USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=67 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 135:sc= -3.58 (180deg=-8.69!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.676 USER MOD Set 2.1: B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 61 TYR OH : rot 15:sc= -0.196 USER MOD Set 3.1: B 51 ASN : amide:sc= -0.211 K(o=-2.2,f=-6.7!) USER MOD Set 3.2: B 54 GLN : amide:sc= -1.95 X(o=-2.2,f=-1.7) USER MOD Set 4.1: A 86 GLN : amide:sc= -0.0498 X(o=-0.097,f=0) USER MOD Set 4.2: A 87 ASN : amide:sc= -0.0475 X(o=-0.097,f=0) USER MOD Set 5.1: A 62 THR OG1 : rot -160:sc= -0.227 USER MOD Set 5.2: A 76 GLN : amide:sc= -1.18 K(o=-1.4,f=-8.1!) USER MOD Set 6.1: A 66 MET CE :methyl -113:sc= -3.69 (180deg=-9.12!) USER MOD Set 6.2: A 67 THR OG1 : rot 180:sc= -0.339 USER MOD Set 7.1: A 15 SER OG : rot -83:sc= 0.611 USER MOD Set 7.2: A 60 LYS NZ :NH3+ -110:sc= -0.667 (180deg=-3.11!) USER MOD Set 7.3: A 61 TYR OH : rot -108:sc= 0.0268 USER MOD Set 8.1: A 51 ASN : amide:sc= -1.07 K(o=-3.4,f=-10!) USER MOD Set 8.2: A 54 GLN :FLIP amide:sc= -2.34 F(o=-4,f=-3.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -53:sc= 0.0267 USER MOD Single : A 3 ASN : amide:sc= -0.0642 K(o=-0.064,f=-1.7) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 6 SER OG : rot 100:sc= 1.01 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -150:sc= -1.44 (180deg=-3.55!) USER MOD Single : A 14 LYS NZ :NH3+ 165:sc= -0.199 (180deg=-0.204) 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= -0.0735 X(o=-0.074,f=0) USER MOD Single : A 22 GLN : amide:sc= -1.31 K(o=-1.3,f=-3.6!) USER MOD Single : A 27 THR OG1 : rot -7:sc= 0.761 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 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 180:sc=-0.00439 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A 46 THR OG1 : rot 63:sc= 0.0821 USER MOD Single : A 49 MET CE :methyl -136:sc= -3.16! (180deg=-6.92!) USER MOD Single : A 50 MET CE :methyl -167:sc= -0.504 (180deg=-1.33) USER MOD Single : A 55 THR OG1 : rot -108:sc= 0.463 USER MOD Single : A 57 GLN : amide:sc= -5.11! C(o=-5.1!,f=-8.5!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0752 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 46:sc= 0.0414 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.112 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0346) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.11 USER MOD Single : B 6 SER OG : rot 105:sc= 0.688 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl -152:sc= -1.78 (180deg=-3.6!) USER MOD Single : B 14 LYS NZ :NH3+ 161:sc= -0.0974 (180deg=-0.485) USER MOD Single : B 15 SER OG : rot -140:sc= -0.0354 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= -0.436 USER MOD Single : B 21 GLN : amide:sc= -0.0488 X(o=-0.049,f=-0.47) USER MOD Single : B 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 THR OG1 : rot -69:sc= -0.151 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot -170:sc= -0.515 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot -102:sc= 0.784 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 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= 0.00125 USER MOD Single : B 46 THR OG1 : rot 60:sc= 0.268 USER MOD Single : B 49 MET CE :methyl 152:sc= -3.19 (180deg=-5.87!) USER MOD Single : B 50 MET CE :methyl 169:sc= -2.71! (180deg=-2.91) USER MOD Single : B 55 THR OG1 : rot -90:sc= 0.757 USER MOD Single : B 57 GLN : amide:sc= -1.75 K(o=-1.8,f=-2.5) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot -65:sc= 0.7 USER MOD Single : B 68 ASN : amide:sc= -0.0145 K(o=-0.015,f=-0.7) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot 119:sc= -1.58 USER MOD Single : B 76 GLN : amide:sc= -1.7 K(o=-1.7,f=-5.7!) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 86 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.025) USER MOD Single : B 87 ASN : amide:sc= -0.245 X(o=-0.25,f=-0.13) USER MOD Single : B 89 THR OG1 : rot 180:sc= -0.462 USER MOD Single : B 90 THR OG1 : rot -72:sc= 0.556 USER MOD Single : B 91 SER OG : rot 80:sc= 0.517 USER MOD Single : B 93 HIS : no HD1:sc= -0.116 X(o=-0.12,f=-0.39) USER MOD Single : B 94 SER OG : rot 5:sc= 0.498 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 THR OG1 : rot 180:sc= -0.348 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.755 -0.648 -4.893 1.00 52.20 N ATOM 2 CA MET A 1 5.493 0.557 -5.671 1.00 50.55 C ATOM 3 C MET A 1 5.286 1.760 -4.756 1.00 74.40 C ATOM 4 O MET A 1 5.951 2.786 -4.903 1.00 64.45 O ATOM 5 CB MET A 1 4.263 0.359 -6.558 1.00 3.44 C ATOM 6 CG MET A 1 4.582 -0.259 -7.909 1.00 12.32 C ATOM 7 SD MET A 1 3.101 -0.678 -8.849 1.00 41.14 S ATOM 8 CE MET A 1 3.426 -2.393 -9.247 1.00 21.33 C ATOM 0 H1 MET A 1 5.893 -1.453 -5.536 1.00 52.20 H new ATOM 0 H2 MET A 1 6.612 -0.512 -4.320 1.00 52.20 H new ATOM 0 H3 MET A 1 4.947 -0.839 -4.267 1.00 52.20 H new ATOM 0 HA MET A 1 6.361 0.748 -6.303 1.00 50.55 H new ATOM 0 HB2 MET A 1 3.548 -0.277 -6.037 1.00 3.44 H new ATOM 0 HB3 MET A 1 3.778 1.323 -6.714 1.00 3.44 H new ATOM 0 HG2 MET A 1 5.190 0.436 -8.488 1.00 12.32 H new ATOM 0 HG3 MET A 1 5.180 -1.158 -7.761 1.00 12.32 H new ATOM 0 HE1 MET A 1 2.597 -2.795 -9.829 1.00 21.33 H new ATOM 0 HE2 MET A 1 4.345 -2.464 -9.828 1.00 21.33 H new ATOM 0 HE3 MET A 1 3.534 -2.966 -8.326 1.00 21.33 H new ATOM 18 N SER A 2 4.361 1.626 -3.811 1.00 63.31 N ATOM 19 CA SER A 2 4.064 2.704 -2.874 1.00 1.32 C ATOM 20 C SER A 2 3.687 3.982 -3.618 1.00 12.31 C ATOM 21 O SER A 2 3.864 5.086 -3.105 1.00 62.31 O ATOM 22 CB SER A 2 5.267 2.965 -1.965 1.00 41.23 C ATOM 23 OG SER A 2 4.868 3.585 -0.755 1.00 50.11 O ATOM 0 H SER A 2 3.804 0.782 -3.674 1.00 63.31 H new ATOM 0 HA SER A 2 3.216 2.397 -2.262 1.00 1.32 H new ATOM 0 HB2 SER A 2 5.772 2.024 -1.746 1.00 41.23 H new ATOM 0 HB3 SER A 2 5.986 3.600 -2.482 1.00 41.23 H new ATOM 0 HG SER A 2 4.341 4.387 -0.956 1.00 50.11 H new ATOM 29 N ASN A 3 3.168 3.822 -4.831 1.00 52.21 N ATOM 30 CA ASN A 3 2.767 4.962 -5.647 1.00 14.51 C ATOM 31 C ASN A 3 3.956 5.878 -5.924 1.00 2.30 C ATOM 32 O ASN A 3 4.327 6.702 -5.087 1.00 44.20 O ATOM 33 CB ASN A 3 1.654 5.748 -4.950 1.00 31.41 C ATOM 34 CG ASN A 3 0.550 4.848 -4.430 1.00 63.51 C ATOM 35 OD1 ASN A 3 0.680 4.238 -3.367 1.00 34.44 O ATOM 36 ND2 ASN A 3 -0.544 4.762 -5.177 1.00 13.33 N ATOM 0 H ASN A 3 3.015 2.914 -5.270 1.00 52.21 H new ATOM 0 HA ASN A 3 2.394 4.583 -6.599 1.00 14.51 H new ATOM 0 HB2 ASN A 3 2.078 6.315 -4.121 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.231 6.471 -5.648 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -1.321 4.173 -4.878 1.00 13.33 H new ATOM 0 HD22 ASN A 3 -0.608 5.285 -6.050 1.00 13.33 H new ATOM 43 N THR A 4 4.548 5.729 -7.103 1.00 55.11 N ATOM 44 CA THR A 4 5.695 6.541 -7.491 1.00 61.02 C ATOM 45 C THR A 4 5.368 8.028 -7.408 1.00 34.12 C ATOM 46 O THR A 4 4.215 8.409 -7.205 1.00 24.32 O ATOM 47 CB THR A 4 6.161 6.209 -8.921 1.00 65.03 C ATOM 48 OG1 THR A 4 5.428 5.088 -9.427 1.00 41.45 O ATOM 49 CG2 THR A 4 7.650 5.901 -8.946 1.00 24.23 C ATOM 0 H THR A 4 4.253 5.053 -7.807 1.00 55.11 H new ATOM 0 HA THR A 4 6.498 6.308 -6.792 1.00 61.02 H new ATOM 0 HB THR A 4 5.975 7.078 -9.552 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.729 4.884 -10.337 1.00 41.45 H new ATOM 0 HG21 THR A 4 7.957 5.669 -9.966 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.207 6.767 -8.587 1.00 24.23 H new ATOM 0 HG23 THR A 4 7.855 5.046 -8.302 1.00 24.23 H new ATOM 57 N ILE A 5 6.390 8.863 -7.565 1.00 21.33 N ATOM 58 CA ILE A 5 6.210 10.308 -7.509 1.00 1.35 C ATOM 59 C ILE A 5 5.092 10.759 -8.442 1.00 62.20 C ATOM 60 O ILE A 5 4.179 11.477 -8.033 1.00 53.40 O ATOM 61 CB ILE A 5 7.506 11.052 -7.881 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.639 10.652 -6.934 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.283 12.556 -7.844 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.973 10.480 -7.627 1.00 64.05 C ATOM 0 H ILE A 5 7.351 8.563 -7.732 1.00 21.33 H new ATOM 0 HA ILE A 5 5.943 10.553 -6.481 1.00 1.35 H new ATOM 0 HB ILE A 5 7.790 10.772 -8.895 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.737 11.410 -6.157 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.374 9.719 -6.437 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.208 13.068 -8.109 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.502 12.826 -8.555 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.978 12.854 -6.841 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.729 10.197 -6.895 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.891 9.701 -8.385 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.261 11.419 -8.101 1.00 64.05 H new ATOM 76 N SER A 6 5.169 10.333 -9.699 1.00 63.44 N ATOM 77 CA SER A 6 4.164 10.695 -10.692 1.00 34.41 C ATOM 78 C SER A 6 2.760 10.386 -10.181 1.00 2.22 C ATOM 79 O SER A 6 1.845 11.198 -10.322 1.00 53.23 O ATOM 80 CB SER A 6 4.419 9.946 -12.001 1.00 71.40 C ATOM 81 OG SER A 6 3.487 8.893 -12.177 1.00 42.32 O ATOM 0 H SER A 6 5.917 9.737 -10.054 1.00 63.44 H new ATOM 0 HA SER A 6 4.237 11.767 -10.874 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.351 10.639 -12.839 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.432 9.543 -12.002 1.00 71.40 H new ATOM 0 HG SER A 6 2.778 9.182 -12.789 1.00 42.32 H new ATOM 87 N GLU A 7 2.598 9.207 -9.589 1.00 61.11 N ATOM 88 CA GLU A 7 1.305 8.791 -9.058 1.00 23.42 C ATOM 89 C GLU A 7 0.788 9.798 -8.034 1.00 40.04 C ATOM 90 O GLU A 7 -0.420 10.001 -7.902 1.00 33.31 O ATOM 91 CB GLU A 7 1.415 7.406 -8.417 1.00 72.32 C ATOM 92 CG GLU A 7 1.862 6.322 -9.383 1.00 53.22 C ATOM 93 CD GLU A 7 0.728 5.804 -10.247 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.260 6.545 -10.434 1.00 43.33 O ATOM 95 OE2 GLU A 7 0.829 4.659 -10.734 1.00 50.32 O ATOM 0 H GLU A 7 3.345 8.524 -9.465 1.00 61.11 H new ATOM 0 HA GLU A 7 0.598 8.746 -9.886 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.120 7.454 -7.587 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.447 7.131 -7.998 1.00 72.32 H new ATOM 0 HG2 GLU A 7 2.651 6.715 -10.024 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.292 5.494 -8.820 1.00 53.22 H new ATOM 102 N LYS A 8 1.709 10.425 -7.312 1.00 33.13 N ATOM 103 CA LYS A 8 1.348 11.411 -6.301 1.00 4.14 C ATOM 104 C LYS A 8 0.792 12.676 -6.947 1.00 74.14 C ATOM 105 O LYS A 8 0.249 13.545 -6.265 1.00 64.53 O ATOM 106 CB LYS A 8 2.566 11.759 -5.441 1.00 75.53 C ATOM 107 CG LYS A 8 3.400 10.552 -5.049 1.00 22.34 C ATOM 108 CD LYS A 8 4.270 10.843 -3.838 1.00 11.10 C ATOM 109 CE LYS A 8 3.934 9.922 -2.675 1.00 11.21 C ATOM 110 NZ LYS A 8 5.155 9.472 -1.953 1.00 5.33 N ATOM 0 H LYS A 8 2.712 10.268 -7.408 1.00 33.13 H new ATOM 0 HA LYS A 8 0.574 10.977 -5.668 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.195 12.463 -5.985 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.229 12.266 -4.537 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.743 9.710 -4.832 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.030 10.256 -5.888 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.320 10.724 -4.106 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.135 11.881 -3.533 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.272 10.440 -1.981 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.390 9.053 -3.045 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.883 8.846 -1.168 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.775 8.955 -2.609 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.661 10.299 -1.577 1.00 5.33 H new ATOM 124 N ILE A 9 0.928 12.769 -8.266 1.00 15.20 N ATOM 125 CA ILE A 9 0.436 13.926 -9.003 1.00 41.10 C ATOM 126 C ILE A 9 -0.746 13.549 -9.892 1.00 71.21 C ATOM 127 O ILE A 9 -1.333 14.402 -10.556 1.00 5.21 O ATOM 128 CB ILE A 9 1.541 14.549 -9.876 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.846 14.658 -9.084 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.108 15.916 -10.383 1.00 73.14 C ATOM 131 CD1 ILE A 9 3.987 15.254 -9.877 1.00 55.24 C ATOM 0 H ILE A 9 1.374 12.058 -8.845 1.00 15.20 H new ATOM 0 HA ILE A 9 0.113 14.658 -8.263 1.00 41.10 H new ATOM 0 HB ILE A 9 1.712 13.902 -10.736 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.673 15.268 -8.197 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.135 13.666 -8.737 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.900 16.343 -10.998 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.201 15.813 -10.979 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.912 16.573 -9.536 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.879 15.300 -9.252 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.187 14.633 -10.750 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.719 16.259 -10.201 1.00 55.24 H new ATOM 143 N VAL A 10 -1.089 12.265 -9.897 1.00 4.30 N ATOM 144 CA VAL A 10 -2.202 11.775 -10.702 1.00 43.34 C ATOM 145 C VAL A 10 -3.461 11.617 -9.858 1.00 34.04 C ATOM 146 O VAL A 10 -4.525 12.130 -10.207 1.00 71.51 O ATOM 147 CB VAL A 10 -1.866 10.424 -11.360 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.941 10.038 -12.365 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.500 10.481 -12.026 1.00 51.14 C ATOM 0 H VAL A 10 -0.613 11.546 -9.353 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.380 12.516 -11.481 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.835 9.659 -10.584 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.687 9.081 -12.820 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.901 9.954 -11.856 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -3.006 10.802 -13.140 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.279 9.518 -12.486 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.501 11.257 -12.792 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.260 10.709 -11.279 1.00 51.14 H new ATOM 159 N LEU A 11 -3.335 10.904 -8.743 1.00 33.50 N ATOM 160 CA LEU A 11 -4.464 10.679 -7.847 1.00 22.11 C ATOM 161 C LEU A 11 -5.136 11.996 -7.475 1.00 23.40 C ATOM 162 O LEU A 11 -6.350 12.144 -7.603 1.00 73.14 O ATOM 163 CB LEU A 11 -4.000 9.954 -6.583 1.00 73.11 C ATOM 164 CG LEU A 11 -2.739 10.507 -5.917 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.105 11.397 -4.739 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.832 9.372 -5.467 1.00 62.13 C ATOM 0 H LEU A 11 -2.463 10.472 -8.438 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.192 10.057 -8.369 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.811 9.978 -5.856 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.826 8.907 -6.832 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.199 11.109 -6.648 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.196 11.782 -4.277 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.715 12.230 -5.088 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.667 10.818 -4.006 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.940 9.784 -4.995 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.363 8.744 -4.752 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.542 8.774 -6.331 1.00 62.13 H new ATOM 178 N MET A 12 -4.336 12.952 -7.013 1.00 51.31 N ATOM 179 CA MET A 12 -4.852 14.260 -6.625 1.00 35.35 C ATOM 180 C MET A 12 -5.429 14.995 -7.831 1.00 14.33 C ATOM 181 O MET A 12 -6.463 15.658 -7.728 1.00 15.55 O ATOM 182 CB MET A 12 -3.746 15.099 -5.983 1.00 43.44 C ATOM 183 CG MET A 12 -2.412 15.003 -6.707 1.00 42.04 C ATOM 184 SD MET A 12 -1.294 16.353 -6.284 1.00 23.34 S ATOM 185 CE MET A 12 -1.082 17.132 -7.882 1.00 1.34 C ATOM 0 H MET A 12 -3.328 12.845 -6.898 1.00 51.31 H new ATOM 0 HA MET A 12 -5.650 14.107 -5.898 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.061 16.142 -5.957 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.613 14.780 -4.949 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.937 14.053 -6.462 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.586 15.004 -7.783 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.094 17.590 -7.935 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.178 16.383 -8.668 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.845 17.899 -8.017 1.00 1.34 H new ATOM 195 N ARG A 13 -4.757 14.876 -8.970 1.00 72.22 N ATOM 196 CA ARG A 13 -5.203 15.531 -10.194 1.00 43.34 C ATOM 197 C ARG A 13 -6.629 15.115 -10.544 1.00 25.20 C ATOM 198 O ARG A 13 -7.459 15.949 -10.904 1.00 32.00 O ATOM 199 CB ARG A 13 -4.262 15.192 -11.352 1.00 43.40 C ATOM 200 CG ARG A 13 -4.783 15.634 -12.708 1.00 23.54 C ATOM 201 CD ARG A 13 -3.653 15.808 -13.710 1.00 1.24 C ATOM 202 NE ARG A 13 -3.386 14.580 -14.454 1.00 13.15 N ATOM 203 CZ ARG A 13 -4.212 14.081 -15.367 1.00 62.43 C ATOM 204 NH1 ARG A 13 -5.351 14.700 -15.646 1.00 34.04 N ATOM 205 NH2 ARG A 13 -3.900 12.958 -16.003 1.00 3.12 N ATOM 0 H ARG A 13 -3.900 14.332 -9.072 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.188 16.608 -10.027 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.295 15.662 -11.173 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.095 14.115 -11.370 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.493 14.898 -13.084 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.325 16.574 -12.602 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -3.907 16.606 -14.407 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -2.749 16.118 -13.186 1.00 1.24 H new ATOM 0 HE ARG A 13 -2.519 14.079 -14.262 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -5.595 15.562 -15.159 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -5.983 14.314 -16.348 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -3.026 12.478 -15.791 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -4.535 12.576 -16.704 1.00 3.12 H new ATOM 219 N LYS A 14 -6.904 13.820 -10.436 1.00 43.14 N ATOM 220 CA LYS A 14 -8.229 13.292 -10.740 1.00 24.33 C ATOM 221 C LYS A 14 -9.252 13.761 -9.710 1.00 14.43 C ATOM 222 O LYS A 14 -10.457 13.734 -9.962 1.00 20.12 O ATOM 223 CB LYS A 14 -8.195 11.762 -10.780 1.00 73.54 C ATOM 224 CG LYS A 14 -7.758 11.198 -12.120 1.00 21.53 C ATOM 225 CD LYS A 14 -7.388 9.728 -12.013 1.00 2.42 C ATOM 226 CE LYS A 14 -6.143 9.526 -11.162 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.566 8.165 -11.339 1.00 3.32 N ATOM 0 H LYS A 14 -6.227 13.116 -10.140 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.526 13.669 -11.719 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.518 11.402 -10.006 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -9.187 11.379 -10.540 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.561 11.320 -12.846 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -6.903 11.763 -12.492 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -8.220 9.173 -11.580 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -7.218 9.321 -13.010 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.396 10.274 -11.427 