new ATOM 0 HH TYR A 36 6.345 13.598 -26.184 1.00 45.51 H new ATOM 580 N TYR A 37 5.297 13.866 -17.447 1.00 54.21 N ATOM 581 CA TYR A 37 5.496 14.235 -16.051 1.00 5.01 C ATOM 582 C TYR A 37 4.700 13.319 -15.126 1.00 44.23 C ATOM 583 O TYR A 37 5.263 12.446 -14.465 1.00 51.30 O ATOM 584 CB TYR A 37 5.087 15.691 -15.822 1.00 11.33 C ATOM 585 CG TYR A 37 6.191 16.683 -16.106 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.154 16.423 -17.073 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.271 17.882 -15.409 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.166 17.326 -17.337 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.278 18.793 -15.667 1.00 1.34 C ATOM 590 CZ TYR A 37 8.223 18.510 -16.630 1.00 71.32 C ATOM 591 OH TYR A 37 9.228 19.413 -16.890 1.00 40.12 O ATOM 0 H TYR A 37 4.850 14.587 -18.014 1.00 54.21 H new ATOM 0 HA TYR A 37 6.555 14.122 -15.820 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.231 15.923 -16.455 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.761 15.809 -14.789 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.111 15.498 -17.629 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.534 18.106 -14.652 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.907 17.107 -18.091 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.324 19.721 -15.117 1.00 1.34 H new ATOM 0 HH TYR A 37 9.124 20.194 -16.308 1.00 40.12 H new ATOM 601 N GLU A 38 3.388 13.526 -15.086 1.00 3.11 N ATOM 602 CA GLU A 38 2.513 12.719 -14.242 1.00 5.14 C ATOM 603 C GLU A 38 2.633 11.239 -14.593 1.00 64.14 C ATOM 604 O GLU A 38 2.315 10.371 -13.781 1.00 41.42 O ATOM 605 CB GLU A 38 1.060 13.174 -14.394 1.00 45.31 C ATOM 606 CG GLU A 38 0.475 12.894 -15.768 1.00 24.31 C ATOM 607 CD GLU A 38 -0.536 11.763 -15.752 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.619 11.945 -15.160 1.00 33.41 O ATOM 609 OE2 GLU A 38 -0.242 10.696 -16.330 1.00 25.54 O ATOM 0 H GLU A 38 2.907 14.245 -15.627 1.00 3.11 H new ATOM 0 HA GLU A 38 2.823 12.855 -13.206 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.451 12.675 -13.640 1.00 45.31 H new ATOM 0 HB3 GLU A 38 1.000 14.244 -14.194 1.00 45.31 H new ATOM 0 HG2 GLU A 38 -0.002 13.798 -16.147 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.281 12.646 -16.458 1.00 24.31 H new ATOM 616 N SER A 39 3.096 10.960 -15.808 1.00 60.13 N ATOM 617 CA SER A 39 3.254 9.586 -16.268 1.00 34.13 C ATOM 618 C SER A 39 4.469 8.932 -15.616 1.00 11.41 C ATOM 619 O SER A 39 4.655 7.718 -15.701 1.00 14.05 O ATOM 620 CB SER A 39 3.396 9.549 -17.791 1.00 51.23 C ATOM 621 OG SER A 39 2.128 9.521 -18.421 1.00 13.01 O ATOM 0 H SER A 39 3.368 11.667 -16.491 1.00 60.13 H new ATOM 0 HA SER A 39 2.364 9.027 -15.980 1.00 34.13 H new ATOM 0 HB2 SER A 39 3.954 10.422 -18.129 1.00 51.23 H new ATOM 0 HB3 SER A 39 3.971 8.671 -18.084 1.00 51.23 H new ATOM 0 HG SER A 39 2.060 10.267 -19.053 1.00 13.01 H new ATOM 627 N GLY A 40 5.293 9.745 -14.963 1.00 14.52 N ATOM 628 CA GLY A 40 6.480 9.229 -14.306 1.00 24.23 C ATOM 629 C GLY A 40 7.547 8.798 -15.292 1.00 45.11 C ATOM 630 O GLY A 40 8.442 8.026 -14.950 1.00 74.53 O ATOM 0 H GLY A 40 5.160 10.753 -14.877 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.888 9.994 -13.646 1.00 24.23 H new ATOM 0 HA3 GLY A 40 6.205 8.381 -13.679 1.00 24.23 H new ATOM 634 N ARG A 41 7.452 9.296 -16.521 1.00 4.24 N ATOM 635 CA ARG A 41 8.416 8.956 -17.560 1.00 13.35 C ATOM 636 C ARG A 41 9.812 9.447 -17.190 1.00 52.13 C ATOM 637 O ARG A 41 10.802 8.745 -17.390 1.00 61.34 O ATOM 638 CB ARG A 41 7.989 9.561 -18.899 1.00 40.30 C ATOM 639 CG ARG A 41 8.297 8.674 -20.094 1.00 52.51 C ATOM 640 CD ARG A 41 7.115 7.784 -20.447 1.00 42.11 C ATOM 641 NE ARG A 41 7.427 6.867 -21.540 1.00 62.55 N ATOM 642 CZ ARG A 41 7.404 7.217 -22.821 1.00 34.51 C ATOM 643 NH1 ARG A 41 7.087 8.456 -23.168 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.701 6.326 -23.759 1.00 43.33 N ATOM 0 H ARG A 41 6.717 9.936 -16.821 1.00 4.24 H new ATOM 0 HA ARG A 41 8.445 7.870 -17.652 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.918 9.761 -18.872 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.490 10.520 -19.031 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.556 9.295 -20.952 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.167 8.055 -19.874 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.817 7.212 -19.568 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.264 8.405 -20.727 1.00 42.11 H new ATOM 0 HE ARG A 41 7.676 5.906 -21.307 1.00 62.55 H new ATOM 0 HH11 ARG A 41 6.860 9.144 -22.450 1.00 62.54 H new ATOM 0 HH12 ARG A 41 7.070 8.721 -24.153 1.00 62.54 H new ATOM 0 HH21 ARG A 41 7.947 5.372 -23.496 1.00 43.33 H new ATOM 0 HH22 ARG A 41 7.683 6.596 -24.743 1.00 43.33 H new ATOM 658 N SER A 42 9.882 10.660 -16.648 1.00 70.41 N ATOM 659 CA SER A 42 11.158 11.247 -16.254 1.00 61.23 C ATOM 660 C SER A 42 10.975 12.201 -15.076 1.00 5.23 C ATOM 661 O SER A 42 10.065 13.031 -15.069 1.00 13.14 O ATOM 662 CB SER A 42 11.788 11.990 -17.433 1.00 24.10 C ATOM 663 OG SER A 42 13.183 11.748 -17.501 1.00 12.30 O ATOM 0 H SER A 42 9.072 11.254 -16.472 1.00 70.41 H new ATOM 0 HA SER A 42 11.822 10.439 -15.947 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.315 11.672 -18.362 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.606 13.060 -17.332 1.00 24.10 H new ATOM 0 HG SER A 42 13.562 12.232 -18.264 1.00 12.30 H new ATOM 669 N THR A 43 11.846 12.075 -14.080 1.00 12.02 N ATOM 670 CA THR A 43 11.783 12.924 -12.897 1.00 14.23 C ATOM 671 C THR A 43 11.906 14.397 -13.270 1.00 53.01 C ATOM 672 O THR A 43 12.956 14.864 -13.711 1.00 0.33 O ATOM 673 CB THR A 43 12.890 12.566 -11.888 1.00 21.52 C ATOM 674 OG1 THR A 43 13.553 11.363 -12.295 1.00 2.04 O ATOM 675 CG2 THR A 43 12.313 12.386 -10.492 1.00 51.25 C ATOM 0 H THR A 43 12.604 11.393 -14.069 1.00 12.02 H new ATOM 0 HA THR A 43 10.811 12.750 -12.435 1.00 14.23 H new ATOM 0 HB THR A 43 13.608 13.386 -11.864 1.00 21.52 H new ATOM 0 HG1 THR A 43 12.908 10.626 -12.318 1.00 2.04 H new ATOM 0 HG21 THR A 43 13.114 12.134 -9.797 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.835 13.312 -10.174 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.576 11.583 -10.504 1.00 51.25 H new ATOM 683 N PRO A 44 10.809 15.148 -13.087 1.00 21.02 N ATOM 684 CA PRO A 44 10.771 16.580 -13.396 1.00 52.42 C ATOM 685 C PRO A 44 11.617 17.405 -12.431 1.00 70.25 C ATOM 686 O PRO A 44 12.048 16.927 -11.382 1.00 3.54 O ATOM 687 CB PRO A 44 9.290 16.936 -13.248 1.00 71.00 C ATOM 688 CG PRO A 44 8.750 15.919 -12.302 1.00 72.24 C ATOM 689 CD PRO A 44 9.524 14.657 -12.565 1.00 61.30 C ATOM 0 HA PRO A 44 11.178 16.794 -14.384 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.162 17.946 -12.859 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.775 16.897 -14.208 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.872 16.244 -11.269 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.683 15.763 -12.463 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.657 14.070 -11.656 1.00 61.30 H new ATOM 0 HD3 PRO A 44 9.016 14.017 -13.286 1.00 61.30 H new ATOM 697 N PRO A 45 11.859 18.674 -12.792 1.00 71.15 N ATOM 698 CA PRO A 45 12.654 19.592 -11.970 1.00 45.31 C ATOM 699 C PRO A 45 11.935 19.991 -10.686 1.00 45.42 C ATOM 700 O PRO A 45 10.820 19.540 -10.421 1.00 14.40 O ATOM 701 CB PRO A 45 12.840 20.810 -12.879 1.00 13.01 C ATOM 702 CG PRO A 45 11.680 20.768 -13.812 1.00 51.14 C ATOM 703 CD PRO A 45 11.376 19.310 -14.028 1.00 25.43 C ATOM 0 HA PRO A 45 13.590 19.140 -11.643 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.851 21.735 -12.303 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.785 20.759 -13.420 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.820 21.288 -13.389 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.919 21.261 -14.754 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.310 19.140 -14.177 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.887 18.919 -14.907 1.00 25.43 H new ATOM 711 N THR A 46 12.579 20.840 -9.891 1.00 13.11 N ATOM 712 CA THR A 46 12.001 21.298 -8.635 1.00 31.11 C ATOM 713 C THR A 46 11.273 22.625 -8.816 1.00 24.32 C ATOM 714 O THR A 46 10.362 22.953 -8.055 1.00 10.01 O ATOM 715 CB THR A 46 13.080 21.464 -7.547 1.00 23.32 C ATOM 716 OG1 THR A 46 13.888 20.284 -7.477 1.00 51.14 O ATOM 717 CG2 THR A 46 12.445 21.731 -6.191 1.00 20.13 C ATOM 0 H THR A 46 13.502 21.224 -10.096 1.00 13.11 H new ATOM 0 HA THR A 46 11.289 20.535 -8.319 1.00 31.11 H new ATOM 0 HB THR A 46 13.704 22.317 -7.812 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.346 20.252 -6.611 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.226 21.845 -5.439 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.853 22.645 -6.240 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.800 20.895 -5.920 1.00 20.13 H new ATOM 725 N ASP A 47 11.679 23.384 -9.828 1.00 42.22 N ATOM 726 CA ASP A 47 11.063 24.674 -10.112 1.00 11.00 C ATOM 727 C ASP A 47 9.661 24.493 -10.685 1.00 64.31 C ATOM 728 O ASP A 47 8.774 25.317 -10.456 1.00 65.11 O ATOM 729 CB ASP A 47 11.927 25.473 -11.087 1.00 53.22 C ATOM 730 CG ASP A 47 11.647 25.117 -12.534 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.670 25.653 -13.099 1.00 21.44 O ATOM 732 OD2 ASP A 47 12.405 24.303 -13.102 1.00 61.13 O ATOM 0 H ASP A 47 12.433 23.127 -10.466 1.00 42.22 H new ATOM 0 HA ASP A 47 10.984 25.225 -9.175 1.00 11.00 H new ATOM 0 HB2 ASP A 47 11.749 26.538 -10.937 1.00 53.22 H new ATOM 0 HB3 ASP A 47 12.979 25.292 -10.868 1.00 53.22 H new ATOM 737 N VAL A 48 9.468 23.411 -11.432 1.00 60.11 N ATOM 738 CA VAL A 48 8.174 23.122 -12.038 1.00 45.24 C ATOM 739 C VAL A 48 7.294 22.309 -11.095 1.00 11.34 C ATOM 740 O VAL A 48 6.113 22.608 -10.920 1.00 1.53 O ATOM 741 CB VAL A 48 8.334 22.353 -13.363 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.974 22.013 -13.952 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.165 23.160 -14.350 1.00 62.30 C ATOM 0 H VAL A 48 10.191 22.720 -11.632 1.00 60.11 H new ATOM 0 HA VAL A 48 7.697 24.082 -12.238 1.00 45.24 H new ATOM 0 HB VAL A 48 8.858 21.419 -13.159 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.108 21.470 -14.888 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.418 21.393 -13.249 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.420 22.932 -14.142 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.268 22.602 -15.281 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.671 24.111 -14.550 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.152 23.346 -13.927 1.00 62.30 H new ATOM 753 N MET A 49 7.878 21.281 -10.490 1.00 23.51 N ATOM 754 CA MET A 49 7.146 20.425 -9.562 1.00 32.02 C ATOM 755 C MET A 49 6.375 21.260 -8.545 1.00 43.12 C ATOM 756 O MET A 49 5.198 21.010 -8.289 1.00 54.11 O ATOM 757 CB MET A 49 8.109 19.481 -8.839 1.00 51.33 C ATOM 758 CG MET A 49 7.436 18.616 -7.785 1.00 21.11 C ATOM 759 SD MET A 49 8.212 18.766 -6.164 1.00 71.53 S ATOM 760 CE MET A 49 7.600 20.367 -5.641 1.00 52.32 C ATOM 0 H MET A 49 8.855 21.020 -10.625 1.00 23.51 H new ATOM 0 HA MET A 49 6.432 19.835 -10.137 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.592 18.836 -9.573 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.895 20.070 -8.366 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.385 18.896 -7.708 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.466 17.574 -8.103 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.700 20.459 -4.560 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.177 21.154 -6.127 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.550 20.463 -5.918 1.00 52.32 H new ATOM 770 N MET A 50 7.046 22.252 -7.969 1.00 13.33 N ATOM 771 CA MET A 50 6.423 23.124 -6.981 1.00 63.34 C ATOM 772 C MET A 50 5.373 24.020 -7.632 1.00 13.15 C ATOM 773 O MET A 50 4.374 24.376 -7.008 1.00 31.51 O ATOM 774 CB MET A 50 7.481 23.981 -6.285 1.00 63.11 C ATOM 775 CG MET A 50 8.024 25.103 -7.156 1.00 51.43 C ATOM 776 SD MET A 50 9.640 25.687 -6.610 1.00 41.12 S ATOM 777 CE MET A 50 9.416 25.689 -4.833 1.00 52.14 C ATOM 0 H MET A 50 8.022 22.472 -8.170 1.00 13.33 H new ATOM 0 HA MET A 50 5.930 22.496 -6.239 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.051 24.410 -5.380 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.307 23.342 -5.973 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.097 24.755 -8.186 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.320 25.935 -7.150 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.203 26.282 -4.368 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.445 26.119 -4.589 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.464 24.666 -4.459 1.00 52.14 H new ATOM 787 N ASN A 51 5.608 24.381 -8.889 1.00 65.21 N ATOM 788 CA ASN A 51 4.683 25.236 -9.624 1.00 34.45 C ATOM 789 C ASN A 51 3.338 24.542 -9.820 1.00 20.22 C ATOM 790 O ASN A 51 2.340 25.182 -10.154 1.00 30.14 O ATOM 791 CB ASN A 51 5.276 25.615 -10.983 1.00 31.11 C ATOM 792 CG ASN A 51 5.922 26.988 -10.969 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.515 27.870 -10.213 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.933 27.173 -11.808 1.00 22.11 N ATOM 0 H ASN A 51 6.431 24.095 -9.420 1.00 65.21 H new ATOM 0 HA ASN A 51 4.523 26.142 -9.039 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.017 24.871 -11.273 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.490 25.594 -11.738 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.407 28.076 -11.844 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.236 26.413 -12.417 1.00 22.11 H new ATOM 801 N ILE A 52 3.320 23.231 -9.609 1.00 3.55 N ATOM 802 CA ILE A 52 2.098 22.449 -9.760 1.00 73.42 C ATOM 803 C ILE A 52 1.369 22.308 -8.429 1.00 71.13 C ATOM 804 O ILE A 52 0.137 22.333 -8.376 1.00 32.44 O ATOM 805 CB ILE A 52 2.392 21.047 -10.323 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.299 21.147 -11.551 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.095 20.334 -10.673 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.952 22.299 -12.467 1.00 62.23 C ATOM 0 H ILE A 52 4.137 22.687 -9.333 1.00 3.55 H new ATOM 0 HA ILE A 52 1.464 22.987 -10.464 1.00 73.42 H new ATOM 0 HB ILE A 52 2.908 20.466 -9.559 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.332 21.254 -11.221 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.239 20.215 -12.114 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.320 19.344 -11.070 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.481 20.235 -9.778 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.553 20.911 -11.423 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.636 22.308 -13.316 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.929 22.183 -12.826 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.040 23.238 -11.920 1.00 62.23 H new ATOM 820 N LEU A 53 2.134 22.160 -7.354 1.00 51.45 N ATOM 821 CA LEU A 53 1.560 22.016 -6.019 1.00 74.54 C ATOM 822 C LEU A 53 1.242 23.379 -5.414 1.00 34.01 C ATOM 823 O LEU A 53 0.469 23.480 -4.461 1.00 42.22 O ATOM 824 CB LEU A 53 2.524 21.253 -5.108 1.00 74.22 C ATOM 825 CG LEU A 53 2.098 19.838 -4.717 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.634 19.062 -5.940 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.240 19.109 -4.024 1.00 13.23 C ATOM 0 H LEU A 53 3.153 22.136 -7.379 1.00 51.45 H new ATOM 0 HA LEU A 53 0.631 21.453 -6.108 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.493 21.195 -5.604 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.667 21.833 -4.196 1.00 74.22 H new ATOM 0 HG LEU A 53 1.263 19.911 -4.020 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.335 18.057 -5.641 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.786 19.573 -6.395 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.449 18.999 -6.661 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.918 18.103 -3.753 1.00 13.23 H new ATOM 0 HD22 LEU A 53 4.094 19.047 -4.698 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.526 19.653 -3.124 1.00 13.23 H new ATOM 839 N GLN A 54 1.842 24.425 -5.974 1.00 35.22 N ATOM 840 CA GLN A 54 1.620 25.782 -5.490 1.00 5.24 C ATOM 841 C GLN A 54 0.251 26.297 -5.921 1.00 40.02 C ATOM 842 O GLN A 54 -0.286 27.237 -5.331 1.00 11.30 O ATOM 843 CB GLN A 54 2.715 26.716 -6.006 1.00 13.40 C ATOM 844 CG GLN A 54 2.568 27.071 -7.477 1.00 75.21 C ATOM 845 CD GLN A 54 3.550 28.137 -7.922 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.188 29.072 -8.637 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.802 28.003 -7.499 1.00 73.44 N ATOM 0 H GLN A 54 2.485 24.358 -6.763 1.00 35.22 H new ATOM 0 HA GLN A 54 1.654 25.762 -4.401 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.706 27.633 -5.417 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.686 26.246 -5.849 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.714 26.174 -8.079 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.552 27.418 -7.663 1.00 75.21 H new ATOM 0 HE21 GLN A 54 5.059 27.213 -6.908 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.507 28.691 -7.765 1.00 73.44 H new ATOM 856 N THR A 55 -0.312 25.676 -6.953 1.00 23.53 N ATOM 857 CA THR A 55 -1.617 26.072 -7.464 1.00 24.25 C ATOM 858 C THR A 55 -2.660 26.092 -6.352 1.00 71.25 C ATOM 859 O THR A 55 -2.569 25.357 -5.369 1.00 30.33 O ATOM 860 CB THR A 55 -2.094 25.126 -8.582 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.421 23.845 -8.034 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.022 24.968 -9.650 1.00 51.14 C ATOM 0 H THR A 55 0.117 24.896 -7.451 1.00 23.53 H new ATOM 0 HA THR A 55 -1.505 27.077 -7.872 1.00 24.25 H new ATOM 0 HB THR A 55 -2.982 25.561 -9.042 1.00 54.30 H new ATOM 0 HG1 THR A 55 -2.413 23.173 -8.747 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.381 24.296 -10.429 1.00 51.14 H new ATOM 0 HG22 THR A 55 -0.797 25.941 -10.086 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.119 24.554 -9.201 1.00 51.14 H new ATOM 870 N PRO A 56 -3.678 26.952 -6.509 1.00 53.52 N ATOM 871 CA PRO A 56 -4.759 27.086 -5.529 1.00 12.33 C ATOM 872 C PRO A 56 -5.669 25.863 -5.497 1.00 31.34 C ATOM 873 O PRO A 56 -6.487 25.711 -4.591 1.00 43.31 O ATOM 874 CB PRO A 56 -5.531 28.315 -6.018 1.00 41.51 C ATOM 875 CG PRO A 56 -5.250 28.380 -7.480 1.00 31.12 C ATOM 876 CD PRO A 56 -3.851 27.858 -7.657 1.00 2.04 C ATOM 0 HA PRO A 56 -4.377 27.182 -4.513 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.599 28.215 -5.824 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.198 29.220 -5.510 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -5.965 27.779 -8.042 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.334 29.402 -7.848 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.735 27.332 -8.605 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.117 28.664 -7.647 1.00 2.04 H new ATOM 884 N GLN A 57 -5.521 24.995 -6.493 1.00 54.13 N ATOM 885 CA GLN A 57 -6.329 23.786 -6.578 1.00 35.45 C ATOM 886 C GLN A 57 -5.599 22.597 -5.962 1.00 15.23 C ATOM 887 O GLN A 57 -6.224 21.674 -5.440 1.00 55.15 O ATOM 888 CB GLN A 57 -6.681 23.483 -8.036 1.00 31.22 C ATOM 889 CG GLN