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.391 9.682 -10.112 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -4.600 8.145 -10.955 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.153 7.471 -10.835 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.541 7.927 -12.351 1.00 3.32 H new ATOM 241 N SER A 15 -8.764 14.194 -8.553 1.00 0.52 N ATOM 242 CA SER A 15 -9.635 14.668 -7.485 1.00 34.52 C ATOM 243 C SER A 15 -10.348 15.953 -7.894 1.00 4.13 C ATOM 244 O SER A 15 -11.478 16.207 -7.481 1.00 42.32 O ATOM 245 CB SER A 15 -8.830 14.903 -6.206 1.00 23.33 C ATOM 246 OG SER A 15 -8.560 16.281 -6.019 1.00 1.04 O ATOM 0 H SER A 15 -7.769 14.226 -8.331 1.00 0.52 H new ATOM 0 HA SER A 15 -10.386 13.901 -7.297 1.00 34.52 H new ATOM 0 HB2 SER A 15 -9.383 14.518 -5.349 1.00 23.33 H new ATOM 0 HB3 SER A 15 -7.893 14.349 -6.256 1.00 23.33 H new ATOM 0 HG SER A 15 -7.772 16.534 -6.544 1.00 1.04 H new ATOM 252 N GLU A 16 -9.676 16.760 -8.710 1.00 24.43 N ATOM 253 CA GLU A 16 -10.244 18.020 -9.175 1.00 22.34 C ATOM 254 C GLU A 16 -11.095 17.805 -10.424 1.00 32.11 C ATOM 255 O GLU A 16 -11.750 18.728 -10.907 1.00 43.32 O ATOM 256 CB GLU A 16 -9.131 19.028 -9.471 1.00 13.35 C ATOM 257 CG GLU A 16 -9.616 20.466 -9.542 1.00 62.31 C ATOM 258 CD GLU A 16 -10.017 21.015 -8.186 1.00 2.34 C ATOM 259 OE1 GLU A 16 -9.269 20.791 -7.212 1.00 72.53 O ATOM 260 OE2 GLU A 16 -11.078 21.668 -8.100 1.00 14.23 O ATOM 0 H GLU A 16 -8.739 16.564 -9.062 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.882 18.415 -8.385 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.366 18.949 -8.699 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.657 18.766 -10.417 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.829 21.090 -9.964 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.468 20.525 -10.220 1.00 62.31 H new ATOM 267 N TYR A 17 -11.079 16.581 -10.940 1.00 34.24 N ATOM 268 CA TYR A 17 -11.846 16.245 -12.132 1.00 3.21 C ATOM 269 C TYR A 17 -11.430 17.119 -13.312 1.00 63.52 C ATOM 270 O TYR A 17 -12.274 17.628 -14.051 1.00 30.34 O ATOM 271 CB TYR A 17 -13.343 16.408 -11.866 1.00 21.42 C ATOM 272 CG TYR A 17 -13.862 15.516 -10.760 1.00 23.24 C ATOM 273 CD1 TYR A 17 -14.239 14.204 -11.018 1.00 54.02 C ATOM 274 CD2 TYR A 17 -13.974 15.986 -9.457 1.00 22.22 C ATOM 275 CE1 TYR A 17 -14.714 13.386 -10.011 1.00 50.43 C ATOM 276 CE2 TYR A 17 -14.447 15.175 -8.444 1.00 21.13 C ATOM 277 CZ TYR A 17 -14.815 13.876 -8.726 1.00 22.22 C ATOM 278 OH TYR A 17 -15.288 13.065 -7.720 1.00 41.24 O ATOM 0 H TYR A 17 -10.543 15.805 -10.551 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.640 15.204 -12.383 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.547 17.447 -11.609 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.892 16.193 -12.783 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -14.159 13.817 -12.023 1.00 54.02 H new ATOM 0 HD2 TYR A 17 -13.686 17.003 -9.233 1.00 22.22 H new ATOM 0 HE1 TYR A 17 -15.004 12.369 -10.229 1.00 50.43 H new ATOM 0 HE2 TYR A 17 -14.528 15.556 -7.437 1.00 21.13 H new ATOM 0 HH TYR A 17 -15.296 13.562 -6.875 1.00 41.24 H new ATOM 288 N LEU A 18 -10.124 17.289 -13.482 1.00 50.01 N ATOM 289 CA LEU A 18 -9.594 18.101 -14.572 1.00 55.21 C ATOM 290 C LEU A 18 -8.618 17.297 -15.426 1.00 11.42 C ATOM 291 O LEU A 18 -7.973 16.367 -14.941 1.00 23.51 O ATOM 292 CB LEU A 18 -8.896 19.343 -14.015 1.00 71.45 C ATOM 293 CG LEU A 18 -7.607 19.096 -13.232 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.420 18.986 -14.176 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.379 20.204 -12.214 1.00 52.43 C ATOM 0 H LEU A 18 -9.412 16.876 -12.879 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.429 18.411 -15.201 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.670 20.011 -14.846 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.597 19.868 -13.366 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.707 18.152 -12.696 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.512 18.810 -13.600 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.579 18.156 -14.865 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.317 19.912 -14.741 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.457 20.011 -11.666 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -7.301 21.161 -12.729 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.216 20.235 -11.516 1.00 52.43 H new ATOM 307 N SER A 19 -8.515 17.662 -16.700 1.00 75.14 N ATOM 308 CA SER A 19 -7.619 16.974 -17.622 1.00 42.32 C ATOM 309 C SER A 19 -6.230 17.600 -17.600 1.00 72.22 C ATOM 310 O SER A 19 -6.031 18.675 -17.032 1.00 2.13 O ATOM 311 CB SER A 19 -8.187 17.013 -19.043 1.00 3.34 C ATOM 312 OG SER A 19 -9.202 16.040 -19.214 1.00 61.02 O ATOM 0 H SER A 19 -9.041 18.430 -17.117 1.00 75.14 H new ATOM 0 HA SER A 19 -7.535 15.936 -17.300 1.00 42.32 H new ATOM 0 HB2 SER A 19 -8.591 18.004 -19.249 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.387 16.839 -19.763 1.00 3.34 H new ATOM 0 HG SER A 19 -9.549 16.087 -20.129 1.00 61.02 H new ATOM 318 N ARG A 20 -5.270 16.922 -18.222 1.00 71.01 N ATOM 319 CA ARG A 20 -3.898 17.411 -18.272 1.00 24.20 C ATOM 320 C ARG A 20 -3.821 18.735 -19.026 1.00 73.30 C ATOM 321 O ARG A 20 -2.832 19.462 -18.923 1.00 23.14 O ATOM 322 CB ARG A 20 -2.990 16.377 -18.942 1.00 14.35 C ATOM 323 CG ARG A 20 -2.461 15.322 -17.985 1.00 64.12 C ATOM 324 CD ARG A 20 -1.316 14.534 -18.603 1.00 52.12 C ATOM 325 NE ARG A 20 -1.194 13.200 -18.023 1.00 31.03 N ATOM 326 CZ ARG A 20 -1.997 12.188 -18.331 1.00 33.21 C ATOM 327 NH1 ARG A 20 -2.974 12.357 -19.212 1.00 13.10 N ATOM 328 NH2 ARG A 20 -1.822 11.003 -17.761 1.00 51.12 N ATOM 0 H ARG A 20 -5.418 16.032 -18.698 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.559 17.574 -17.249 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.542 15.885 -19.743 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.148 16.891 -19.405 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -2.121 15.800 -17.066 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -3.267 14.641 -17.711 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.473 14.449 -19.678 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.383 15.078 -18.460 1.00 52.12 H new ATOM 0 HE ARG A 20 -0.451 13.036 -17.344 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -3.110 13.266 -19.655 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -3.589 11.578 -19.447 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -1.070 10.868 -17.085 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -2.439 10.227 -17.998 1.00 51.12 H new ATOM 342 N GLN A 21 -4.869 19.042 -19.783 1.00 33.24 N ATOM 343 CA GLN A 21 -4.918 20.278 -20.555 1.00 62.13 C ATOM 344 C GLN A 21 -5.211 21.472 -19.653 1.00 32.54 C ATOM 345 O GLN A 21 -4.682 22.563 -19.861 1.00 15.25 O ATOM 346 CB GLN A 21 -5.983 20.179 -21.650 1.00 31.45 C ATOM 347 CG GLN A 21 -7.397 20.028 -21.112 1.00 12.41 C ATOM 348 CD GLN A 21 -8.388 19.617 -22.183 1.00 73.14 C ATOM 349 OE1 GLN A 21 -9.357 20.327 -22.454 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.150 18.465 -22.799 1.00 2.12 N ATOM 0 H GLN A 21 -5.696 18.452 -19.878 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.942 20.426 -21.018 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.934 21.071 -22.274 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -5.754 19.328 -22.292 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -7.401 19.285 -20.314 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -7.716 20.972 -20.670 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -7.335 17.908 -22.542 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -8.783 18.137 -23.529 1.00 2.12 H new ATOM 359 N GLN A 22 -6.057 21.257 -18.651 1.00 51.23 N ATOM 360 CA GLN A 22 -6.420 22.316 -17.717 1.00 0.45 C ATOM 361 C GLN A 22 -5.230 22.705 -16.845 1.00 51.31 C ATOM 362 O GLN A 22 -4.752 23.839 -16.899 1.00 43.21 O ATOM 363 CB GLN A 22 -7.589 21.870 -16.835 1.00 11.44 C ATOM 364 CG GLN A 22 -8.677 21.132 -17.598 1.00 2.14 C ATOM 365 CD GLN A 22 -10.019 21.181 -16.893 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.655 20.151 -16.671 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.456 22.383 -16.535 1.00 62.52 N ATOM 0 H GLN A 22 -6.504 20.359 -18.465 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.723 23.188 -18.297 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -7.210 21.224 -16.043 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -8.024 22.745 -16.353 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.777 21.567 -18.593 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -8.379 20.092 -17.733 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -9.896 23.211 -16.739 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -11.352 22.478 -16.056 1.00 62.52 H new ATOM 376 N LEU A 23 -4.757 21.759 -16.042 1.00 1.25 N ATOM 377 CA LEU A 23 -3.623 22.002 -15.158 1.00 22.42 C ATOM 378 C LEU A 23 -2.447 22.590 -15.931 1.00 63.10 C ATOM 379 O LEU A 23 -1.819 23.551 -15.488 1.00 73.44 O ATOM 380 CB LEU A 23 -3.199 20.703 -14.471 1.00 64.12 C ATOM 381 CG LEU A 23 -1.775 20.674 -13.913 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.549 21.843 -12.966 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.508 19.353 -13.205 1.00 24.14 C ATOM 0 H LEU A 23 -5.141 20.816 -15.985 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.932 22.722 -14.400 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.892 20.504 -13.654 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.305 19.886 -15.185 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.077 20.766 -14.745 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.531 21.806 -12.579 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -1.700 22.780 -13.502 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.255 21.782 -12.137 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.491 19.349 -12.814 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -2.213 19.232 -12.383 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -1.629 18.531 -13.911 1.00 24.14 H new ATOM 395 N ALA A 24 -2.156 22.008 -17.089 1.00 40.14 N ATOM 396 CA ALA A 24 -1.058 22.477 -17.925 1.00 33.11 C ATOM 397 C ALA A 24 -1.177 23.972 -18.200 1.00 23.23 C ATOM 398 O ALA A 24 -0.175 24.658 -18.400 1.00 34.43 O ATOM 399 CB ALA A 24 -1.022 21.699 -19.233 1.00 43.12 C ATOM 0 H ALA A 24 -2.665 21.211 -17.470 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.125 22.307 -17.387 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.197 22.059 -19.848 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.881 20.639 -19.022 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.962 21.841 -19.767 1.00 43.12 H new ATOM 405 N ASP A 25 -2.408 24.470 -18.210 1.00 0.02 N ATOM 406 CA ASP A 25 -2.659 25.885 -18.461 1.00 72.22 C ATOM 407 C ASP A 25 -2.618 26.683 -17.161 1.00 62.10 C ATOM 408 O ASP A 25 -2.347 27.885 -17.166 1.00 11.21 O ATOM 409 CB ASP A 25 -4.014 26.071 -19.146 1.00 75.11 C ATOM 410 CG ASP A 25 -3.910 26.879 -20.425 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.357 27.998 -20.376 1.00 32.35 O ATOM 412 OD2 ASP A 25 -4.381 26.394 -21.473 1.00 73.30 O ATOM 0 H ASP A 25 -3.248 23.915 -18.047 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.874 26.257 -19.119 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.441 25.094 -19.371 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.699 26.569 -18.460 1.00 75.11 H new ATOM 417 N LEU A 26 -2.889 26.007 -16.049 1.00 11.45 N ATOM 418 CA LEU A 26 -2.883 26.652 -14.742 1.00 42.33 C ATOM 419 C LEU A 26 -1.469 27.059 -14.340 1.00 31.40 C ATOM 420 O LEU A 26 -1.271 28.059 -13.648 1.00 63.25 O ATOM 421 CB LEU A 26 -3.476 25.716 -13.687 1.00 5.25 C ATOM 422 CG LEU A 26 -4.844 26.112 -13.131 1.00 72.31 C ATOM 423 CD1 LEU A 26 -5.892 25.076 -13.503 1.00 51.25 C ATOM 424 CD2 LEU A 26 -4.776 26.284 -11.619 1.00 64.15 C ATOM 0 H LEU A 26 -3.115 25.013 -16.028 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.495 27.552 -14.806 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.557 24.719 -14.119 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -2.774 25.647 -12.856 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.132 27.066 -13.574 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -6.859 25.375 -13.099 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -5.960 25.001 -14.588 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.609 24.108 -13.089 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -5.758 26.566 -11.240 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -4.466 25.346 -11.160 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.055 27.064 -11.374 1.00 64.15 H new ATOM 436 N THR A 27 -0.487 26.279 -14.780 1.00 4.14 N ATOM 437 CA THR A 27 0.909 26.557 -14.468 1.00 54.35 C ATOM 438 C THR A 27 1.696 26.898 -15.729 1.00 0.33 C ATOM 439 O THR A 27 2.879 27.233 -15.662 1.00 41.53 O ATOM 440 CB THR A 27 1.578 25.361 -13.766 1.00 71.31 C ATOM 441 OG1 THR A 27 2.989 25.580 -13.663 1.00 70.12 O ATOM 442 CG2 THR A 27 1.314 24.070 -14.528 1.00 31.12 C ATOM 0 H THR A 27 -0.633 25.449 -15.354 1.00 4.14 H new ATOM 0 HA THR A 27 0.918 27.414 -13.794 1.00 54.35 H new ATOM 0 HB THR A 27 1.152 25.269 -12.767 1.00 71.31 H new ATOM 0 HG1 THR A 27 3.232 26.387 -14.163 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.796 23.239 -14.014 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.240 23.891 -14.579 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.716 24.155 -15.537 1.00 31.12 H new ATOM 450 N GLY A 28 1.032 26.810 -16.877 1.00 71.14 N ATOM 451 CA GLY A 28 1.687 27.114 -18.137 1.00 55.42 C ATOM 452 C GLY A 28 2.531 25.960 -18.644 1.00 63.01 C ATOM 453 O GLY A 28 3.179 26.067 -19.684 1.00 24.43 O ATOM 0 H GLY A 28 0.053 26.534 -16.958 1.00 71.14 H new ATOM 0 HA2 GLY A 28 0.934 27.365 -18.884 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.318 27.994 -18.012 1.00 55.42 H new ATOM 457 N VAL A 29 2.523 24.855 -17.906 1.00 50.12 N ATOM 458 CA VAL A 29 3.294 23.677 -18.286 1.00 54.03 C ATOM 459 C VAL A 29 2.857 23.151 -19.650 1.00 24.12 C ATOM 460 O VAL A 29 1.668 23.086 -19.965 1.00 11.23 O ATOM 461 CB VAL A 29 3.151 22.552 -17.244 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.217 21.189 -17.917 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.222 22.680 -16.172 1.00 50.23 C ATOM 0 H VAL A 29 1.991 24.751 -17.042 1.00 50.12 H new ATOM 0 HA VAL A 29 4.339 23.985 -18.336 1.00 54.03 H new ATOM 0 HB VAL A 29 2.177 22.646 -16.764 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.114 20.407 -17.165 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.409 21.102 -18.644 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.175 21.080 -18.425 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.106 21.877 -15.444 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.208 22.613 -16.633 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.121 23.642 -15.670 1.00 50.23 H new ATOM 473 N PRO A 30 3.839 22.764 -20.477 1.00 5.34 N ATOM 474 CA PRO A 30 3.580 22.234 -21.819 1.00 54.13 C ATOM 475 C PRO A 30 2.933 20.854 -21.784 1.00 3.43 C ATOM 476 O PRO A 30 3.515 19.897 -21.272 1.00 5.21 O ATOM 477 CB PRO A 30 4.975 22.154 -22.444 1.00 44.23 C ATOM 478 CG PRO A 30 5.902 22.027 -21.284 1.00 71.13 C ATOM 479 CD PRO A 30 5.277 22.812 -20.166 1.00 14.15 C ATOM 0 HA PRO A 30 2.883 22.860 -22.376 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.060 21.299 -23.115 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.197 23.044 -23.033 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.033 20.982 -21.002 1.00 71.13 H new ATOM 0 HG3 PRO A 30 6.890 22.417 -21.530 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.493 22.368 -19.194 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.648 23.837 -20.138 1.00 14.15 H new ATOM 487 N TYR A 31 1.726 20.758 -22.330 1.00 25.44 N ATOM 488 CA TYR A 31 0.998 19.495 -22.360 1.00 32.30 C ATOM 489 C TYR A 31 1.793 18.426 -23.105 1.00 14.22 C ATOM 490 O TYR A 31 1.664 17.234 -22.828 1.00 34.33 O ATOM 491 CB TYR A 31 -0.368 19.684 -23.020 1.00 63.02 C ATOM 492 CG TYR A 31 -1.229 18.441 -22.996 1.00 1.51 C ATOM 493 CD1 TYR A 31 -1.023 17.411 -23.906 1.00 12.33 C ATOM 494 CD2 TYR A 31 -2.249 18.296 -22.064 1.00 32.10 C ATOM 495 CE1 TYR A 31 -1.808 16.275 -23.889 1.00 62.12 C ATOM 496 CE2 TYR A 31 -3.037 17.163 -22.037 1.00 35.12 C ATOM 497 CZ TYR A 31 -2.814 16.155 -22.951 1.00 32.41 C ATOM 498 OH TYR A 31 -3.599 15.025 -22.929 1.00 11.03 O ATOM 0 H TYR A 31 1.231 21.540 -22.758 1.00 25.44 H new ATOM 0 HA TYR A 31 0.853 19.164 -21.332 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.897 20.492 -22.515 1.00 63.02 H new ATOM 0 HB3 TYR A 31 -0.222 19.995 -24.054 1.00 63.02 H new ATOM 0 HD1 TYR A 31 -0.235 17.501 -24.639 1.00 12.33 H new ATOM 0 HD2 TYR A 31 -2.429 19.084 -21.348 1.00 32.10 H new ATOM 0 HE1 TYR A 31 -1.636 15.485 -24.605 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -3.824 17.067 -21.304 1.00 35.12 H new ATOM 0 HH TYR A 31 -4.259 15.099 -22.208 1.00 11.03 H new ATOM 508 N GLY A 32 2.617 18.863 -24.052 1.00 2.44 N ATOM 509 CA GLY A 32 3.421 17.932 -24.823 1.00 73.33 C ATOM 510 C GLY A 32 4.359 17.119 -23.954 1.00 15.40 C ATOM 511 O GLY A 32 4.641 15.957 -24.250 1.00 5.33 O ATOM 0 H GLY A 32 2.742 19.845 -24.299 1.00 2.44 H new ATOM 0 HA2 GLY A 32 2.764 17.258 -25.373 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.002 18.484 -25.562 1.00 73.33 H new ATOM 515 N THR A 33 4.845 17.729 -22.879 1.00 2.10 N ATOM 516 CA THR A 33 5.760 17.055 -21.965 1.00 33.22 C ATOM 517 C THR A 33 5.040 16.606 -20.699 1.00 41.20 C ATOM 518 O THR A 33 5.416 15.610 -20.079 1.00 25.30 O ATOM 519 CB THR A 33 6.938 17.966 -21.576 1.00 51.23 C ATOM 520 OG1 THR A 33 7.336 18.761 -22.699 1.00 63.51 O ATOM 521 CG2 THR A 33 8.121 17.143 -21.087 1.00 43.02 C ATOM 0 H THR A 33 4.621 18.689 -22.619 1.00 2.10 H new ATOM 0 HA THR A 33 6.145 16.181 -22.491 1.00 33.22 H new ATOM 0 HB THR A 33 6.610 18.619 -20.767 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.085 19.339 -22.442 1.00 63.51 H new ATOM 0 HG21 THR A 33 8.941 17.809 -20.818 1.00 43.02 H new ATOM 0 HG22 THR A 33 7.824 16.562 -20.214 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.447 16.468 -21.878 1.00 43.02 H new ATOM 529 N LEU A 34 4.002 17.344 -20.320 1.00 24.43 N ATOM 530 CA LEU A 34 3.228 17.020 -19.127 1.00 43.23 C ATOM 531 C LEU A 34 2.778 15.563 -19.148 1.00 50.10 C ATOM 532 O LEU A 34 2.784 14.885 -18.121 1.00 64.13 O ATOM 533 CB LEU A 34 2.011 17.940 -19.020 1.00 34.41 C ATOM 534 CG LEU A 34 1.035 17.634 -17.883 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.643 18.013 -16.542 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.282 18.364 -18.100 1.00 12.32 C ATOM 0 H LEU A 34 3.677 18.171 -20.822 1.00 24.43 H new ATOM 0 HA LEU A 34 