A 57 -5.523 22.904 -8.833 1.00 70.00 C ATOM 890 CD GLN A 57 -5.907 22.572 -10.262 1.00 22.24 C ATOM 891 OE1 GLN A 57 -7.086 22.560 -10.613 1.00 74.05 O ATOM 892 NE2 GLN A 57 -4.909 22.300 -11.094 1.00 50.03 N ATOM 0 H GLN A 57 -4.849 25.107 -7.252 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.248 23.955 -6.017 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.515 22.782 -8.062 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.020 24.400 -8.518 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.698 23.617 -8.839 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.162 22.002 -8.339 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -3.946 22.322 -10.759 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -5.105 22.069 -12.068 1.00 50.03 H new ATOM 901 N PHE A 58 -4.272 22.626 -6.026 1.00 44.33 N ATOM 902 CA PHE A 58 -3.456 21.550 -5.476 1.00 12.11 C ATOM 903 C PHE A 58 -2.749 22.002 -4.201 1.00 32.20 C ATOM 904 O PHE A 58 -1.682 21.493 -3.855 1.00 14.11 O ATOM 905 CB PHE A 58 -2.426 21.084 -6.507 1.00 65.32 C ATOM 906 CG PHE A 58 -3.034 20.376 -7.684 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.025 19.425 -7.501 1.00 54.23 C ATOM 908 CD2 PHE A 58 -2.615 20.661 -8.973 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.587 18.772 -8.581 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.173 20.011 -10.057 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.160 19.065 -9.861 1.00 14.14 C ATOM 0 H PHE A 58 -3.739 23.383 -6.453 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.115 20.717 -5.230 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.864 21.947 -6.863 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.713 20.418 -6.021 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.362 19.191 -6.502 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -1.843 21.400 -9.133 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.359 18.033 -8.424 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -2.838 20.243 -11.057 1.00 51.05 H new ATOM 0 HZ PHE A 58 -4.597 18.555 -10.707 1.00 14.14 H new ATOM 921 N THR A 59 -3.349 22.964 -3.507 1.00 4.20 N ATOM 922 CA THR A 59 -2.778 23.487 -2.272 1.00 22.31 C ATOM 923 C THR A 59 -3.010 22.528 -1.109 1.00 21.11 C ATOM 924 O THR A 59 -2.186 22.427 -0.201 1.00 21.14 O ATOM 925 CB THR A 59 -3.372 24.862 -1.917 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.945 25.842 -2.869 1.00 4.22 O ATOM 927 CG2 THR A 59 -2.950 25.289 -0.518 1.00 32.12 C ATOM 0 H THR A 59 -4.231 23.397 -3.780 1.00 4.20 H new ATOM 0 HA THR A 59 -1.707 23.596 -2.440 1.00 22.31 H new ATOM 0 HB THR A 59 -4.459 24.781 -1.943 1.00 62.34 H new ATOM 0 HG1 THR A 59 -3.240 25.577 -3.765 1.00 4.22 H new ATOM 0 HG21 THR A 59 -3.382 26.263 -0.289 1.00 32.12 H new ATOM 0 HG22 THR A 59 -3.303 24.556 0.208 1.00 32.12 H new ATOM 0 HG23 THR A 59 -1.863 25.353 -0.470 1.00 32.12 H new ATOM 935 N LYS A 60 -4.137 21.827 -1.145 1.00 35.52 N ATOM 936 CA LYS A 60 -4.479 20.874 -0.094 1.00 52.53 C ATOM 937 C LYS A 60 -3.628 19.613 -0.205 1.00 41.24 C ATOM 938 O LYS A 60 -3.561 18.813 0.727 1.00 22.22 O ATOM 939 CB LYS A 60 -5.963 20.509 -0.172 1.00 75.42 C ATOM 940 CG LYS A 60 -6.868 21.698 -0.446 1.00 41.34 C ATOM 941 CD LYS A 60 -8.326 21.361 -0.179 1.00 60.34 C ATOM 942 CE LYS A 60 -8.944 20.600 -1.342 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.683 19.392 -0.883 1.00 64.02 N ATOM 0 H LYS A 60 -4.830 21.900 -1.890 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.277 21.344 0.868 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.105 19.766 -0.957 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.264 20.043 0.766 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.567 22.538 0.180 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.751 22.015 -1.482 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.402 20.764 0.730 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.887 22.279 -0.005 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.623 21.257 -1.886 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.161 20.303 -2.039 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -9.275 18.545 -1.328 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.607 19.311 0.151 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -10.684 19.475 -1.151 1.00 64.02 H new ATOM 957 N TYR A 61 -2.979 19.443 -1.352 1.00 14.05 N ATOM 958 CA TYR A 61 -2.132 18.279 -1.586 1.00 71.14 C ATOM 959 C TYR A 61 -0.692 18.698 -1.864 1.00 30.13 C ATOM 960 O TYR A 61 -0.191 18.541 -2.978 1.00 60.54 O ATOM 961 CB TYR A 61 -2.672 17.457 -2.757 1.00 71.25 C ATOM 962 CG TYR A 61 -4.177 17.508 -2.890 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.993 16.771 -2.041 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.782 18.290 -3.866 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.370 16.814 -2.160 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.157 18.340 -3.990 1.00 44.31 C ATOM 967 CZ TYR A 61 -6.946 17.600 -3.135 1.00 4.15 C ATOM 968 OH TYR A 61 -8.316 17.646 -3.257 1.00 1.43 O ATOM 0 H TYR A 61 -3.023 20.096 -2.134 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.144 17.666 -0.685 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.222 17.818 -3.682 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.361 16.419 -2.635 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.545 16.155 -1.276 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.167 18.869 -4.539 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -6.991 16.235 -1.493 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.611 18.955 -4.752 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.559 18.247 -3.992 1.00 1.43 H new ATOM 978 N THR A 62 -0.031 19.233 -0.842 1.00 71.44 N ATOM 979 CA THR A 62 1.352 19.677 -0.975 1.00 10.10 C ATOM 980 C THR A 62 2.313 18.677 -0.345 1.00 71.52 C ATOM 981 O THR A 62 3.128 18.063 -1.035 1.00 70.23 O ATOM 982 CB THR A 62 1.564 21.057 -0.324 1.00 54.41 C ATOM 983 OG1 THR A 62 0.299 21.675 -0.063 1.00 54.14 O ATOM 984 CG2 THR A 62 2.398 21.958 -1.222 1.00 32.11 C ATOM 0 H THR A 62 -0.431 19.369 0.087 1.00 71.44 H new ATOM 0 HA THR A 62 1.559 19.752 -2.043 1.00 10.10 H new ATOM 0 HB THR A 62 2.098 20.912 0.615 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.238 21.680 -0.883 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.534 22.926 -0.741 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.371 21.499 -1.395 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.887 22.095 -2.175 1.00 32.11 H new ATOM 992 N LEU A 63 2.214 18.516 0.970 1.00 70.40 N ATOM 993 CA LEU A 63 3.075 17.588 1.694 1.00 22.45 C ATOM 994 C LEU A 63 2.295 16.355 2.139 1.00 21.32 C ATOM 995 O LEU A 63 2.856 15.435 2.736 1.00 24.35 O ATOM 996 CB LEU A 63 3.695 18.279 2.911 1.00 14.53 C ATOM 997 CG LEU A 63 2.904 18.175 4.215 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.440 17.040 5.074 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.955 19.492 4.976 1.00 34.14 C ATOM 0 H LEU A 63 1.546 19.016 1.556 1.00 70.40 H new ATOM 0 HA LEU A 63 3.870 17.269 1.020 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.687 17.859 3.076 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.831 19.334 2.675 1.00 14.53 H new ATOM 0 HG LEU A 63 1.864 17.959 3.971 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.865 16.981 5.998 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.352 16.099 4.531 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.488 17.226 5.310 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.387 19.400 5.902 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.991 19.738 5.209 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.524 20.283 4.363 1.00 34.14 H new ATOM 1011 N TRP A 64 1.001 16.340 1.841 1.00 4.53 N ATOM 1012 CA TRP A 64 0.145 15.219 2.208 1.00 50.12 C ATOM 1013 C TRP A 64 0.750 13.898 1.746 1.00 52.11 C ATOM 1014 O TRP A 64 0.488 12.846 2.329 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.248 15.394 1.602 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.446 14.623 0.332 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.270 13.550 0.144 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.805 14.866 -0.926 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.179 13.111 -1.155 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.289 13.901 -1.831 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.129 15.803 -1.375 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.868 13.850 -3.158 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.545 15.751 -2.691 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.046 14.780 -3.571 1.00 13.15 C ATOM 0 H TRP A 64 0.522 17.092 1.346 1.00 4.53 H new ATOM 0 HA TRP A 64 0.061 15.199 3.295 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -1.995 15.078 2.330 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.421 16.452 1.406 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.900 13.111 0.904 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.692 12.324 -1.551 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.519 16.555 -0.705 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.250 13.102 -3.837 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.267 16.470 -3.048 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.390 14.766 -4.595 1.00 13.15 H new ATOM 1035 N PHE A 65 1.562 13.959 0.696 1.00 21.42 N ATOM 1036 CA PHE A 65 2.204 12.767 0.155 1.00 54.41 C ATOM 1037 C PHE A 65 3.723 12.910 0.178 1.00 55.14 C ATOM 1038 O PHE A 65 4.448 11.925 0.316 1.00 43.01 O ATOM 1039 CB PHE A 65 1.726 12.507 -1.275 1.00 0.51 C ATOM 1040 CG PHE A 65 0.787 11.341 -1.391 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.141 11.081 -0.396 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.832 10.506 -2.495 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.009 10.010 -0.499 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.033 9.433 -2.604 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.954 9.184 -1.605 1.00 12.20 C ATOM 0 H PHE A 65 1.791 14.822 0.203 1.00 21.42 H new ATOM 0 HA PHE A 65 1.927 11.920 0.782 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.230 13.401 -1.652 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.592 12.330 -1.913 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.187 11.723 0.471 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.550 10.695 -3.279 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.729 9.819 0.283 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.011 8.789 -3.470 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.630 8.345 -1.688 1.00 12.20 H new ATOM 1055 N MET A 66 4.197 14.144 0.041 1.00 21.31 N ATOM 1056 CA MET A 66 5.630 14.417 0.045 1.00 54.24 C ATOM 1057 C MET A 66 6.296 13.802 1.272 1.00 62.12 C ATOM 1058 O MET A 66 7.447 13.366 1.215 1.00 43.23 O ATOM 1059 CB MET A 66 5.884 15.925 0.016 1.00 0.42 C ATOM 1060 CG MET A 66 7.065 16.325 -0.853 1.00 60.21 C ATOM 1061 SD MET A 66 8.218 17.417 0.002 1.00 74.33 S ATOM 1062 CE MET A 66 8.951 16.282 1.177 1.00 12.21 C ATOM 0 H MET A 66 3.610 14.970 -0.074 1.00 21.31 H new ATOM 0 HA MET A 66 6.063 13.966 -0.848 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.989 16.429 -0.347 1.00 0.42 H new ATOM 0 HB3 MET A 66 6.057 16.276 1.033 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.593 15.428 -1.177 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.698 16.822 -1.751 1.00 60.21 H new ATOM 0 HE1 MET A 66 10.030 16.433 1.205 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.534 16.464 2.167 1.00 12.21 H new ATOM 0 HE3 MET A 66 8.736 15.257 0.875 1.00 12.21 H new ATOM 1072 N THR A 67 5.566 13.769 2.382 1.00 35.53 N ATOM 1073 CA THR A 67 6.087 13.208 3.623 1.00 25.30 C ATOM 1074 C THR A 67 5.076 12.269 4.269 1.00 54.02 C ATOM 1075 O THR A 67 5.293 11.771 5.374 1.00 4.44 O ATOM 1076 CB THR A 67 6.457 14.315 4.628 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.141 15.379 3.955 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.335 13.765 5.741 1.00 3.14 C ATOM 0 H THR A 67 4.612 14.124 2.447 1.00 35.53 H new ATOM 0 HA THR A 67 6.985 12.648 3.364 1.00 25.30 H new ATOM 0 HB THR A 67 5.536 14.697 5.069 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.371 16.080 4.600 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.583 14.565 6.438 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.800 12.976 6.270 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.252 13.359 5.314 1.00 3.14 H new ATOM 1086 N ASN A 68 3.968 12.030 3.574 1.00 30.33 N ATOM 1087 CA ASN A 68 2.922 11.149 4.081 1.00 74.32 C ATOM 1088 C ASN A 68 2.316 11.707 5.365 1.00 52.13 C ATOM 1089 O ASN A 68 2.138 10.985 6.345 1.00 64.53 O ATOM 1090 CB ASN A 68 3.485 9.750 4.336 1.00 33.53 C ATOM 1091 CG ASN A 68 2.458 8.661 4.095 1.00 60.54 C ATOM 1092 OD1 ASN A 68 1.337 8.933 3.662 1.00 41.20 O ATOM 1093 ND2 ASN A 68 2.835 7.418 4.373 1.00 22.32 N ATOM 0 H ASN A 68 3.772 12.434 2.658 1.00 30.33 H new ATOM 0 HA ASN A 68 2.137 11.086 3.327 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.346 9.584 3.688 1.00 33.53 H new ATOM 0 HB3 ASN A 68 3.843 9.687 5.364 1.00 33.53 H new ATOM 0 HD21 ASN A 68 2.186 6.644 4.229 1.00 22.32 H new ATOM 0 HD22 ASN A 68 3.773 7.237 4.730 1.00 22.32 H new ATOM 1100 N GLN A 69 1.999 12.999 5.350 1.00 44.34 N ATOM 1101 CA GLN A 69 1.412 13.654 6.514 1.00 22.34 C ATOM 1102 C GLN A 69 0.357 14.671 6.090 1.00 11.24 C ATOM 1103 O GLN A 69 0.672 15.679 5.457 1.00 12.43 O ATOM 1104 CB GLN A 69 2.500 14.343 7.339 1.00 24.40 C ATOM 1105 CG GLN A 69 1.974 15.013 8.599 1.00 53.41 C ATOM 1106 CD GLN A 69 1.764 14.033 9.737 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.712 13.409 10.217 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.519 13.893 10.176 1.00 3.22 N ATOM 0 H GLN A 69 2.139 13.611 4.546 1.00 44.34 H new ATOM 0 HA GLN A 69 0.930 12.891 7.126 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.255 13.607 7.616 1.00 24.40 H new ATOM 0 HB3 GLN A 69 2.996 15.090 6.720 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.675 15.786 8.915 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.031 15.511 8.374 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.236 14.430 9.749 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.317 13.248 10.940 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.895 14.399 6.444 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.995 15.291 6.102 1.00 1.12 C ATOM 1119 C ILE A 70 -2.106 16.436 7.102 1.00 5.32 C ATOM 1120 O ILE A 70 -2.173 16.214 8.311 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.337 14.536 6.052 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.583 13.800 7.370 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.353 13.562 4.883 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.774 14.322 8.141 1.00 41.24 C ATOM 0 H ILE A 70 -1.172 13.568 6.967 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.777 15.695 5.113 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.139 15.260 5.908 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.731 12.740 7.163 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.693 13.881 7.994 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.307 13.036 4.861 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.219 14.110 3.951 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.544 12.841 4.999 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.888 13.753 9.064 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.620 15.374 8.380 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.674 14.215 7.536 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.126 17.663 6.590 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.234 18.843 7.438 1.00 71.32 C ATOM 1138 C ALA A 71 -3.559 19.561 7.214 1.00 23.44 C ATOM 1139 O ALA A 71 -3.620 20.627 6.600 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.069 19.787 7.179 1.00 72.44 C ATOM 0 H ALA A 71 -2.069 17.865 5.592 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.199 18.517 8.478 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.162 20.664 7.819 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.131 19.276 7.398 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.078 20.098 6.134 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.649 18.967 7.723 1.00 32.32 N ATOM 1147 CA PRO A 72 -5.995 19.534 7.591 1.00 40.23 C ATOM 1148 C PRO A 72 -6.176 20.799 8.423 1.00 33.14 C ATOM 1149 O PRO A 72 -7.083 21.592 8.173 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.903 18.417 8.111 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.042 17.629 9.037 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.651 17.697 8.468 1.00 55.43 C ATOM 0 HA PRO A 72 -6.211 19.835 6.566 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.773 18.822 8.628 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.277 17.798 7.295 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.072 18.043 10.045 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.385 16.597 9.106 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.895 17.690 9.253 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.441 16.849 7.817 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.307 20.980 9.413 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.372 22.149 10.282 1.00 5.13 C ATOM 1162 C GLU A 73 -5.248 23.437 9.471 1.00 20.24 C ATOM 1163 O GLU A 73 -5.698 24.499 9.901 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.267 22.090 11.338 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.282 20.814 12.163 1.00 1.34 C ATOM 1166 CD GLU A 73 -4.328 21.084 13.655 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -4.988 22.064 14.059 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -3.706 20.316 14.416 1.00 50.44 O ATOM 0 H GLU A 73 -4.550 20.332 9.633 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.341 22.145 10.781 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.299 22.183 10.845 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.368 22.946 12.006 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -5.146 20.213 11.880 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -3.394 20.226 11.931 1.00 1.34 H new ATOM 1175 N SER A 74 -4.633 23.333 8.298 1.00 3.44 N ATOM 1176 CA SER A 74 -4.443 24.489 7.429 1.00 51.31 C ATOM 1177 C SER A 74 -5.264 24.347 6.150 1.00 0.10 C ATOM 1178 O SER A 74 -5.600 25.337 5.502 1.00 72.23 O ATOM 1179 CB SER A 74 -2.963 24.657 7.082 1.00 74.54 C ATOM 1180 OG SER A 74 -2.336 25.576 7.960 1.00 24.41 O ATOM 0 H SER A 74 -4.258 22.460 7.927 1.00 3.44 H new ATOM 0 HA SER A 74 -4.785 25.375 7.964 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.460 23.692 7.141 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.864 25.006 6.054 1.00 74.54 H new ATOM 0 HG SER A 74 -1.714 26.139 7.454 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.583 23.106 5.794 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.360 22.855 4.594 1.00 41.33 C ATOM 1188 C GLY A 75 -5.684 21.871 3.660 1.00 61.32 C ATOM 1189 O GLY