3.868 17.170 -18.257 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.364 18.964 -18.903 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.465 17.897 -19.962 1.00 34.41 H new ATOM 0 HG LEU A 34 0.836 16.562 -17.878 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.934 17.788 -15.745 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.559 17.444 -16.384 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.872 19.079 -16.534 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.964 18.135 -17.281 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.102 19.438 -18.132 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.725 18.043 -19.043 1.00 12.32 H new ATOM 548 N SER A 35 2.388 15.087 -20.327 1.00 63.13 N ATOM 549 CA SER A 35 1.933 13.710 -20.482 1.00 73.31 C ATOM 550 C SER A 35 2.946 12.733 -19.895 1.00 51.22 C ATOM 551 O SER A 35 2.577 11.711 -19.315 1.00 50.40 O ATOM 552 CB SER A 35 1.698 13.392 -21.960 1.00 42.24 C ATOM 553 OG SER A 35 1.803 12.000 -22.205 1.00 24.01 O ATOM 0 H SER A 35 2.378 15.634 -21.188 1.00 63.13 H new ATOM 0 HA SER A 35 0.994 13.601 -19.940 1.00 73.31 H new ATOM 0 HB2 SER A 35 0.710 13.743 -22.258 1.00 42.24 H new ATOM 0 HB3 SER A 35 2.425 13.928 -22.571 1.00 42.24 H new ATOM 0 HG SER A 35 1.647 11.823 -23.156 1.00 24.01 H new ATOM 559 N TYR A 36 4.226 13.054 -20.049 1.00 24.31 N ATOM 560 CA TYR A 36 5.295 12.206 -19.536 1.00 24.32 C ATOM 561 C TYR A 36 5.601 12.535 -18.078 1.00 10.31 C ATOM 562 O TYR A 36 6.121 11.700 -17.337 1.00 72.52 O ATOM 563 CB TYR A 36 6.557 12.371 -20.384 1.00 60.32 C ATOM 564 CG TYR A 36 6.293 12.353 -21.873 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.490 11.374 -22.444 1.00 33.34 C ATOM 566 CD2 TYR A 36 6.846 13.315 -22.708 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.245 11.353 -23.804 1.00 14.13 C ATOM 568 CE2 TYR A 36 6.607 13.303 -24.069 1.00 11.33 C ATOM 569 CZ TYR A 36 5.807 12.321 -24.612 1.00 3.04 C ATOM 570 OH TYR A 36 5.566 12.305 -25.966 1.00 45.51 O ATOM 0 H TYR A 36 4.548 13.896 -20.526 1.00 24.31 H new ATOM 0 HA TYR A 36 4.960 11.170 -19.592 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.041 13.311 -20.121 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.257 11.572 -20.138 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.049 10.616 -21.814 1.00 33.34 H new ATOM 0 HD2 TYR A 36 7.474 14.086 -22.286 1.00 21.51 H new ATOM 0 HE1 TYR A 36 4.618 10.585 -24.232 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.045 14.059 -24.704 1.00 11.33 H new ATOM 0 HH TYR A 36 6.034 13.054 -26.390 1.00 45.51 H new ATOM 580 N TYR A 37 5.276 13.759 -17.675 1.00 54.21 N ATOM 581 CA TYR A 37 5.518 14.201 -16.307 1.00 5.01 C ATOM 582 C TYR A 37 4.695 13.383 -15.316 1.00 44.23 C ATOM 583 O TYR A 37 5.237 12.582 -14.555 1.00 51.30 O ATOM 584 CB TYR A 37 5.181 15.687 -16.162 1.00 11.33 C ATOM 585 CG TYR A 37 6.325 16.605 -16.527 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.261 16.234 -17.485 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.469 17.844 -15.917 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.309 17.070 -17.822 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.513 18.687 -16.248 1.00 1.34 C ATOM 590 CZ TYR A 37 8.429 18.295 -17.201 1.00 71.32 C ATOM 591 OH TYR A 37 9.471 19.132 -17.534 1.00 40.12 O ATOM 0 H TYR A 37 4.845 14.462 -18.276 1.00 54.21 H new ATOM 0 HA TYR A 37 6.575 14.051 -16.085 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.324 15.920 -16.793 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.882 15.884 -15.133 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.168 15.276 -17.975 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.753 18.154 -15.171 1.00 44.14 H new ATOM 0 HE1 TYR A 37 9.029 16.765 -18.567 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.611 19.647 -15.763 1.00 1.34 H new ATOM 0 HH TYR A 37 9.410 19.956 -17.006 1.00 40.12 H new ATOM 601 N GLU A 38 3.382 13.591 -15.334 1.00 3.11 N ATOM 602 CA GLU A 38 2.484 12.873 -14.437 1.00 5.14 C ATOM 603 C GLU A 38 2.585 11.366 -14.657 1.00 64.14 C ATOM 604 O GLU A 38 2.225 10.575 -13.785 1.00 41.42 O ATOM 605 CB GLU A 38 1.041 13.335 -14.647 1.00 45.31 C ATOM 606 CG GLU A 38 0.889 14.844 -14.726 1.00 24.31 C ATOM 607 CD GLU A 38 -0.431 15.329 -14.160 1.00 34.22 C ATOM 608 OE1 GLU A 38 -0.923 14.713 -13.191 1.00 33.41 O ATOM 609 OE2 GLU A 38 -0.973 16.324 -14.686 1.00 25.54 O ATOM 0 H GLU A 38 2.917 14.250 -15.959 1.00 3.11 H new ATOM 0 HA GLU A 38 2.783 13.094 -13.412 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.657 12.891 -15.565 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.426 12.959 -13.830 1.00 45.31 H new ATOM 0 HG2 GLU A 38 1.708 15.317 -14.184 1.00 24.31 H new ATOM 0 HG3 GLU A 38 0.972 15.160 -15.766 1.00 24.31 H new ATOM 616 N SER A 39 3.076 10.978 -15.830 1.00 60.13 N ATOM 617 CA SER A 39 3.220 9.566 -16.167 1.00 34.13 C ATOM 618 C SER A 39 4.449 8.968 -15.489 1.00 11.41 C ATOM 619 O SER A 39 4.598 7.749 -15.413 1.00 14.05 O ATOM 620 CB SER A 39 3.325 9.392 -17.684 1.00 51.23 C ATOM 621 OG SER A 39 3.711 8.070 -18.019 1.00 13.01 O ATOM 0 H SER A 39 3.380 11.620 -16.562 1.00 60.13 H new ATOM 0 HA SER A 39 2.336 9.039 -15.807 1.00 34.13 H new ATOM 0 HB2 SER A 39 2.366 9.623 -18.147 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.051 10.099 -18.085 1.00 51.23 H new ATOM 0 HG SER A 39 3.770 7.983 -18.993 1.00 13.01 H new ATOM 627 N GLY A 40 5.326 9.837 -14.996 1.00 14.52 N ATOM 628 CA GLY A 40 6.531 9.377 -14.330 1.00 24.23 C ATOM 629 C GLY A 40 7.582 8.885 -15.306 1.00 45.11 C ATOM 630 O GLY A 40 8.507 8.168 -14.924 1.00 74.53 O ATOM 0 H GLY A 40 5.224 10.851 -15.046 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.946 10.190 -13.734 1.00 24.23 H new ATOM 0 HA3 GLY A 40 6.276 8.573 -13.639 1.00 24.23 H new ATOM 634 N ARG A 41 7.438 9.270 -16.571 1.00 4.24 N ATOM 635 CA ARG A 41 8.381 8.860 -17.605 1.00 13.35 C ATOM 636 C ARG A 41 9.779 9.396 -17.309 1.00 52.13 C ATOM 637 O ARG A 41 10.772 8.681 -17.451 1.00 61.34 O ATOM 638 CB ARG A 41 7.913 9.354 -18.975 1.00 40.30 C ATOM 639 CG ARG A 41 8.186 8.372 -20.102 1.00 52.51 C ATOM 640 CD ARG A 41 6.895 7.811 -20.677 1.00 42.11 C ATOM 641 NE ARG A 41 7.143 6.742 -21.641 1.00 62.55 N ATOM 642 CZ ARG A 41 7.586 6.953 -22.875 1.00 34.51 C ATOM 643 NH1 ARG A 41 7.827 8.188 -23.295 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.788 5.929 -23.694 1.00 43.33 N ATOM 0 H ARG A 41 6.679 9.864 -16.904 1.00 4.24 H new ATOM 0 HA ARG A 41 8.423 7.771 -17.613 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.843 9.557 -18.933 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.408 10.299 -19.200 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.751 8.869 -20.890 1.00 52.51 H new ATOM 0 HG3 ARG A 41 8.806 7.555 -19.732 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.273 7.431 -19.867 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.335 8.612 -21.160 1.00 42.11 H new ATOM 0 HE ARG A 41 6.966 5.780 -21.350 1.00 62.55 H new ATOM 0 HH11 ARG A 41 7.672 8.979 -22.670 1.00 62.54 H new ATOM 0 HH12 ARG A 41 8.167 8.347 -24.243 1.00 62.54 H new ATOM 0 HH21 ARG A 41 7.603 4.978 -23.376 1.00 43.33 H new ATOM 0 HH22 ARG A 41 8.128 6.093 -24.641 1.00 43.33 H new ATOM 658 N SER A 42 9.849 10.658 -16.897 1.00 70.41 N ATOM 659 CA SER A 42 11.125 11.292 -16.586 1.00 61.23 C ATOM 660 C SER A 42 10.988 12.230 -15.391 1.00 5.23 C ATOM 661 O SER A 42 10.216 13.188 -15.425 1.00 13.14 O ATOM 662 CB SER A 42 11.644 12.064 -17.799 1.00 24.10 C ATOM 663 OG SER A 42 12.913 12.639 -17.534 1.00 12.30 O ATOM 0 H SER A 42 9.037 11.262 -16.771 1.00 70.41 H new ATOM 0 HA SER A 42 11.839 10.509 -16.331 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.717 11.395 -18.656 1.00 24.10 H new ATOM 0 HB3 SER A 42 10.935 12.848 -18.066 1.00 24.10 H new ATOM 0 HG SER A 42 13.223 13.126 -18.326 1.00 12.30 H new ATOM 669 N THR A 43 11.745 11.948 -14.335 1.00 12.02 N ATOM 670 CA THR A 43 11.709 12.765 -13.128 1.00 14.23 C ATOM 671 C THR A 43 11.892 14.242 -13.459 1.00 53.01 C ATOM 672 O THR A 43 12.977 14.688 -13.834 1.00 0.33 O ATOM 673 CB THR A 43 12.797 12.335 -12.127 1.00 21.52 C ATOM 674 OG1 THR A 43 13.222 10.997 -12.408 1.00 2.04 O ATOM 675 CG2 THR A 43 12.281 12.419 -10.698 1.00 51.25 C ATOM 0 H THR A 43 12.391 11.160 -14.291 1.00 12.02 H new ATOM 0 HA THR A 43 10.729 12.616 -12.674 1.00 14.23 H new ATOM 0 HB THR A 43 13.644 13.013 -12.232 1.00 21.52 H new ATOM 0 HG1 THR A 43 13.915 10.733 -11.768 1.00 2.04 H new ATOM 0 HG21 THR A 43 13.067 12.110 -10.009 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.987 13.445 -10.477 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.419 11.762 -10.583 1.00 51.25 H new ATOM 683 N PRO A 44 10.809 15.020 -13.318 1.00 21.02 N ATOM 684 CA PRO A 44 10.827 16.459 -13.594 1.00 52.42 C ATOM 685 C PRO A 44 11.642 17.238 -12.567 1.00 70.25 C ATOM 686 O PRO A 44 12.014 16.720 -11.514 1.00 3.54 O ATOM 687 CB PRO A 44 9.350 16.854 -13.516 1.00 71.00 C ATOM 688 CG PRO A 44 8.733 15.832 -12.624 1.00 72.24 C ATOM 689 CD PRO A 44 9.484 14.554 -12.875 1.00 61.30 C ATOM 0 HA PRO A 44 11.292 16.683 -14.554 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.229 17.859 -13.110 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.886 16.851 -14.502 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.809 16.130 -11.578 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.672 15.711 -12.845 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.553 13.944 -11.974 1.00 61.30 H new ATOM 0 HD3 PRO A 44 8.997 13.944 -13.636 1.00 61.30 H new ATOM 697 N PRO A 45 11.926 18.511 -12.877 1.00 71.15 N ATOM 698 CA PRO A 45 12.699 19.389 -11.993 1.00 45.31 C ATOM 699 C PRO A 45 11.927 19.765 -10.733 1.00 45.42 C ATOM 700 O PRO A 45 10.794 19.328 -10.531 1.00 14.40 O ATOM 701 CB PRO A 45 12.951 20.627 -12.856 1.00 13.01 C ATOM 702 CG PRO A 45 11.837 20.636 -13.844 1.00 51.14 C ATOM 703 CD PRO A 45 11.514 19.193 -14.116 1.00 25.43 C ATOM 0 HA PRO A 45 13.610 18.910 -11.636 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.953 21.535 -12.254 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.920 20.572 -13.353 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.969 21.163 -13.448 1.00 51.14 H new ATOM 0 HG3 PRO A 45 12.131 21.149 -14.759 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.453 19.050 -14.319 1.00 25.43 H new ATOM 0 HD3 PRO A 45 12.058 18.816 -14.982 1.00 25.43 H new ATOM 711 N THR A 46 12.549 20.580 -9.885 1.00 13.11 N ATOM 712 CA THR A 46 11.921 21.015 -8.644 1.00 31.11 C ATOM 713 C THR A 46 11.188 22.338 -8.833 1.00 24.32 C ATOM 714 O THR A 46 10.246 22.645 -8.104 1.00 10.01 O ATOM 715 CB THR A 46 12.959 21.172 -7.516 1.00 23.32 C ATOM 716 OG1 THR A 46 13.603 19.919 -7.265 1.00 51.14 O ATOM 717 CG2 THR A 46 12.298 21.674 -6.241 1.00 20.13 C ATOM 0 H THR A 46 13.487 20.951 -10.036 1.00 13.11 H new ATOM 0 HA THR A 46 11.204 20.243 -8.364 1.00 31.11 H new ATOM 0 HB THR A 46 13.702 21.903 -7.834 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.094 19.638 -8.065 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.049 21.777 -5.458 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.834 22.642 -6.429 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.537 20.962 -5.921 1.00 20.13 H new ATOM 725 N ASP A 47 11.626 23.117 -9.817 1.00 42.22 N ATOM 726 CA ASP A 47 11.010 24.407 -10.103 1.00 11.00 C ATOM 727 C ASP A 47 9.622 24.223 -10.710 1.00 64.31 C ATOM 728 O ASP A 47 8.753 25.084 -10.571 1.00 65.11 O ATOM 729 CB ASP A 47 11.892 25.219 -11.051 1.00 53.22 C ATOM 730 CG ASP A 47 11.826 26.708 -10.772 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.748 27.187 -10.363 1.00 61.13 O ATOM 732 OD2 ASP A 47 12.852 27.394 -10.964 1.00 21.44 O ATOM 0 H ASP A 47 12.405 22.877 -10.430 1.00 42.22 H new ATOM 0 HA ASP A 47 10.907 24.949 -9.163 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.924 24.881 -10.961 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.584 25.031 -12.079 1.00 53.22 H new ATOM 737 N VAL A 48 9.423 23.097 -11.386 1.00 60.11 N ATOM 738 CA VAL A 48 8.142 22.800 -12.016 1.00 45.24 C ATOM 739 C VAL A 48 7.242 21.999 -11.080 1.00 11.34 C ATOM 740 O VAL A 48 6.083 22.352 -10.863 1.00 1.53 O ATOM 741 CB VAL A 48 8.329 22.014 -13.327 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.981 21.678 -13.946 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.190 22.803 -14.301 1.00 62.30 C ATOM 0 H VAL A 48 10.132 22.375 -11.512 1.00 60.11 H new ATOM 0 HA VAL A 48 7.670 23.757 -12.239 1.00 45.24 H new ATOM 0 HB VAL A 48 8.840 21.078 -13.100 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.134 21.123 -14.871 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.402 21.071 -13.250 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.440 22.599 -14.161 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.312 22.233 -15.222 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.708 23.755 -14.524 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.168 22.987 -13.856 1.00 62.30 H new ATOM 753 N MET A 49 7.784 20.918 -10.528 1.00 23.51 N ATOM 754 CA MET A 49 7.031 20.068 -9.614 1.00 32.02 C ATOM 755 C MET A 49 6.442 20.886 -8.470 1.00 43.12 C ATOM 756 O MET A 49 5.458 20.485 -7.849 1.00 54.11 O ATOM 757 CB MET A 49 7.929 18.962 -9.056 1.00 51.33 C ATOM 758 CG MET A 49 8.745 19.393 -7.849 1.00 21.11 C ATOM 759 SD MET A 49 8.019 18.851 -6.289 1.00 71.53 S ATOM 760 CE MET A 49 7.846 20.415 -5.435 1.00 52.32 C ATOM 0 H MET A 49 8.742 20.610 -10.698 1.00 23.51 H new ATOM 0 HA MET A 49 6.211 19.615 -10.172 1.00 32.02 H new ATOM 0 HB2 MET A 49 7.311 18.108 -8.780 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.606 18.625 -9.841 1.00 51.33 H new ATOM 0 HG2 MET A 49 9.754 18.990 -7.935 1.00 21.11 H new ATOM 0 HG3 MET A 49 8.835 20.479 -7.845 1.00 21.11 H new ATOM 0 HE1 MET A 49 8.175 20.304 -4.402 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.456 21.170 -5.931 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.801 20.725 -5.452 1.00 52.32 H new ATOM 770 N MET A 50 7.051 22.037 -8.197 1.00 13.33 N ATOM 771 CA MET A 50 6.585 22.911 -7.127 1.00 63.34 C ATOM 772 C MET A 50 5.515 23.872 -7.638 1.00 13.15 C ATOM 773 O MET A 50 4.630 24.285 -6.889 1.00 31.51 O ATOM 774 CB MET A 50 7.756 23.701 -6.539 1.00 63.11 C ATOM 775 CG MET A 50 8.090 24.963 -7.317 1.00 51.43 C ATOM 776 SD MET A 50 9.570 25.787 -6.701 1.00 41.12 S ATOM 777 CE MET A 50 9.262 25.765 -4.938 1.00 52.14 C ATOM 0 H MET A 50 7.867 22.385 -8.701 1.00 13.33 H new ATOM 0 HA MET A 50 6.147 22.288 -6.347 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.521 23.970 -5.509 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.637 23.060 -6.508 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.230 24.711 -8.368 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.247 25.652 -7.264 1.00 51.43 H new ATOM 0 HE1 MET A 50 9.963 26.433 -4.438 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.242 26.096 -4.743 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.393 24.752 -4.558 1.00 52.14 H new ATOM 787 N ASN A 51 5.602 24.222 -8.917 1.00 65.21 N ATOM 788 CA ASN A 51 4.640 25.134 -9.527 1.00 34.45 C ATOM 789 C ASN A 51 3.284 24.459 -9.701 1.00 20.22 C ATOM 790 O ASN A 51 2.271 25.125 -9.910 1.00 30.14 O ATOM 791 CB ASN A 51 5.158 25.622 -10.881 1.00 31.11 C ATOM 792 CG ASN A 51 5.748 27.017 -10.808 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.140 27.930 -10.249 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.938 27.186 -11.373 1.00 22.11 N ATOM 0 H ASN A 51 6.328 23.889 -9.551 1.00 65.21 H new ATOM 0 HA ASN A 51 4.516 25.989 -8.863 1.00 34.45 H new ATOM 0 HB2 ASN A 51 5.915 24.929 -11.248 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.342 25.613 -11.603 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.386 28.102 -11.355 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.404 26.399 -11.825 1.00 22.11 H new ATOM 801 N ILE A 52 3.273 23.133 -9.611 1.00 3.55 N ATOM 802 CA ILE A 52 2.042 22.367 -9.757 1.00 73.42 C ATOM 803 C ILE A 52 1.308 22.248 -8.426 1.00 71.13 C ATOM 804 O ILE A 52 0.077 22.246 -8.380 1.00 32.44 O ATOM 805 CB ILE A 52 2.317 20.955 -10.307 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.207 21.033 -11.549 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.010 20.247 -10.627 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.867 22.190 -12.465 1.00 62.23 C ATOM 0 H ILE A 52 4.104 22.567 -9.438 1.00 3.55 H new ATOM 0 HA ILE A 52 1.417 22.908 -10.467 1.00 73.42 H new ATOM 0 HB ILE A 52 2.841 20.379 -9.544 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.247 21.122 -11.236 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.121 20.101 -12.107 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.221 19.250 -11.015 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.410 20.164 -9.721 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.460 20.818 -11.375 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.538 22.183 -13.324 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.837 22.092 -12.808 1.00 62.23 H new ATOM 0 HD13 ILE A 52 2.981 23.129 -11.923 1.00 62.23 H new ATOM 820 N LEU A 53 2.071 22.150 -7.343 1.00 51.45 N ATOM 821 CA LEU A 53 1.494 22.033 -6.008 1.00 74.54 C ATOM 822 C LEU A 53 1.186 23.409 -5.425 1.00 34.01 C ATOM 823 O LEU A 53 0.236 23.569 -4.659 1.00 42.22 O ATOM 824 CB LEU A 53 2.449 21.276 -5.083 1.00 74.22 C ATOM 825 CG LEU A 53 2.009 19.872 -4.668 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.538 19.080 -5.878 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.144 19.144 -3.961 1.00 13.23 C ATOM 0 H LEU A 53 3.091 22.149 -7.363 1.00 51.45 H new ATOM 0 HA LEU A 53 0.560 21.477 -6.090 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.418 21.200 -5.577 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.597 21.870 -4.181 1.00 74.22 H new ATOM 0 HG LEU A 53 1.174 19.965 -3.973 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.229 18.083 -5.563 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.695 19.592 -6.342 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.352 18.997 -6.598 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.813 18.146 -3.673 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.998 19.063 -4.633 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.435 19.701 -3.070 1.00 13.23 H new ATOM 839 N GLN A 54 1.995 24.397 -5.794 1.00 35.22 N ATOM 840 CA GLN A 54 1.806 25.759 -5.308 1.00 5.24 C ATOM 841 C GLN A 54 0.427 26.287 -5.688 1.00 40.02 C ATOM 842 O GLN A 54 -0.096 27.201 -5.051 1.00 11.30 O ATOM 843 CB GLN A 54 2.891 26.678 -5.873 1.00 13.40 C ATOM 844 CG GLN A 54 2.678 27.043 -7.333 1.00 75.21 C ATOM 845 CD GLN A 54 3.667 28.082 -7.826 1.00 20.35 C ATOM 846 OE1 GLN A 54 4.932 27.917 -7.455 1.00 45.45 O flip ATOM 847 