A 75 -5.824 21.967 2.441 1.00 21.02 O ATOM 0 H GLY A 75 -5.317 22.270 6.315 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.341 22.470 4.874 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.525 23.796 4.068 1.00 41.33 H new ATOM 1193 N GLN A 76 -4.949 20.924 4.233 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.248 19.919 3.442 1.00 71.34 C ATOM 1195 C GLN A 76 -4.666 18.511 3.855 1.00 22.20 C ATOM 1196 O GLN A 76 -4.500 18.119 5.010 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.734 20.081 3.599 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.166 21.263 2.830 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.548 22.596 3.442 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -2.869 22.679 4.628 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -2.515 23.649 2.633 1.00 55.24 N ATOM 0 H GLN A 76 -4.823 20.831 5.241 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.516 20.065 2.396 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.497 20.198 4.656 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.242 19.169 3.262 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -1.080 21.181 2.796 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.521 21.226 1.800 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.243 23.534 1.657 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -2.762 24.573 2.988 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.209 17.759 2.905 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.649 16.394 3.170 1.00 50.55 C ATOM 1212 C ILE A 77 -5.375 15.486 1.977 1.00 25.22 C ATOM 1213 O ILE A 77 -4.824 15.921 0.966 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.151 16.344 3.506 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -7.985 16.407 2.223 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.524 17.484 4.442 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.715 17.637 1.387 1.00 65.21 C ATOM 0 H ILE A 77 -5.355 18.071 1.945 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.080 16.040 4.030 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.364 15.402 4.011 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.783 15.519 1.624 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.043 16.381 2.485 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.589 17.434 4.670 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.951 17.399 5.365 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.300 18.437 3.962 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.340 17.615 0.494 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -7.944 18.530 1.969 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.665 17.655 1.094 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.765 14.221 2.100 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.565 13.252 1.030 1.00 35.42 C ATOM 1231 C ALA A 78 -6.843 13.055 0.222 1.00 61.12 C ATOM 1232 O ALA A 78 -7.938 12.923 0.769 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.090 11.925 1.603 1.00 72.54 C ATOM 0 H ALA A 78 -6.221 13.844 2.931 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.799 13.641 0.359 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -4.945 11.210 0.793 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.147 12.073 2.130 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.837 11.540 2.297 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.704 13.036 -1.112 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.837 12.856 -2.024 1.00 73.10 C ATOM 1241 C PRO A 79 -8.409 11.444 -1.966 1.00 74.34 C ATOM 1242 O PRO A 79 -7.855 10.567 -1.305 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.230 13.130 -3.403 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.781 12.820 -3.247 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.428 13.188 -1.832 1.00 54.14 C ATOM 0 HA PRO A 79 -8.671 13.511 -1.772 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.689 12.504 -4.169 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.383 14.166 -3.704 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.585 11.764 -3.436 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.182 13.388 -3.959 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.657 12.533 -1.427 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.047 14.207 -1.765 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.522 11.233 -2.661 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.169 9.927 -2.690 1.00 34.34 C ATOM 1255 C ALA A 80 -9.333 8.918 -3.471 1.00 51.31 C ATOM 1256 O ALA A 80 -9.316 7.729 -3.149 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.560 10.039 -3.293 1.00 63.50 C ATOM 0 H ALA A 80 -9.994 11.950 -3.212 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.258 9.571 -1.664 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.030 9.056 -3.308 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.163 10.721 -2.693 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.486 10.421 -4.311 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.640 9.398 -4.496 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.802 8.538 -5.324 1.00 2.43 C ATOM 1265 C LEU A 81 -6.506 8.183 -4.602 1.00 54.42 C ATOM 1266 O LEU A 81 -5.906 7.140 -4.860 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.486 9.225 -6.654 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.671 9.444 -7.594 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.037 10.918 -7.661 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.356 8.908 -8.983 1.00 41.44 C ATOM 0 H LEU A 81 -8.641 10.379 -4.775 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.352 7.618 -5.520 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.033 10.193 -6.441 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.737 8.631 -7.178 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.527 8.897 -7.199 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.883 11.053 -8.335 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.307 11.272 -6.666 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.184 11.488 -8.030 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.211 9.072 -9.639 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.486 9.427 -9.384 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.146 7.840 -8.922 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.081 9.057 -3.695 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.859 8.834 -2.933 1.00 42.42 C ATOM 1284 C ALA A 82 -4.856 7.450 -2.293 1.00 41.25 C ATOM 1285 O ALA A 82 -3.854 6.736 -2.339 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.697 9.910 -1.869 1.00 60.33 C ATOM 0 H ALA A 82 -6.565 9.926 -3.470 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.016 8.889 -3.621 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.780 9.731 -1.307 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.645 10.889 -2.346 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.550 9.882 -1.190 1.00 60.33 H new ATOM 1292 N HIS A 83 -5.983 7.076 -1.697 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.110 5.776 -1.047 1.00 62.14 C ATOM 1294 C HIS A 83 -4.998 5.569 -0.024 1.00 43.04 C ATOM 1295 O HIS A 83 -4.609 4.437 0.264 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.076 4.657 -2.089 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.395 4.420 -2.758 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -8.537 4.073 -2.067 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.751 4.483 -4.062 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -9.538 3.932 -2.917 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -9.087 4.176 -4.135 1.00 35.44 N ATOM 0 H HIS A 83 -6.822 7.654 -1.650 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.067 5.749 -0.526 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.332 4.901 -2.847 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.751 3.734 -1.608 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.104 4.729 -4.891 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -10.552 3.663 -2.660 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.642 4.142 -4.990 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.488 6.669 0.520 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.419 6.609 1.509 1.00 21.02 C ATOM 1311 C PHE A 84 -3.883 7.177 2.847 1.00 45.34 C ATOM 1312 O PHE A 84 -4.065 6.442 3.816 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.192 7.377 1.014 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.984 6.509 0.810 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.181 6.153 1.881 1.00 20.34 C ATOM 1316 CD2 PHE A 84 -0.649 6.051 -0.454 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.931 5.354 1.696 1.00 14.32 C ATOM 1318 CE2 PHE A 84 0.462 5.250 -0.645 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.254 4.903 0.432 1.00 4.42 C ATOM 0 H PHE A 84 -4.798 7.613 0.292 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.150 5.563 1.652 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.437 7.871 0.074 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.950 8.160 1.732 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -0.427 6.504 2.872 1.00 20.34 H new ATOM 0 HD2 PHE A 84 -1.263 6.323 -1.300 1.00 43.32 H new ATOM 0 HE1 PHE A 84 1.547 5.082 2.540 1.00 14.32 H new ATOM 0 HE2 PHE A 84 0.710 4.896 -1.635 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.124 4.280 0.286 1.00 4.42 H new ATOM 1329 N GLY A 85 -4.072 8.493 2.891 1.00 64.22 N ATOM 1330 CA GLY A 85 -4.512 9.139 4.113 1.00 5.30 C ATOM 1331 C GLY A 85 -6.020 9.116 4.271 1.00 2.52 C ATOM 1332 O GLY A 85 -6.601 8.078 4.587 1.00 22.04 O ATOM 0 H GLY A 85 -3.928 9.123 2.102 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -4.053 8.643 4.968 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.165 10.172 4.119 1.00 5.30 H new ATOM 1336 N GLN A 86 -6.654 10.263 4.051 1.00 42.43 N ATOM 1337 CA GLN A 86 -8.103 10.371 4.173 1.00 52.01 C ATOM 1338 C GLN A 86 -8.787 10.038 2.850 1.00 63.41 C ATOM 1339 O GLN A 86 -8.160 10.070 1.793 1.00 73.22 O ATOM 1340 CB GLN A 86 -8.495 11.778 4.624 1.00 35.20 C ATOM 1341 CG GLN A 86 -9.337 11.799 5.890 1.00 10.42 C ATOM 1342 CD GLN A 86 -10.583 12.650 5.748 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -11.702 12.168 5.926 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -10.396 13.925 5.426 1.00 61.55 N ATOM 0 H GLN A 86 -6.187 11.131 3.787 1.00 42.43 H new ATOM 0 HA GLN A 86 -8.434 9.652 4.923 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -7.590 12.363 4.790 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -9.048 12.267 3.822 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -9.625 10.780 6.147 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -8.735 12.178 6.716 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -9.451 14.283 5.288 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -11.198 14.546 5.317 1.00 61.55 H new ATOM 1353 N ASN A 87 -10.075 9.720 2.920 1.00 31.20 N ATOM 1354 CA ASN A 87 -10.844 9.382 1.728 1.00 45.35 C ATOM 1355 C ASN A 87 -12.115 10.220 1.645 1.00 15.25 C ATOM 1356 O ASN A 87 -12.416 11.000 2.547 1.00 4.03 O ATOM 1357 CB ASN A 87 -11.199 7.893 1.731 1.00 34.33 C ATOM 1358 CG ASN A 87 -11.006 7.251 0.371 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -11.954 7.112 -0.403 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -9.775 6.852 0.075 1.00 35.51 N ATOM 0 H ASN A 87 -10.608 9.689 3.789 1.00 31.20 H new ATOM 0 HA ASN A 87 -10.230 9.600 0.855 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -10.581 7.376 2.465 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -12.236 7.770 2.044 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -9.585 6.410 -0.824 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -9.020 6.987 0.747 1.00 35.51 H new ATOM 1367 N GLU A 88 -12.858 10.052 0.555 1.00 63.12 N ATOM 1368 CA GLU A 88 -14.098 10.793 0.354 1.00 73.11 C ATOM 1369 C GLU A 88 -15.180 10.316 1.318 1.00 72.51 C ATOM 1370 O GLU A 88 -15.035 9.281 1.970 1.00 5.10 O ATOM 1371 CB GLU A 88 -14.582 10.640 -1.089 1.00 3.53 C ATOM 1372 CG GLU A 88 -14.863 9.201 -1.488 1.00 14.52 C ATOM 1373 CD GLU A 88 -15.795 9.096 -2.679 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -16.860 9.747 -2.658 1.00 1.34 O ATOM 1375 OE2 GLU A 88 -15.458 8.363 -3.633 1.00 74.22 O ATOM 0 H GLU A 88 -12.623 9.410 -0.202 1.00 63.12 H new ATOM 0 HA GLU A 88 -13.897 11.846 0.553 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -15.489 11.229 -1.223 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -13.831 11.054 -1.761 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -13.922 8.703 -1.723 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -15.301 8.672 -0.641 1.00 14.52 H new ATOM 1382 N THR A 89 -16.265 11.079 1.405 1.00 42.12 N ATOM 1383 CA THR A 89 -17.371 10.737 2.290 1.00 64.33 C ATOM 1384 C THR A 89 -16.916 10.685 3.745 1.00 65.52 C ATOM 1385 O THR A 89 -16.342 9.691 4.192 1.00 3.15 O ATOM 1386 CB THR A 89 -17.995 9.379 1.911 1.00 3.44 C ATOM 1387 OG1 THR A 89 -18.072 9.257 0.487 1.00 34.35 O ATOM 1388 CG2 THR A 89 -19.384 9.235 2.514 1.00 35.32 C ATOM 0 H THR A 89 -16.401 11.938 0.873 1.00 42.12 H new ATOM 0 HA THR A 89 -18.121 11.519 2.174 1.00 64.33 H new ATOM 0 HB THR A 89 -17.360 8.588 2.309 1.00 3.44 H new ATOM 0 HG1 THR A 89 -18.468 8.391 0.254 1.00 34.35 H new ATOM 0 HG21 THR A 89 -19.804 8.269 2.233 1.00 35.32 H new ATOM 0 HG22 THR A 89 -19.318 9.300 3.600 1.00 35.32 H new ATOM 0 HG23 THR A 89 -20.027 10.033 2.142 1.00 35.32 H new ATOM 1396 N THR A 90 -17.176 11.762 4.479 1.00 53.34 N ATOM 1397 CA THR A 90 -16.793 11.839 5.883 1.00 64.10 C ATOM 1398 C THR A 90 -17.546 10.810 6.717 1.00 11.52 C ATOM 1399 O THR A 90 -18.761 10.657 6.581 1.00 4.22 O ATOM 1400 CB THR A 90 -17.055 13.243 6.460 1.00 4.33 C ATOM 1401 OG1 THR A 90 -18.434 13.589 6.298 1.00 0.33 O ATOM 1402 CG2 THR A 90 -16.182 14.283 5.774 1.00 44.52 C ATOM 0 H THR A 90 -17.650 12.593 4.125 1.00 53.34 H new ATOM 0 HA THR A 90 -15.725 11.628 5.931 1.00 64.10 H new ATOM 0 HB THR A 90 -16.807 13.227 7.521 1.00 4.33 H new ATOM 0 HG1 THR A 90 -18.971 12.772 6.237 1.00 0.33 H new ATOM 0 HG21 THR A 90 -16.385 15.266 6.199 1.00 44.52 H new ATOM 0 HG22 THR A 90 -15.132 14.033 5.924 1.00 44.52 H new ATOM 0 HG23 THR A 90 -16.403 14.296 4.707 1.00 44.52 H new ATOM 1410 N SER A 91 -16.820 10.108 7.580 1.00 52.22 N ATOM 1411 CA SER A 91 -17.421 9.090 8.434 1.00 23.32 C ATOM 1412 C SER A 91 -16.589 8.878 9.695 1.00 73.34 C ATOM 1413 O SER A 91 -15.410 9.228 9.758 1.00 65.30 O ATOM 1414 CB SER A 91 -17.558 7.770 7.672 1.00 10.52 C ATOM 1415 OG SER A 91 -18.888 7.575 7.225 1.00 22.30 O ATOM 0 H SER A 91 -15.815 10.225 7.707 1.00 52.22 H new ATOM 0 HA SER A 91 -18.412 9.437 8.727 1.00 23.32 H new ATOM 0 HB2 SER A 91 -16.880 7.767 6.818 1.00 10.52 H new ATOM 0 HB3 SER A 91 -17.263 6.942 8.316 1.00 10.52 H new ATOM 0 HG SER A 91 -19.247 8.422 6.887 1.00 22.30 H new ATOM 1421 N PRO A 92 -17.216 8.291 10.725 1.00 60.30 N ATOM 1422 CA PRO A 92 -16.552 8.018 12.004 1.00 30.11 C ATOM 1423 C PRO A 92 -15.502 6.919 11.889 1.00 60.04 C ATOM 1424 O PRO A 92 -15.782 5.749 12.154 1.00 32.42 O ATOM 1425 CB PRO A 92 -17.701 7.568 12.910 1.00 33.35 C ATOM 1426 CG PRO A 92 -18.730 7.030 11.978 1.00 55.04 C ATOM 1427 CD PRO A 92 -18.619 7.847 10.721 1.00 64.13 C ATOM 0 HA PRO A 92 -16.012 8.888 12.377 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -17.372 6.807 13.618 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -18.093 8.400 13.495 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -18.557 5.974 11.773 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -19.728 7.111 12.409 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -18.851 7.255 9.835 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -19.308 8.692 10.729 1.00 64.13 H new ATOM 1435 N HIS A 93 -14.291 7.302 11.496 1.00 62.43 N ATOM 1436 CA HIS A 93 -13.199 6.348 11.347 1.00 33.42 C ATOM 1437 C HIS A 93 -11.897 7.063 10.995 1.00 14.13 C ATOM 1438 O HIS A 93 -11.887 8.270 10.754 1.00 3.43 O ATOM 1439 CB HIS A 93 -13.536 5.316 10.270 1.00 33.41 C ATOM 1440 CG HIS A 93 -13.651 3.919 10.795 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -14.818 3.187 10.736 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -12.735 3.118 11.390 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -14.616 1.996 11.274 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -13.360 1.929 11.678 1.00 24.32 N ATOM 0 H HIS A 93 -14.042 8.266 11.275 1.00 62.43 H new ATOM 0 HA HIS A 93 -13.066 5.835 12.300 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -14.476 5.595 9.793 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -12.766 5.343 9.499 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -11.705 3.368 11.599 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -15.352 1.212 11.367 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -12.925 1.125 12.130 1.00 24.32 H new ATOM 1452 N SER A 94 -10.803 6.310 10.966 1.00 52.11 N ATOM 1453 CA SER A 94 -9.495 6.872 10.647 1.00 70.32 C ATOM 1454 C SER A 94 -9.153 8.020 11.592 1.00 14.44 C ATOM 1455 O SER A 94 -9.911 8.330 12.510 1.00 10.43 O ATOM 1456 CB SER A 94 -9.469 7.364 9.199 1.00 51.10 C ATOM 1457 OG SER A 94 -8.139 7.589 8.762 1.00 3.42 O ATOM 0 H SER A 94 -10.796 5.309 11.160 1.00 52.11 H new ATOM 0 HA SER A 94 -8.749 6.087 10.771 1.00 70.32 H new ATOM 0 HB2 SER A 94 -9.948 6.629 8.553 1.00 51.10 H new ATOM 0 HB3 SER A 94 -10.044 8.286 9.114 1.00 51.10 H new ATOM 0 HG SER A 94 -8.148 7.901 7.833 1.00 3.42 H new ATOM 1463 N GLY A 95 -8.004 8.647 11.360 1.00 21.35 N ATOM 1464 CA GLY A 95 -7.579 9.752 12.199 1.00 44.10 C ATOM 1465 C GLY A 95 -6.459 9.366 13.144 1.00 74.11 C ATOM 1466 O GLY A 95 -6.700 8.752 14.183 1.00 73.43 O ATOM 0 H GLY A 95 -7.360 8.409 10.606 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -7.249 10.577 11.568 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -8.430 10.113 12.777 1.00 44.10 H new ATOM 1470 N GLN A 96 -5.231 9.727 12.783 1.00 10.41 N ATOM 1471 CA GLN A 96 -4.071 9.410 13.607 1.00 71.33 C ATOM 1472 C GLN A 96 -3.617 10.633 14.399 1.00 34.40 C ATOM 1473 O GLN A 96 -2.570 11.216 14.117 1.00 15.22 O ATOM 1474 CB GLN A 96 -2.923 8.900 12.735 1.00 73.40 C ATOM 1475 CG GLN A 96 -3.234 7.592 12.026 1.00 74.35 C ATOM 1476 CD GLN A 96 -3.013 7.672 10.528 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -1.915 7.982 10.067 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -4.059 7.393 9.759 1.00 12.22 N ATOM 0 H GLN A 96 -5.015 10.238 11.927 1.00 10.41 H new ATOM 0 HA GLN A 96 -4.359 8.628 14.310 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -2.678 9.658 11.991 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -2.038 8.766 13.356 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -2.608 6.801 12.440 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -4.270 7.314 12.222 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -4.951 7.140 10.184 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -3.970 7.431 8.744 1.00 12.22 H new ATOM 1487 N LYS A 97 -4.412 11.016 15.393 1.00 3.33 N ATOM 1488 CA LYS A 97 -4.093 12.168 16.227 1.00 3.12 C ATOM 1489 C LYS A 97 -4.367 11.867 17.698 1.00 51.43 C ATOM 1490 O LYS A 97 -5.131 10.959 18.024 1.00 55.44 O ATOM 1491 CB LYS A 97 -4.909 13.386 15.785 1.00 25.30 C ATOM 1492 CG LYS A 97 -4.059 14.523 15.245 1.00 72.12 C ATOM 1493 CD LYS A 97 -3.635 15.476 16.350 1.00 72.33 C ATOM 1494 CE LYS A 97 -2.158 15.325 16.680 1.00 74.13 C ATOM 1495 NZ LYS A 97 -1.291 15.736 15.543 1.00 13.31 N ATOM 0 H LYS A 97 -5.282 10.545 15.640 1.00 3.33 H new ATOM 0 HA LYS A 97 -3.032 12.387 16.110 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -5.619 13.078 15.018 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -5.492 13.749 16.631 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -3.174 14.116 14.755 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -4.620 15.070 14.487 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -3.837 16.502 16.044 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -4.230 15.286 17.244 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -1.918 15.928 17.556 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -1.948 14.287 16.940 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -0.365 16.042 15.905 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -1.161 14.931 14.897 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -1.740 16.522 15.031 1.00 13.31 H new ATOM 1509 N THR A 98 -3.738 12.636 18.582 1.00 53.15 N ATOM 1510 CA THR A 98 -3.913 12.452 20.016 1.00 52.21 C ATOM 1511 C THR A 98 -3.825 13.782 20.756 1.00 33.53 C ATOM 1512 O THR A 98 -3.404 14.791 20.192 1.00 23.30 O ATOM 1513 CB THR A 98 -2.859 11.487 20.592 1.00 34.33 C ATOM 1514 OG1 THR A 98 -3.139 11.222 21.971 1.00 75.54 O ATOM 1515 CG2 THR A 98 -1.461 12.069 20.455 1.00 31.14 C ATOM 0 H THR A 98 -3.102 13.393 18.329 1.00 53.15 H new ATOM 0 HA THR A 98 -4.905 12.023 20.160 1.00 52.21 H new ATOM 0 HB THR A 98 -2.904 10.555 20.028 1.00 34.33 H new ATOM 0 HG1 THR A 98 -2.466 10.607 22.329 1.00 75.54 H new ATOM 0 HG21 THR A 98 -0.734 11.370 20.868 1.00 31.14 H new ATOM 0 HG22 THR A 98 -1.240 12.241 19.402 1.00 31.14 H new ATOM 0 HG23 THR A 98 -1.405 13.013 20.997 1.00 31.14 H new ATOM 1523 N GLY A 99 -4.226 13.776 22.024 1.00 2.33 N ATOM 1524 CA GLY A 99 -4.184 14.989 22.820 1.00 43.31 C ATOM 1525 C GLY A 99 -4.498 14.733 24.281 1.00 74.10 C ATOM 1526 O GLY A 99 -4.543 13.574 24.691 1.00 11.42 O ATOM 0 H GLY A 99 -4.579 12.954 22.514 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -3.195 15.440 22.737 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -4.898 15.709 22.419 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 14.581 39.078 -3.413 1.00 51.11 N ATOM 1532 CA MET B 1 13.276 38.926 -4.046 1.00 63.42 C ATOM 1533 C MET B 1 13.171 37.583 -4.763 1.00 24.41 C ATOM 1534 O MET B 1 13.941 37.297 -5.680 1.00 25.51 O ATOM 1535 CB MET B 1 13.031 40.065 -5.037 1.00 75.14 C ATOM 1536 CG MET B 1 11.655 40.698 -4.908 1.00 44.22 C ATOM 1537 SD MET B 1 11.521 42.257 -5.802 1.00 21.25 S ATOM 1538 CE MET B 1 9.749 42.350 -6.057 1.00 23.32 C ATOM 0 H1 MET B 1 14.628 39.999 -2.932 1.00 51.11 H new ATOM 0 H2 MET B 1 14.721 38.317 -2.718 1.00 51.11 H new ATOM 0 H3 MET B 1 15.326 39.027 -4.137 1.00 51.11 H new ATOM 0 HA MET B 1 12.516 38.962 -3.266 1.00 63.42 H new ATOM 0 HB2 MET B 1 13.790 40.833 -4.890 1.00 75.14 H new ATOM 0 HB3 MET B 1 13.154 39.686 -6.051 1.00 75.14 H new ATOM 0 HG2 MET B 1 10.903 40.003 -5.283 1.00 44.22 H new ATOM 0 HG3 MET B 1 11.435 40.868 -3.854 1.00 44.22 H new ATOM 0 HE1 MET B 1 9.507 43.264 -6.600 1.00 23.32 H new ATOM 0 HE2 MET B 1 9.419 41.487 -6.635 1.00 23.32 H new ATOM 0 HE3 MET B 1 9.242 42.356 -5.092 1.00 23.32 H new ATOM 1548 N SER B 2 12.216 36.763 -4.337 1.00 52.41 N ATOM 1549 CA SER B 2 12.013 35.450 -4.934 1.00 52.31 C ATOM 1550 C SER B 2 13.280 34.604 -4.829 1.00 72.12 C ATOM 1551 O SER B 2 14.053 34.503 -5.781 1.00 1.24 O ATOM 1552 CB SER B 2 11.602 35.591 -6.402 1.00 33.21 C ATOM 1553 OG SER B 2 11.009 34.397 -6.882 1.00 21.32 O ATOM 0 H SER B 2 11.570 36.986 -3.580 1.00 52.41 H new ATOM 0 HA SER B 2 11.215 34.949 -4.387 1.00 52.31 H new ATOM 0 HB2 SER B 2 10.900 36.418 -6.509 1.00 33.21 H new ATOM 0 HB3 SER B 2 12.476 35.835 -7.006 1.00 33.21 H new ATOM 0 HG SER B 2 10.754 34.513 -7.821 1.00 21.32 H new ATOM 1559 N ASN B 3 13.484 33.998 -3.664 1.00 61.32 N ATOM 1560 CA ASN B 3 14.655 33.161 -3.432 1.00 34.05 C ATOM 1561 C ASN B 3 14.587 31.886 -4.267 1.00 13.43 C ATOM 1562 O ASN B 3 13.573 31.188 -4.274 1.00 63.53 O ATOM 1563 CB ASN B 3 14.769 32.807 -1.948 1.00 35.42 C ATOM 1564 CG ASN B 3 15.444 33.901 -1.143 1.00 24.34 C ATOM 1565 OD1 ASN B 3 16.670 33.970 -1.074 1.00 34.54 O ATOM 1566 ND2 ASN B 3 14.640 34.762 -0.528 1.00 22.22 N ATOM 0 H ASN B 3 12.853 34.071 -2.866 1.00 61.32 H new ATOM 0 HA ASN B 3 15.538 33.724 -3.733 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.774 32.624 -1.544 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.333 31.880 -1.841 1.00 35.42 H new ATOM 0 HD21 ASN B 3 15.035 35.519 0.030 1.00 22.22 H new ATOM 0 HD22 ASN B 3 13.628 34.666 -0.614 1.00 22.22 H new ATOM 1573 N THR B 4 15.675 31.586 -4.970 1.00 72.34 N ATOM 1574 CA THR B 4 15.740 30.396 -5.809 1.00 42.42 C ATOM 1575 C THR B 4 15.376 29.145 -5.018 1.00 52.45 C ATOM 1576 O THR B 4 15.209 29.197 -3.799 1.00 62.33 O ATOM 1577 CB THR B 4 17.142 30.214 -6.420 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.904 31.417 -6.262 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.047 29.857 -7.895 1.00 44.11 C ATOM 0 H THR B 4 16.524 32.152 -4.975 1.00 72.34 H new ATOM 0 HA THR B 4 15.018 30.537 -6.613 1.00 42.42 H new ATOM 0 HB THR B 4 17.640 29.397 -5.897 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.795 31.293 -6.651 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.049 29.733 -8.305 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.491 28.926 -8.009 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.532 30.655 -8.430 1.00 44.11 H new ATOM 1587 N ILE B 5 15.256 28.023 -5.717 1.00 72.43 N ATOM 1588 CA ILE B 5 14.913 26.758 -5.079 1.00 60.40 C ATOM 1589 C ILE B 5 15.982 26.344 -4.072 1.00 73.52 C ATOM 1590 O ILE B 5 15.680 26.044 -2.917 1.00 14.01 O ATOM 1591 CB ILE B 5 14.737 25.632 -6.115 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.666 26.015 -7.138 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.375 24.327 -5.423 1.00 64.43 C ATOM 1594 CD1 ILE B 5 14.055 25.704 -8.566 1.00 71.13 C ATOM 0 H ILE B 5 15.391 27.963 -6.726 1.00 72.43 H new ATOM 0 HA ILE B 5 13.967 26.913 -4.560 1.00 60.40 H new ATOM 0 HB ILE B 5 15.681 25.491 -6.641 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.742 25.488 -6.899 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.457 27.081 -7.051 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.254 23.541 -6.169 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.169 24.050 -4.730 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.442 24.453 -4.874 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.248 26.002 -9.236 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.962 26.251 -8.824 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.236 24.634 -8.669 1.00 71.13 H new ATOM 1606 N SER B 6 17.234 26.331 -4.519 1.00 1.32 N ATOM 1607 CA SER B 6 18.348 25.952 -3.658 1.00 35.53 C ATOM 1608 C SER B 6 18.331 26.755 -2.361 1.00 22.31 C ATOM 1609 O SER B 6 18.576 26.217 -1.282 1.00 0.21 O ATOM 1610 CB SER B 6 19.678 26.164 -4.385 1.00 41.32 C ATOM 1611 OG SER B 6 19.466 26.618 -5.711 1.00 21.35 O ATOM 0 H SER B 6 17.502 26.578 -5.472 1.00 1.32 H new ATOM 0 HA SER B 6 18.241 24.896 -3.412 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.282 26.890 -3.841 1.00 41.32 H new ATOM 0 HB3 SER B 6 20.240 25.230 -4.402 1.00 41.32 H new ATOM 0 HG SER B 6 19.892 27.493 -5.829 1.00 21.35 H new ATOM 1617 N GLU B 7 18.040 28.047 -2.476 1.00 32.11 N ATOM 1618 CA GLU B 7 17.992 28.925 -1.314 1.00 62.35 C ATOM 1619 C GLU B 7 16.974 28.422 -0.293 1.00 42.41 C ATOM 1620 O GLU B 7 17.122 28.643 0.909 1.00 11.21 O ATOM 1621 CB GLU B 7 17.640 30.352 -1.739 1.00 23.21 C ATOM 1622 CG GLU B 7 18.709 31.014 -2.594 1.00 1.43 C ATOM 1623 CD GLU B 7 19.899 31.484 -1.779 1.00 1.34 C ATOM 1624 OE1 GLU B 7 20.761 30.642 -1.451 1.00 2.32 O ATOM 1625 OE2 GLU B 7 19.967 32.692 -1.471 1.00 64.22 O ATOM 0 H GLU B 7 17.834 28.508 -3.362 1.00 32.11 H new ATOM 0 HA GLU B 7 18.978 28.924 -0.850 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.702 30.336 -2.293 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.473 30.957 -0.848 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.049 30.310 -3.354 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.274 31.864 -3.119 1.00 1.43 H new ATOM 1632 N LYS B 8 15.941 27.744 -0.782 1.00 33.03 N ATOM 1633 CA LYS B 8 14.899 27.207 0.085 1.00 74.20 C ATOM 1634 C LYS B 8 15.393 25.972 0.830 1.00 72.42 C ATOM 1635 O LYS B 8 14.681 25.413 1.665 1.00 55.43 O ATOM 1636 CB LYS B 8 13.655 26.858 -0.735 1.00 61.22 C ATOM 1637 CG LYS B 8 13.373 27.838 -1.861 1.00 10.12 C ATOM 1638 CD LYS B 8 11.922 27.774 -2.306 1.00 72.53 C ATOM 1639 CE LYS B 8 11.259 29.142 -2.245 1.00 74.45 C ATOM 1640 NZ LYS B 8 11.141 29.761 -3.593 1.00 44.13 N ATOM 0 H LYS B 8 15.803 27.553 -1.775 1.00 33.03 H new ATOM 0 HA LYS B 8 14.641 27.972 0.818 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.776 25.860 -1.155 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.791 26.822 -0.071 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.609 28.850 -1.531 1.00 10.12 H new ATOM 0 HG3 LYS B 8 14.024 27.618 -2.707 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.869 27.388 -3.324 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.376 27.075 -1.672 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.268 29.046 -1.801 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.837 29.797 -1.594 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.322 30.402 -3.610 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 12.006 30.298 -3.805 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 11.012 29.016 -4.307 1.00 44.13 H new ATOM 1654 N ILE B 9 16.617 25.553 0.525 1.00 12.54 N ATOM 1655 CA ILE B 9 17.206 24.385 1.168 1.00 14.12 C ATOM 1656 C ILE B 9 18.420 24.772 2.005 1.00 2.44 C ATOM 1657 O ILE B 9 19.026 23.930 2.666 1.00 32.42 O ATOM 1658 CB ILE B 9 17.627 23.325 0.133 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.511 23.110 -0.892 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.973 22.015 0.828 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.861 22.102 -1.963 1.00 4.43 C ATOM 0 H ILE B 9 17.219 26.005 -0.163 1.00 12.54 H new ATOM 0 HA ILE B 9 16.440 23.962 1.818 1.00 14.12 H new ATOM 0 HB ILE B 9 18.513 23.682 -0.391 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.611 22.779 -0.373 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.274 24.063 -1.365 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.269 21.275 0.084 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.796 22.179 1.524 1.00 21.54 H new ATOM 0 HG23 ILE B 9 17.102 21.652 1.374 1.00 21.54 H new ATOM 0 HD11 ILE B 9 16.024 22.000 -2.654 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.742 22.441 -2.507 1.00 4.43 H new ATOM 0 HD13 ILE B 9 17.069 21.137 -1.501 1.00 4.43 H new ATOM 1673 N VAL B 10 18.769 26.055 1.972 1.00 31.43 N ATOM 1674 CA VAL B 10 19.910 26.556 2.729 1.00 4.14 C ATOM 1675 C VAL B 10 19.455 27.297 3.981 1.00 20.24 C ATOM 1676 O VAL B 10 19.896 26.993 5.091 1.00 25.00 O ATOM 1677 CB VAL B 10 20.781 27.498 1.875 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.953 28.024 2.689 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.266 26.785 0.623 1.00 13.31 C ATOM 0 H VAL B 10 18.278 26.765 1.429 1.00 31.43 H new ATOM 0 HA VAL B 10 20.503 25.689 3.019 1.00 4.14 H new ATOM 0 HB VAL B 10 20.173 28.349 1.567 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.557 28.687 2.070 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.579 28.574 3.552 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.564 27.188 3.029 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.879 27.465 0.032 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.858 25.915 0.906 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.408 26.463 0.032 1.00 13.31 H new ATOM 1689 N LEU B 11 18.572 28.270 3.797 1.00 4.44 N ATOM 1690 CA LEU B 11 18.055 29.056 4.913 1.00 2.34 C ATOM 1691 C LEU B 11 17.538 28.149 6.025 1.00 45.43 C ATOM 1692 O LEU B 11 17.826 28.367 7.201 1.00 75.44 O ATOM 1693 CB LEU B 11 16.937 29.985 4.434 1.00 4.21 C ATOM 1694 CG LEU B 11 15.857 29.341 3.565 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.673 28.910 4.416 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.409 30.302 2.474 1.00 42.24 C ATOM 0 H LEU B 11 18.198 28.535 2.886 1.00 4.44 H new ATOM 0 HA LEU B 11 18.872 29.657 5.311 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.457 30.425 5.308 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.387 30.803 3.872 1.00 4.21 H new ATOM 0 HG LEU B 11 16.279 28.455 3.091 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.915 28.454 3.780 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.005 28.187 5.161 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.250 29.780 4.918 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.640 29.828 1.865 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.005 31.206 2.929 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.261 30.562 1.846 1.00 42.24 H new ATOM 1708 N MET B 12 16.775 27.131 5.642 1.00 15.32 N ATOM 1709 CA MET B 12 16.221 26.187 6.607 1.00 4.44 C ATOM 1710 C MET B 12 17.302 25.247 7.131 1.00 75.53 C ATOM 1711 O MET B 12 17.286 24.860 8.301 1.00 31.24 O ATOM 1712 CB MET B 12 15.090 25.378 5.970 1.00 24.25 C ATOM 1713 CG MET B 12 15.427 24.852 4.583 1.00 13.14 C ATOM 1714 SD MET B 12 14.487 23.373 4.155 1.00 25.25 S ATOM 1715 CE MET B 12 15.812 22.207 3.847 1.00 64.33 C ATOM 0 H MET B 12 16.526 26.938 4.672 1.00 15.32 H new ATOM 0 HA MET B 12 15.822 26.757 7.446 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.845 24.537 6.619 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.199 26.002 5.907 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.229 25.630 3.845 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.493 24.628 4.532 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.939 22.076 2.772 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.738 22.586 4.279 1.00 64.33 H new ATOM 0 HE3 MET B 12 15.566 21.248 4.302 1.00 64.33 H new ATOM 1725 N ARG B 13 18.237 24.884 6.260 1.00 31.24 N ATOM 1726 CA ARG B 13 19.325 23.988 6.637 1.00 74.51 C ATOM 1727 C ARG B 13 20.116 24.557 7.810 1.00 20.12 C ATOM 1728 O ARG B 13 20.304 23.891 8.828 1.00 41.34 O ATOM 1729 CB ARG B 13 20.255 23.754 5.445 1.00 32.34 C ATOM 1730 CG ARG B 13 21.546 23.040 5.813 1.00 45.45 C ATOM 1731 CD ARG B 13 22.253 22.499 4.580 1.00 63.05 C ATOM 1732 NE ARG B 13 23.662 22.883 4.544 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.079 24.123 4.310 1.00 41.31 C ATOM 1734 NH1 ARG B 13 23.201 25.093 4.094 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.377 24.395 4.293 1.00 12.23 N ATOM 0 H ARG B 13 18.264 25.196 5.289 1.00 31.24 H new ATOM 0 HA ARG B 13 18.891 23.036 6.943 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.727 23.168 4.692 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.497 24.714 4.990 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.207 23.728 6.340 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.328 22.221 6.498 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.173 21.412 4.564 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.754 22.869 3.684 1.00 63.05 H new ATOM 0 HE ARG B 13 24.363 22.161 4.707 1.00 42.01 H new ATOM 0 HH11 ARG B 13 22.202 24.889 4.107 1.00 23.35 H new ATOM 0 HH12 ARG B 13 23.525 26.043 3.915 1.00 23.35 H new ATOM 0 HH21 ARG B 13 26.056 23.652 4.460 1.00 12.23 H new ATOM 0 HH22 ARG B 13 25.696 25.347 4.113 1.00 12.23 H new ATOM 1749 N LYS B 14 20.580 25.793 7.660 1.00 12.22 N ATOM 1750 CA LYS B 14 21.352 26.453 8.707 1.00 65.30 C ATOM 1751 C LYS B 14 20.529 26.592 9.983 1.00 55.42 C ATOM 1752 O LYS B 14 21.078 26.778 11.070 1.00 72.04 O ATOM 1753 CB LYS B 14 21.815 27.834 8.233 1.00 13.55 C ATOM 1754 CG LYS B 14 23.181 27.820 7.568 1.00 13.50 C ATOM 1755 CD LYS B 14 23.064 27.890 6.055 1.00 31.23 C ATOM 1756 CE LYS B 14 22.512 29.232 5.599 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.475 29.962 4.730 1.00 72.34 N ATOM 0 H LYS B 14 20.435 26.358 6.823 1.00 12.22 H new ATOM 0 HA LYS B 14 22.225 25.838 8.924 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.082 28.233 7.532 1.00 13.55 H new ATOM 0 HB3 LYS B 14 21.842 28.512 9.086 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.771 28.663 7.928 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.715 26.913 7.851 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.044 27.727 5.606 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.414 27.089 5.702 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.580 29.076 5.056 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.275 29.842 6.471 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 22.975 30.714 4.213 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.222 30.384 5.318 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 23.901 29.299 4.051 1.00 72.34 H new ATOM 1771 N SER B 15 19.210 26.500 9.845 1.00 70.12 N ATOM 1772 CA SER B 15 18.312 26.618 10.989 1.00 60.13 C ATOM 1773 C SER B 15 18.505 25.452 11.954 1.00 64.13 C ATOM 1774 O SER B 15 18.274 25.584 13.155 1.00 73.31 O ATOM 1775 CB SER B 15 16.858 26.668 10.517 1.00 63.31 C ATOM 1776 OG SER B 15 16.050 27.389 11.432 1.00 42.11 O ATOM 0 H SER B 15 18.740 26.344 8.953 1.00 70.12 H new ATOM 0 HA SER B 15 18.550 27.544 11.513 1.00 60.13 H new ATOM 0 HB2 SER B 15 16.807 27.137 9.534 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.473 25.654 10.407 1.00 63.31 H new ATOM 0 HG SER B 15 16.333 27.187 12.348 1.00 42.11 H new ATOM 1782 N GLU B 16 18.932 24.313 11.419 1.00 40.41 N ATOM 1783 CA GLU B 16 19.156 23.124 12.232 1.00 13.44 C ATOM 1784 C GLU B 16 20.571 23.114 12.804 1.00 32.01 C ATOM 1785 O GLU B 16 20.943 22.214 13.556 1.00 23.44 O ATOM 1786 CB GLU B 16 18.921 21.860 11.403 1.00 54.12 C ATOM 1787 CG GLU B 16 18.956 20.580 12.222 1.00 50.43 C ATOM 1788 CD GLU B 16 18.170 19.454 11.579 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.510 19.704 10.549 1.00 51.44 O ATOM 1790 OE2 GLU B 16 18.217 18.322 12.106 1.00 35.53 O ATOM 0 H GLU B 16 19.130 24.189 10.426 1.00 40.41 H new ATOM 0 HA GLU B 16 18.448 23.144 13.060 1.00 13.44 H new ATOM 0 HB2 GLU B 16 17.954 21.937 10.905 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.678 21.802 10.621 1.00 54.12 H new ATOM 0 HG2 GLU B 16 19.991 20.266 12.354 1.00 50.43 H new ATOM 0 HG3 GLU B 16 18.554 20.778 13.216 1.00 50.43 H new ATOM 1797 N TYR B 17 21.356 24.123 12.440 1.00 34.32 N ATOM 1798 CA TYR B 17 22.731 24.230 12.913 1.00 12.14 C ATOM 1799 C TYR B 