NE2 GLN A 54 3.299 29.022 -8.530 1.00 73.44 N flip ATOM 0 H GLN A 54 2.786 24.280 -6.427 1.00 35.22 H new ATOM 0 HA GLN A 54 1.881 25.744 -4.221 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.927 27.592 -5.280 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.860 26.191 -5.766 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.765 26.145 -7.944 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.664 27.421 -7.465 1.00 75.21 H new ATOM 0 HE21 GLN A 54 2.317 29.110 -8.791 1.00 73.44 H new ATOM 0 HE22 GLN A 54 3.976 29.713 -8.852 1.00 73.44 H new ATOM 856 N THR A 55 -0.158 25.703 -6.730 1.00 23.53 N ATOM 857 CA THR A 55 -1.477 26.116 -7.194 1.00 24.25 C ATOM 858 C THR A 55 -2.506 26.036 -6.072 1.00 71.25 C ATOM 859 O THR A 55 -2.374 25.254 -5.131 1.00 30.33 O ATOM 860 CB THR A 55 -1.953 25.248 -8.375 1.00 54.30 C ATOM 861 OG1 THR A 55 -1.923 23.864 -8.008 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.079 25.473 -9.599 1.00 51.14 C ATOM 0 H THR A 55 0.260 24.944 -7.268 1.00 23.53 H new ATOM 0 HA THR A 55 -1.386 27.150 -7.525 1.00 24.25 H new ATOM 0 HB THR A 55 -2.975 25.536 -8.621 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.184 23.418 -8.472 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.434 24.850 -10.419 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.127 26.522 -9.893 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.048 25.209 -9.363 1.00 51.14 H new ATOM 870 N PRO A 56 -3.556 26.864 -6.172 1.00 53.52 N ATOM 871 CA PRO A 56 -4.629 26.905 -5.175 1.00 12.33 C ATOM 872 C PRO A 56 -5.492 25.647 -5.199 1.00 31.34 C ATOM 873 O PRO A 56 -6.074 25.263 -4.186 1.00 43.31 O ATOM 874 CB PRO A 56 -5.452 28.127 -5.588 1.00 41.51 C ATOM 875 CG PRO A 56 -5.193 28.282 -7.047 1.00 31.12 C ATOM 876 CD PRO A 56 -3.778 27.824 -7.267 1.00 2.04 C ATOM 0 HA PRO A 56 -4.239 26.962 -4.159 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.513 27.976 -5.388 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.147 29.015 -5.035 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -5.892 27.685 -7.633 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.320 29.319 -7.358 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.654 27.355 -8.243 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.075 28.656 -7.221 1.00 2.04 H new ATOM 884 N GLN A 57 -5.570 25.012 -6.364 1.00 54.13 N ATOM 885 CA GLN A 57 -6.362 23.798 -6.520 1.00 35.45 C ATOM 886 C GLN A 57 -5.636 22.594 -5.931 1.00 15.23 C ATOM 887 O GLN A 57 -6.264 21.660 -5.431 1.00 55.15 O ATOM 888 CB GLN A 57 -6.670 23.551 -7.998 1.00 31.22 C ATOM 889 CG GLN A 57 -5.503 22.957 -8.771 1.00 70.00 C ATOM 890 CD GLN A 57 -5.661 23.107 -10.271 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.715 23.463 -10.973 1.00 74.05 O ATOM 892 NE2 GLN A 57 -6.861 22.834 -10.770 1.00 50.03 N ATOM 0 H GLN A 57 -5.095 25.318 -7.213 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.298 23.934 -5.979 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.525 22.880 -8.075 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -6.961 24.493 -8.462 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.579 23.442 -8.456 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.408 21.900 -8.523 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.617 22.542 -10.150 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.027 22.916 -11.773 1.00 50.03 H new ATOM 901 N PHE A 58 -4.308 22.621 -5.993 1.00 44.33 N ATOM 902 CA PHE A 58 -3.496 21.531 -5.467 1.00 12.11 C ATOM 903 C PHE A 58 -2.778 21.955 -4.189 1.00 32.20 C ATOM 904 O PHE A 58 -1.738 21.399 -3.832 1.00 14.11 O ATOM 905 CB PHE A 58 -2.473 21.078 -6.512 1.00 65.32 C ATOM 906 CG PHE A 58 -3.098 20.512 -7.755 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.005 19.467 -7.677 1.00 54.23 C ATOM 908 CD2 PHE A 58 -2.779 21.025 -9.002 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.582 18.944 -8.819 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.353 20.506 -10.148 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.255 19.464 -10.056 1.00 14.14 C ATOM 0 H PHE A 58 -3.772 23.386 -6.402 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.159 20.699 -5.232 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.844 21.925 -6.784 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.820 20.326 -6.068 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.264 19.056 -6.712 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.074 21.839 -9.080 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.288 18.130 -8.744 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -3.096 20.915 -11.114 1.00 51.05 H new ATOM 0 HZ PHE A 58 -4.704 19.057 -10.950 1.00 14.14 H new ATOM 921 N THR A 59 -3.341 22.945 -3.502 1.00 4.20 N ATOM 922 CA THR A 59 -2.756 23.446 -2.265 1.00 22.31 C ATOM 923 C THR A 59 -3.031 22.498 -1.103 1.00 21.11 C ATOM 924 O THR A 59 -2.207 22.351 -0.200 1.00 21.14 O ATOM 925 CB THR A 59 -3.299 24.844 -1.912 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.614 25.360 -0.765 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.794 24.789 -1.634 1.00 32.12 C ATOM 0 H THR A 59 -4.202 23.415 -3.782 1.00 4.20 H new ATOM 0 HA THR A 59 -1.680 23.513 -2.429 1.00 22.31 H new ATOM 0 HB THR A 59 -3.128 25.502 -2.764 1.00 62.34 H new ATOM 0 HG1 THR A 59 -2.964 26.249 -0.548 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.155 25.787 -1.387 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.315 24.423 -2.519 1.00 32.12 H new ATOM 0 HG23 THR A 59 -4.984 24.117 -0.797 1.00 32.12 H new ATOM 935 N LYS A 60 -4.194 21.855 -1.133 1.00 35.52 N ATOM 936 CA LYS A 60 -4.577 20.919 -0.083 1.00 52.53 C ATOM 937 C LYS A 60 -3.735 19.650 -0.151 1.00 41.24 C ATOM 938 O LYS A 60 -3.766 18.822 0.759 1.00 22.22 O ATOM 939 CB LYS A 60 -6.062 20.567 -0.205 1.00 75.42 C ATOM 940 CG LYS A 60 -6.948 21.760 -0.515 1.00 41.34 C ATOM 941 CD LYS A 60 -8.413 21.449 -0.260 1.00 60.34 C ATOM 942 CE LYS A 60 -8.990 20.555 -1.347 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.651 19.348 -0.780 1.00 64.02 N ATOM 0 H LYS A 60 -4.887 21.965 -1.873 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.400 21.398 0.880 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.186 19.820 -0.989 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.396 20.110 0.727 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.644 22.609 0.097 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.813 22.053 -1.556 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.519 20.961 0.709 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.981 22.378 -0.212 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.711 21.120 -1.937 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.194 20.248 -2.025 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -9.085 18.505 -1.004 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.730 19.448 0.252 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -10.601 19.246 -1.192 1.00 64.02 H new ATOM 957 N TYR A 61 -2.982 19.503 -1.236 1.00 14.05 N ATOM 958 CA TYR A 61 -2.132 18.334 -1.423 1.00 71.14 C ATOM 959 C TYR A 61 -0.694 18.748 -1.725 1.00 30.13 C ATOM 960 O TYR A 61 -0.223 18.622 -2.855 1.00 60.54 O ATOM 961 CB TYR A 61 -2.671 17.461 -2.557 1.00 71.25 C ATOM 962 CG TYR A 61 -4.179 17.484 -2.675 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.965 16.598 -1.949 1.00 71.04 C ATOM 964 CD2 TYR A 61 -4.815 18.393 -3.511 1.00 2.40 C ATOM 965 CE1 TYR A 61 -6.343 16.615 -2.054 1.00 44.31 C ATOM 966 CE2 TYR A 61 -6.193 18.418 -3.621 1.00 73.23 C ATOM 967 CZ TYR A 61 -6.951 17.527 -2.890 1.00 4.15 C ATOM 968 OH TYR A 61 -8.323 17.547 -2.997 1.00 1.43 O ATOM 0 H TYR A 61 -2.943 20.179 -1.999 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.139 17.760 -0.496 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.236 17.795 -3.499 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.343 16.433 -2.401 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.491 15.884 -1.292 1.00 71.04 H new ATOM 0 HD2 TYR A 61 -4.224 19.091 -4.084 1.00 2.40 H new ATOM 0 HE1 TYR A 61 -6.940 15.918 -1.485 1.00 44.31 H new ATOM 0 HE2 TYR A 61 -6.673 19.131 -4.275 1.00 73.23 H new ATOM 0 HH TYR A 61 -8.588 17.191 -3.871 1.00 1.43 H new ATOM 978 N THR A 62 -0.002 19.242 -0.704 1.00 71.44 N ATOM 979 CA THR A 62 1.382 19.675 -0.857 1.00 10.10 C ATOM 980 C THR A 62 2.345 18.668 -0.238 1.00 71.52 C ATOM 981 O THR A 62 3.183 18.090 -0.931 1.00 70.23 O ATOM 982 CB THR A 62 1.613 21.054 -0.210 1.00 54.41 C ATOM 983 OG1 THR A 62 0.358 21.711 0.005 1.00 54.14 O ATOM 984 CG2 THR A 62 2.500 21.922 -1.090 1.00 32.11 C ATOM 0 H THR A 62 -0.377 19.352 0.238 1.00 71.44 H new ATOM 0 HA THR A 62 1.575 19.747 -1.927 1.00 10.10 H new ATOM 0 HB THR A 62 2.113 20.903 0.747 1.00 54.41 H new ATOM 0 HG1 THR A 62 0.507 22.674 0.109 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.649 22.891 -0.613 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.464 21.433 -1.229 1.00 32.11 H new ATOM 0 HG23 THR A 62 2.023 22.065 -2.059 1.00 32.11 H new ATOM 992 N LEU A 63 2.221 18.463 1.068 1.00 70.40 N ATOM 993 CA LEU A 63 3.081 17.526 1.781 1.00 22.45 C ATOM 994 C LEU A 63 2.298 16.290 2.215 1.00 21.32 C ATOM 995 O LEU A 63 2.860 15.355 2.785 1.00 24.35 O ATOM 996 CB LEU A 63 3.705 18.202 3.002 1.00 14.53 C ATOM 997 CG LEU A 63 2.928 18.072 4.312 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.474 16.922 5.145 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.985 19.374 5.098 1.00 34.14 C ATOM 0 H LEU A 63 1.533 18.934 1.655 1.00 70.40 H new ATOM 0 HA LEU A 63 3.874 17.212 1.103 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.702 17.788 3.152 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.830 19.262 2.781 1.00 14.53 H new ATOM 0 HG LEU A 63 1.886 17.859 4.074 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.909 16.845 6.074 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.381 15.991 4.585 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.524 17.105 5.374 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.426 19.263 6.027 1.00 34.14 H new ATOM 0 HD22 LEU A 63 4.023 19.617 5.325 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.546 20.176 4.505 1.00 34.14 H new ATOM 1011 N TRP A 64 0.999 16.292 1.937 1.00 4.53 N ATOM 1012 CA TRP A 64 0.140 15.170 2.297 1.00 50.12 C ATOM 1013 C TRP A 64 0.722 13.854 1.793 1.00 52.11 C ATOM 1014 O TRP A 64 0.447 12.790 2.346 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.265 15.374 1.726 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.487 14.658 0.427 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.339 13.613 0.203 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.847 14.932 -0.824 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.265 13.222 -1.112 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.358 14.016 -1.763 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.107 15.863 -1.242 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.946 14.006 -3.093 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.516 15.851 -2.562 1.00 55.11 C ATOM 1024 CH2 TRP A 64 -0.011 14.928 -3.475 1.00 13.15 C ATOM 0 H TRP A 64 0.518 17.057 1.464 1.00 4.53 H new ATOM 0 HA TRP A 64 0.080 15.125 3.384 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -1.999 15.028 2.454 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.439 16.440 1.580 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.976 13.162 0.949 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.799 12.463 -1.535 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.518 16.579 -0.546 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.351 13.295 -3.798 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.254 16.565 -2.895 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.328 14.945 -4.500 1.00 13.15 H new ATOM 1035 N PHE A 65 1.528 13.935 0.738 1.00 21.42 N ATOM 1036 CA PHE A 65 2.148 12.749 0.159 1.00 54.41 C ATOM 1037 C PHE A 65 3.669 12.866 0.180 1.00 55.14 C ATOM 1038 O PHE A 65 4.379 11.862 0.234 1.00 43.01 O ATOM 1039 CB PHE A 65 1.660 12.542 -1.277 1.00 0.51 C ATOM 1040 CG PHE A 65 0.710 11.389 -1.426 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.232 11.117 -0.446 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.757 10.576 -2.547 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.107 10.058 -0.581 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.117 9.515 -2.688 1.00 63.43 C ATOM 1045 CZ PHE A 65 -1.050 9.254 -1.703 1.00 12.20 C ATOM 0 H PHE A 65 1.766 14.808 0.268 1.00 21.42 H new ATOM 0 HA PHE A 65 1.859 11.887 0.761 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.170 13.453 -1.621 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.521 12.379 -1.925 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.282 11.741 0.434 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.485 10.774 -3.320 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.836 9.858 0.190 1.00 74.41 H new ATOM 0 HE2 PHE A 65 -0.071 8.890 -3.568 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.733 8.424 -1.810 1.00 12.20 H new ATOM 1055 N MET A 66 4.162 14.100 0.135 1.00 21.31 N ATOM 1056 CA MET A 66 5.599 14.349 0.150 1.00 54.24 C ATOM 1057 C MET A 66 6.252 13.700 1.367 1.00 62.12 C ATOM 1058 O MET A 66 7.392 13.239 1.301 1.00 43.23 O ATOM 1059 CB MET A 66 5.877 15.853 0.148 1.00 0.42 C ATOM 1060 CG MET A 66 7.106 16.243 -0.658 1.00 60.21 C ATOM 1061 SD MET A 66 8.218 17.330 0.253 1.00 74.33 S ATOM 1062 CE MET A 66 8.925 16.181 1.432 1.00 12.21 C ATOM 0 H MET A 66 3.588 14.942 0.088 1.00 21.31 H new ATOM 0 HA MET A 66 6.028 13.906 -0.749 1.00 54.24 H new ATOM 0 HB2 MET A 66 5.008 16.374 -0.254 1.00 0.42 H new ATOM 0 HB3 MET A 66 6.004 16.192 1.176 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.645 15.342 -0.951 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.791 16.739 -1.576 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.596 16.443 2.438 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.597 15.169 1.195 1.00 12.21 H new ATOM 0 HE3 MET A 66 10.013 16.231 1.382 1.00 12.21 H new ATOM 1072 N THR A 67 5.521 13.668 2.477 1.00 35.53 N ATOM 1073 CA THR A 67 6.030 13.077 3.708 1.00 25.30 C ATOM 1074 C THR A 67 4.987 12.170 4.354 1.00 54.02 C ATOM 1075 O THR A 67 5.092 11.830 5.532 1.00 4.44 O ATOM 1076 CB THR A 67 6.447 14.161 4.721 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.108 15.234 4.043 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.370 13.581 5.783 1.00 3.14 C ATOM 0 H THR A 67 4.576 14.044 2.548 1.00 35.53 H new ATOM 0 HA THR A 67 6.905 12.486 3.437 1.00 25.30 H new ATOM 0 HB THR A 67 5.548 14.538 5.209 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.369 15.920 4.692 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.652 14.364 6.487 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.855 12.782 6.316 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.266 13.181 5.308 1.00 3.14 H new ATOM 1086 N ASN A 68 3.984 11.781 3.575 1.00 30.33 N ATOM 1087 CA ASN A 68 2.923 10.912 4.071 1.00 74.32 C ATOM 1088 C ASN A 68 2.323 11.468 5.359 1.00 52.13 C ATOM 1089 O ASN A 68 2.057 10.724 6.303 1.00 64.53 O ATOM 1090 CB ASN A 68 3.461 9.502 4.314 1.00 33.53 C ATOM 1091 CG ASN A 68 4.428 9.057 3.233 1.00 60.54 C ATOM 1092 OD1 ASN A 68 4.026 8.770 2.105 1.00 41.20 O ATOM 1093 ND2 ASN A 68 5.710 9.000 3.573 1.00 22.32 N ATOM 0 H ASN A 68 3.883 12.054 2.597 1.00 30.33 H new ATOM 0 HA ASN A 68 2.140 10.869 3.314 1.00 74.32 H new ATOM 0 HB2 ASN A 68 3.962 9.469 5.282 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.627 8.801 4.363 1.00 33.53 H new ATOM 0 HD21 ASN A 68 6.407 8.709 2.887 1.00 22.32 H new ATOM 0 HD22 ASN A 68 5.998 9.247 4.520 1.00 22.32 H new ATOM 1100 N GLN A 69 2.112 12.780 5.389 1.00 44.34 N ATOM 1101 CA GLN A 69 1.542 13.436 6.561 1.00 22.34 C ATOM 1102 C GLN A 69 0.459 14.429 6.157 1.00 11.24 C ATOM 1103 O GLN A 69 0.745 15.463 5.551 1.00 12.43 O ATOM 1104 CB GLN A 69 2.638 14.153 7.352 1.00 24.40 C ATOM 1105 CG GLN A 69 2.130 14.841 8.608 1.00 53.41 C ATOM 1106 CD GLN A 69 2.018 13.897 9.788 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.935 13.790 10.601 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.889 13.204 9.888 1.00 3.22 N ATOM 0 H GLN A 69 2.327 13.410 4.616 1.00 44.34 H new ATOM 0 HA GLN A 69 1.089 12.670 7.191 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.406 13.431 7.629 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.113 14.894 6.709 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.802 15.660 8.866 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.153 15.281 8.406 1.00 53.41 H new ATOM 0 HE21 GLN A 69 0.154 13.324 9.191 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.757 12.552 10.662 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.786 14.108 6.494 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.913 14.974 6.167 1.00 1.12 C ATOM 1119 C ILE A 70 -2.073 16.082 7.201 1.00 5.32 C ATOM 1120 O ILE A 70 -2.166 15.819 8.400 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.227 14.176 6.078 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.468 13.401 7.374 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.194 13.231 4.886 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.677 13.877 8.148 1.00 41.24 C ATOM 0 H ILE A 70 -1.040 13.255 6.993 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.699 15.417 5.194 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.051 14.876 5.938 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.591 12.344 7.138 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.585 13.485 8.008 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.130 12.674 4.837 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.066 13.806 3.969 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.363 12.535 4.997 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.786 13.282 9.055 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.548 14.926 8.415 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.570 13.767 7.532 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.106 17.325 6.728 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.259 18.474 7.611 1.00 71.32 C ATOM 1138 C ALA A 71 -3.603 19.159 7.392 1.00 23.44 C ATOM 1139 O ALA A 71 -3.695 20.216 6.768 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.121 19.461 7.396 1.00 72.44 C ATOM 0 H ALA A 71 -2.029 17.561 5.739 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.226 18.116 8.640 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.249 20.314 8.062 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.170 18.972 7.610 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.128 19.804 6.362 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.675 18.545 7.918 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.034 