17 23.536 22.990 12.534 1.00 53.41 C ATOM 1800 O TYR B 17 24.323 22.479 13.330 1.00 71.22 O ATOM 1801 CB TYR B 17 22.756 24.423 14.430 1.00 12.25 C ATOM 1802 CG TYR B 17 21.859 25.540 14.913 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.055 26.849 14.489 1.00 24.11 C ATOM 1804 CD2 TYR B 17 20.814 25.287 15.794 1.00 4.33 C ATOM 1805 CE1 TYR B 17 21.238 27.872 14.928 1.00 12.34 C ATOM 1806 CE2 TYR B 17 19.992 26.304 16.238 1.00 21.33 C ATOM 1807 CZ TYR B 17 20.208 27.594 15.802 1.00 21.44 C ATOM 1808 OH TYR B 17 19.391 28.611 16.242 1.00 40.42 O ATOM 0 H TYR B 17 21.063 24.878 11.819 1.00 34.32 H new ATOM 0 HA TYR B 17 23.187 25.097 12.435 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.455 23.493 14.911 1.00 12.25 H new ATOM 0 HB3 TYR B 17 23.779 24.628 14.745 1.00 12.25 H new ATOM 0 HD1 TYR B 17 22.860 27.070 13.804 1.00 24.11 H new ATOM 0 HD2 TYR B 17 20.642 24.278 16.137 1.00 4.33 H new ATOM 0 HE1 TYR B 17 21.405 28.884 14.589 1.00 12.34 H new ATOM 0 HE2 TYR B 17 19.185 26.090 16.923 1.00 21.33 H new ATOM 0 HH TYR B 17 18.715 28.247 16.851 1.00 40.42 H new ATOM 1818 N LEU B 18 23.332 22.513 11.311 1.00 12.20 N ATOM 1819 CA LEU B 18 24.038 21.333 10.823 1.00 24.40 C ATOM 1820 C LEU B 18 24.860 21.666 9.582 1.00 52.21 C ATOM 1821 O LEU B 18 24.590 22.647 8.891 1.00 53.11 O ATOM 1822 CB LEU B 18 23.045 20.214 10.506 1.00 20.43 C ATOM 1823 CG LEU B 18 22.031 20.511 9.401 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.637 20.240 8.033 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.768 19.684 9.600 1.00 4.13 C ATOM 0 H LEU B 18 22.684 22.925 10.639 1.00 12.20 H new ATOM 0 HA LEU B 18 24.716 20.996 11.607 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.608 19.324 10.225 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.499 19.971 11.417 1.00 20.43 H new ATOM 0 HG LEU B 18 21.763 21.566 9.454 1.00 13.14 H new ATOM 0 HD11 LEU B 18 21.900 20.457 7.259 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.511 20.875 7.890 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.934 19.193 7.968 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.057 19.908 8.805 1.00 4.13 H new ATOM 0 HD22 LEU B 18 21.019 18.624 9.574 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.322 19.927 10.564 1.00 4.13 H new ATOM 1837 N SER B 19 25.864 20.839 9.304 1.00 12.41 N ATOM 1838 CA SER B 19 26.727 21.047 8.147 1.00 64.34 C ATOM 1839 C SER B 19 26.147 20.369 6.910 1.00 33.32 C ATOM 1840 O SER B 19 25.258 19.524 7.010 1.00 1.23 O ATOM 1841 CB SER B 19 28.130 20.506 8.429 1.00 15.24 C ATOM 1842 OG SER B 19 29.115 21.500 8.201 1.00 63.44 O ATOM 0 H SER B 19 26.099 20.020 9.864 1.00 12.41 H new ATOM 0 HA SER B 19 26.790 22.119 7.957 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.189 20.161 9.461 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.325 19.643 7.792 1.00 15.24 H new ATOM 0 HG SER B 19 30.003 21.130 8.390 1.00 63.44 H new ATOM 1848 N ARG B 20 26.657 20.748 5.742 1.00 0.34 N ATOM 1849 CA ARG B 20 26.190 20.179 4.484 1.00 13.34 C ATOM 1850 C ARG B 20 26.308 18.658 4.498 1.00 61.45 C ATOM 1851 O ARG B 20 25.423 17.954 4.013 1.00 32.35 O ATOM 1852 CB ARG B 20 26.991 20.751 3.313 1.00 32.01 C ATOM 1853 CG ARG B 20 26.524 20.253 1.954 1.00 12.30 C ATOM 1854 CD ARG B 20 26.420 21.389 0.949 1.00 43.42 C ATOM 1855 NE ARG B 20 27.576 22.280 1.009 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.791 21.937 0.594 1.00 13.22 C ATOM 1857 NH1 ARG B 20 29.006 20.729 0.092 1.00 45.34 N ATOM 1858 NH2 ARG B 20 29.792 22.803 0.681 1.00 44.43 N ATOM 0 H ARG B 20 27.393 21.447 5.641 1.00 0.34 H new ATOM 0 HA ARG B 20 25.140 20.444 4.362 1.00 13.34 H new ATOM 0 HB2 ARG B 20 26.924 21.839 3.335 1.00 32.01 H new ATOM 0 HB3 ARG B 20 28.042 20.494 3.443 1.00 32.01 H new ATOM 0 HG2 ARG B 20 27.219 19.500 1.583 1.00 12.30 H new ATOM 0 HG3 ARG B 20 25.554 19.767 2.057 1.00 12.30 H new ATOM 0 HD2 ARG B 20 26.332 20.977 -0.056 1.00 43.42 H new ATOM 0 HD3 ARG B 20 25.512 21.960 1.140 1.00 43.42 H new ATOM 0 HE ARG B 20 27.443 23.217 1.390 1.00 33.34 H new ATOM 0 HH11 ARG B 20 28.238 20.061 0.024 1.00 45.34 H new ATOM 0 HH12 ARG B 20 29.939 20.468 -0.226 1.00 45.34 H new ATOM 0 HH21 ARG B 20 29.630 23.733 1.067 1.00 44.43 H new ATOM 0 HH22 ARG B 20 30.724 22.539 0.362 1.00 44.43 H new ATOM 1872 N GLN B 21 27.404 18.159 5.058 1.00 14.43 N ATOM 1873 CA GLN B 21 27.638 16.721 5.134 1.00 43.34 C ATOM 1874 C GLN B 21 26.607 16.051 6.036 1.00 62.14 C ATOM 1875 O GLN B 21 26.123 14.960 5.737 1.00 41.54 O ATOM 1876 CB GLN B 21 29.048 16.439 5.652 1.00 2.32 C ATOM 1877 CG GLN B 21 29.443 14.973 5.572 1.00 23.52 C ATOM 1878 CD GLN B 21 30.775 14.690 6.240 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.799 14.545 5.571 1.00 14.14 O ATOM 1880 NE2 GLN B 21 30.768 14.609 7.564 1.00 71.20 N ATOM 0 H GLN B 21 28.145 18.729 5.466 1.00 14.43 H new ATOM 0 HA GLN B 21 27.540 16.308 4.130 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.762 17.031 5.079 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.118 16.770 6.688 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.669 14.366 6.042 1.00 23.52 H new ATOM 0 HG3 GLN B 21 29.494 14.671 4.526 1.00 23.52 H new ATOM 0 HE21 GLN B 21 29.896 14.736 8.078 1.00 71.20 H new ATOM 0 HE22 GLN B 21 31.634 14.420 8.068 1.00 71.20 H new ATOM 1889 N GLN B 22 26.278 16.709 7.143 1.00 33.40 N ATOM 1890 CA GLN B 22 25.306 16.175 8.089 1.00 53.02 C ATOM 1891 C GLN B 22 24.013 15.788 7.381 1.00 53.44 C ATOM 1892 O GLN B 22 23.634 14.617 7.353 1.00 72.23 O ATOM 1893 CB GLN B 22 25.014 17.201 9.187 1.00 4.03 C ATOM 1894 CG GLN B 22 26.227 17.546 10.035 1.00 5.22 C ATOM 1895 CD GLN B 22 26.782 16.345 10.777 1.00 40.14 C ATOM 1896 OE1 GLN B 22 26.429 16.096 11.930 1.00 24.31 O ATOM 1897 NE2 GLN B 22 27.655 15.594 10.117 1.00 70.34 N ATOM 0 H GLN B 22 26.670 17.613 7.407 1.00 33.40 H new ATOM 0 HA GLN B 22 25.732 15.280 8.542 1.00 53.02 H new ATOM 0 HB2 GLN B 22 24.631 18.112 8.728 1.00 4.03 H new ATOM 0 HB3 GLN B 22 24.227 16.814 9.834 1.00 4.03 H new ATOM 0 HG2 GLN B 22 27.005 17.965 9.396 1.00 5.22 H new ATOM 0 HG3 GLN B 22 25.955 18.319 10.754 1.00 5.22 H new ATOM 0 HE21 GLN B 22 27.919 15.838 9.162 1.00 70.34 H new ATOM 0 HE22 GLN B 22 28.062 14.773 10.564 1.00 70.34 H new ATOM 1906 N LEU B 23 23.338 16.780 6.810 1.00 15.24 N ATOM 1907 CA LEU B 23 22.085 16.544 6.101 1.00 60.42 C ATOM 1908 C LEU B 23 22.242 15.425 5.075 1.00 74.31 C ATOM 1909 O LEU B 23 21.443 14.489 5.036 1.00 34.01 O ATOM 1910 CB LEU B 23 21.619 17.825 5.406 1.00 62.13 C ATOM 1911 CG LEU B 23 20.384 17.695 4.515 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.124 18.026 5.298 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.509 18.595 3.295 1.00 12.23 C ATOM 0 H LEU B 23 23.637 17.755 6.824 1.00 15.24 H new ATOM 0 HA LEU B 23 21.335 16.241 6.832 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.413 18.575 6.170 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.441 18.205 4.800 1.00 62.13 H new ATOM 0 HG LEU B 23 20.313 16.662 4.173 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.255 17.928 4.647 1.00 33.53 H new ATOM 0 HD12 LEU B 23 19.027 17.339 6.139 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.185 19.049 5.670 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.621 18.489 2.672 1.00 12.23 H new ATOM 0 HD22 LEU B 23 20.605 19.632 3.616 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.391 18.309 2.721 1.00 12.23 H new ATOM 1925 N ALA B 24 23.277 15.527 4.249 1.00 31.24 N ATOM 1926 CA ALA B 24 23.541 14.523 3.227 1.00 75.43 C ATOM 1927 C ALA B 24 23.596 13.124 3.833 1.00 63.14 C ATOM 1928 O ALA B 24 23.330 12.132 3.155 1.00 31.23 O ATOM 1929 CB ALA B 24 24.841 14.837 2.501 1.00 65.45 C ATOM 0 H ALA B 24 23.947 16.296 4.268 1.00 31.24 H new ATOM 0 HA ALA B 24 22.722 14.548 2.509 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.025 14.078 1.740 1.00 65.45 H new ATOM 0 HB2 ALA B 24 24.766 15.816 2.027 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.664 14.842 3.215 1.00 65.45 H new ATOM 1935 N ASP B 25 23.946 13.053 5.114 1.00 53.33 N ATOM 1936 CA ASP B 25 24.036 11.776 5.811 1.00 63.20 C ATOM 1937 C ASP B 25 22.719 11.442 6.506 1.00 41.34 C ATOM 1938 O ASP B 25 22.382 10.272 6.694 1.00 55.50 O ATOM 1939 CB ASP B 25 25.171 11.808 6.834 1.00 35.03 C ATOM 1940 CG ASP B 25 25.982 10.526 6.842 1.00 31.34 C ATOM 1941 OD1 ASP B 25 25.475 9.507 7.356 1.00 75.51 O ATOM 1942 OD2 ASP B 25 27.120 10.542 6.330 1.00 43.25 O ATOM 0 H ASP B 25 24.172 13.865 5.689 1.00 53.33 H new ATOM 0 HA ASP B 25 24.244 11.002 5.073 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.829 12.649 6.616 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.756 11.978 7.827 1.00 35.03 H new ATOM 1947 N LEU B 26 21.977 12.477 6.885 1.00 71.41 N ATOM 1948 CA LEU B 26 20.697 12.294 7.561 1.00 64.24 C ATOM 1949 C LEU B 26 19.622 11.844 6.577 1.00 43.13 C ATOM 1950 O LEU B 26 18.686 11.133 6.945 1.00 10.22 O ATOM 1951 CB LEU B 26 20.268 13.594 8.243 1.00 4.31 C ATOM 1952 CG LEU B 26 20.634 13.728 9.722 1.00 10.30 C ATOM 1953 CD1 LEU B 26 19.716 12.872 10.579 1.00 61.54 C ATOM 1954 CD2 LEU B 26 22.089 13.346 9.948 1.00 62.25 C ATOM 0 H LEU B 26 22.240 13.451 6.736 1.00 71.41 H new ATOM 0 HA LEU B 26 20.820 11.518 8.317 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.713 14.429 7.702 1.00 4.31 H new ATOM 0 HB3 LEU B 26 19.187 13.692 8.146 1.00 4.31 H new ATOM 0 HG LEU B 26 20.503 14.769 10.016 1.00 10.30 H new ATOM 0 HD11 LEU B 26 19.992 12.980 11.628 1.00 61.54 H new ATOM 0 HD12 LEU B 26 18.684 13.194 10.440 1.00 61.54 H new ATOM 0 HD13 LEU B 26 19.813 11.827 10.284 1.00 61.54 H new ATOM 0 HD21 LEU B 26 22.332 13.447 11.006 1.00 62.25 H new ATOM 0 HD22 LEU B 26 22.247 12.313 9.637 1.00 62.25 H new ATOM 0 HD23 LEU B 26 22.733 14.003 9.363 1.00 62.25 H new ATOM 1966 N THR B 27 19.763 12.261 5.323 1.00 72.41 N ATOM 1967 CA THR B 27 18.805 11.901 4.284 1.00 53.05 C ATOM 1968 C THR B 27 19.316 10.735 3.446 1.00 51.22 C ATOM 1969 O THR B 27 18.548 10.079 2.744 1.00 32.24 O ATOM 1970 CB THR B 27 18.505 13.094 3.358 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.690 13.476 2.652 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.978 14.278 4.154 1.00 64.34 C ATOM 0 H THR B 27 20.532 12.849 5.002 1.00 72.41 H new ATOM 0 HA THR B 27 17.886 11.605 4.790 1.00 53.05 H new ATOM 0 HB THR B 27 17.740 12.788 2.644 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.345 13.840 3.284 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.773 15.109 3.478 1.00 64.34 H new ATOM 0 HG22 THR B 27 17.059 13.992 4.666 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.723 14.583 4.889 1.00 64.34 H new ATOM 1980 N GLY B 28 20.620 10.484 3.522 1.00 31.12 N ATOM 1981 CA GLY B 28 21.212 9.397 2.764 1.00 0.51 C ATOM 1982 C GLY B 28 21.638 9.825 1.374 1.00 21.43 C ATOM 1983 O GLY B 28 21.914 8.986 0.515 1.00 31.15 O ATOM 0 H GLY B 28 21.277 11.014 4.095 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.077 9.011 3.303 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.495 8.580 2.686 1.00 0.51 H new ATOM 1987 N VAL B 29 21.690 11.134 1.149 1.00 41.33 N ATOM 1988 CA VAL B 29 22.085 11.672 -0.148 1.00 64.40 C ATOM 1989 C VAL B 29 23.597 11.837 -0.237 1.00 1.32 C ATOM 1990 O VAL B 29 24.282 12.064 0.761 1.00 12.41 O ATOM 1991 CB VAL B 29 21.413 13.031 -0.420 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.460 14.095 -0.712 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.422 12.916 -1.569 1.00 55.14 C ATOM 0 H VAL B 29 21.464 11.842 1.848 1.00 41.33 H new ATOM 0 HA VAL B 29 21.756 10.956 -0.901 1.00 64.40 H new ATOM 0 HB VAL B 29 20.864 13.330 0.473 1.00 61.44 H new ATOM 0 HG11 VAL B 29 21.967 15.048 -0.902 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.126 14.195 0.145 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.039 13.805 -1.589 1.00 50.43 H new ATOM 0 HG21 VAL B 29 19.957 13.886 -1.747 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.945 12.594 -2.469 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.653 12.186 -1.315 1.00 55.14 H new ATOM 2003 N PRO B 30 24.134 11.723 -1.461 1.00 64.31 N ATOM 2004 CA PRO B 30 25.572 11.858 -1.711 1.00 44.21 C ATOM 2005 C PRO B 30 26.062 13.290 -1.523 1.00 55.44 C ATOM 2006 O PRO B 30 25.600 14.208 -2.202 1.00 52.10 O ATOM 2007 CB PRO B 30 25.721 11.430 -3.173 1.00 72.05 C ATOM 2008 CG PRO B 30 24.388 11.699 -3.783 1.00 25.14 C ATOM 2009 CD PRO B 30 23.378 11.454 -2.696 1.00 2.43 C ATOM 0 HA PRO B 30 26.163 11.262 -1.016 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.507 11.996 -3.673 1.00 72.05 H new ATOM 0 HB3 PRO B 30 25.987 10.376 -3.252 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.326 12.724 -4.149 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.210 11.044 -4.636 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.516 12.115 -2.792 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.000 10.432 -2.721 1.00 2.43 H new ATOM 2017 N TYR B 31 26.997 13.474 -0.598 1.00 55.04 N ATOM 2018 CA TYR B 31 27.547 14.796 -0.320 1.00 73.24 C ATOM 2019 C TYR B 31 28.114 15.428 -1.587 1.00 50.10 C ATOM 2020 O TYR B 31 27.830 16.584 -1.899 1.00 14.12 O ATOM 2021 CB TYR B 31 28.638 14.702 0.748 1.00 71.51 C ATOM 2022 CG TYR B 31 29.377 16.002 0.974 1.00 71.30 C ATOM 2023 CD1 TYR B 31 28.786 17.048 1.672 1.00 4.21 C ATOM 2024 CD2 TYR B 31 30.667 16.184 0.489 1.00 11.35 C ATOM 2025 CE1 TYR B 31 29.458 18.238 1.880 1.00 23.24 C ATOM 2026 CE2 TYR B 31 31.346 17.369 0.694 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.737 18.393 1.388 1.00 13.24 C ATOM 2028 OH TYR B 31 31.410 19.576 1.594 1.00 2.20 O ATOM 0 H TYR B 31 27.390 12.725 -0.028 1.00 55.04 H new ATOM 0 HA TYR B 31 26.739 15.428 0.049 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.188 14.381 1.688 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.354 13.933 0.458 1.00 71.51 H new ATOM 0 HD1 TYR B 31 27.785 16.929 2.059 1.00 4.21 H new ATOM 0 HD2 TYR B 31 31.146 15.385 -0.057 1.00 11.35 H new ATOM 0 HE1 TYR B 31 28.984 19.041 2.424 1.00 23.24 H new ATOM 0 HE2 TYR B 31 32.349 17.493 0.313 1.00 75.30 H new ATOM 0 HH TYR B 31 32.299 19.522 1.185 1.00 2.20 H new ATOM 2038 N GLY B 32 28.917 14.659 -2.317 1.00 45.13 N ATOM 2039 CA GLY B 32 29.511 15.159 -3.542 1.00 74.01 C ATOM 2040 C GLY B 32 28.486 15.776 -4.473 1.00 73.43 C ATOM 2041 O GLY B 32 28.793 16.710 -5.216 1.00 1.33 O ATOM 0 H GLY B 32 29.166 13.698 -2.081 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.269 15.903 -3.297 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.019 14.343 -4.056 1.00 74.01 H new ATOM 2045 N THR B 33 27.265 15.252 -4.438 1.00 10.04 N ATOM 2046 CA THR B 33 26.192 15.755 -5.286 1.00 11.04 C ATOM 2047 C THR B 33 25.408 16.859 -4.586 1.00 2.51 C ATOM 2048 O THR B 33 24.978 17.826 -5.217 1.00 23.25 O ATOM 2049 CB THR B 33 25.222 14.630 -5.692 1.00 3.23 C ATOM 2050 OG1 THR B 33 25.896 13.367 -5.660 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.659 14.875 -7.083 1.00 42.22 C ATOM 0 H THR B 33 26.995 14.478 -3.831 1.00 10.04 H new ATOM 0 HA THR B 33 26.662 16.160 -6.182 1.00 11.04 H new ATOM 0 HB THR B 33 24.396 14.619 -4.981 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.402 12.719 -6.204 1.00 14.15 H new ATOM 0 HG21 THR B 33 23.977 14.067 -7.347 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.121 15.823 -7.096 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.475 14.911 -7.805 1.00 42.22 H new ATOM 2059 N LEU B 34 25.225 16.710 -3.278 1.00 5.42 N ATOM 2060 CA LEU B 34 24.492 17.695 -2.491 1.00 11.23 C ATOM 2061 C LEU B 34 25.232 19.030 -2.465 1.00 53.41 C ATOM 2062 O LEU B 34 24.636 20.076 -2.209 1.00 25.43 O ATOM 2063 CB LEU B 34 24.287 17.186 -1.064 1.00 44.11 C ATOM 2064 CG LEU B 34 23.854 18.230 -0.034 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.381 18.569 -0.207 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.126 17.732 1.378 1.00 54.42 C ATOM 0 H LEU B 34 25.574 15.916 -2.741 1.00 5.42 H new ATOM 0 HA LEU B 34 23.520 17.848 -2.959 1.00 11.23 H new ATOM 0 HB2 LEU B 34 23.538 16.394 -1.086 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.219 16.734 -0.724 1.00 44.11 H new ATOM 0 HG LEU B 34 24.437 19.137 -0.196 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.089 19.313 0.534 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.215 18.968 -1.207 1.00 30.33 H new ATOM 0 HD13 LEU B 34 21.782 17.668 -0.072 1.00 30.33 H new ATOM 0 HD21 LEU B 34 23.812 18.488 2.097 1.00 54.42 H new ATOM 0 HD22 LEU B 34 23.569 16.811 1.553 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.192 17.539 1.497 1.00 54.42 H new ATOM 2078 N SER B 35 26.533 18.986 -2.735 1.00 61.31 N ATOM 2079 CA SER B 35 27.353 20.190 -2.741 1.00 34.14 C ATOM 2080 C SER B 35 26.806 21.215 -3.730 1.00 4.52 C ATOM 2081 O SER B 35 26.699 22.401 -3.418 1.00 30.41 O ATOM 2082 CB SER B 35 28.800 19.846 -3.095 1.00 14.21 C ATOM 2083 OG SER B 35 29.113 20.247 -4.417 1.00 62.41 O ATOM 0 H SER B 35 27.041 18.129 -2.952 1.00 61.31 H new ATOM 0 HA SER B 35 27.324 20.624 -1.741 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.475 20.337 -2.394 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.957 18.772 -2.991 1.00 14.21 H new ATOM 0 HG SER B 35 30.044 20.017 -4.617 1.00 62.41 H new ATOM 2089 N TYR B 36 26.462 20.748 -4.926 1.00 41.34 N ATOM 2090 CA TYR B 36 25.929 21.623 -5.963 1.00 34.30 C ATOM 2091 C TYR B 36 24.428 21.833 -5.781 1.00 45.21 C ATOM 2092 O TYR B 36 23.870 22.831 -6.235 1.00 45.01 O ATOM 2093 CB TYR B 36 26.209 21.036 -7.348 1.00 40.31 C ATOM 2094 CG TYR B 36 25.069 20.209 -7.896 1.00 34.30 C ATOM 2095 CD1 TYR B 36 23.911 20.814 -8.372 1.00 32.43 C ATOM 2096 CD2 TYR B 36 25.147 18.823 -7.939 1.00 45.14 C ATOM 2097 CE1 TYR B 36 22.866 20.062 -8.875 1.00 62.53 C ATOM 2098 CE2 TYR B 36 24.107 18.063 -8.440 1.00 64.54 C ATOM 2099 CZ TYR B 36 22.970 18.687 -8.906 1.00 62.20 C ATOM 2100 OH TYR B 36 21.931 17.934 -9.405 1.00 51.03 O ATOM 0 H TYR B 36 26.543 19.769 -5.201 1.00 41.34 H new ATOM 0 HA TYR B 36 26.425 22.590 -5.878 1.00 34.30 H new ATOM 0 HB2 TYR B 36 26.423 21.849 -8.042 1.00 40.31 H new ATOM 0 HB3 TYR B 36 27.104 20.417 -7.297 1.00 40.31 H new ATOM 0 HD1 TYR B 36 23.827 21.890 -8.348 1.00 32.43 H new ATOM 0 HD2 TYR B 36 26.036 18.330 -7.574 1.00 45.14 H new ATOM 0 HE1 TYR B 36 21.974 20.548 -9.241 1.00 62.53 H new ATOM 0 HE2 TYR B 36 24.185 16.986 -8.466 1.00 64.54 H new ATOM 0 HH TYR B 36 21.423 17.545 -8.663 1.00 51.03 H new ATOM 2110 N TYR B 37 23.782 20.883 -5.114 1.00 23.03 N ATOM 2111 CA TYR B 37 22.347 20.961 -4.871 1.00 71.53 C ATOM 2112 C TYR B 37 21.968 22.312 -4.274 1.00 1.34 C ATOM 2113 O TYR B 37 21.218 23.081 -4.876 1.00 12.02 O ATOM 2114 CB TYR B 37 21.903 19.834 -3.937 1.00 44.25 C ATOM 2115 CG TYR B 37 21.499 18.571 -4.660 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.157 18.165 -5.814 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.457 17.780 -4.189 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.789 17.012 -6.479 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.083 16.624 -4.847 1.00 0.41 C ATOM 2120 CZ TYR B 37 20.752 16.245 -5.991 1.00 71.12 C ATOM 2121 OH TYR B 37 20.384 15.094 -6.650 1.00 2.50 O ATOM 0 H TYR B 37 24.230 20.050 -4.732 1.00 23.03 H new ATOM 0 HA TYR B 37 21.836 20.851 -5.828 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.715 19.604 -3.248 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.064 20.182 -3.335 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.971 18.762 -6.198 1.00 52.14 H new ATOM 0 HD2 TYR B 37 19.931 18.074 -3.293 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.310 16.713 -7.376 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.271 16.021 -4.467 1.00 0.41 H new ATOM 0 HH TYR B 37 19.638 14.670 -6.176 1.00 2.50 H new ATOM 2131 N GLU B 38 22.491 22.594 -3.086 1.00 43.22 N ATOM 2132 CA GLU B 38 22.207 23.852 -2.406 1.00 44.31 C ATOM 2133 C GLU B 38 22.863 25.023 -3.132 1.00 24.45 C ATOM 2134 O GLU B 38 22.439 26.171 -2.992 1.00 42.22 O ATOM 2135 CB GLU B 38 22.699 23.798 -0.957 1.00 11.21 C ATOM 2136 CG GLU B 38 22.494 22.445 -0.296 1.00 54.50 C ATOM 2137 CD GLU B 38 22.415 22.541 1.215 1.00 35.11 C ATOM 2138 OE1 GLU B 38 22.752 23.613 1.759 1.00 63.32 O ATOM 2139 OE2 GLU B 38 22.017 21.544 1.854 1.00 70.20 O ATOM 0 H GLU B 38 23.114 21.969 -2.574 1.00 43.22 H new ATOM 0 HA GLU B 38 21.127 24.001 -2.411 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.760 24.048 -0.932 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.178 24.560 -0.376 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.577 21.994 -0.676 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.314 21.782 -0.572 1.00 54.50 H new ATOM 2146 N SER B 39 23.900 24.725 -3.908 1.00 53.34 N ATOM 2147 CA SER B 39 24.618 25.752 -4.654 1.00 70.11 C ATOM 2148 C SER B 39 23.787 26.246 -5.834 1.00 24.54 C ATOM 2149 O SER B 39 24.136 27.231 -6.485 1.00 41.42 O ATOM 2150 CB SER B 39 25.959 25.209 -5.150 1.00 1.22 C ATOM 2151 OG SER B 39 26.907 26.251 -5.301 1.00 11.15 O ATOM 0 H SER B 39 24.262 23.780 -4.037 1.00 53.34 H new ATOM 0 HA SER B 39 24.801 26.592 -3.984 1.00 70.11 H new ATOM 0 HB2 SER B 39 26.338 24.468 -4.446 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.818 24.700 -6.104 1.00 1.22 H new ATOM 0 HG SER B 39 27.756 25.878 -5.618 1.00 11.15 H new ATOM 2157 N GLY B 40 22.685 25.553 -6.106 1.00 41.23 N ATOM 2158 CA GLY B 40 21.821 25.935 -7.208 1.00 73.32 C ATOM 2159 C GLY B 40 22.455 25.672 -8.560 1.00 71.50 C ATOM 2160 O GLY B 40 21.951 26.123 -9.588 1.00 64.32 O ATOM 0 H GLY B 40 22.375 24.734 -5.583 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.882 25.385 -7.137 1.00 73.32 H new ATOM 0 HA3 GLY B 40 21.577 26.994 -7.124 1.00 73.32 H new ATOM 2164 N ARG B 41 23.565 24.939 -8.559 1.00 73.33 N ATOM 2165 CA ARG B 41 24.269 24.619 -9.794 1.00 73.31 C ATOM 2166 C ARG B 41 23.323 23.986 -10.811 1.00 30.24 C ATOM 2167 O ARG B 41 23.355 24.323 -11.995 1.00 23.15 O ATOM 2168 CB ARG B 41 25.436 23.671 -9.509 1.00 2.45 C ATOM 2169 CG ARG B 41 26.643 23.905 -10.403 1.00 71.20 C ATOM 2170 CD ARG B 41 27.873 24.276 -9.591 1.00 3.45 C ATOM 2171 NE ARG B 41 29.108 23.830 -10.233 1.00 73.34 N ATOM 2172 CZ ARG B 41 29.661 24.447 -11.270 1.00 44.45 C ATOM 2173 NH1 ARG B 41 29.095 25.533 -11.780 1.00 73.10 N ATOM 2174 NH2 ARG B 41 30.786 23.981 -11.799 1.00 72.43 N ATOM 0 H ARG B 41 23.995 24.556 -7.717 1.00 73.33 H new ATOM 0 HA ARG B 41 24.657 25.548 -10.213 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.738 23.783 -8.468 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.096 22.643 -9.633 1.00 2.45 H new ATOM 0 HG2 ARG B 41 26.847 23.006 -10.984 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.422 24.701 -11.114 1.00 71.20 H new ATOM 0 HD2 ARG B 41 27.905 25.357 -9.455 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.800 23.832 -8.598 1.00 3.45 H new ATOM 0 HE ARG B 41 29.570 22.999 -9.864 1.00 73.34 H new ATOM 0 HH11 ARG B 41 28.232 25.896 -11.375 1.00 73.10 H new ATOM 0 HH12 ARG B 41 29.523 26.005 -12.577 1.00 73.10 H new ATOM 0 HH21 ARG B 41 31.226 23.148 -11.409 1.00 72.43 H new ATOM 0 HH22 ARG B 41 31.210 24.456 -12.596 1.00 72.43 H new ATOM 2188 N SER B 42 22.484 23.070 -10.341 1.00 53.33 N ATOM 2189 CA SER B 42 21.532 22.387 -11.210 1.00 23.23 C ATOM 2190 C SER B 42 20.261 22.026 -10.446 1.00 3.44 C ATOM 2191 O SER B 42 20.233 22.051 -9.216 1.00 55.33 O ATOM 2192 CB SER B 42 22.163 21.124 -11.799 1.00 33.02 C ATOM 2193 OG SER B 42 22.100 21.137 -13.215 1.00 14.24 O ATOM 0 H SER B 42 22.443 22.783 -9.363 1.00 53.33 H new ATOM 0 HA SER B 42 21.267 23.065 -12.022 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.202 21.049 -11.478 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.647 20.243 -11.417 1.00 33.02 H new ATOM 0 HG SER B 42 22.511 20.320 -13.568 1.00 14.24 H new ATOM 2199 N THR B 43 19.210 21.690 -11.186 1.00 54.02 N ATOM 2200 CA THR B 43 17.935 21.325 -10.581 1.00 44.13 C ATOM 2201 C THR B 43 17.883 19.835 -10.266 1.00 62.42 C ATOM 2202 O THR B 43 17.888 18.986 -11.159 1.00 42.45 O ATOM 2203 CB THR B 43 16.753 21.685 -11.501 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.210 22.489 -12.594 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.676 22.433 -10.729 1.00 51.13 C ATOM 0 H THR B 43 19.216 21.663 -12.206 1.00 54.02 H new ATOM 0 HA THR B 43 17.851 21.893 -9.654 1.00 44.13 H new ATOM 0 HB THR B 43 16.325 20.759 -11.886 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.453 22.712 -13.175 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.851 22.677 -11.399 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.310 21.806 -9.916 1.00 51.13 H new ATOM 0 HG23 THR B 43 16.094 23.352 -10.319 1.00 51.13 H new ATOM 2213 N PRO B 44 17.831 19.505 -8.966 1.00 34.10 N ATOM 2214 CA PRO B 44 17.776 18.115 -8.504 1.00 64.22 C ATOM 2215 C PRO B 44 16.443 17.449 -8.827 1.00 65.12 C ATOM 2216 O PRO B 44 15.460 18.107 -9.170 1.00 43.23 O ATOM 2217 CB PRO B 44 17.959 18.238 -6.989 1.00 42.35 C ATOM 2218 CG PRO B 44 17.481 19.609 -6.660 1.00 43.14 C ATOM 2219 CD PRO B 44 17.822 20.464 -7.849 1.00 4.14 C ATOM 0 HA PRO B 44 18.529 17.494 -8.989 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.383 17.480 -6.458 1.00 42.35 H new ATOM 0 HB3 PRO B 44 19.002 18.104 -6.704 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.407 19.613 -6.472 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.964 19.985 -5.758 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.085 21.252 -8.002 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.790 20.951 -7.730 1.00 4.14 H new ATOM 2227 N PRO B 45 16.405 16.113 -8.715 1.00 22.42 N ATOM 2228 CA PRO B 45 15.197 15.329 -8.989 1.00 43.51 C ATOM 2229 C PRO B 45 14.114 15.547 -7.938 1.00 62.05 C ATOM 2230 O PRO B 45 14.304 16.297 -6.981 1.00 14.40 O ATOM 2231 CB PRO B 45 15.697 13.883 -8.951 1.00 65.34 C ATOM 2232 CG PRO B 45 16.904 13.921 -8.078 1.00 42.52 C ATOM 2233 CD PRO B 45 17.538 15.265 -8.309 1.00 44.51 C ATOM 0 HA PRO B 45 14.734 15.609 -9.935 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.938 13.212 -8.548 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.942 13.523 -9.950 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.632 13.792 -7.030 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.594 13.115 -8.330 1.00 42.52 H new ATOM 0 HD2 PRO B 45 18.019 15.643 -7.407 1.00 44.51 H new ATOM 0 HD3 PRO B 45 18.304 15.220 -9.083 1.00 44.51 H new ATOM 2241 N THR B 46 12.976 14.885 -8.122 1.00 11.44 N ATOM 2242 CA THR B 46 11.861 15.006 -7.191 1.00 63.42 C ATOM 2243 C THR B 46 11.922 13.924 -6.117 1.00 5.13 C ATOM 2244 O THR B 46 11.389 14.095 -5.020 1.00 4.01 O ATOM 2245 CB THR B 46 10.507 14.914 -7.919 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.396 15.971 -8.879 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.354 14.997 -6.930 1.00 3.02 C ATOM 0 H THR B 46 12.802 14.259 -8.908 1.00 11.44 H new ATOM 0 HA THR B 46 11.946 15.986 -6.722 1.00 63.42 H new ATOM 0 HB THR B 46 10.458 13.952 -8.430 1.00 52.33 H new ATOM 0 HG1 THR B 46 11.122 15.897 -9.533 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.408 14.930 -7.467 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.426 14.175 -6.218 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.401 15.946 -6.395 1.00 3.02 H new ATOM 2255 N ASP B 47 12.575 12.813 -6.440 1.00 1.43 N ATOM 2256 CA ASP B 47 12.706 11.705 -5.502 1.00 54.30 C ATOM 2257 C ASP B 47 13.658 12.064 -4.365 1.00 63.03 C ATOM 2258 O ASP B 47 13.502 11.593 -3.238 1.00 32.00 O ATOM 2259 CB ASP B 47 13.206 10.453 -6.226 1.00 61.00 C ATOM 2260 CG ASP B 47 14.718 10.410 -6.329 1.00 74.43 C ATOM 2261 OD1 ASP B 47 15.260 10.933 -7.325 1.00 53.32 O ATOM 2262 OD2 ASP B 47 15.360 9.850 -5.415 1.00 4.34 O ATOM 0 H ASP B 47 13.021 12.656 -7.344 1.00 1.43 H new ATOM 0 HA ASP B 47 11.723 11.502 -5.078 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.855 9.567 -5.698 1.00 61.00 H new ATOM 0 HB3 ASP B 47 12.775 10.419 -7.227 1.00 61.00 H new ATOM 2267 N VAL B 48 14.645 12.901 -4.669 1.00 74.22 N ATOM 2268 CA VAL B 48 15.622 13.324 -3.673 1.00 22.51 C ATOM 2269 C VAL B 48 15.153 14.577 -2.941 1.00 4.50 C ATOM 2270 O VAL B 48 15.222 14.653 -1.715 1.00 11.21 O ATOM 2271 CB VAL B 48 16.994 13.601 -4.316 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.976 14.118 -3.276 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.529 12.347 -4.990 1.00 54.21 C ATOM 0 H VAL B 48 14.789 13.299 -5.597 1.00 74.22 H new ATOM 0 HA VAL B 48 15.722 12.506 -2.959 1.00 22.51 H new ATOM 0 HB VAL B 48 16.870 14.370 -5.078 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.940 14.308 -3.748 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.595 15.043 -2.844 1.00 24.23 H new ATOM 0 HG13 VAL B 48 18.098 13.374 -2.489 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.499 12.561 -5.439 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.639 11.555 -4.250 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.833 12.026 -5.765 1.00 54.21 H new ATOM 2283 N MET B 49 14.676 15.556 -3.702 1.00 33.43 N ATOM 2284 CA MET B 49 14.194 16.805 -3.124 1.00 40.22 C ATOM 2285 C MET B 49 13.236 16.536 -1.969 1.00 4.22 C ATOM 2286 O MET B 49 13.370 17.119 -0.892 1.00 1.31 O ATOM 2287 CB MET B 49 13.497 17.650 -4.193 1.00 44.14 C ATOM 2288 CG MET B 49 12.849 18.910 -3.645 1.00 51.34 C ATOM 2289 SD MET B 49 11.089 19.010 -4.027 1.00 51.12 S ATOM 2290 CE MET B 49 10.401 17.988 -2.727 1.00 51.15 C ATOM 0 H MET B 49 14.613 15.509 -4.719 1.00 33.43 H new ATOM 0 HA MET B 49 15.054 17.354 -2.739 1.00 40.22 H new ATOM 0 HB2 MET B 49 14.224 17.928 -4.956 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.736 17.044 -4.684 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.984 18.943 -2.564 1.00 51.34 H new ATOM 0 HG3 MET B 49 13.356 19.783 -4.056 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.401 18.342 -2.477 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.346 16.954 -3.068 1.00 51.15 H new ATOM 0 HE3 MET B 49 11.037 18.045 -1.844 1.00 51.15 H new ATOM 2300 N MET B 50 12.272 15.652 -2.198 1.00 73.41 N ATOM 2301 CA MET B 50 11.293 15.305 -1.174 1.00 53.21 C ATOM 2302 C MET B 50 11.948 14.526 -0.037 1.00 3.12 C ATOM 2303 O MET B 50 11.501 14.586 1.107 1.00 20.05 O ATOM 2304 CB MET B 50 10.156 14.484 -1.782 1.00 34.20 C ATOM 2305 CG MET B 50 10.538 13.043 -2.082 1.00 34.23 C ATOM 2306 SD MET B 50 9.386 12.239 -3.211 1.00 14.43 S ATOM 2307 CE MET B 50 7.822 12.860 -2.599 1.00 65.11 C ATOM 0 H MET B 50 12.147 15.162 -3.084 1.00 73.41 H new ATOM 0 HA MET B 50 10.885 16.231 -0.768 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.308 14.491 -1.098 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.826 14.963 -2.704 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.539 13.019 -2.513 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.579 12.480 -1.149 1.00 34.23 H new ATOM 0 HE1 MET B 50 7.010 12.240 -2.979 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.821 12.832 -1.509 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.682 13.887 -2.935 1.00 65.11 H new ATOM 2317 N ASN B 51 13.009 13.794 -0.362 1.00 10.42 N ATOM 2318 CA ASN B 51 13.724 13.001 0.631 1.00 73.03 C ATOM 2319 C ASN B 51 14.436 13.902 1.636 1.00 51.31 C ATOM 2320 O ASN B 51 14.887 13.443 2.686 1.00 61.22 O ATOM 2321 CB ASN B 51 14.736 12.081 -0.052 1.00 41.34 C ATOM 2322 CG ASN B 51 14.209 10.670 -0.228 1.00 53.40 C ATOM 2323 OD1 ASN B 51 14.908 9.694 0.045 1.00 40.12 O ATOM 2324 ND2 ASN B 51 12.967 10.556 -0.686 1.00 25.24 N ATOM 0 H ASN B 51 13.392 13.734 -1.305 1.00 10.42 H new ATOM 0 HA ASN B 51 12.995 12.393 1.167 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.997 12.493 -1.027 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.652 12.053 0.537 1.00 41.34 H new ATOM 0 HD21 ASN B 51 12.557 9.632 -0.824 1.00 25.24 H new ATOM 0 HD22 ASN B 51 12.423 11.392 -0.899 1.00 25.24 H new ATOM 2331 N ILE B 52 14.533 15.185 1.306 1.00 15.14 N ATOM 2332 CA ILE B 52 15.188 16.151 2.179 1.00 71.33 C ATOM 2333 C ILE B 52 14.179 16.848 3.085 1.00 63.34 C ATOM 2334 O ILE B 52 14.503 17.244 4.205 1.00 22.32 O ATOM 2335 CB ILE B 52 15.954 17.214 1.369 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.835 16.545 0.312 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.794 18.082 2.294 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.515 15.285 0.802 1.00 3.43 C ATOM 0 H ILE B 52 14.166 15.580 0.440 1.00 15.14 H new ATOM 0 HA ILE B 52 15.896 15.592 2.791 1.00 71.33 H new ATOM 0 HB ILE B 52 15.231 17.852 0.861 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.225 16.304 -0.558 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.595 17.254 -0.018 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.329 18.828 1.706 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.145 18.583 3.012 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.511 17.458 2.827 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.123 14.864 0.001 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.152 15.523 1.654 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.761 14.559 1.105 1.00 3.43 H new ATOM 2350 N LEU B 53 12.954 16.993 2.593 1.00 63.51 N ATOM 2351 CA LEU B 53 11.894 17.640 3.358 1.00 30.02 C ATOM 2352 C LEU B 53 11.068 16.612 4.124 1.00 3.01 C ATOM 2353 O LEU B 53 10.380 16.947 5.087 1.00 32.54 O ATOM 2354 CB LEU B 53 10.986 18.449 2.428 1.00 71.32 C ATOM 2355 CG LEU B 53 11.087 19.969 2.548 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.542 20.411 2.550 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.324 20.645 1.418 1.00 70.41 C ATOM 0 H LEU B 53 12.670 16.671 1.668 1.00 63.51 H new ATOM 0 HA LEU B 53 12.360 18.313 4.077 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.212 18.170 1.399 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.953 18.157 2.618 1.00 71.32 H new ATOM 0 HG LEU B 53 10.637 20.269 3.495 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.592 21.496 2.636 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.059 19.956 3.394 1.00 64.42 H new ATOM 0 HD13 LEU B 53 13.019 20.098 1.621 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.407 21.727 1.519 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.744 20.337 0.460 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.274 20.356 1.464 1.00 70.41 H new ATOM 2369 N GLN B 54 11.144 15.358 3.690 1.00 45.30 N ATOM 2370 CA GLN B 54 10.406 14.280 4.336 1.00 4.44 C ATOM 2371 C GLN B 54 10.929 14.030 5.747 1.00 73.55 C ATOM 2372 O GLN B 54 10.227 13.474 6.592 1.00 22.03 O ATOM 2373 CB GLN B 54 10.505 12.997 3.509 1.00 31.43 C ATOM 2374 CG GLN B 54 11.882 12.354 3.547 1.00 54.24 C ATOM 2375 CD GLN B 54 11.899 10.974 2.918 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.499 10.042 3.453 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.238 10.837 1.774 1.00 32.34 N ATOM 0 H GLN B 54 11.709 15.064 2.894 1.00 45.30 H new ATOM 0 HA GLN B 54 9.361 14.581 4.403 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.769 12.281 3.874 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.246 13.221 2.474 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.593 12.995 3.026 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.217 12.282 4.582 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.754 11.637 1.366 1.00 32.34 H new ATOM 0 HE22 GLN B 54 11.214 9.932 1.304 1.00 32.34 H new ATOM 2386 N THR B 55 12.167 14.446 5.996 1.00 55.12 N ATOM 2387 CA THR B 55 12.785 14.268 7.304 1.00 13.51 C ATOM 2388 C THR B 55 11.937 14.896 8.403 1.00 42.11 C ATOM 2389 O THR B 55 11.206 15.861 8.180 1.00 72.25 O ATOM 2390 CB THR B 55 14.198 14.879 7.346 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.263 16.021 6.483 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.243 13.857 6.923 1.00 63.21 C ATOM 0 H THR B 55 12.762 14.909 5.308 1.00 55.12 H new ATOM 0 HA THR B 55 12.858 13.194 7.476 1.00 13.51 H new ATOM 0 HB THR B 55 14.407 15.185 8.371 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.503 15.733 5.577 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.233 14.312 6.961 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.210 13.002 7.599 1.00 63.21 H new ATOM 0 HG23 THR B 55 15.035 13.524 5.906 1.00 63.21 H new ATOM 2400 N PRO B 56 12.037 14.341 9.620 1.00 31.25 N ATOM 2401 CA PRO B 56 11.288 14.834 10.779 1.00 41.22 C ATOM 2402 C PRO B 56 11.783 16.196 11.254 1.00 3.50 C ATOM 2403 O PRO B 56 11.024 16.977 11.825 1.00 61.54 O ATOM 2404 CB PRO B 56 11.547 13.769 11.848 1.00 43.23 C ATOM 2405 CG PRO B 56 12.846 13.151 11.459 1.00 22.11 C ATOM 2406 CD PRO B 56 12.890 13.189 9.957 1.00 60.25 C ATOM 0 HA PRO B 56 10.233 14.980 10.549 1.00 41.22 H new ATOM 0 HB2 PRO B 56 11.601 14.211 12.843 1.00 43.23 H new ATOM 0 HB3 PRO B 56 10.747 13.029 11.871 1.00 43.23 H new ATOM 0 HG2 PRO B 56 13.684 13.701 11.888 1.00 22.11 H new ATOM 0 HG3 PRO B 56 12.916 12.127 11.826 1.00 22.11 H new ATOM 0 HD2 PRO B 56 13.907 13.321 9.588 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.509 12.266 9.520 1.00 60.25 H new ATOM 2414 N GLN B 57 13.060 16.473 11.011 1.00 42.31 N ATOM 2415 CA GLN B 57 13.655 17.742 11.414 1.00 55.32 C ATOM 2416 C GLN B 57 13.237 18.864 10.470 1.00 1.51 C ATOM 2417 O GLN B 57 13.082 20.012 10.885 1.00 23.51 O ATOM 2418 CB GLN B 57 15.180 17.627 11.445 1.00 61.00 C ATOM 2419 CG GLN B 57 15.776 17.079 10.158 1.00 72.54 C ATOM 2420 CD GLN B 57 16.317 15.673 10.318 1.00 74.05 C ATOM 2421 OE1 GLN B 57 15.646 14.793 10.859 1.00 63.42 O ATOM 2422 NE2 GLN B 57 17.539 15.451 9.845 1.00 41.13 N ATOM 0 H GLN B 57 13.702 15.837 10.538 1.00 42.31 H new ATOM 0 HA GLN B 57 13.295 17.981 12.415 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.606 18.611 11.643 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.470 16.981 12.274 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.014 17.085 9.378 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.578 17.737 9.825 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.061 16.209 9.404 1.00 41.13 H new ATOM 0 HE22 GLN B 57 17.955 14.523 9.923 1.00 41.13 H new ATOM 2431 N PHE B 58 13.056 18.524 9.199 1.00 72.25 N ATOM 2432 CA