19.078 7.792 1.00 40.23 C ATOM 1148 C PRO A 72 -6.237 20.347 8.614 1.00 33.14 C ATOM 1149 O PRO A 72 -7.201 21.083 8.407 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.910 17.946 8.332 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.022 17.187 9.258 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.640 17.282 8.675 1.00 55.43 C ATOM 0 HA PRO A 72 -6.267 19.363 6.766 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.784 18.336 8.853 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.277 17.311 7.526 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.052 17.610 10.262 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.341 16.148 9.340 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.876 17.301 9.453 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.417 16.433 8.029 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.322 20.595 9.545 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.403 21.776 10.398 1.00 5.13 C ATOM 1162 C GLU A 73 -5.561 23.042 9.560 1.00 20.24 C ATOM 1163 O GLU A 73 -6.167 24.019 10.002 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.154 21.884 11.276 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.344 21.328 12.676 1.00 1.34 C ATOM 1166 CD GLU A 73 -3.553 20.056 12.911 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -3.717 19.103 12.122 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -2.772 20.014 13.884 1.00 50.44 O ATOM 0 H GLU A 73 -4.517 19.996 9.728 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.280 21.673 11.037 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.333 21.354 10.792 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -3.860 22.931 11.347 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -4.042 22.079 13.405 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -5.403 21.129 12.843 1.00 1.34 H new ATOM 1175 N SER A 74 -5.012 23.016 8.350 1.00 3.44 N ATOM 1176 CA SER A 74 -5.088 24.163 7.453 1.00 51.31 C ATOM 1177 C SER A 74 -5.934 23.837 6.225 1.00 0.10 C ATOM 1178 O SER A 74 -6.351 24.730 5.490 1.00 72.23 O ATOM 1179 CB SER A 74 -3.685 24.592 7.019 1.00 74.54 C ATOM 1180 OG SER A 74 -2.945 25.098 8.117 1.00 24.41 O ATOM 0 H SER A 74 -4.510 22.214 7.968 1.00 3.44 H new ATOM 0 HA SER A 74 -5.561 24.984 7.992 1.00 51.31 H new ATOM 0 HB2 SER A 74 -3.160 23.742 6.583 1.00 74.54 H new ATOM 0 HB3 SER A 74 -3.758 25.354 6.243 1.00 74.54 H new ATOM 0 HG SER A 74 -2.052 25.364 7.815 1.00 24.41 H new ATOM 1186 N GLY A 75 -6.182 22.548 6.011 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.977 22.124 4.873 1.00 41.33 C ATOM 1188 C GLY A 75 -6.245 21.131 3.992 1.00 61.32 C ATOM 1189 O GLY A 75 -6.706 20.804 2.900 1.00 21.02 O ATOM 0 H GLY A 75 -5.847 21.790 6.605 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.904 21.675 5.229 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -7.252 22.997 4.281 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.101 20.651 4.469 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.303 19.690 3.715 1.00 71.34 C ATOM 1195 C GLN A 76 -4.736 18.262 4.025 1.00 22.20 C ATOM 1196 O GLN A 76 -4.563 17.779 5.145 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.818 19.866 4.036 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.419 21.310 4.301 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.684 22.214 3.113 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -3.833 22.512 2.788 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.617 22.660 2.460 1.00 55.24 N ATOM 0 H GLN A 76 -4.706 20.911 5.373 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.463 19.876 2.653 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.570 19.263 4.910 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.227 19.481 3.205 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -2.968 21.682 5.166 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -1.360 21.350 4.554 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -0.682 22.388 2.764 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -1.732 23.275 1.654 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.301 17.590 3.027 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.757 16.216 3.194 1.00 50.55 C ATOM 1212 C ILE A 77 -5.568 15.415 1.911 1.00 25.22 C ATOM 1213 O ILE A 77 -5.223 15.967 0.866 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.240 16.162 3.605 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.138 16.422 2.394 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.521 17.173 4.707 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.902 17.767 1.744 1.00 65.21 C ATOM 0 H ILE A 77 -5.454 17.975 2.095 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.152 15.776 3.987 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.459 15.165 3.988 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.975 15.637 1.656 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.181 16.356 2.704 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.573 17.123 4.987 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.903 16.945 5.576 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.288 18.176 4.349 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.573 17.883 0.893 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.094 18.559 2.467 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.869 17.830 1.402 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.798 14.109 1.996 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.657 13.231 0.840 1.00 35.42 C ATOM 1231 C ALA A 78 -6.981 13.082 0.099 1.00 61.12 C ATOM 1232 O ALA A 78 -8.055 13.039 0.698 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.137 11.868 1.273 1.00 72.54 C ATOM 0 H ALA A 78 -6.083 13.635 2.853 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.937 13.683 0.158 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.037 11.223 0.400 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.165 11.985 1.752 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.837 11.419 1.978 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.906 13.002 -1.238 1.00 45.11 N ATOM 1240 CA PRO A 79 -8.090 12.858 -2.091 1.00 73.10 C ATOM 1241 C PRO A 79 -8.743 11.487 -1.947 1.00 74.34 C ATOM 1242 O PRO A 79 -8.401 10.717 -1.051 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.533 13.039 -3.505 1.00 3.43 C ATOM 1244 CG PRO A 79 -6.100 12.646 -3.401 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.659 13.046 -2.021 1.00 54.14 C ATOM 0 HA PRO A 79 -8.870 13.574 -1.831 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -8.064 12.414 -4.223 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.637 14.070 -3.843 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.978 11.574 -3.554 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.502 13.147 -4.162 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.911 12.360 -1.624 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.215 14.041 -2.014 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.686 11.191 -2.836 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.385 9.912 -2.810 1.00 34.34 C ATOM 1255 C ALA A 80 -9.592 8.838 -3.546 1.00 51.31 C ATOM 1256 O ALA A 80 -9.628 7.662 -3.176 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.772 10.056 -3.419 1.00 63.50 C ATOM 0 H ALA A 80 -9.983 11.819 -3.583 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.487 9.603 -1.770 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.283 9.093 -3.393 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.346 10.787 -2.849 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.683 10.391 -4.452 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.877 9.245 -4.588 1.00 5.22 N ATOM 1264 CA LEU A 81 -8.076 8.316 -5.377 1.00 2.43 C ATOM 1265 C LEU A 81 -6.790 7.947 -4.643 1.00 54.42 C ATOM 1266 O LEU A 81 -6.266 6.845 -4.804 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.741 8.929 -6.739 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.934 9.284 -7.626 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.153 10.788 -7.651 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.727 8.750 -9.036 1.00 41.44 C ATOM 0 H LEU A 81 -8.835 10.213 -4.907 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.660 7.408 -5.528 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.155 9.833 -6.574 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -7.104 8.231 -7.283 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.825 8.815 -7.208 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -10.007 11.021 -8.288 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.347 11.144 -6.639 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.263 11.279 -8.044 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.586 9.012 -9.654 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.825 9.189 -9.463 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.621 7.666 -9.003 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.288 8.877 -3.836 1.00 61.40 N ATOM 1283 CA ALA A 82 -5.067 8.648 -3.075 1.00 42.42 C ATOM 1284 C ALA A 82 -5.133 7.327 -2.314 1.00 41.25 C ATOM 1285 O ALA A 82 -4.241 6.487 -2.430 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.821 9.801 -2.112 1.00 60.33 C ATOM 0 H ALA A 82 -6.708 9.795 -3.693 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.236 8.592 -3.778 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.905 9.617 -1.550 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.721 10.730 -2.674 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.660 9.884 -1.421 1.00 60.33 H new ATOM 1292 N HIS A 83 -6.197 7.151 -1.535 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.379 5.932 -0.756 1.00 62.14 C ATOM 1294 C HIS A 83 -5.274 5.783 0.285 1.00 43.04 C ATOM 1295 O HIS A 83 -5.038 4.690 0.802 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.399 4.712 -1.675 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.744 4.061 -1.780 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -8.081 2.916 -1.091 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -8.839 4.403 -2.498 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -9.325 2.579 -1.381 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -9.808 3.466 -2.232 1.00 35.44 N ATOM 0 H HIS A 83 -6.945 7.837 -1.427 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.335 6.001 -0.237 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -6.071 5.012 -2.670 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.678 3.981 -1.309 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -8.933 5.253 -3.157 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -9.856 1.724 -0.989 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -10.748 3.457 -2.628 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.599 6.886 0.587 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.516 6.877 1.564 1.00 21.02 C ATOM 1311 C PHE A 84 -3.880 7.716 2.785 1.00 45.34 C ATOM 1312 O PHE A 84 -5.012 8.178 2.921 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.227 7.406 0.934 1.00 72.42 C ATOM 1314 CG PHE A 84 -1.134 6.378 0.852 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -1.363 5.150 0.254 1.00 43.32 C ATOM 1316 CD2 PHE A 84 0.123 6.640 1.374 1.00 20.34 C ATOM 1317 CE1 PHE A 84 -0.360 4.203 0.178 1.00 15.34 C ATOM 1318 CE2 PHE A 84 1.130 5.698 1.301 1.00 14.32 C ATOM 1319 CZ PHE A 84 0.889 4.477 0.700 1.00 4.42 C ATOM 0 H PHE A 84 -4.782 7.798 0.169 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.358 5.847 1.885 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.446 7.773 -0.069 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.871 8.257 1.514 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -2.337 4.930 -0.158 1.00 43.32 H new ATOM 0 HD2 PHE A 84 0.317 7.593 1.844 1.00 20.34 H new ATOM 0 HE1 PHE A 84 -0.553 3.249 -0.289 1.00 15.34 H new ATOM 0 HE2 PHE A 84 2.104 5.915 1.713 1.00 14.32 H new ATOM 0 HZ PHE A 84 1.675 3.739 0.639 1.00 4.42 H new ATOM 1329 N GLY A 85 -2.910 7.909 3.674 1.00 64.22 N ATOM 1330 CA GLY A 85 -3.147 8.691 4.874 1.00 5.30 C ATOM 1331 C GLY A 85 -4.271 8.129 5.720 1.00 2.52 C ATOM 1332 O GLY A 85 -4.266 6.948 6.065 1.00 22.04 O ATOM 0 H GLY A 85 -1.964 7.538 3.585 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -2.233 8.727 5.467 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -3.385 9.717 4.594 1.00 5.30 H new ATOM 1336 N GLN A 86 -5.239 8.978 6.055 1.00 42.43 N ATOM 1337 CA GLN A 86 -6.374 8.559 6.868 1.00 52.01 C ATOM 1338 C GLN A 86 -7.688 9.024 6.250 1.00 63.41 C ATOM 1339 O GLN A 86 -7.694 9.776 5.276 1.00 73.22 O ATOM 1340 CB GLN A 86 -6.242 9.111 8.289 1.00 35.20 C ATOM 1341 CG GLN A 86 -6.111 10.624 8.344 1.00 10.42 C ATOM 1342 CD GLN A 86 -6.765 11.221 9.574 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -6.349 10.957 10.703 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -7.795 12.033 9.363 1.00 61.55 N ATOM 0 H GLN A 86 -5.259 9.959 5.776 1.00 42.43 H new ATOM 0 HA GLN A 86 -6.378 7.470 6.907 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -7.114 8.809 8.870 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -5.370 8.662 8.765 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -5.055 10.894 8.331 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -6.562 11.057 7.451 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -8.107 12.224 8.411 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -8.274 12.465 10.153 1.00 61.55 H new ATOM 1353 N ASN A 87 -8.799 8.570 6.821 1.00 31.20 N ATOM 1354 CA ASN A 87 -10.119 8.939 6.324 1.00 45.35 C ATOM 1355 C ASN A 87 -10.327 8.429 4.901 1.00 15.25 C ATOM 1356 O ASN A 87 -9.369 8.093 4.206 1.00 4.03 O ATOM 1357 CB ASN A 87 -10.296 10.458 6.364 1.00 34.33 C ATOM 1358 CG ASN A 87 -11.304 10.896 7.410 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -12.471 11.136 7.101 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -10.856 11.002 8.656 1.00 35.51 N ATOM 0 H ASN A 87 -8.811 7.946 7.628 1.00 31.20 H new ATOM 0 HA ASN A 87 -10.865 8.476 6.970 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -9.334 10.928 6.571 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -10.618 10.809 5.384 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -11.488 11.292 9.402 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -9.880 10.793 8.867 1.00 35.51 H new ATOM 1367 N GLU A 88 -11.586 8.376 4.476 1.00 63.12 N ATOM 1368 CA GLU A 88 -11.918 7.907 3.136 1.00 73.11 C ATOM 1369 C GLU A 88 -13.164 8.613 2.606 1.00 72.51 C ATOM 1370 O GLU A 88 -13.829 9.352 3.332 1.00 5.10 O ATOM 1371 CB GLU A 88 -12.142 6.394 3.141 1.00 3.53 C ATOM 1372 CG GLU A 88 -11.426 5.669 2.013 1.00 14.52 C ATOM 1373 CD GLU A 88 -10.012 5.265 2.382 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -9.790 4.884 3.550 1.00 1.34 O ATOM 1375 OE2 GLU A 88 -9.129 5.329 1.502 1.00 74.22 O ATOM 0 H GLU A 88 -12.391 8.651 5.039 1.00 63.12 H new ATOM 0 HA GLU A 88 -11.080 8.141 2.480 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -11.804 5.988 4.095 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -13.211 6.193 3.070 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -11.994 4.780 1.740 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -11.398 6.312 1.133 1.00 14.52 H new ATOM 1382 N THR A 89 -13.473 8.381 1.334 1.00 42.12 N ATOM 1383 CA THR A 89 -14.636 8.995 0.705 1.00 64.33 C ATOM 1384 C THR A 89 -15.884 8.143 0.908 1.00 65.52 C ATOM 1385 O THR A 89 -15.795 6.963 1.249 1.00 3.15 O ATOM 1386 CB THR A 89 -14.413 9.205 -0.804 1.00 3.44 C ATOM 1387 OG1 THR A 89 -15.480 9.989 -1.352 1.00 34.35 O ATOM 1388 CG2 THR A 89 -14.331 7.872 -1.530 1.00 35.32 C ATOM 0 H THR A 89 -12.934 7.772 0.719 1.00 42.12 H new ATOM 0 HA THR A 89 -14.779 9.964 1.182 1.00 64.33 H new ATOM 0 HB THR A 89 -13.469 9.732 -0.940 1.00 3.44 H new ATOM 0 HG1 THR A 89 -15.330 10.120 -2.312 1.00 34.35 H new ATOM 0 HG21 THR A 89 -14.173 8.046 -2.594 1.00 35.32 H new ATOM 0 HG22 THR A 89 -13.500 7.291 -1.131 1.00 35.32 H new ATOM 0 HG23 THR A 89 -15.261 7.322 -1.386 1.00 35.32 H new ATOM 1396 N THR A 90 -17.048 8.749 0.698 1.00 53.34 N ATOM 1397 CA THR A 90 -18.315 8.047 0.859 1.00 64.10 C ATOM 1398 C THR A 90 -18.944 7.730 -0.493 1.00 11.52 C ATOM 1399 O THR A 90 -18.905 8.547 -1.413 1.00 4.22 O ATOM 1400 CB THR A 90 -19.313 8.871 1.695 1.00 4.33 C ATOM 1401 OG1 THR A 90 -18.663 10.029 2.231 1.00 0.33 O ATOM 1402 CG2 THR A 90 -19.889 8.037 2.829 1.00 44.52 C ATOM 0 H THR A 90 -17.140 9.725 0.416 1.00 53.34 H new ATOM 0 HA THR A 90 -18.095 7.116 1.382 1.00 64.10 H new ATOM 0 HB THR A 90 -20.130 9.181 1.043 1.00 4.33 H new ATOM 0 HG1 THR A 90 -19.304 10.549 2.760 1.00 0.33 H new ATOM 0 HG21 THR A 90 -20.591 8.641 3.405 1.00 44.52 H new ATOM 0 HG22 THR A 90 -20.408 7.172 2.417 1.00 44.52 H new ATOM 0 HG23 THR A 90 -19.082 7.700 3.479 1.00 44.52 H new ATOM 1410 N SER A 91 -19.524 6.540 -0.607 1.00 52.22 N ATOM 1411 CA SER A 91 -20.158 6.114 -1.849 1.00 23.32 C ATOM 1412 C SER A 91 -19.192 6.237 -3.023 1.00 73.34 C ATOM 1413 O SER A 91 -19.353 7.078 -3.906 1.00 65.30 O ATOM 1414 CB SER A 91 -21.413 6.947 -2.116 1.00 10.52 C ATOM 1415 OG SER A 91 -22.307 6.891 -1.018 1.00 22.30 O ATOM 0 H SER A 91 -19.568 5.853 0.146 1.00 52.22 H new ATOM 0 HA SER A 91 -20.441 5.067 -1.743 1.00 23.32 H new ATOM 0 HB2 SER A 91 -21.132 7.983 -2.307 1.00 10.52 H new ATOM 0 HB3 SER A 91 -21.912 6.581 -3.014 1.00 10.52 H new ATOM 0 HG SER A 91 -23.100 7.433 -1.214 1.00 22.30 H new ATOM 1421 N PRO A 92 -18.162 5.377 -3.032 1.00 60.30 N ATOM 1422 CA PRO A 92 -17.149 5.368 -4.091 1.00 30.11 C ATOM 1423 C PRO A 92 -17.704 4.871 -5.421 1.00 60.04 C ATOM 1424 O PRO A 92 -17.311 5.346 -6.487 1.00 32.42 O ATOM 1425 CB PRO A 92 -16.088 4.401 -3.560 1.00 33.35 C ATOM 1426 CG PRO A 92 -16.827 3.503 -2.627 1.00 55.04 C ATOM 1427 CD PRO A 92 -17.908 4.347 -2.011 1.00 64.13 C ATOM 0 HA PRO A 92 -16.768 6.368 -4.298 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -15.626 3.837 -4.370 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -15.288 4.934 -3.046 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -17.252 2.652 -3.159 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -16.162 3.102 -1.863 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -18.803 3.762 -1.800 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -17.585 4.788 -1.068 1.00 64.13 H new ATOM 1435 N HIS A 93 -18.622 3.911 -5.352 1.00 62.43 N ATOM 1436 CA HIS A 93 -19.233 3.349 -6.552 1.00 33.42 C ATOM 1437 C HIS A 93 -18.184 2.674 -7.431 1.00 14.13 C ATOM 1438 O HIS A 93 -17.036 2.499 -7.021 1.00 3.43 O ATOM 1439 CB HIS A 93 -19.952 4.443 -7.343 1.00 33.41 C ATOM 1440 CG HIS A 93 -21.367 4.098 -7.690 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -22.374 4.020 -6.751 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -21.943 3.815 -8.881 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -23.507 3.700 -7.349 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -23.274 3.570 -8.643 1.00 24.32 N ATOM 0 H HIS A 93 -18.959 3.506 -4.478 1.00 62.43 H new ATOM 0 HA HIS A 93 -19.959 2.597 -6.243 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -19.943 5.365 -6.762 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -19.399 4.639 -8.261 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -21.448 3.787 -9.841 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -24.462 3.567 -6.863 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -23.968 3.327 -9.350 1.00 24.32 H new ATOM 1452 N SER A 94 -18.587 2.297 -8.640 1.00 52.11 N ATOM 1453 CA SER A 94 -17.683 1.637 -9.574 1.00 70.32 C ATOM 1454 C SER A 94 -16.413 2.459 -9.774 1.00 14.44 C ATOM 1455 O SER A 94 -16.452 3.560 -10.322 1.00 10.43 O ATOM 1456 CB SER A 94 -18.377 1.416 -10.919 1.00 51.10 C ATOM 1457 OG SER A 94 -19.113 2.564 -11.308 1.00 3.42 O ATOM 0 H SER A 94 -19.533 2.437 -8.995 1.00 52.11 H new ATOM 0 HA SER A 94 -17.407 0.671 -9.152 1.00 70.32 H new ATOM 0 HB2 SER A 94 -17.634 1.181 -11.681 1.00 51.10 H new ATOM 0 HB3 SER A 94 -19.045 0.558 -10.850 1.00 51.10 H new ATOM 0 HG SER A 94 -18.566 3.365 -11.170 1.00 3.42 H new ATOM 1463 N GLY A 95 -15.286 1.914 -9.326 1.00 21.35 N ATOM 1464 CA GLY A 95 -14.019 2.610 -9.464 1.00 44.10 C ATOM 1465 C GLY A 95 -12.842 1.658 -9.546 1.00 74.11 C ATOM 1466 O GLY A 95 -11.927 1.722 -8.725 1.00 73.43 O ATOM 0 H GLY A 95 -15.227 1.003 -8.870 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -14.044 3.230 -10.360 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -13.882 3.281 -8.616 1.00 44.10 H new ATOM 1470 N GLN A 96 -12.865 0.774 -10.538 1.00 10.41 N ATOM 1471 CA GLN A 96 -11.792 -0.195 -10.722 1.00 71.33 C ATOM 1472 C GLN A 96 -10.656 0.401 -11.546 1.00 34.40 C ATOM 1473 O GLN A 96 -10.890 1.113 -12.523 1.00 15.22 O ATOM 1474 CB GLN A 96 -12.327 -1.456 -11.405 1.00 73.40 C ATOM 1475 CG GLN A 96 -12.951 -1.193 -12.765 1.00 74.35 C ATOM 1476 CD GLN A 96 -13.337 -2.469 -13.487 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -14.051 -3.312 -12.943 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -12.865 -2.618 -14.719 1.00 12.22 N ATOM 0 H GLN A 96 -13.615 0.709 -11.226 1.00 10.41 H new ATOM 0 HA GLN A 96 -11.403 -0.460 -9.739 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -11.512 -2.170 -11.521 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -13.070 -1.922 -10.758 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -13.836 -0.569 -12.640 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -12.249 -0.630 -13.380 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -12.277 -1.894 -15.131 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -13.091 -3.457 -15.254 1.00 12.22 H new ATOM 1487 N LYS A 97 -9.423 0.105 -11.147 1.00 3.33 N ATOM 1488 CA LYS A 97 -8.250 0.609 -11.848 1.00 3.12 C ATOM 1489 C LYS A 97 -6.984 -0.094 -11.368 1.00 51.43 C ATOM 1490 O LYS A 97 -6.424 -0.935 -12.071 1.00 55.44 O ATOM 1491 CB LYS A 97 -8.116 2.120 -11.641 1.00 25.30 C ATOM 1492 CG LYS A 97 -8.555 2.941 -12.841 1.00 72.12 C ATOM 1493 CD LYS A 97 -7.463 3.895 -13.294 1.00 72.33 C ATOM 1494 CE LYS A 97 -8.001 4.940 -14.258 1.00 74.13 C ATOM 1495 NZ LYS A 97 -6.968 5.373 -15.240 1.00 13.31 N ATOM 0 H LYS A 97 -9.211 -0.482 -10.340 1.00 3.33 H new ATOM 0 HA LYS A 97 -8.378 0.403 -12.911 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -8.709 2.413 -10.775 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -7.077 2.356 -11.411 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -8.820 2.274 -13.662 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -9.451 3.507 -12.587 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -7.027 4.389 -12.426 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -6.663 3.332 -13.775 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -8.861 4.534 -14.791 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -8.353 5.805 -13.696 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -7.374 6.086 -15.879 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -6.158 5.784 -14.733 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -6.650 4.552 -15.794 1.00 13.31 H new ATOM 1509 N THR A 98 -6.539 0.255 -10.165 1.00 53.15 N ATOM 1510 CA THR A 98 -5.341 -0.344 -9.590 1.00 52.21 C ATOM 1511 C THR A 98 -4.152 -0.209 -10.534 1.00 33.53 C ATOM 1512 O THR A 98 -3.265 -1.060 -10.557 1.00 23.30 O ATOM 1513 CB THR A 98 -5.557 -1.834 -9.265 1.00 34.33 C ATOM 1514 OG1 THR A 98 -6.957 -2.138 -9.268 1.00 75.54 O ATOM 1515 CG2 THR A 98 -4.960 -2.185 -7.911 1.00 31.14 C ATOM 0 H THR A 98 -6.990 0.950 -9.570 1.00 53.15 H new ATOM 0 HA THR A 98 -5.131 0.195 -8.666 1.00 52.21 H new ATOM 0 HB THR A 98 -5.055 -2.426 -10.030 1.00 34.33 H new ATOM 0 HG1 THR A 98 -7.086 -3.087 -9.062 1.00 75.54 H new ATOM 0 HG21 THR A 98 -5.125 -3.242 -7.704 1.00 31.14 H new ATOM 0 HG22 THR A 98 -3.889 -1.980 -7.921 1.00 31.14 H new ATOM 0 HG23 THR A 98 -5.437 -1.585 -7.136 1.00 31.14 H new ATOM 1523 N GLY A 99 -4.141 0.869 -11.314 1.00 2.33 N ATOM 1524 CA GLY A 99 -3.055 1.095 -12.250 1.00 43.31 C ATOM 1525 C GLY A 99 -2.738 2.568 -12.423 1.00 74.10 C ATOM 1526 O GLY A 99 -2.858 3.079 -13.535 1.00 11.42 O ATOM 0 H GLY A 99 -4.864 1.588 -11.314 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -2.164 0.573 -11.901 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -3.318 0.667 -13.217 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 10.609 33.986 -5.262 1.00 51.11 N ATOM 1532 CA MET B 1 10.850 34.868 -6.398 1.00 63.42 C ATOM 1533 C MET B 1 12.299 35.345 -6.418 1.00 24.41 C ATOM 1534 O MET B 1 12.948 35.343 -7.463 1.00 25.51 O ATOM 1535 CB MET B 1 9.906 36.071 -6.346 1.00 75.14 C ATOM 1536 CG MET B 1 8.581 35.835 -7.053 1.00 44.22 C ATOM 1537 SD MET B 1 8.267 37.035 -8.361 1.00 21.25 S ATOM 1538 CE MET B 1 8.577 36.039 -9.817 1.00 23.32 C ATOM 0 H1 MET B 1 9.648 33.594 -5.325 1.00 51.11 H new ATOM 0 H2 MET B 1 11.301 33.210 -5.272 1.00 51.11 H new ATOM 0 H3 MET B 1 10.706 34.525 -4.378 1.00 51.11 H new ATOM 0 HA MET B 1 10.659 34.304 -7.311 1.00 63.42 H new ATOM 0 HB2 MET B 1 9.712 36.326 -5.304 1.00 75.14 H new ATOM 0 HB3 MET B 1 10.401 36.931 -6.797 1.00 75.14 H new ATOM 0 HG2 MET B 1 8.574 34.831 -7.477 1.00 44.22 H new ATOM 0 HG3 MET B 1 7.772 35.878 -6.324 1.00 44.22 H new ATOM 0 HE1 MET B 1 8.423 36.644 -10.711 1.00 23.32 H new ATOM 0 HE2 MET B 1 9.604 35.675 -9.797 1.00 23.32 H new ATOM 0 HE3 MET B 1 7.892 35.191 -9.830 1.00 23.32 H new ATOM 1548 N SER B 2 12.799 35.752 -5.257 1.00 52.41 N ATOM 1549 CA SER B 2 14.170 36.235 -5.142 1.00 52.31 C ATOM 1550 C SER B 2 15.101 35.121 -4.673 1.00 72.12 C ATOM 1551 O SER B 2 16.284 35.102 -5.010 1.00 1.24 O ATOM 1552 CB SER B 2 14.238 37.414 -4.170 1.00 33.21 C ATOM 1553 OG SER B 2 15.524 38.011 -4.182 1.00 21.32 O ATOM 0 H SER B 2 12.275 35.757 -4.382 1.00 52.41 H new ATOM 0 HA SER B 2 14.496 36.567 -6.128 1.00 52.31 H new ATOM 0 HB2 SER B 2 13.487 38.156 -4.440 1.00 33.21 H new ATOM 0 HB3 SER B 2 14.001 37.073 -3.162 1.00 33.21 H new ATOM 0 HG SER B 2 15.541 38.763 -3.554 1.00 21.32 H new ATOM 1559 N ASN B 3 14.558 34.194 -3.891 1.00 61.32 N ATOM 1560 CA ASN B 3 15.338 33.076 -3.374 1.00 34.05 C ATOM 1561 C ASN B 3 15.092 31.813 -4.195 1.00 13.43 C ATOM 1562 O ASN B 3 14.051 31.168 -4.064 1.00 63.53 O ATOM 1563 CB ASN B 3 14.990 32.819 -1.907 1.00 35.42 C ATOM 1564 CG ASN B 3 15.048 34.082 -1.069 1.00 24.34 C ATOM 1565 OD1 ASN B 3 14.097 34.863 -1.037 1.00 34.54 O ATOM 1566 ND2 ASN B 3 16.168 34.288 -0.386 1.00 22.22 N ATOM 0 H ASN B 3 13.580 34.195 -3.601 1.00 61.32 H new ATOM 0 HA ASN B 3 16.393 33.337 -3.450 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.990 32.390 -1.843 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.680 32.082 -1.496 1.00 35.42 H new ATOM 0 HD21 ASN B 3 16.265 35.121 0.195 1.00 22.22 H new ATOM 0 HD22 ASN B 3 16.931 33.613 -0.442 1.00 22.22 H new ATOM 1573 N THR B 4 16.055 31.467 -5.042 1.00 72.34 N ATOM 1574 CA THR B 4 15.944 30.284 -5.885 1.00 42.42 C ATOM 1575 C THR B 4 15.667 29.038 -5.051 1.00 52.45 C ATOM 1576 O THR B 4 15.764 29.068 -3.823 1.00 62.33 O ATOM 1577 CB THR B 4 17.224 30.059 -6.712 1.00 14.31 C ATOM 1578 OG1 THR B 4 18.051 31.226 -6.658 1.00 24.44 O ATOM 1579 CG2 THR B 4 16.882 29.739 -8.160 1.00 44.11 C ATOM 0 H THR B 4 16.922 31.990 -5.163 1.00 72.34 H new ATOM 0 HA THR B 4 15.109 30.458 -6.563 1.00 42.42 H new ATOM 0 HB THR B 4 17.763 29.212 -6.287 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.864 31.076 -7.184 1.00 24.44 H new ATOM 0 HG21 THR B 4 17.801 29.584 -8.725 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.275 28.835 -8.199 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.325 30.569 -8.594 1.00 44.11 H new ATOM 1587 N ILE B 5 15.322 27.945 -5.722 1.00 72.43 N ATOM 1588 CA ILE B 5 15.033 26.689 -5.042 1.00 60.40 C ATOM 1589 C ILE B 5 16.158 26.312 -4.083 1.00 73.52 C ATOM 1590 O ILE B 5 15.909 25.875 -2.959 1.00 14.01 O ATOM 1591 CB ILE B 5 14.823 25.540 -6.046 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.718 25.899 -7.041 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.484 24.251 -5.312 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.446 24.814 -8.059 1.00 71.13 C ATOM 0 H ILE B 5 15.236 27.904 -6.738 1.00 72.43 H new ATOM 0 HA ILE B 5 14.113 26.840 -4.478 1.00 60.40 H new ATOM 0 HB ILE B 5 15.749 25.387 -6.600 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.800 26.109 -6.492 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.994 26.815 -7.563 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.338 23.448 -6.035 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.301 23.990 -4.639 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.570 24.390 -4.735 1.00 64.43 H new ATOM 0 HD11 ILE B 5 12.651 25.137 -8.732 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.351 24.619 -8.634 1.00 71.13 H new ATOM 0 HD13 ILE B 5 13.139 23.903 -7.546 1.00 71.13 H new ATOM 1606 N SER B 6 17.396 26.487 -4.535 1.00 1.32 N ATOM 1607 CA SER B 6 18.559 26.163 -3.717 1.00 35.53 C ATOM 1608 C SER B 6 18.529 26.932 -2.400 1.00 22.31 C ATOM 1609 O SER B 6 18.781 26.368 -1.336 1.00 0.21 O ATOM 1610 CB SER B 6 19.848 26.483 -4.478 1.00 41.32 C ATOM 1611 OG SER B 6 20.449 27.668 -3.988 1.00 21.35 O ATOM 0 H SER B 6 17.619 26.851 -5.461 1.00 1.32 H new ATOM 0 HA SER B 6 18.531 25.096 -3.495 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.546 25.651 -4.383 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.629 26.595 -5.540 1.00 41.32 H new ATOM 0 HG SER B 6 21.235 27.438 -3.450 1.00 21.35 H new ATOM 1617 N GLU B 7 18.220 28.221 -2.482 1.00 32.11 N ATOM 1618 CA GLU B 7 18.157 29.069 -1.296 1.00 62.35 C ATOM 1619 C GLU B 7 17.122 28.542 -0.306 1.00 42.41 C ATOM 1620 O GLU B 7 17.274 28.691 0.906 1.00 11.21 O ATOM 1621 CB GLU B 7 17.819 30.508 -1.688 1.00 23.21 C ATOM 1622 CG GLU B 7 18.877 31.167 -2.557 1.00 1.43 C ATOM 1623 CD GLU B 7 20.014 31.756 -1.746 1.00 1.34 C ATOM 1624 OE1 GLU B 7 20.329 31.199 -0.674 1.00 2.32 O ATOM 1625 OE2 GLU B 7 20.590 32.774 -2.184 1.00 64.22 O ATOM 0 H GLU B 7 18.009 28.702 -3.356 1.00 32.11 H new ATOM 0 HA GLU B 7 19.135 29.052 -0.816 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.867 30.517 -2.219 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.684 31.100 -0.783 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.277 30.432 -3.256 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.414 31.954 -3.152 1.00 1.43 H new ATOM 1632 N LYS B 8 16.068 27.926 -0.832 1.00 33.03 N ATOM 1633 CA LYS B 8 15.007 27.377 0.004 1.00 74.20 C ATOM 1634 C LYS B 8 15.496 26.150 0.768 1.00 72.42 C ATOM 1635 O LYS B 8 14.813 25.652 1.663 1.00 55.43 O ATOM 1636 CB LYS B 8 13.796 27.006 -0.854 1.00 61.22 C ATOM 1637 CG LYS B 8 13.474 28.030 -1.928 1.00 10.12 C ATOM 1638 CD LYS B 8 12.023 27.939 -2.370 1.00 72.53 C ATOM 1639 CE LYS B 8 11.302 29.266 -2.195 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.482 29.614 -3.389 1.00 44.13 N ATOM 0 H LYS B 8 15.926 27.795 -1.834 1.00 33.03 H new ATOM 0 HA LYS B 8 14.715 28.140 0.725 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.979 26.041 -1.327 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.927 26.885 -0.207 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.678 29.032 -1.549 1.00 10.12 H new ATOM 0 HG3 LYS B 8 14.127 27.875 -2.787 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.979 27.635 -3.416 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.513 27.168 -1.792 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.660 29.217 -1.315 1.00 74.45 H new ATOM 0 HE3 LYS B 8 12.032 30.055 -2.013 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.007 30.525 -3.230 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.098 29.686 -4.224 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.768 28.874 -3.548 1.00 44.13 H new ATOM 1654 N ILE B 9 16.683 25.671 0.411 1.00 12.54 N ATOM 1655 CA ILE B 9 17.264 24.506 1.066 1.00 14.12 C ATOM 1656 C ILE B 9 18.518 24.882 1.848 1.00 2.44 C ATOM 1657 O ILE B 9 19.182 24.024 2.430 1.00 32.42 O ATOM 1658 CB ILE B 9 17.618 23.406 0.048 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.485 23.237 -0.967 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.898 22.092 0.762 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.781 22.208 -2.036 1.00 4.43 C ATOM 0 H ILE B 9 17.261 26.072 -0.328 1.00 12.54 H new ATOM 0 HA ILE B 9 16.511 24.124 1.755 1.00 14.12 H new ATOM 0 HB ILE B 9 18.519 23.704 -0.488 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.575 22.950 -0.440 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.288 24.198 -1.443 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.147 21.325 0.028 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.734 22.222 1.449 1.00 21.54 H new ATOM 0 HG23 ILE B 9 17.014 21.786 1.321 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.935 22.141 -2.720 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.673 22.504 -2.589 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.949 21.237 -1.570 1.00 4.43 H new ATOM 1673 N VAL B 10 18.836 26.172 1.859 1.00 31.43 N ATOM 1674 CA VAL B 10 20.009 26.664 2.572 1.00 4.14 C ATOM 1675 C VAL B 10 19.609 27.412 3.838 1.00 20.24 C ATOM 1676 O VAL B 10 20.142 27.157 4.919 1.00 25.00 O ATOM 1677 CB VAL B 10 20.856 27.595 1.685 1.00 14.00 C ATOM 1678 CG1 VAL B 10 22.098 28.059 2.430 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.232 26.897 0.387 1.00 13.31 C ATOM 0 H VAL B 10 18.298 26.896 1.382 1.00 31.43 H new ATOM 0 HA VAL B 10 20.604 25.791 2.842 1.00 4.14 H new ATOM 0 HB VAL B 10 20.260 28.474 1.439 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.684 28.716 1.787 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.802 28.600 3.329 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.699 27.194 2.709 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.830 27.570 -0.228 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.809 26.000 0.610 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.326 26.621 -0.153 1.00 13.31 H new ATOM 1689 N LEU B 11 18.666 28.338 3.699 1.00 4.44 N ATOM 1690 CA LEU B 11 18.192 29.125 4.832 1.00 2.34 C ATOM 1691 C LEU B 11 17.720 28.219 5.965 1.00 45.43 C ATOM 1692 O LEU B 11 18.079 28.419 7.124 1.00 75.44 O ATOM 1693 CB LEU B 11 17.055 30.051 4.396 1.00 4.21 C ATOM 1694 CG LEU B 11 15.956 29.410 3.547 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.781 28.998 4.420 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.502 30.365 2.454 1.00 42.24 C ATOM 0 H LEU B 11 18.215 28.562 2.812 1.00 4.44 H new ATOM 0 HA LEU B 11 19.023 29.728 5.197 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.596 30.475 5.289 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.484 30.880 3.834 1.00 4.21 H new ATOM 0 HG LEU B 11 16.362 28.516 3.074 1.00 62.10 H new ATOM 0 HD11 LEU B 11 14.008 28.544 3.800 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.117 28.278 5.166 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.374 29.877 4.921 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.720 29.892 1.860 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.113 31.277 2.906 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.347 30.611 1.811 1.00 42.24 H new ATOM 1708 N MET B 12 16.914 27.220 5.619 1.00 15.32 N ATOM 1709 CA MET B 12 16.395 26.280 6.607 1.00 4.44 C ATOM 1710 C MET B 12 17.503 25.369 7.124 1.00 75.53 C ATOM 1711 O MET B 12 17.520 25.004 8.300 1.00 31.24 O ATOM 1712 CB MET B 12 15.268 25.440 6.000 1.00 24.25 C ATOM 1713 CG MET B 12 15.598 24.884 4.624 1.00 13.14 C ATOM 1714 SD MET B 12 14.760 23.324 4.287 1.00 25.25 S ATOM 1715 CE MET B 12 16.146 22.288 3.823 1.00 64.33 C ATOM 0 H MET B 12 16.606 27.041 4.663 1.00 15.32 H new ATOM 0 HA MET B 12 16.000 26.853 7.446 1.00 4.44 H new ATOM 0 HB2 MET B 12 15.040 24.613 6.672 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.368 26.051 5.930 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.318 25.614 3.865 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.675 24.738 4.544 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.806 21.509 3.140 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.906 22.895 3.331 1.00 64.33 H new ATOM 0 HE3 MET B 12 16.571 21.828 4.715 1.00 64.33 H new ATOM 1725 N ARG B 13 18.425 25.005 6.240 1.00 31.24 N ATOM 1726 CA ARG B 13 19.535 24.135 6.609 1.00 74.51 C ATOM 1727 C ARG B 13 20.363 24.755 7.731 1.00 20.12 C ATOM 1728 O ARG B 13 20.602 24.125 8.761 1.00 41.34 O ATOM 1729 CB ARG B 13 20.425 23.866 5.394 1.00 32.34 C ATOM 1730 CG ARG B 13 21.488 22.808 5.640 1.00 45.45 C ATOM 1731 CD ARG B 13 22.800 23.431 6.094 1.00 63.05 C ATOM 1732 NE ARG B 13 23.333 24.363 5.105 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.523 24.946 5.210 1.00 41.31 C ATOM 1734 NH1 ARG B 13 25.298 24.693 6.255 1.00 23.35 N ATOM 1735 NH2 ARG B 13 24.938 25.784 4.268 1.00 12.23 N ATOM 0 H ARG B 13 18.426 25.299 5.263 1.00 31.24 H new ATOM 0 HA ARG B 13 19.121 23.192 6.965 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.799 23.553 4.558 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.911 24.795 5.098 1.00 32.34 H new ATOM 0 HG2 ARG B 13 21.136 22.106 6.396 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.652 22.236 4.727 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.646 23.953 7.038 1.00 63.05 H new ATOM 0 HD3 ARG B 13 23.530 22.643 6.281 1.00 63.05 H new ATOM 0 HE ARG B 13 22.761 24.579 4.289 1.00 42.01 H new ATOM 0 HH11 ARG B 13 24.982 24.050 6.981 1.00 23.35 H new ATOM 0 HH12 ARG B 13 26.211 25.141 6.333 1.00 23.35 H new ATOM 0 HH21 ARG B 13 24.344 25.981 3.463 1.00 12.23 H new ATOM 0 HH22 ARG B 13 25.851 26.231 4.349 1.00 12.23 H new ATOM 1749 N LYS B 14 20.797 25.993 7.524 