PHE B 58 12.657 19.504 8.194 1.00 73.52 C ATOM 2433 C PHE B 58 11.178 19.353 7.846 1.00 1.21 C ATOM 2434 O PHE B 58 10.753 19.684 6.739 1.00 54.13 O ATOM 2435 CB PHE B 58 13.509 19.348 6.933 1.00 21.34 C ATOM 2436 CG PHE B 58 14.952 19.709 7.136 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.371 21.026 7.033 1.00 54.32 C ATOM 2438 CD2 PHE B 58 15.890 18.733 7.430 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.699 21.361 7.219 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.219 19.061 7.618 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.624 20.378 7.512 1.00 13.33 C ATOM 0 H PHE B 58 13.179 17.577 8.839 1.00 72.25 H new ATOM 0 HA PHE B 58 12.815 20.500 8.609 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.446 18.316 6.587 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.094 19.975 6.144 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.652 21.799 6.805 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.578 17.702 7.513 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.013 22.391 7.135 1.00 23.24 H new ATOM 0 HE2 PHE B 58 17.940 18.290 7.847 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.662 20.638 7.658 1.00 13.33 H new ATOM 2451 N THR B 59 10.400 18.850 8.799 1.00 3.42 N ATOM 2452 CA THR B 59 8.971 18.654 8.593 1.00 32.14 C ATOM 2453 C THR B 59 8.209 19.968 8.735 1.00 21.44 C ATOM 2454 O THR B 59 7.162 20.160 8.117 1.00 24.22 O ATOM 2455 CB THR B 59 8.395 17.631 9.591 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.034 17.335 9.257 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.470 18.161 11.014 1.00 63.52 C ATOM 0 H THR B 59 10.736 18.571 9.721 1.00 3.42 H new ATOM 0 HA THR B 59 8.848 18.273 7.579 1.00 32.14 H new ATOM 0 HB THR B 59 8.991 16.720 9.529 1.00 53.35 H new ATOM 0 HG1 THR B 59 6.675 16.683 9.895 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.058 17.421 11.700 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.510 18.358 11.275 1.00 63.52 H new ATOM 0 HG23 THR B 59 7.896 19.085 11.089 1.00 63.52 H new ATOM 2465 N LYS B 60 8.743 20.870 9.551 1.00 13.34 N ATOM 2466 CA LYS B 60 8.115 22.168 9.773 1.00 2.41 C ATOM 2467 C LYS B 60 8.357 23.098 8.589 1.00 33.42 C ATOM 2468 O LYS B 60 7.833 24.212 8.544 1.00 21.23 O ATOM 2469 CB LYS B 60 8.654 22.805 11.056 1.00 14.22 C ATOM 2470 CG LYS B 60 8.849 21.816 12.190 1.00 61.42 C ATOM 2471 CD LYS B 60 9.047 22.525 13.520 1.00 54.34 C ATOM 2472 CE LYS B 60 10.453 23.092 13.645 1.00 31.41 C ATOM 2473 NZ LYS B 60 10.439 24.541 13.986 1.00 31.11 N ATOM 0 H LYS B 60 9.609 20.727 10.070 1.00 13.34 H new ATOM 0 HA LYS B 60 7.041 22.012 9.876 1.00 2.41 H new ATOM 0 HB2 LYS B 60 9.606 23.289 10.839 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.966 23.586 11.380 1.00 14.22 H new ATOM 0 HG2 LYS B 60 7.983 21.158 12.253 1.00 61.42 H new ATOM 0 HG3 LYS B 60 9.713 21.186 11.980 1.00 61.42 H new ATOM 0 HD2 LYS B 60 8.319 23.330 13.616 1.00 54.34 H new ATOM 0 HD3 LYS B 60 8.861 21.828 14.337 1.00 54.34 H new ATOM 0 HE2 LYS B 60 10.999 22.544 14.413 1.00 31.41 H new ATOM 0 HE3 LYS B 60 10.988 22.945 12.707 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 10.950 25.075 13.254 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 9.456 24.876 14.036 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 10.901 24.686 14.906 1.00 31.11 H new ATOM 2487 N TYR B 61 9.153 22.635 7.631 1.00 63.31 N ATOM 2488 CA TYR B 61 9.465 23.427 6.448 1.00 12.35 C ATOM 2489 C TYR B 61 9.278 22.604 5.177 1.00 43.03 C ATOM 2490 O TYR B 61 10.246 22.252 4.502 1.00 15.42 O ATOM 2491 CB TYR B 61 10.900 23.951 6.522 1.00 51.41 C ATOM 2492 CG TYR B 61 11.361 24.258 7.930 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.926 23.273 8.728 1.00 43.25 C ATOM 2494 CD2 TYR B 61 11.230 25.536 8.460 1.00 24.22 C ATOM 2495 CE1 TYR B 61 12.346 23.549 10.014 1.00 20.34 C ATOM 2496 CE2 TYR B 61 11.649 25.823 9.744 1.00 72.43 C ATOM 2497 CZ TYR B 61 12.207 24.825 10.518 1.00 62.03 C ATOM 2498 OH TYR B 61 12.626 25.106 11.798 1.00 73.32 O ATOM 0 H TYR B 61 9.594 21.715 7.651 1.00 63.31 H new ATOM 0 HA TYR B 61 8.778 24.273 6.417 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.571 23.213 6.082 1.00 51.41 H new ATOM 0 HB3 TYR B 61 10.980 24.854 5.917 1.00 51.41 H new ATOM 0 HD1 TYR B 61 12.039 22.273 8.336 1.00 43.25 H new ATOM 0 HD2 TYR B 61 10.793 26.318 7.857 1.00 24.22 H new ATOM 0 HE1 TYR B 61 12.781 22.770 10.622 1.00 20.34 H new ATOM 0 HE2 TYR B 61 11.541 26.822 10.140 1.00 72.43 H new ATOM 0 HH TYR B 61 12.458 26.051 11.997 1.00 73.32 H new ATOM 2508 N THR B 62 8.024 22.301 4.855 1.00 34.42 N ATOM 2509 CA THR B 62 7.708 21.519 3.667 1.00 72.42 C ATOM 2510 C THR B 62 7.173 22.409 2.550 1.00 31.24 C ATOM 2511 O THR B 62 7.800 22.547 1.498 1.00 31.52 O ATOM 2512 CB THR B 62 6.671 20.423 3.975 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.468 20.324 5.389 1.00 23.01 O ATOM 2514 CG2 THR B 62 7.126 19.078 3.428 1.00 4.41 C ATOM 0 H THR B 62 7.211 22.586 5.401 1.00 34.42 H new ATOM 0 HA THR B 62 8.636 21.049 3.342 1.00 72.42 H new ATOM 0 HB THR B 62 5.733 20.696 3.492 1.00 33.53 H new ATOM 0 HG1 THR B 62 6.227 19.403 5.621 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.377 18.320 3.658 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.252 19.148 2.348 1.00 4.41 H new ATOM 0 HG23 THR B 62 8.075 18.801 3.886 1.00 4.41 H new ATOM 2522 N LEU B 63 6.012 23.011 2.784 1.00 12.13 N ATOM 2523 CA LEU B 63 5.393 23.889 1.798 1.00 1.11 C ATOM 2524 C LEU B 63 5.524 25.352 2.212 1.00 22.24 C ATOM 2525 O LEU B 63 5.078 26.251 1.499 1.00 42.13 O ATOM 2526 CB LEU B 63 3.917 23.528 1.620 1.00 73.21 C ATOM 2527 CG LEU B 63 2.933 24.248 2.542 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.315 25.444 1.835 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.852 23.291 3.021 1.00 54.43 C ATOM 0 H LEU B 63 5.480 22.907 3.648 1.00 12.13 H new ATOM 0 HA LEU B 63 5.912 23.751 0.849 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.635 23.736 0.588 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.806 22.454 1.771 1.00 73.21 H new ATOM 0 HG LEU B 63 3.480 24.610 3.412 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.617 25.944 2.507 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.101 26.141 1.544 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.783 25.106 0.946 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.161 23.821 3.676 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.308 22.897 2.162 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.311 22.468 3.568 1.00 54.43 H new ATOM 2541 N TRP B 64 6.140 25.581 3.366 1.00 1.21 N ATOM 2542 CA TRP B 64 6.331 26.935 3.874 1.00 43.23 C ATOM 2543 C TRP B 64 6.978 27.826 2.819 1.00 72.02 C ATOM 2544 O TRP B 64 6.814 29.045 2.837 1.00 64.33 O ATOM 2545 CB TRP B 64 7.194 26.911 5.137 1.00 62.22 C ATOM 2546 CG TRP B 64 8.645 27.171 4.869 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.375 28.248 5.285 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.543 26.340 4.125 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.672 28.136 4.843 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.800 26.974 4.131 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.406 25.119 3.456 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.912 26.429 3.493 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.510 24.581 2.824 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.750 25.234 2.846 1.00 30.42 C ATOM 0 H TRP B 64 6.516 24.848 3.967 1.00 1.21 H new ATOM 0 HA TRP B 64 5.352 27.346 4.119 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.821 27.659 5.837 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.090 25.940 5.622 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.990 29.067 5.874 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.418 28.810 5.017 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.455 24.607 3.434 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.868 26.932 3.508 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.416 23.640 2.303 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.594 24.786 2.343 1.00 30.42 H new ATOM 2565 N PHE B 65 7.713 27.208 1.899 1.00 3.22 N ATOM 2566 CA PHE B 65 8.385 27.946 0.836 1.00 51.24 C ATOM 2567 C PHE B 65 7.943 27.448 -0.536 1.00 44.13 C ATOM 2568 O PHE B 65 7.905 28.209 -1.503 1.00 61.53 O ATOM 2569 CB PHE B 65 9.904 27.811 0.974 1.00 33.14 C ATOM 2570 CG PHE B 65 10.573 29.061 1.471 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.976 29.842 2.446 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.800 29.455 0.961 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.589 30.992 2.907 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.419 30.603 1.417 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.812 31.374 2.390 1.00 1.24 C ATOM 0 H PHE B 65 7.858 26.199 1.869 1.00 3.22 H new ATOM 0 HA PHE B 65 8.110 28.997 0.928 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.128 26.992 1.658 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.327 27.542 0.006 1.00 33.14 H new ATOM 0 HD1 PHE B 65 9.019 29.549 2.852 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.278 28.858 0.198 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.113 31.591 3.670 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.376 30.898 1.013 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.293 32.273 2.746 1.00 1.24 H new ATOM 2585 N MET B 66 7.607 26.164 -0.612 1.00 55.55 N ATOM 2586 CA MET B 66 7.166 25.563 -1.866 1.00 63.34 C ATOM 2587 C MET B 66 6.038 26.378 -2.492 1.00 2.10 C ATOM 2588 O MET B 66 5.918 26.455 -3.715 1.00 23.20 O ATOM 2589 CB MET B 66 6.702 24.124 -1.631 1.00 52.14 C ATOM 2590 CG MET B 66 7.089 23.170 -2.751 1.00 45.22 C ATOM 2591 SD MET B 66 5.703 22.169 -3.320 1.00 33.32 S ATOM 2592 CE MET B 66 4.696 23.411 -4.126 1.00 54.53 C ATOM 0 H MET B 66 7.632 25.520 0.179 1.00 55.55 H new ATOM 0 HA MET B 66 8.011 25.557 -2.554 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.126 23.763 -0.694 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.618 24.115 -1.515 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.487 23.742 -3.589 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.888 22.514 -2.405 1.00 45.22 H new ATOM 0 HE1 MET B 66 4.363 23.037 -5.094 1.00 54.53 H new ATOM 0 HE2 MET B 66 3.828 23.635 -3.505 1.00 54.53 H new ATOM 0 HE3 MET B 66 5.283 24.318 -4.270 1.00 54.53 H new ATOM 2602 N THR B 67 5.212 26.984 -1.645 1.00 4.01 N ATOM 2603 CA THR B 67 4.093 27.791 -2.115 1.00 64.01 C ATOM 2604 C THR B 67 4.047 29.137 -1.400 1.00 4.11 C ATOM 2605 O THR B 67 3.122 29.922 -1.595 1.00 25.32 O ATOM 2606 CB THR B 67 2.750 27.065 -1.905 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.874 25.689 -2.279 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.648 27.722 -2.723 1.00 73.01 C ATOM 0 H THR B 67 5.297 26.931 -0.630 1.00 4.01 H new ATOM 0 HA THR B 67 4.247 27.954 -3.182 1.00 64.01 H new ATOM 0 HB THR B 67 2.486 27.131 -0.850 1.00 50.32 H new ATOM 0 HG1 THR B 67 2.017 25.234 -2.141 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.709 27.193 -2.559 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.537 28.762 -2.415 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.907 27.682 -3.781 1.00 73.01 H new ATOM 2616 N ASN B 68 5.054 29.396 -0.572 1.00 11.41 N ATOM 2617 CA ASN B 68 5.129 30.649 0.172 1.00 74.22 C ATOM 2618 C ASN B 68 3.961 30.773 1.144 1.00 14.40 C ATOM 2619 O ASN B 68 3.372 31.845 1.289 1.00 0.14 O ATOM 2620 CB ASN B 68 5.135 31.838 -0.791 1.00 72.14 C ATOM 2621 CG ASN B 68 6.031 31.605 -1.992 1.00 24.42 C ATOM 2622 OD1 ASN B 68 7.238 31.840 -1.935 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.442 31.140 -3.088 1.00 25.24 N ATOM 0 H ASN B 68 5.829 28.756 -0.399 1.00 11.41 H new ATOM 0 HA ASN B 68 6.057 30.649 0.744 1.00 74.22 H new ATOM 0 HB2 ASN B 68 4.118 32.031 -1.132 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.468 32.730 -0.260 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.994 30.963 -3.928 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.438 30.959 -3.090 1.00 25.24 H new ATOM 2630 N GLN B 69 3.630 29.671 1.810 1.00 42.21 N ATOM 2631 CA GLN B 69 2.532 29.657 2.769 1.00 70.13 C ATOM 2632 C GLN B 69 2.908 28.863 4.015 1.00 10.34 C ATOM 2633 O GLN B 69 3.090 27.647 3.956 1.00 41.40 O ATOM 2634 CB GLN B 69 1.276 29.063 2.130 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.012 29.463 2.832 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.550 30.795 2.348 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.032 30.911 1.221 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.472 31.810 3.201 1.00 14.11 N ATOM 0 H GLN B 69 4.107 28.776 1.703 1.00 42.21 H new ATOM 0 HA GLN B 69 2.328 30.686 3.065 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.225 29.378 1.088 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.358 27.976 2.130 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.764 28.691 2.670 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.165 29.516 3.906 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.065 31.669 4.125 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.819 32.730 2.932 1.00 14.11 H new ATOM 2647 N ILE B 70 3.022 29.559 5.141 1.00 24.34 N ATOM 2648 CA ILE B 70 3.374 28.918 6.402 1.00 24.43 C ATOM 2649 C ILE B 70 2.149 28.295 7.064 1.00 41.10 C ATOM 2650 O ILE B 70 1.139 28.963 7.276 1.00 43.13 O ATOM 2651 CB ILE B 70 4.020 29.916 7.381 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.102 31.123 7.592 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.379 30.362 6.862 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.561 31.231 8.999 1.00 23.21 C ATOM 0 H ILE B 70 2.876 30.566 5.206 1.00 24.34 H new ATOM 0 HA ILE B 70 4.095 28.135 6.166 1.00 24.43 H new ATOM 0 HB ILE B 70 4.164 29.420 8.341 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.651 32.033 7.352 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.267 31.061 6.894 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.823 31.067 7.565 1.00 40.03 H new ATOM 0 HG22 ILE B 70 6.031 29.495 6.757 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.258 30.844 5.892 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.919 32.109 9.076 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.984 30.337 9.237 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.389 31.325 9.701 1.00 23.21 H new ATOM 2666 N ALA B 71 2.250 27.010 7.391 1.00 31.41 N ATOM 2667 CA ALA B 71 1.152 26.298 8.032 1.00 42.14 C ATOM 2668 C ALA B 71 1.511 25.909 9.462 1.00 13.21 C ATOM 2669 O ALA B 71 1.809 24.752 9.761 1.00 44.11 O ATOM 2670 CB ALA B 71 0.780 25.063 7.225 1.00 21.42 C ATOM 0 H ALA B 71 3.080 26.442 7.222 1.00 31.41 H new ATOM 0 HA ALA B 71 0.292 26.966 8.070 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.042 24.541 7.716 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.473 25.362 6.223 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.642 24.399 7.157 1.00 21.42 H new ATOM 2676 N PRO B 72 1.485 26.896 10.370 1.00 64.10 N ATOM 2677 CA PRO B 72 1.806 26.681 11.784 1.00 11.04 C ATOM 2678 C PRO B 72 0.739 25.860 12.502 1.00 33.42 C ATOM 2679 O PRO B 72 1.023 25.194 13.497 1.00 25.43 O ATOM 2680 CB PRO B 72 1.862 28.100 12.355 1.00 2.43 C ATOM 2681 CG PRO B 72 0.993 28.906 11.454 1.00 51.11 C ATOM 2682 CD PRO B 72 1.139 28.299 10.086 1.00 31.23 C ATOM 0 HA PRO B 72 2.731 26.119 11.911 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.500 28.128 13.383 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.883 28.482 12.366 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.045 28.877 11.785 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.298 29.952 11.451 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.216 28.377 9.511 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.918 28.796 9.507 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.486 25.913 11.989 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.594 25.174 12.583 1.00 61.34 C ATOM 2692 C GLU B 73 -1.241 23.698 12.740 1.00 54.44 C ATOM 2693 O GLU B 73 -1.748 23.019 13.633 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.852 25.321 11.725 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.286 26.762 11.521 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.289 27.222 12.560 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -4.128 26.857 13.743 1.00 41.10 O ATOM 2698 OE2 GLU B 73 -5.237 27.946 12.190 1.00 33.02 O ATOM 0 H GLU B 73 -0.736 26.459 11.165 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.787 25.591 13.572 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.673 24.863 10.752 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.667 24.768 12.192 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.410 27.410 11.556 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -3.722 26.869 10.528 1.00 64.33 H new ATOM 2705 N SER B 74 -0.369 23.207 11.865 1.00 3.13 N ATOM 2706 CA SER B 74 0.049 21.810 11.903 1.00 54.43 C ATOM 2707 C SER B 74 1.464 21.682 12.461 1.00 41.34 C ATOM 2708 O SER B 74 1.850 20.629 12.966 1.00 62.25 O ATOM 2709 CB SER B 74 -0.017 21.199 10.503 1.00 12.33 C ATOM 2710 OG SER B 74 -1.306 20.673 10.237 1.00 21.43 O ATOM 0 H SER B 74 0.062 23.756 11.121 1.00 3.13 H new ATOM 0 HA SER B 74 -0.632 21.269 12.560 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.231 21.957 9.760 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.728 20.408 10.412 1.00 12.33 H new ATOM 0 HG SER B 74 -1.236 19.713 10.052 1.00 21.43 H new ATOM 2716 N GLY B 75 2.232 22.763 12.363 1.00 32.12 N ATOM 2717 CA GLY B 75 3.595 22.751 12.860 1.00 40.12 C ATOM 2718 C GLY B 75 4.608 23.098 11.785 1.00 61.53 C ATOM 2719 O GLY B 75 5.752 22.648 11.834 1.00 74.03 O ATOM 0 H GLY B 75 1.935 23.646 11.948 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.685 23.461 13.682 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.822 21.765 13.264 1.00 40.12 H new ATOM 2723 N GLN B 76 4.185 23.899 10.813 1.00 5.14 N ATOM 2724 CA GLN B 76 5.063 24.302 9.721 1.00 30.43 C ATOM 2725 C GLN B 76 5.228 25.819 9.687 1.00 1.04 C ATOM 2726 O GLN B 76 4.251 26.556 9.547 1.00 20.13 O ATOM 2727 CB GLN B 76 4.508 23.809 8.383 1.00 34.10 C ATOM 2728 CG GLN B 76 4.676 22.312 8.172 1.00 32.22 C ATOM 2729 CD GLN B 76 3.724 21.493 9.021 1.00 51.40 C ATOM 2730 OE1 GLN B 76 2.703 21.996 9.491 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.055 20.223 9.224 1.00 72.22 N ATOM 0 H GLN B 76 3.241 24.281 10.759 1.00 5.14 H new ATOM 0 HA GLN B 76 6.041 23.851 9.890 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.449 24.060 8.323 1.00 34.10 H new ATOM 0 HB3 GLN B 76 5.008 24.341 7.573 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.513 22.077 7.120 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.702 22.029 8.407 1.00 32.22 H new ATOM 0 HE21 GLN B 76 4.911 19.847 8.815 1.00 72.22 H new ATOM 0 HE22 GLN B 76 3.453 19.623 9.789 1.00 72.22 H new ATOM 2740 N ILE B 77 6.467 26.277 9.818 1.00 41.52 N ATOM 2741 CA ILE B 77 6.760 27.705 9.801 1.00 50.31 C ATOM 