1.00 12.22 N ATOM 1750 CA LYS B 14 21.598 26.700 8.517 1.00 65.30 C ATOM 1751 C LYS B 14 20.829 26.853 9.825 1.00 55.42 C ATOM 1752 O LYS B 14 21.422 27.057 10.885 1.00 72.04 O ATOM 1753 CB LYS B 14 22.003 28.077 7.988 1.00 13.55 C ATOM 1754 CG LYS B 14 23.364 28.093 7.313 1.00 13.50 C ATOM 1755 CD LYS B 14 23.237 28.099 5.799 1.00 31.23 C ATOM 1756 CE LYS B 14 22.627 29.399 5.297 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.547 30.125 4.379 1.00 72.34 N ATOM 0 H LYS B 14 20.608 26.529 6.677 1.00 12.22 H new ATOM 0 HA LYS B 14 22.496 26.113 8.709 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.250 28.420 7.278 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.008 28.787 8.815 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.920 28.973 7.636 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.937 27.221 7.627 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.220 27.960 5.350 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.619 27.259 5.481 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.692 29.185 4.780 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.383 30.037 6.146 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 23.005 30.811 3.816 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.268 30.626 4.936 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 24.011 29.445 3.743 1.00 72.34 H new ATOM 1771 N SER B 15 19.507 26.750 9.746 1.00 70.12 N ATOM 1772 CA SER B 15 18.657 26.879 10.924 1.00 60.13 C ATOM 1773 C SER B 15 18.961 25.778 11.936 1.00 64.13 C ATOM 1774 O SER B 15 18.901 25.998 13.145 1.00 73.31 O ATOM 1775 CB SER B 15 17.182 26.825 10.524 1.00 63.31 C ATOM 1776 OG SER B 15 16.424 27.789 11.236 1.00 42.11 O ATOM 0 H SER B 15 19.000 26.577 8.878 1.00 70.12 H new ATOM 0 HA SER B 15 18.865 27.843 11.387 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.086 27.001 9.453 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.785 25.829 10.720 1.00 63.31 H new ATOM 0 HG SER B 15 15.561 27.402 11.492 1.00 42.11 H new ATOM 1782 N GLU B 16 19.287 24.593 11.430 1.00 40.41 N ATOM 1783 CA GLU B 16 19.600 23.456 12.290 1.00 13.44 C ATOM 1784 C GLU B 16 21.036 23.538 12.799 1.00 32.01 C ATOM 1785 O GLU B 16 21.460 22.731 13.627 1.00 23.44 O ATOM 1786 CB GLU B 16 19.389 22.144 11.534 1.00 54.12 C ATOM 1787 CG GLU B 16 19.581 20.907 12.397 1.00 50.43 C ATOM 1788 CD GLU B 16 18.769 20.957 13.676 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.709 21.616 13.681 1.00 35.53 O ATOM 1790 OE2 GLU B 16 19.195 20.338 14.674 1.00 51.44 O ATOM 0 H GLU B 16 19.341 24.395 10.431 1.00 40.41 H new ATOM 0 HA GLU B 16 18.927 23.485 13.147 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.382 22.133 11.116 1.00 54.12 H new ATOM 0 HB3 GLU B 16 20.083 22.102 10.694 1.00 54.12 H new ATOM 0 HG2 GLU B 16 19.298 20.023 11.826 1.00 50.43 H new ATOM 0 HG3 GLU B 16 20.637 20.802 12.645 1.00 50.43 H new ATOM 1797 N TYR B 17 21.780 24.517 12.296 1.00 34.32 N ATOM 1798 CA TYR B 17 23.170 24.703 12.697 1.00 12.14 C ATOM 1799 C TYR B 17 24.013 23.487 12.322 1.00 53.41 C ATOM 1800 O TYR B 17 25.085 23.262 12.885 1.00 71.22 O ATOM 1801 CB TYR B 17 23.260 24.955 14.203 1.00 12.25 C ATOM 1802 CG TYR B 17 23.366 26.418 14.567 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.295 27.282 14.369 1.00 4.33 C ATOM 1804 CD2 TYR B 17 24.535 26.938 15.107 1.00 24.11 C ATOM 1805 CE1 TYR B 17 22.388 28.620 14.699 1.00 21.33 C ATOM 1806 CE2 TYR B 17 24.635 28.274 15.442 1.00 12.34 C ATOM 1807 CZ TYR B 17 23.559 29.111 15.236 1.00 21.44 C ATOM 1808 OH TYR B 17 23.656 30.444 15.567 1.00 40.42 O ATOM 0 H TYR B 17 21.444 25.194 11.610 1.00 34.32 H new ATOM 0 HA TYR B 17 23.561 25.571 12.167 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.380 24.532 14.687 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.127 24.427 14.600 1.00 12.25 H new ATOM 0 HD1 TYR B 17 21.375 26.901 13.950 1.00 4.33 H new ATOM 0 HD2 TYR B 17 25.381 26.286 15.268 1.00 24.11 H new ATOM 0 HE1 TYR B 17 21.547 29.278 14.537 1.00 21.33 H new ATOM 0 HE2 TYR B 17 25.551 28.661 15.863 1.00 12.34 H new ATOM 0 HH TYR B 17 24.546 30.626 15.934 1.00 40.42 H new ATOM 1818 N LEU B 18 23.519 22.706 11.368 1.00 12.20 N ATOM 1819 CA LEU B 18 24.225 21.512 10.915 1.00 24.40 C ATOM 1820 C LEU B 18 25.096 21.821 9.701 1.00 52.21 C ATOM 1821 O LEU B 18 25.005 22.903 9.119 1.00 53.11 O ATOM 1822 CB LEU B 18 23.228 20.404 10.573 1.00 20.43 C ATOM 1823 CG LEU B 18 22.235 20.717 9.452 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.861 20.444 8.093 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.960 19.906 9.627 1.00 4.13 C ATOM 0 H LEU B 18 22.633 22.878 10.893 1.00 12.20 H new ATOM 0 HA LEU B 18 24.871 21.173 11.725 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.789 19.511 10.296 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.664 20.160 11.473 1.00 20.43 H new ATOM 0 HG LEU B 18 21.978 21.775 9.505 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.140 20.672 7.308 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.745 21.070 7.967 1.00 73.11 H new ATOM 0 HD13 LEU B 18 23.147 19.394 8.029 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.265 20.142 8.821 1.00 4.13 H new ATOM 0 HD22 LEU B 18 21.199 18.843 9.601 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.501 20.152 10.585 1.00 4.13 H new ATOM 1837 N SER B 19 25.936 20.864 9.323 1.00 12.41 N ATOM 1838 CA SER B 19 26.824 21.035 8.178 1.00 64.34 C ATOM 1839 C SER B 19 26.252 20.349 6.941 1.00 33.32 C ATOM 1840 O SER B 19 25.437 19.433 7.046 1.00 1.23 O ATOM 1841 CB SER B 19 28.211 20.470 8.493 1.00 15.24 C ATOM 1842 OG SER B 19 28.115 19.272 9.243 1.00 63.44 O ATOM 0 H SER B 19 26.021 19.962 9.792 1.00 12.41 H new ATOM 0 HA SER B 19 26.912 22.102 7.973 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.749 20.279 7.564 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.789 21.207 9.051 1.00 15.24 H new ATOM 0 HG SER B 19 29.014 18.930 9.430 1.00 63.44 H new ATOM 1848 N ARG B 20 26.686 20.801 5.769 1.00 0.34 N ATOM 1849 CA ARG B 20 26.218 20.233 4.510 1.00 13.34 C ATOM 1850 C ARG B 20 26.430 18.722 4.482 1.00 61.45 C ATOM 1851 O ARG B 20 25.691 17.994 3.820 1.00 32.35 O ATOM 1852 CB ARG B 20 26.946 20.882 3.331 1.00 32.01 C ATOM 1853 CG ARG B 20 26.422 20.439 1.974 1.00 12.30 C ATOM 1854 CD ARG B 20 26.518 21.558 0.949 1.00 43.42 C ATOM 1855 NE ARG B 20 25.759 22.738 1.353 1.00 33.34 N ATOM 1856 CZ ARG B 20 25.981 23.955 0.870 1.00 13.22 C ATOM 1857 NH1 ARG B 20 26.934 24.152 -0.030 1.00 45.34 N ATOM 1858 NH2 ARG B 20 25.247 24.979 1.287 1.00 44.43 N ATOM 0 H ARG B 20 27.361 21.559 5.665 1.00 0.34 H new ATOM 0 HA ARG B 20 25.150 20.434 4.425 1.00 13.34 H new ATOM 0 HB2 ARG B 20 26.855 21.965 3.410 1.00 32.01 H new ATOM 0 HB3 ARG B 20 28.008 20.646 3.396 1.00 32.01 H new ATOM 0 HG2 ARG B 20 26.990 19.576 1.627 1.00 12.30 H new ATOM 0 HG3 ARG B 20 25.384 20.120 2.070 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.564 21.831 0.807 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.149 21.201 -0.012 1.00 43.42 H new ATOM 0 HE ARG B 20 25.018 22.621 2.044 1.00 33.34 H new ATOM 0 HH11 ARG B 20 27.500 23.367 -0.354 1.00 45.34 H new ATOM 0 HH12 ARG B 20 27.102 25.088 -0.399 1.00 45.34 H new ATOM 0 HH21 ARG B 20 24.512 24.831 1.979 1.00 44.43 H new ATOM 0 HH22 ARG B 20 25.418 25.914 0.916 1.00 44.43 H new ATOM 1872 N GLN B 21 27.444 18.258 5.206 1.00 14.43 N ATOM 1873 CA GLN B 21 27.753 16.835 5.263 1.00 43.34 C ATOM 1874 C GLN B 21 26.757 16.097 6.151 1.00 62.14 C ATOM 1875 O GLN B 21 26.486 14.914 5.945 1.00 41.54 O ATOM 1876 CB GLN B 21 29.176 16.621 5.785 1.00 2.32 C ATOM 1877 CG GLN B 21 29.372 17.077 7.222 1.00 23.52 C ATOM 1878 CD GLN B 21 30.793 17.523 7.503 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.392 18.259 6.718 1.00 14.14 O ATOM 1880 NE2 GLN B 21 31.341 17.081 8.628 1.00 71.20 N ATOM 0 H GLN B 21 28.065 18.847 5.761 1.00 14.43 H new ATOM 0 HA GLN B 21 27.679 16.432 4.253 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.426 15.563 5.711 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.874 17.159 5.144 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.688 17.899 7.435 1.00 23.52 H new ATOM 0 HG3 GLN B 21 29.111 16.262 7.897 1.00 23.52 H new ATOM 0 HE21 GLN B 21 30.809 16.473 9.250 1.00 71.20 H new ATOM 0 HE22 GLN B 21 32.295 17.350 8.871 1.00 71.20 H new ATOM 1889 N GLN B 22 26.216 16.803 7.139 1.00 33.40 N ATOM 1890 CA GLN B 22 25.251 16.213 8.058 1.00 53.02 C ATOM 1891 C GLN B 22 23.912 15.980 7.367 1.00 53.44 C ATOM 1892 O GLN B 22 23.336 14.895 7.456 1.00 72.23 O ATOM 1893 CB GLN B 22 25.058 17.116 9.278 1.00 4.03 C ATOM 1894 CG GLN B 22 24.666 16.362 10.538 1.00 5.22 C ATOM 1895 CD GLN B 22 25.598 16.643 11.700 1.00 40.14 C ATOM 1896 OE1 GLN B 22 26.784 16.313 11.653 1.00 24.31 O ATOM 1897 NE2 GLN B 22 25.065 17.254 12.752 1.00 70.34 N ATOM 0 H GLN B 22 26.430 17.783 7.323 1.00 33.40 H new ATOM 0 HA GLN B 22 25.642 15.250 8.386 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.982 17.663 9.465 1.00 4.03 H new ATOM 0 HB3 GLN B 22 24.290 17.856 9.054 1.00 4.03 H new ATOM 0 HG2 GLN B 22 23.649 16.635 10.819 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.663 15.292 10.330 1.00 5.22 H new ATOM 0 HE21 GLN B 22 24.077 17.509 12.747 1.00 70.34 H new ATOM 0 HE22 GLN B 22 25.643 17.468 13.565 1.00 70.34 H new ATOM 1906 N LEU B 23 23.421 17.005 6.679 1.00 15.24 N ATOM 1907 CA LEU B 23 22.149 16.913 5.971 1.00 60.42 C ATOM 1908 C LEU B 23 22.147 15.732 5.005 1.00 74.31 C ATOM 1909 O LEU B 23 21.252 14.888 5.043 1.00 34.01 O ATOM 1910 CB LEU B 23 21.872 18.209 5.209 1.00 62.13 C ATOM 1911 CG LEU B 23 20.623 18.215 4.326 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.430 18.763 5.093 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.867 19.028 3.063 1.00 12.23 C ATOM 0 H LEU B 23 23.885 17.910 6.596 1.00 15.24 H new ATOM 0 HA LEU B 23 21.362 16.757 6.709 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.785 19.020 5.932 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.736 18.431 4.583 1.00 62.13 H new ATOM 0 HG LEU B 23 20.401 17.188 4.036 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.551 18.760 4.449 1.00 33.53 H new ATOM 0 HD12 LEU B 23 19.242 18.140 5.967 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.641 19.783 5.414 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.968 19.021 2.447 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.114 20.055 3.333 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.694 18.591 2.503 1.00 12.23 H new ATOM 1925 N ALA B 24 23.157 15.677 4.144 1.00 31.24 N ATOM 1926 CA ALA B 24 23.275 14.598 3.171 1.00 75.43 C ATOM 1927 C ALA B 24 23.233 13.236 3.856 1.00 63.14 C ATOM 1928 O ALA B 24 22.828 12.240 3.255 1.00 31.23 O ATOM 1929 CB ALA B 24 24.558 14.748 2.367 1.00 65.45 C ATOM 0 H ALA B 24 23.906 16.368 4.100 1.00 31.24 H new ATOM 0 HA ALA B 24 22.425 14.661 2.491 1.00 75.43 H new ATOM 0 HB1 ALA B 24 24.632 13.935 1.645 1.00 65.45 H new ATOM 0 HB2 ALA B 24 24.548 15.702 1.840 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.415 14.715 3.040 1.00 65.45 H new ATOM 1935 N ASP B 25 23.655 13.198 5.115 1.00 53.33 N ATOM 1936 CA ASP B 25 23.666 11.958 5.881 1.00 63.20 C ATOM 1937 C ASP B 25 22.333 11.747 6.593 1.00 41.34 C ATOM 1938 O ASP B 25 21.967 10.620 6.928 1.00 55.50 O ATOM 1939 CB ASP B 25 24.806 11.973 6.900 1.00 35.03 C ATOM 1940 CG ASP B 25 25.727 10.776 6.757 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.411 10.677 5.718 1.00 43.25 O ATOM 1942 OD2 ASP B 25 25.761 9.939 7.683 1.00 75.51 O ATOM 0 H ASP B 25 23.994 14.013 5.627 1.00 53.33 H new ATOM 0 HA ASP B 25 23.821 11.132 5.187 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.384 12.889 6.780 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.389 11.989 7.907 1.00 35.03 H new ATOM 1947 N LEU B 26 21.613 12.840 6.824 1.00 71.41 N ATOM 1948 CA LEU B 26 20.320 12.775 7.498 1.00 64.24 C ATOM 1949 C LEU B 26 19.225 12.332 6.533 1.00 43.13 C ATOM 1950 O LEU B 26 18.134 11.945 6.953 1.00 10.22 O ATOM 1951 CB LEU B 26 19.967 14.139 8.096 1.00 4.31 C ATOM 1952 CG LEU B 26 20.052 14.245 9.619 1.00 10.30 C ATOM 1953 CD1 LEU B 26 21.175 15.188 10.026 1.00 61.54 C ATOM 1954 CD2 LEU B 26 18.725 14.714 10.197 1.00 62.25 C ATOM 0 H LEU B 26 21.902 13.781 6.555 1.00 71.41 H new ATOM 0 HA LEU B 26 20.391 12.040 8.300 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.631 14.887 7.662 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.953 14.397 7.790 1.00 4.31 H new ATOM 0 HG LEU B 26 20.271 13.256 10.021 1.00 10.30 H new ATOM 0 HD11 LEU B 26 21.221 15.251 11.113 1.00 61.54 H new ATOM 0 HD12 LEU B 26 22.124 14.810 9.644 1.00 61.54 H new ATOM 0 HD13 LEU B 26 20.986 16.179 9.612 1.00 61.54 H new ATOM 0 HD21 LEU B 26 18.805 14.783 11.282 1.00 62.25 H new ATOM 0 HD22 LEU B 26 18.476 15.693 9.788 1.00 62.25 H new ATOM 0 HD23 LEU B 26 17.942 14.002 9.936 1.00 62.25 H new ATOM 1966 N THR B 27 19.525 12.387 5.240 1.00 72.41 N ATOM 1967 CA THR B 27 18.566 11.989 4.216 1.00 53.05 C ATOM 1968 C THR B 27 19.096 10.820 3.392 1.00 51.22 C ATOM 1969 O THR B 27 18.354 10.199 2.632 1.00 32.24 O ATOM 1970 CB THR B 27 18.235 13.160 3.272 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.410 13.564 2.559 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.677 14.342 4.050 1.00 64.34 C ATOM 0 H THR B 27 20.424 12.703 4.876 1.00 72.41 H new ATOM 0 HA THR B 27 17.658 11.682 4.734 1.00 53.05 H new ATOM 0 HB THR B 27 17.479 12.822 2.563 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.044 13.977 3.181 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.451 15.156 3.362 1.00 64.34 H new ATOM 0 HG22 THR B 27 16.766 14.040 4.567 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.414 14.678 4.780 1.00 64.34 H new ATOM 1980 N GLY B 28 20.383 10.527 3.549 1.00 31.12 N ATOM 1981 CA GLY B 28 20.988 9.432 2.812 1.00 0.51 C ATOM 1982 C GLY B 28 21.555 9.874 1.477 1.00 21.43 C ATOM 1983 O GLY B 28 22.170 9.084 0.763 1.00 31.15 O ATOM 0 H GLY B 28 21.017 11.027 4.172 1.00 31.12 H new ATOM 0 HA2 GLY B 28 21.783 8.990 3.412 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.243 8.654 2.647 1.00 0.51 H new ATOM 1987 N VAL B 29 21.345 11.143 1.139 1.00 41.33 N ATOM 1988 CA VAL B 29 21.838 11.689 -0.119 1.00 64.40 C ATOM 1989 C VAL B 29 23.357 11.822 -0.103 1.00 1.32 C ATOM 1990 O VAL B 29 23.975 12.041 0.939 1.00 12.41 O ATOM 1991 CB VAL B 29 21.218 13.068 -0.415 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.305 14.117 -0.591 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.328 12.997 -1.647 1.00 55.14 C ATOM 0 H VAL B 29 20.837 11.811 1.719 1.00 41.33 H new ATOM 0 HA VAL B 29 21.544 10.990 -0.903 1.00 64.40 H new ATOM 0 HB VAL B 29 20.601 13.360 0.435 1.00 61.44 H new ATOM 0 HG11 VAL B 29 21.847 15.084 -0.799 1.00 50.43 H new ATOM 0 HG12 VAL B 29 22.897 14.185 0.322 1.00 50.43 H new ATOM 0 HG13 VAL B 29 22.952 13.835 -1.422 1.00 50.43 H new ATOM 0 HG21 VAL B 29 19.898 13.979 -1.842 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.921 12.683 -2.506 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.527 12.278 -1.476 1.00 55.14 H new ATOM 2003 N PRO B 30 23.976 11.687 -1.286 1.00 64.31 N ATOM 2004 CA PRO B 30 25.430 11.789 -1.434 1.00 44.21 C ATOM 2005 C PRO B 30 25.937 13.211 -1.221 1.00 55.44 C ATOM 2006 O PRO B 30 25.526 14.138 -1.920 1.00 52.10 O ATOM 2007 CB PRO B 30 25.672 11.346 -2.880 1.00 72.05 C ATOM 2008 CG PRO B 30 24.392 11.638 -3.583 1.00 25.14 C ATOM 2009 CD PRO B 30 23.303 11.424 -2.568 1.00 2.43 C ATOM 0 HA PRO B 30 25.957 11.186 -0.695 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.503 11.891 -3.328 1.00 72.05 H new ATOM 0 HB3 PRO B 30 25.920 10.286 -2.933 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.378 12.661 -3.960 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.260 10.980 -4.442 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.465 12.102 -2.729 1.00 2.43 H new ATOM 0 HD3 PRO B 30 22.905 10.410 -2.613 1.00 2.43 H new ATOM 2017 N TYR B 31 26.831 13.377 -0.253 1.00 55.04 N ATOM 2018 CA TYR B 31 27.393 14.688 0.052 1.00 73.24 C ATOM 2019 C TYR B 31 28.034 15.309 -1.185 1.00 50.10 C ATOM 2020 O TYR B 31 27.814 16.479 -1.491 1.00 14.12 O ATOM 2021 CB TYR B 31 28.427 14.574 1.174 1.00 71.51 C ATOM 2022 CG TYR B 31 29.201 15.850 1.415 1.00 71.30 C ATOM 2023 CD1 TYR B 31 28.562 16.999 1.866 1.00 11.35 C ATOM 2024 CD2 TYR B 31 30.571 15.907 1.193 1.00 4.21 C ATOM 2025 CE1 TYR B 31 29.266 18.167 2.087 1.00 75.30 C ATOM 2026 CE2 TYR B 31 31.283 17.070 1.413 1.00 23.24 C ATOM 2027 CZ TYR B 31 30.626 18.197 1.859 1.00 13.24 C ATOM 2028 OH TYR B 31 31.330 19.360 2.079 1.00 2.20 O ATOM 0 H TYR B 31 27.182 12.621 0.334 1.00 55.04 H new ATOM 0 HA TYR B 31 26.580 15.336 0.380 1.00 73.24 H new ATOM 0 HB2 TYR B 31 27.921 14.286 2.095 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.127 13.774 0.932 1.00 71.51 H new ATOM 0 HD1 TYR B 31 27.497 16.978 2.047 1.00 11.35 H new ATOM 0 HD2 TYR B 31 31.089 15.026 0.842 1.00 4.21 H new ATOM 0 HE1 TYR B 31 28.754 19.052 2.436 1.00 75.30 H new ATOM 0 HE2 TYR B 31 32.348 17.096 1.237 1.00 23.24 H new ATOM 0 HH TYR B 31 32.277 19.213 1.872 1.00 2.20 H new ATOM 2038 N GLY B 32 28.829 14.512 -1.894 1.00 45.13 N ATOM 2039 CA GLY B 32 29.490 14.998 -3.090 1.00 74.01 C ATOM 2040 C GLY B 32 28.524 15.641 -4.066 1.00 73.43 C ATOM 2041 O GLY B 32 28.902 16.526 -4.834 1.00 1.33 O ATOM 0 H GLY B 32 29.026 13.539 -1.661 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.255 15.723 -2.810 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.001 14.170 -3.581 1.00 74.01 H new ATOM 2045 N THR B 33 27.273 15.193 -4.040 1.00 10.04 N ATOM 2046 CA THR B 33 26.251 15.727 -4.930 1.00 11.04 C ATOM 2047 C THR B 33 25.482 16.864 -4.265 1.00 2.51 C ATOM 2048 O THR B 33 25.181 17.877 -4.898 1.00 23.25 O ATOM 2049 CB THR B 33 25.256 14.635 -5.363 1.00 3.23 C ATOM 2050 OG1 THR B 33 25.937 13.383 -5.512 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.579 15.007 -6.674 1.00 42.22 C ATOM 0 H THR B 33 26.943 14.461 -3.411 1.00 10.04 H new ATOM 0 HA THR B 33 26.768 16.107 -5.811 1.00 11.04 H new ATOM 0 HB THR B 33 24.492 14.545 -4.591 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.338 12.733 -5.936 1.00 14.15 H new ATOM 0 HG21 THR B 33 23.881 14.220 -6.959 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.038 15.945 -6.551 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.333 15.123 -7.453 1.00 42.22 H new ATOM 2059 N LEU B 34 25.166 16.689 -2.986 1.00 5.42 N ATOM 2060 CA LEU B 34 24.432 17.702 -2.235 1.00 11.23 C ATOM 2061 C LEU B 34 25.208 19.013 -2.185 1.00 53.41 C ATOM 2062 O LEU B 34 24.641 20.072 -1.921 1.00 25.43 O ATOM 2063 CB LEU B 34 24.153 17.208 -0.814 1.00 44.11 C ATOM 2064 CG LEU B 34 23.723 18.272 0.194 