2742 C ILE B 77 8.097 27.985 9.124 1.00 5.22 C ATOM 2743 O ILE B 77 8.801 27.063 8.713 1.00 61.33 O ATOM 2744 CB ILE B 77 6.785 28.291 11.225 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.105 27.945 11.918 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.605 27.772 12.034 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.356 26.458 12.033 1.00 2.32 C ATOM 0 H ILE B 77 7.285 25.680 9.937 1.00 41.52 H new ATOM 0 HA ILE B 77 5.962 28.184 9.234 1.00 50.31 H new ATOM 0 HB ILE B 77 6.704 29.376 11.157 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.926 28.402 11.366 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.108 28.384 12.916 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.638 28.196 13.038 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.674 28.063 11.547 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.657 26.685 12.097 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.309 26.288 12.534 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.555 25.997 12.611 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.386 26.016 11.037 1.00 2.32 H new ATOM 2759 N ALA B 78 8.442 29.264 9.014 1.00 60.23 N ATOM 2760 CA ALA B 78 9.697 29.665 8.389 1.00 30.33 C ATOM 2761 C ALA B 78 10.784 29.887 9.436 1.00 42.43 C ATOM 2762 O ALA B 78 10.532 30.391 10.530 1.00 1.45 O ATOM 2763 CB ALA B 78 9.494 30.925 7.561 1.00 22.31 C ATOM 0 H ALA B 78 7.871 30.040 9.349 1.00 60.23 H new ATOM 0 HA ALA B 78 10.022 28.859 7.731 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.439 31.214 7.100 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.754 30.734 6.784 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.144 31.731 8.205 1.00 22.31 H new ATOM 2769 N PRO B 79 12.022 29.500 9.095 1.00 54.52 N ATOM 2770 CA PRO B 79 13.172 29.647 9.993 1.00 53.33 C ATOM 2771 C PRO B 79 13.574 31.105 10.186 1.00 52.42 C ATOM 2772 O PRO B 79 12.853 32.017 9.782 1.00 11.10 O ATOM 2773 CB PRO B 79 14.283 28.876 9.274 1.00 0.21 C ATOM 2774 CG PRO B 79 13.898 28.911 7.836 1.00 1.12 C ATOM 2775 CD PRO B 79 12.395 28.890 7.808 1.00 63.55 C ATOM 0 HA PRO B 79 12.957 29.277 10.995 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.256 29.341 9.435 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.355 27.852 9.640 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.285 29.807 7.350 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.310 28.055 7.301 1.00 1.12 H new ATOM 0 HD2 PRO B 79 12.001 29.457 6.965 1.00 63.55 H new ATOM 0 HD3 PRO B 79 12.009 27.875 7.717 1.00 63.55 H new ATOM 2783 N ALA B 80 14.731 31.318 10.804 1.00 25.42 N ATOM 2784 CA ALA B 80 15.230 32.666 11.048 1.00 0.54 C ATOM 2785 C ALA B 80 15.930 33.223 9.813 1.00 35.22 C ATOM 2786 O ALA B 80 15.801 34.407 9.497 1.00 62.14 O ATOM 2787 CB ALA B 80 16.176 32.670 12.240 1.00 73.13 C ATOM 0 H ALA B 80 15.340 30.574 11.145 1.00 25.42 H new ATOM 0 HA ALA B 80 14.378 33.308 11.272 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.541 33.683 12.411 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.646 32.321 13.126 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.019 32.010 12.038 1.00 73.13 H new ATOM 2793 N LEU B 81 16.670 32.365 9.119 1.00 30.02 N ATOM 2794 CA LEU B 81 17.390 32.774 7.919 1.00 34.04 C ATOM 2795 C LEU B 81 16.424 33.050 6.770 1.00 42.43 C ATOM 2796 O LEU B 81 16.681 33.902 5.922 1.00 23.42 O ATOM 2797 CB LEU B 81 18.391 31.692 7.509 1.00 64.45 C ATOM 2798 CG LEU B 81 19.489 31.374 8.524 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.293 29.983 9.104 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.863 31.498 7.880 1.00 62.22 C ATOM 0 H LEU B 81 16.787 31.382 9.367 1.00 30.02 H new ATOM 0 HA LEU B 81 17.929 33.694 8.145 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.840 30.775 7.301 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.864 31.998 6.576 1.00 64.45 H new ATOM 0 HG LEU B 81 19.425 32.096 9.338 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.084 29.774 9.824 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.325 29.930 9.602 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.329 29.246 8.302 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.632 31.268 8.617 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.939 30.800 7.047 1.00 62.22 H new ATOM 0 HD23 LEU B 81 21.003 32.515 7.515 1.00 62.22 H new ATOM 2812 N ALA B 82 15.311 32.324 6.754 1.00 60.51 N ATOM 2813 CA ALA B 82 14.304 32.494 5.714 1.00 44.45 C ATOM 2814 C ALA B 82 13.910 33.959 5.565 1.00 20.32 C ATOM 2815 O ALA B 82 14.011 34.533 4.479 1.00 2.23 O ATOM 2816 CB ALA B 82 13.080 31.644 6.021 1.00 40.20 C ATOM 0 H ALA B 82 15.084 31.613 7.449 1.00 60.51 H new ATOM 0 HA ALA B 82 14.734 32.164 4.769 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.336 31.781 5.236 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.369 30.594 6.068 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.657 31.948 6.979 1.00 40.20 H new ATOM 2822 N HIS B 83 13.460 34.560 6.661 1.00 22.34 N ATOM 2823 CA HIS B 83 13.049 35.960 6.653 1.00 63.42 C ATOM 2824 C HIS B 83 11.847 36.168 5.738 1.00 41.50 C ATOM 2825 O HIS B 83 11.565 37.288 5.309 1.00 61.44 O ATOM 2826 CB HIS B 83 14.208 36.849 6.201 1.00 44.31 C ATOM 2827 CG HIS B 83 14.770 37.703 7.295 1.00 73.22 C ATOM 2828 ND1 HIS B 83 14.175 38.873 7.720 1.00 55.33 N ATOM 2829 CD2 HIS B 83 15.881 37.551 8.055 1.00 3.54 C ATOM 2830 CE1 HIS B 83 14.895 39.403 8.692 1.00 61.52 C ATOM 2831 NE2 HIS B 83 15.935 38.620 8.915 1.00 31.24 N ATOM 0 H HIS B 83 13.370 34.100 7.567 1.00 22.34 H new ATOM 0 HA HIS B 83 12.762 36.236 7.668 1.00 63.42 H new ATOM 0 HB2 HIS B 83 15.002 36.220 5.798 1.00 44.31 H new ATOM 0 HB3 HIS B 83 13.867 37.491 5.389 1.00 44.31 H new ATOM 0 HD2 HIS B 83 16.592 36.740 7.996 1.00 3.54 H new ATOM 0 HE1 HIS B 83 14.671 40.321 9.216 1.00 61.52 H new ATOM 0 HE2 HIS B 83 16.661 38.783 9.613 1.00 31.24 H new ATOM 2839 N PHE B 84 11.140 35.083 5.442 1.00 53.42 N ATOM 2840 CA PHE B 84 9.967 35.145 4.576 1.00 42.43 C ATOM 2841 C PHE B 84 8.697 34.821 5.357 1.00 52.55 C ATOM 2842 O PHE B 84 8.724 34.687 6.579 1.00 52.41 O ATOM 2843 CB PHE B 84 10.121 34.175 3.403 1.00 71.00 C ATOM 2844 CG PHE B 84 10.170 34.854 2.065 1.00 12.12 C ATOM 2845 CD1 PHE B 84 11.124 35.823 1.800 1.00 2.13 C ATOM 2846 CD2 PHE B 84 9.261 34.525 1.073 1.00 61.02 C ATOM 2847 CE1 PHE B 84 11.173 36.451 0.570 1.00 63.12 C ATOM 2848 CE2 PHE B 84 9.305 35.149 -0.160 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.261 36.114 -0.412 1.00 4.43 C ATOM 0 H PHE B 84 11.358 34.149 5.789 1.00 53.42 H new ATOM 0 HA PHE B 84 9.885 36.161 4.189 1.00 42.43 H new ATOM 0 HB2 PHE B 84 11.033 33.594 3.540 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.290 33.470 3.413 1.00 71.00 H new ATOM 0 HD1 PHE B 84 11.838 36.091 2.564 1.00 2.13 H new ATOM 0 HD2 PHE B 84 8.510 33.773 1.265 1.00 61.02 H new ATOM 0 HE1 PHE B 84 11.923 37.204 0.377 1.00 63.12 H new ATOM 0 HE2 PHE B 84 8.592 34.882 -0.926 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.295 36.604 -1.374 1.00 4.43 H new ATOM 2859 N GLY B 85 7.584 34.698 4.639 1.00 21.14 N ATOM 2860 CA GLY B 85 6.319 34.391 5.280 1.00 12.21 C ATOM 2861 C GLY B 85 5.128 34.852 4.464 1.00 31.01 C ATOM 2862 O GLY B 85 5.006 34.510 3.288 1.00 44.13 O ATOM 0 H GLY B 85 7.536 34.805 3.626 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.249 33.315 5.443 1.00 12.21 H new ATOM 0 HA3 GLY B 85 6.288 34.865 6.261 1.00 12.21 H new ATOM 2866 N GLN B 86 4.249 35.628 5.088 1.00 3.43 N ATOM 2867 CA GLN B 86 3.060 36.134 4.411 1.00 12.21 C ATOM 2868 C GLN B 86 3.416 37.282 3.471 1.00 13.14 C ATOM 2869 O GLN B 86 3.054 38.432 3.716 1.00 55.43 O ATOM 2870 CB GLN B 86 2.023 36.601 5.434 1.00 53.42 C ATOM 2871 CG GLN B 86 2.572 37.591 6.448 1.00 53.00 C ATOM 2872 CD GLN B 86 1.516 38.558 6.948 1.00 33.32 C ATOM 2873 OE1 GLN B 86 0.538 38.155 7.576 1.00 54.14 O ATOM 2874 NE2 GLN B 86 1.711 39.842 6.672 1.00 34.34 N ATOM 0 H GLN B 86 4.337 35.921 6.061 1.00 3.43 H new ATOM 0 HA GLN B 86 2.637 35.322 3.820 1.00 12.21 H new ATOM 0 HB2 GLN B 86 1.186 37.060 4.907 1.00 53.42 H new ATOM 0 HB3 GLN B 86 1.630 35.733 5.963 1.00 53.42 H new ATOM 0 HG2 GLN B 86 2.990 37.045 7.294 1.00 53.00 H new ATOM 0 HG3 GLN B 86 3.389 38.153 5.996 1.00 53.00 H new ATOM 0 HE21 GLN B 86 2.537 40.131 6.148 1.00 34.34 H new ATOM 0 HE22 GLN B 86 1.035 40.539 6.984 1.00 34.34 H new ATOM 2883 N ASN B 87 4.130 36.961 2.397 1.00 61.14 N ATOM 2884 CA ASN B 87 4.536 37.966 1.421 1.00 22.41 C ATOM 2885 C ASN B 87 4.512 37.392 0.007 1.00 34.44 C ATOM 2886 O ASN B 87 5.516 37.424 -0.703 1.00 43.53 O ATOM 2887 CB ASN B 87 5.936 38.488 1.748 1.00 1.54 C ATOM 2888 CG ASN B 87 6.959 37.373 1.849 1.00 64.20 C ATOM 2889 OD1 ASN B 87 6.732 36.262 1.371 1.00 64.54 O ATOM 2890 ND2 ASN B 87 8.094 37.665 2.476 1.00 70.15 N ATOM 0 H ASN B 87 4.439 36.013 2.180 1.00 61.14 H new ATOM 0 HA ASN B 87 3.827 38.792 1.471 1.00 22.41 H new ATOM 0 HB2 ASN B 87 6.247 39.194 0.978 1.00 1.54 H new ATOM 0 HB3 ASN B 87 5.906 39.036 2.690 1.00 1.54 H new ATOM 0 HD21 ASN B 87 8.819 36.954 2.576 1.00 70.15 H new ATOM 0 HD22 ASN B 87 8.240 38.600 2.857 1.00 70.15 H new ATOM 2897 N GLU B 88 3.356 36.870 -0.394 1.00 72.14 N ATOM 2898 CA GLU B 88 3.202 36.290 -1.723 1.00 60.50 C ATOM 2899 C GLU B 88 2.003 36.897 -2.445 1.00 51.31 C ATOM 2900 O GLU B 88 1.086 37.424 -1.816 1.00 64.11 O ATOM 2901 CB GLU B 88 3.038 34.772 -1.624 1.00 11.22 C ATOM 2902 CG GLU B 88 3.237 34.052 -2.948 1.00 72.12 C ATOM 2903 CD GLU B 88 1.938 33.518 -3.522 1.00 70.14 C ATOM 2904 OE1 GLU B 88 0.957 34.287 -3.584 1.00 44.44 O ATOM 2905 OE2 GLU B 88 1.904 32.331 -3.908 1.00 31.35 O ATOM 0 H GLU B 88 2.515 36.837 0.182 1.00 72.14 H new ATOM 0 HA GLU B 88 4.101 36.514 -2.297 1.00 60.50 H new ATOM 0 HB2 GLU B 88 3.752 34.384 -0.898 1.00 11.22 H new ATOM 0 HB3 GLU B 88 2.042 34.546 -1.243 1.00 11.22 H new ATOM 0 HG2 GLU B 88 3.693 34.736 -3.664 1.00 72.12 H new ATOM 0 HG3 GLU B 88 3.934 33.226 -2.807 1.00 72.12 H new ATOM 2912 N THR B 89 2.017 36.818 -3.772 1.00 72.22 N ATOM 2913 CA THR B 89 0.932 37.360 -4.582 1.00 72.03 C ATOM 2914 C THR B 89 0.612 36.444 -5.757 1.00 64.32 C ATOM 2915 O THR B 89 1.466 35.684 -6.215 1.00 11.41 O ATOM 2916 CB THR B 89 1.278 38.763 -5.117 1.00 44.43 C ATOM 2917 OG1 THR B 89 0.182 39.279 -5.881 1.00 72.23 O ATOM 2918 CG2 THR B 89 2.529 38.719 -5.982 1.00 55.41 C ATOM 0 H THR B 89 2.768 36.384 -4.309 1.00 72.22 H new ATOM 0 HA THR B 89 0.059 37.432 -3.934 1.00 72.03 H new ATOM 0 HB THR B 89 1.467 39.416 -4.265 1.00 44.43 H new ATOM 0 HG1 THR B 89 0.408 40.172 -6.216 1.00 72.23 H new ATOM 0 HG21 THR B 89 2.754 39.721 -6.348 1.00 55.41 H new ATOM 0 HG22 THR B 89 3.368 38.353 -5.390 1.00 55.41 H new ATOM 0 HG23 THR B 89 2.363 38.052 -6.828 1.00 55.41 H new ATOM 2926 N THR B 90 -0.622 36.521 -6.243 1.00 33.34 N ATOM 2927 CA THR B 90 -1.054 35.698 -7.366 1.00 70.14 C ATOM 2928 C THR B 90 -1.630 36.556 -8.487 1.00 13.32 C ATOM 2929 O THR B 90 -1.705 37.779 -8.369 1.00 24.44 O ATOM 2930 CB THR B 90 -2.111 34.666 -6.931 1.00 21.30 C ATOM 2931 OG1 THR B 90 -2.628 35.007 -5.640 1.00 24.01 O ATOM 2932 CG2 THR B 90 -1.515 33.266 -6.891 1.00 74.34 C ATOM 0 H THR B 90 -1.341 37.145 -5.877 1.00 33.34 H new ATOM 0 HA THR B 90 -0.172 35.173 -7.731 1.00 70.14 H new ATOM 0 HB THR B 90 -2.921 34.679 -7.660 1.00 21.30 H new ATOM 0 HG1 THR B 90 -3.301 34.347 -5.372 1.00 24.01 H new ATOM 0 HG21 THR B 90 -2.280 32.554 -6.581 1.00 74.34 H new ATOM 0 HG22 THR B 90 -1.149 32.998 -7.882 1.00 74.34 H new ATOM 0 HG23 THR B 90 -0.688 33.243 -6.181 1.00 74.34 H new ATOM 2940 N SER B 91 -2.036 35.907 -9.573 1.00 21.33 N ATOM 2941 CA SER B 91 -2.603 36.612 -10.717 1.00 52.45 C ATOM 2942 C SER B 91 -3.616 35.736 -11.448 1.00 40.41 C ATOM 2943 O SER B 91 -3.630 34.513 -11.311 1.00 20.02 O ATOM 2944 CB SER B 91 -1.493 37.040 -11.680 1.00 73.32 C ATOM 2945 OG SER B 91 -1.155 38.403 -11.495 1.00 4.32 O ATOM 0 H SER B 91 -1.983 34.895 -9.685 1.00 21.33 H new ATOM 0 HA SER B 91 -3.117 37.500 -10.347 1.00 52.45 H new ATOM 0 HB2 SER B 91 -0.611 36.419 -11.523 1.00 73.32 H new ATOM 0 HB3 SER B 91 -1.817 36.879 -12.708 1.00 73.32 H new ATOM 0 HG SER B 91 -1.230 38.633 -10.545 1.00 4.32 H new ATOM 2951 N PRO B 92 -4.485 36.376 -12.244 1.00 53.44 N ATOM 2952 CA PRO B 92 -5.519 35.676 -13.013 1.00 21.04 C ATOM 2953 C PRO B 92 -4.932 34.849 -14.152 1.00 43.21 C ATOM 2954 O PRO B 92 -3.742 34.945 -14.454 1.00 61.11 O ATOM 2955 CB PRO B 92 -6.382 36.813 -13.565 1.00 71.35 C ATOM 2956 CG PRO B 92 -5.470 37.990 -13.616 1.00 30.20 C ATOM 2957 CD PRO B 92 -4.526 37.832 -12.455 1.00 2.15 C ATOM 0 HA PRO B 92 -6.072 34.964 -12.400 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -6.771 36.570 -14.554 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -7.241 37.006 -12.923 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -4.926 38.022 -14.560 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -6.030 38.922 -13.540 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -3.538 38.233 -12.683 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -4.886 38.356 -11.570 1.00 2.15 H new ATOM 2965 N HIS B 93 -5.775 34.037 -14.782 1.00 34.50 N ATOM 2966 CA HIS B 93 -5.340 33.194 -15.891 1.00 54.15 C ATOM 2967 C HIS B 93 -6.522 32.444 -16.500 1.00 12.25 C ATOM 2968 O HIS B 93 -6.787 32.552 -17.696 1.00 33.42 O ATOM 2969 CB HIS B 93 -4.280 32.200 -15.417 1.00 0.42 C ATOM 2970 CG HIS B 93 -3.323 31.788 -16.493 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -2.631 30.594 -16.468 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -2.946 32.415 -17.631 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -1.868 30.508 -17.542 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -2.041 31.600 -18.266 1.00 23.02 N ATOM 0 H HIS B 93 -6.763 33.945 -14.544 1.00 34.50 H new ATOM 0 HA HIS B 93 -4.908 33.838 -16.657 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -3.720 32.644 -14.594 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -4.776 31.313 -15.023 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -3.292 33.378 -17.976 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -1.213 29.685 -17.787 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -1.578 31.804 -19.152 1.00 23.02 H new ATOM 2982 N SER B 94 -7.227 31.685 -15.667 1.00 3.43 N ATOM 2983 CA SER B 94 -8.377 30.914 -16.124 1.00 1.32 C ATOM 2984 C SER B 94 -7.984 29.973 -17.259 1.00 64.45 C ATOM 2985 O SER B 94 -6.812 29.873 -17.619 1.00 61.34 O ATOM 2986 CB SER B 94 -9.494 31.851 -16.588 1.00 12.44 C ATOM 2987 OG SER B 94 -9.578 32.994 -15.755 1.00 54.11 O ATOM 0 H SER B 94 -7.022 31.588 -14.673 1.00 3.43 H new ATOM 0 HA SER B 94 -8.738 30.316 -15.287 1.00 1.32 H new ATOM 0 HB2 SER B 94 -9.310 32.160 -17.617 1.00 12.44 H new ATOM 0 HB3 SER B 94 -10.446 31.320 -16.579 1.00 12.44 H new ATOM 0 HG SER B 94 -10.298 33.578 -16.073 1.00 54.11 H new ATOM 2993 N GLY B 95 -8.974 29.284 -17.819 1.00 1.35 N ATOM 2994 CA GLY B 95 -8.713 28.360 -18.906 1.00 64.00 C ATOM 2995 C GLY B 95 -9.969 27.997 -19.673 1.00 62.35 C ATOM 2996 O GLY B 95 -10.952 28.736 -19.650 1.00 43.33 O ATOM 0 H GLY B 95 -9.952 29.350 -17.539 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -7.989 28.803 -19.590 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -8.260 27.453 -18.507 1.00 64.00 H new ATOM 3000 N GLN B 96 -9.936 26.855 -20.354 1.00 50.51 N ATOM 3001 CA GLN B 96 -11.080 26.397 -21.132 1.00 72.12 C ATOM 3002 C GLN B 96 -10.894 24.950 -21.574 1.00 65.24 C ATOM 3003 O GLN B 96 -9.833 24.359 -21.369 1.00 63.21 O ATOM 3004 CB GLN B 96 -11.284 27.295 -22.354 1.00 43.41 C ATOM 3005 CG GLN B 96 -12.602 28.052 -22.340 1.00 33.45 C ATOM 3006 CD GLN B 96 -12.578 29.281 -23.227 1.00 33.12 C ATOM 3007 OE1 GLN B 96 -12.708 29.182 -24.448 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -12.412 30.449 -22.617 1.00 2.42 N ATOM 0 H GLN B 96 -9.130 26.231 -20.382 1.00 50.51 H new ATOM 0 HA GLN B 96 -11.965 26.452 -20.498 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -10.464 28.011 -22.409 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -11.235 26.684 -23.255 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -13.402 27.388 -22.668 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -12.834 28.351 -21.318 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -12.308 30.485 -21.603 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -12.388 31.310 -23.163 1.00 2.42 H new ATOM 3017 N LYS B 97 -11.930 24.384 -22.183 1.00 34.32 N ATOM 3018 CA LYS B 97 -11.881 23.005 -22.656 1.00 14.32 C ATOM 3019 C LYS B 97 -11.922 22.952 -24.179 1.00 71.32 C ATOM 3020 O LYS B 97 -11.915 23.985 -24.848 1.00 33.34 O ATOM 3021 CB LYS B 97 -13.048 22.204 -22.075 1.00 35.20 C ATOM 3022 CG LYS B 97 -14.412 22.737 -22.477 1.00 51.33 C ATOM 3023 CD LYS B 97 -15.444 21.624 -22.562 1.00 44.12 C ATOM 3024 CE LYS B 97 -16.808 22.159 -22.965 1.00 74.43 C ATOM 3025 NZ LYS B 97 -17.625 22.546 -21.782 1.00 5.41 N ATOM 0 H LYS B 97 -12.815 24.859 -22.361 1.00 34.32 H new ATOM 0 HA LYS B 97 -10.943 22.564 -22.320 1.00 14.32 H new ATOM 0 HB2 LYS B 97 -12.963 21.167 -22.399 1.00 35.20 H new ATOM 0 HB3 LYS B 97 -12.973 22.205 -20.988 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -14.740 23.483 -21.753 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -14.337 23.239 -23.441 1.00 51.33 H new ATOM 0 HD2 LYS B 97 -15.117 20.877 -23.285 1.00 44.12 H new ATOM 0 HD3 LYS B 97 -15.519 21.122 -21.598 1.00 44.12 H new ATOM 0 HE2 LYS B 97 -16.681 23.023 -23.617 1.00 74.43 H new ATOM 0 HE3 LYS B 97 -17.339 21.401 -23.541 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 -18.548 22.906 -22.100 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 -17.769 21.716 -21.173 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 -17.130 23.287 -21.246 1.00 5.41 H new ATOM 3039 N THR B 98 -11.966 21.739 -24.723 1.00 34.52 N ATOM 3040 CA THR B 98 -12.009 21.550 -26.167 1.00 3.20 C ATOM 3041 C THR B 98 -13.361 21.964 -26.737 1.00 4.23 C ATOM 3042 O THR B 98 -13.451 22.433 -27.870 1.00 73.42 O ATOM 3043 CB THR B 98 -11.730 20.084 -26.551 1.00 33.41 C ATOM 3044 OG1 THR B 98 -11.640 19.959 -27.975 1.00 41.12 O ATOM 3045 CG2 THR B 98 -12.827 19.170 -26.025 1.00 31.23 C ATOM 0 H THR B 98 -11.973 20.873 -24.184 1.00 34.52 H new ATOM 0 HA THR B 98 -11.230 22.184 -26.591 1.00 3.20 H new ATOM 0 HB THR B 98 -10.783 19.787 -26.100 1.00 33.41 H new ATOM 0 HG1 THR B 98 -11.461 19.025 -28.211 1.00 41.12 H new ATOM 0 HG21 THR B 98 -12.609 18.140 -26.308 1.00 31.23 H new ATOM 0 HG22 THR B 98 -12.874 19.246 -24.939 1.00 31.23 H new ATOM 0 HG23 THR B 98 -13.785 19.469 -26.451 1.00 31.23 H new ATOM 3053 N GLY B 99 -14.413 21.787 -25.942 1.00 24.23 N ATOM 3054 CA GLY B 99 -15.746 22.149 -26.384 1.00 5.30 C ATOM 3055 C GLY B 99 -16.446 21.013 -27.102 1.00 13.10 C ATOM 3056 O GLY B 99 -17.676 20.954 -27.136 1.00 22.51 O ATOM 0 H GLY B 99 -14.365 21.399 -25.000 1.00 24.23 H new ATOM 0 HA2 GLY B 99 -16.341 22.452 -25.523 1.00 5.30 H new ATOM 0 HA3 GLY B 99 -15.684 23.011 -27.048 1.00 5.30 H new TER 3060 GLY B 99