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.301 18.734 -0.089 1.00 30.33 C ATOM 2066 CD2 LEU B 34 23.840 17.740 1.615 1.00 54.42 C ATOM 0 H LEU B 34 25.406 15.856 -2.448 1.00 5.42 H new ATOM 0 HA LEU B 34 23.485 17.881 -2.745 1.00 11.23 H new ATOM 0 HB2 LEU B 34 23.375 16.446 -0.862 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.053 16.721 -0.437 1.00 44.11 H new ATOM 0 HG LEU B 34 24.388 19.129 0.093 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.013 19.492 0.640 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.249 19.157 -1.092 1.00 30.33 H new ATOM 0 HD13 LEU B 34 21.621 17.885 -0.017 1.00 30.33 H new ATOM 0 HD21 LEU B 34 23.529 18.512 2.319 1.00 54.42 H new ATOM 0 HD22 LEU B 34 23.200 16.865 1.730 1.00 54.42 H new ATOM 0 HD23 LEU B 34 24.875 17.461 1.815 1.00 54.42 H new ATOM 2078 N SER B 35 26.510 18.934 -2.444 1.00 61.31 N ATOM 2079 CA SER B 35 27.365 20.116 -2.428 1.00 34.14 C ATOM 2080 C SER B 35 26.852 21.171 -3.402 1.00 4.52 C ATOM 2081 O SER B 35 26.788 22.357 -3.074 1.00 30.41 O ATOM 2082 CB SER B 35 28.804 19.734 -2.782 1.00 14.21 C ATOM 2083 OG SER B 35 29.437 20.764 -3.521 1.00 62.41 O ATOM 0 H SER B 35 26.995 18.065 -2.667 1.00 61.31 H new ATOM 0 HA SER B 35 27.345 20.536 -1.422 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.367 19.538 -1.869 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.807 18.811 -3.362 1.00 14.21 H new ATOM 0 HG SER B 35 30.356 20.497 -3.734 1.00 62.41 H new ATOM 2089 N TYR B 36 26.488 20.733 -4.602 1.00 41.34 N ATOM 2090 CA TYR B 36 25.982 21.639 -5.626 1.00 34.30 C ATOM 2091 C TYR B 36 24.484 21.872 -5.456 1.00 45.21 C ATOM 2092 O TYR B 36 23.948 22.888 -5.899 1.00 45.01 O ATOM 2093 CB TYR B 36 26.268 21.077 -7.020 1.00 40.31 C ATOM 2094 CG TYR B 36 25.130 20.259 -7.588 1.00 34.30 C ATOM 2095 CD1 TYR B 36 23.972 20.871 -8.054 1.00 32.43 C ATOM 2096 CD2 TYR B 36 25.211 18.874 -7.657 1.00 45.14 C ATOM 2097 CE1 TYR B 36 22.930 20.128 -8.573 1.00 62.53 C ATOM 2098 CE2 TYR B 36 24.175 18.123 -8.177 1.00 64.54 C ATOM 2099 CZ TYR B 36 23.036 18.755 -8.632 1.00 62.20 C ATOM 2100 OH TYR B 36 22.001 18.010 -9.148 1.00 51.03 O ATOM 0 H TYR B 36 26.534 19.755 -4.890 1.00 41.34 H new ATOM 0 HA TYR B 36 26.494 22.595 -5.515 1.00 34.30 H new ATOM 0 HB2 TYR B 36 26.485 21.902 -7.698 1.00 40.31 H new ATOM 0 HB3 TYR B 36 27.163 20.457 -6.976 1.00 40.31 H new ATOM 0 HD1 TYR B 36 23.886 21.947 -8.009 1.00 32.43 H new ATOM 0 HD2 TYR B 36 26.099 18.376 -7.298 1.00 45.14 H new ATOM 0 HE1 TYR B 36 22.037 20.620 -8.931 1.00 62.53 H new ATOM 0 HE2 TYR B 36 24.256 17.047 -8.227 1.00 64.54 H new ATOM 0 HH TYR B 36 21.490 17.608 -8.415 1.00 51.03 H new ATOM 2110 N TYR B 37 23.813 20.923 -4.811 1.00 23.03 N ATOM 2111 CA TYR B 37 22.377 21.021 -4.584 1.00 71.53 C ATOM 2112 C TYR B 37 22.014 22.370 -3.968 1.00 1.34 C ATOM 2113 O TYR B 37 21.254 23.144 -4.549 1.00 12.02 O ATOM 2114 CB TYR B 37 21.905 19.888 -3.672 1.00 44.25 C ATOM 2115 CG TYR B 37 21.487 18.643 -4.419 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.173 18.227 -5.554 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.408 17.881 -3.990 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.794 17.090 -6.241 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.023 16.741 -4.669 1.00 0.41 C ATOM 2120 CZ TYR B 37 20.719 16.350 -5.795 1.00 71.12 C ATOM 2121 OH TYR B 37 20.339 15.216 -6.475 1.00 2.50 O ATOM 0 H TYR B 37 24.242 20.077 -4.436 1.00 23.03 H new ATOM 0 HA TYR B 37 21.876 20.935 -5.548 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.707 19.633 -2.979 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.066 20.241 -3.073 1.00 44.25 H new ATOM 0 HD1 TYR B 37 23.017 18.803 -5.905 1.00 52.14 H new ATOM 0 HD2 TYR B 37 19.860 18.185 -3.110 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.337 16.782 -7.123 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.182 16.159 -4.321 1.00 0.41 H new ATOM 0 HH TYR B 37 19.566 14.811 -6.030 1.00 2.50 H new ATOM 2131 N GLU B 38 22.566 22.643 -2.790 1.00 43.22 N ATOM 2132 CA GLU B 38 22.301 23.897 -2.096 1.00 44.31 C ATOM 2133 C GLU B 38 22.937 25.073 -2.833 1.00 24.45 C ATOM 2134 O GLU B 38 22.493 26.213 -2.706 1.00 42.22 O ATOM 2135 CB GLU B 38 22.830 23.834 -0.661 1.00 11.21 C ATOM 2136 CG GLU B 38 22.609 22.489 0.009 1.00 54.50 C ATOM 2137 CD GLU B 38 22.591 22.589 1.523 1.00 35.11 C ATOM 2138 OE1 GLU B 38 21.951 23.523 2.048 1.00 63.32 O ATOM 2139 OE2 GLU B 38 23.219 21.733 2.181 1.00 70.20 O ATOM 0 H GLU B 38 23.199 22.013 -2.297 1.00 43.22 H new ATOM 0 HA GLU B 38 21.222 24.047 -2.072 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.897 24.057 -0.666 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.344 24.610 -0.069 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.665 22.066 -0.335 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.397 21.801 -0.297 1.00 54.50 H new ATOM 2146 N SER B 39 23.981 24.784 -3.603 1.00 53.34 N ATOM 2147 CA SER B 39 24.682 25.817 -4.358 1.00 70.11 C ATOM 2148 C SER B 39 23.844 26.288 -5.543 1.00 24.54 C ATOM 2149 O SER B 39 24.188 27.261 -6.213 1.00 41.42 O ATOM 2150 CB SER B 39 26.032 25.290 -4.851 1.00 1.22 C ATOM 2151 OG SER B 39 27.059 26.243 -4.639 1.00 11.15 O ATOM 0 H SER B 39 24.360 23.844 -3.721 1.00 53.34 H new ATOM 0 HA SER B 39 24.851 26.666 -3.695 1.00 70.11 H new ATOM 0 HB2 SER B 39 26.277 24.365 -4.330 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.967 25.051 -5.912 1.00 1.22 H new ATOM 0 HG SER B 39 27.912 25.882 -4.961 1.00 11.15 H new ATOM 2157 N GLY B 40 22.742 25.588 -5.796 1.00 41.23 N ATOM 2158 CA GLY B 40 21.871 25.949 -6.899 1.00 73.32 C ATOM 2159 C GLY B 40 22.509 25.690 -8.249 1.00 71.50 C ATOM 2160 O GLY B 40 21.991 26.119 -9.280 1.00 64.32 O ATOM 0 H GLY B 40 22.437 24.778 -5.257 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.942 25.383 -6.825 1.00 73.32 H new ATOM 0 HA3 GLY B 40 21.609 27.004 -6.821 1.00 73.32 H new ATOM 2164 N ARG B 41 23.636 24.986 -8.244 1.00 73.33 N ATOM 2165 CA ARG B 41 24.346 24.673 -9.477 1.00 73.31 C ATOM 2166 C ARG B 41 23.405 24.047 -10.503 1.00 30.24 C ATOM 2167 O ARG B 41 23.440 24.393 -11.684 1.00 23.15 O ATOM 2168 CB ARG B 41 25.512 23.722 -9.193 1.00 2.45 C ATOM 2169 CG ARG B 41 26.712 23.944 -10.099 1.00 71.20 C ATOM 2170 CD ARG B 41 27.633 25.021 -9.550 1.00 3.45 C ATOM 2171 NE ARG B 41 28.490 25.589 -10.588 1.00 73.34 N ATOM 2172 CZ ARG B 41 29.572 24.980 -11.062 1.00 44.45 C ATOM 2173 NH1 ARG B 41 29.925 23.790 -10.595 1.00 73.10 N ATOM 2174 NH2 ARG B 41 30.301 25.560 -12.006 1.00 72.43 N ATOM 0 H ARG B 41 24.077 24.622 -7.399 1.00 73.33 H new ATOM 0 HA ARG B 41 24.737 25.604 -9.887 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.823 23.842 -8.155 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.167 22.694 -9.306 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.265 23.011 -10.207 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.370 24.229 -11.094 1.00 71.20 H new ATOM 0 HD2 ARG B 41 27.036 25.814 -9.099 1.00 3.45 H new ATOM 0 HD3 ARG B 41 28.253 24.599 -8.759 1.00 3.45 H new ATOM 0 HE ARG B 41 28.245 26.503 -10.970 1.00 73.34 H new ATOM 0 HH11 ARG B 41 29.366 23.340 -9.870 1.00 73.10 H new ATOM 0 HH12 ARG B 41 30.756 23.325 -10.960 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.031 26.474 -12.369 1.00 72.43 H new ATOM 0 HH22 ARG B 41 31.131 25.092 -12.369 1.00 72.43 H new ATOM 2188 N SER B 42 22.567 23.125 -10.044 1.00 53.33 N ATOM 2189 CA SER B 42 21.619 22.448 -10.922 1.00 23.23 C ATOM 2190 C SER B 42 20.337 22.101 -10.172 1.00 3.44 C ATOM 2191 O SER B 42 20.297 22.122 -8.941 1.00 55.33 O ATOM 2192 CB SER B 42 22.245 21.177 -11.500 1.00 33.02 C ATOM 2193 OG SER B 42 22.167 21.169 -12.915 1.00 14.24 O ATOM 0 H SER B 42 22.524 22.829 -9.069 1.00 53.33 H new ATOM 0 HA SER B 42 21.370 23.126 -11.739 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.288 21.108 -11.190 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.734 20.301 -11.099 1.00 33.02 H new ATOM 0 HG SER B 42 22.575 20.348 -13.260 1.00 14.24 H new ATOM 2199 N THR B 43 19.287 21.781 -10.924 1.00 54.02 N ATOM 2200 CA THR B 43 18.003 21.429 -10.332 1.00 44.13 C ATOM 2201 C THR B 43 17.901 19.929 -10.089 1.00 62.42 C ATOM 2202 O THR B 43 17.918 19.122 -11.018 1.00 42.45 O ATOM 2203 CB THR B 43 16.831 21.873 -11.229 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.283 22.842 -12.181 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.703 22.461 -10.395 1.00 51.13 C ATOM 0 H THR B 43 19.302 21.759 -11.944 1.00 54.02 H new ATOM 0 HA THR B 43 17.941 21.953 -9.378 1.00 44.13 H new ATOM 0 HB THR B 43 16.453 20.996 -11.755 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.533 23.118 -12.748 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.887 22.767 -11.050 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.341 21.711 -9.692 1.00 51.13 H new ATOM 0 HG23 THR B 43 16.071 23.327 -9.845 1.00 51.13 H new ATOM 2213 N PRO B 44 17.792 19.542 -8.808 1.00 34.10 N ATOM 2214 CA PRO B 44 17.683 18.135 -8.413 1.00 64.22 C ATOM 2215 C PRO B 44 16.347 17.520 -8.815 1.00 65.12 C ATOM 2216 O PRO B 44 15.409 18.216 -9.206 1.00 43.23 O ATOM 2217 CB PRO B 44 17.812 18.183 -6.889 1.00 42.35 C ATOM 2218 CG PRO B 44 17.357 19.552 -6.514 1.00 43.14 C ATOM 2219 CD PRO B 44 17.764 20.449 -7.649 1.00 4.14 C ATOM 0 HA PRO B 44 18.437 17.517 -8.900 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.197 17.418 -6.415 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.840 18.007 -6.573 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.278 19.577 -6.365 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.816 19.873 -5.579 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.053 21.263 -7.793 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.738 20.904 -7.472 1.00 4.14 H new ATOM 2227 N PRO B 45 16.256 16.186 -8.718 1.00 22.42 N ATOM 2228 CA PRO B 45 15.037 15.449 -9.067 1.00 43.51 C ATOM 2229 C PRO B 45 13.906 15.696 -8.075 1.00 62.05 C ATOM 2230 O PRO B 45 14.056 16.465 -7.124 1.00 14.40 O ATOM 2231 CB PRO B 45 15.481 13.984 -9.016 1.00 65.34 C ATOM 2232 CG PRO B 45 16.639 13.972 -8.077 1.00 42.52 C ATOM 2233 CD PRO B 45 17.333 15.293 -8.260 1.00 44.51 C ATOM 0 HA PRO B 45 14.639 15.755 -10.034 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.677 13.339 -8.662 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.768 13.623 -10.003 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.305 13.846 -7.047 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.312 13.144 -8.298 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.778 15.645 -7.329 1.00 44.51 H new ATOM 0 HD3 PRO B 45 18.137 15.226 -8.992 1.00 44.51 H new ATOM 2241 N THR B 46 12.771 15.041 -8.302 1.00 11.44 N ATOM 2242 CA THR B 46 11.614 15.191 -7.428 1.00 63.42 C ATOM 2243 C THR B 46 11.622 14.146 -6.320 1.00 5.13 C ATOM 2244 O THR B 46 11.031 14.347 -5.259 1.00 4.01 O ATOM 2245 CB THR B 46 10.296 15.076 -8.218 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.304 15.988 -9.321 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.102 15.365 -7.321 1.00 3.02 C ATOM 0 H THR B 46 12.629 14.402 -9.084 1.00 11.44 H new ATOM 0 HA THR B 46 11.679 16.185 -6.985 1.00 63.42 H new ATOM 0 HB THR B 46 10.210 14.056 -8.593 1.00 52.33 H new ATOM 0 HG1 THR B 46 11.053 15.775 -9.916 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.183 15.278 -7.900 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.083 14.649 -6.499 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.184 16.375 -6.920 1.00 3.02 H new ATOM 2255 N ASP B 47 12.297 13.029 -6.571 1.00 1.43 N ATOM 2256 CA ASP B 47 12.385 11.952 -5.592 1.00 54.30 C ATOM 2257 C ASP B 47 13.332 12.325 -4.456 1.00 63.03 C ATOM 2258 O ASP B 47 13.068 12.029 -3.290 1.00 32.00 O ATOM 2259 CB ASP B 47 12.857 10.661 -6.263 1.00 61.00 C ATOM 2260 CG ASP B 47 12.288 9.422 -5.601 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.588 9.566 -4.577 1.00 53.32 O ATOM 2262 OD2 ASP B 47 12.544 8.308 -6.104 1.00 4.34 O ATOM 0 H ASP B 47 12.791 12.846 -7.444 1.00 1.43 H new ATOM 0 HA ASP B 47 11.391 11.793 -5.174 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.566 10.674 -7.313 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.946 10.617 -6.234 1.00 61.00 H new ATOM 2267 N VAL B 48 14.437 12.976 -4.803 1.00 74.22 N ATOM 2268 CA VAL B 48 15.425 13.390 -3.814 1.00 22.51 C ATOM 2269 C VAL B 48 14.962 14.635 -3.065 1.00 4.50 C ATOM 2270 O VAL B 48 15.106 14.728 -1.846 1.00 11.21 O ATOM 2271 CB VAL B 48 16.790 13.673 -4.466 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.788 14.164 -3.428 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.311 12.430 -5.171 1.00 54.21 C ATOM 0 H VAL B 48 14.671 13.229 -5.763 1.00 74.22 H new ATOM 0 HA VAL B 48 15.534 12.565 -3.110 1.00 22.51 H new ATOM 0 HB VAL B 48 16.661 14.459 -5.210 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.747 14.359 -3.909 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.417 15.082 -2.973 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.916 13.403 -2.658 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.277 12.648 -5.626 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.425 11.622 -4.448 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.605 12.128 -5.945 1.00 54.21 H new ATOM 2283 N MET B 49 14.409 15.591 -3.803 1.00 33.43 N ATOM 2284 CA MET B 49 13.924 16.831 -3.208 1.00 40.22 C ATOM 2285 C MET B 49 13.025 16.545 -2.010 1.00 4.22 C ATOM 2286 O MET B 49 13.183 17.146 -0.947 1.00 1.31 O ATOM 2287 CB MET B 49 13.161 17.657 -4.248 1.00 44.14 C ATOM 2288 CG MET B 49 12.522 18.911 -3.676 1.00 51.34 C ATOM 2289 SD MET B 49 10.741 18.971 -3.952 1.00 51.12 S ATOM 2290 CE MET B 49 10.155 17.940 -2.610 1.00 51.15 C ATOM 0 H MET B 49 14.285 15.531 -4.814 1.00 33.43 H new ATOM 0 HA MET B 49 14.787 17.401 -2.864 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.845 17.940 -5.048 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.386 17.036 -4.696 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.722 18.960 -2.606 1.00 51.34 H new ATOM 0 HG3 MET B 49 12.985 19.788 -4.127 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.150 18.250 -2.325 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.136 16.899 -2.933 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.822 18.042 -1.754 1.00 51.15 H new ATOM 2300 N MET B 50 12.083 15.625 -2.189 1.00 73.41 N ATOM 2301 CA MET B 50 11.161 15.259 -1.121 1.00 53.21 C ATOM 2302 C MET B 50 11.880 14.480 -0.023 1.00 3.12 C ATOM 2303 O MET B 50 11.457 14.483 1.132 1.00 20.05 O ATOM 2304 CB MET B 50 10.004 14.427 -1.679 1.00 34.20 C ATOM 2305 CG MET B 50 10.441 13.091 -2.258 1.00 34.23 C ATOM 2306 SD MET B 50 9.134 11.851 -2.207 1.00 14.43 S ATOM 2307 CE MET B 50 7.714 12.837 -2.675 1.00 65.11 C ATOM 0 H MET B 50 11.938 15.120 -3.063 1.00 73.41 H new ATOM 0 HA MET B 50 10.763 16.177 -0.689 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.278 14.250 -0.885 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.495 15.001 -2.454 1.00 34.20 H new ATOM 0 HG2 MET B 50 10.761 13.234 -3.290 1.00 34.23 H new ATOM 0 HG3 MET B 50 11.306 12.725 -1.704 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.867 12.182 -2.879 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.459 13.517 -1.862 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.950 13.414 -3.569 1.00 65.11 H new ATOM 2317 N ASN B 51 12.969 13.815 -0.393 1.00 10.42 N ATOM 2318 CA ASN B 51 13.746 13.030 0.559 1.00 73.03 C ATOM 2319 C ASN B 51 14.487 13.940 1.535 1.00 51.31 C ATOM 2320 O ASN B 51 15.011 13.480 2.551 1.00 61.22 O ATOM 2321 CB ASN B 51 14.743 12.135 -0.179 1.00 41.34 C ATOM 2322 CG ASN B 51 14.228 10.720 -0.358 1.00 53.40 C ATOM 2323 OD1 ASN B 51 13.646 10.139 0.558 1.00 40.12 O ATOM 2324 ND2 ASN B 51 14.439 10.160 -1.544 1.00 25.24 N ATOM 0 H ASN B 51 13.334 13.804 -1.346 1.00 10.42 H new ATOM 0 HA ASN B 51 13.057 12.403 1.125 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.960 12.566 -1.156 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.682 12.110 0.373 1.00 41.34 H new ATOM 0 HD21 ASN B 51 14.114 9.210 -1.725 1.00 25.24 H new ATOM 0 HD22 ASN B 51 14.926 10.680 -2.274 1.00 25.24 H new ATOM 2331 N ILE B 52 14.525 15.230 1.221 1.00 15.14 N ATOM 2332 CA ILE B 52 15.199 16.203 2.071 1.00 71.33 C ATOM 2333 C ILE B 52 14.213 16.894 3.006 1.00 63.34 C ATOM 2334 O ILE B 52 14.574 17.316 4.106 1.00 22.32 O ATOM 2335 CB ILE B 52 15.930 17.270 1.235 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.780 16.606 0.150 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.794 18.145 2.131 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.477 15.346 0.615 1.00 3.43 C ATOM 0 H ILE B 52 14.097 15.626 0.384 1.00 15.14 H new ATOM 0 HA ILE B 52 15.930 15.652 2.662 1.00 71.33 H new ATOM 0 HB ILE B 52 15.186 17.903 0.751 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.144 16.366 -0.702 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.528 17.317 -0.200 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.304 18.894 1.525 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.165 18.642 2.870 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.533 17.526 2.641 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.061 14.929 -0.206 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.139 15.583 1.448 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.734 14.617 0.938 1.00 3.43 H new ATOM 2350 N LEU B 53 12.965 17.003 2.564 1.00 63.51 N ATOM 2351 CA LEU B 53 11.923 17.642 3.362 1.00 30.02 C ATOM 2352 C LEU B 53 11.159 16.609 4.184 1.00 3.01 C ATOM 2353 O LEU B 53 10.638 16.918 5.256 1.00 32.54 O ATOM 2354 CB LEU B 53 10.957 18.407 2.457 1.00 71.32 C ATOM 2355 CG LEU B 53 11.085 19.931 2.474 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.541 20.346 2.338 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.246 20.549 1.366 1.00 70.41 C ATOM 0 H LEU B 53 12.649 16.657 1.658 1.00 63.51 H new ATOM 0 HA LEU B 53 12.401 18.343 4.046 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.100 18.062 1.433 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.938 18.145 2.743 1.00 71.32 H new ATOM 0 HG LEU B 53 10.713 20.297 3.431 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.612 21.434 2.352 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.116 19.934 3.167 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.941 19.968 1.397 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.349 21.634 1.393 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.587 20.176 0.400 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.199 20.280 1.509 1.00 70.41 H new ATOM 2369 N GLN B 54 11.098 15.383 3.676 1.00 45.30 N ATOM 2370 CA GLN B 54 10.397 14.305 4.365 1.00 4.44 C ATOM 2371 C GLN B 54 11.041 14.015 5.717 1.00 73.55 C ATOM 2372 O GLN B 54 10.436 13.376 6.580 1.00 22.03 O ATOM 2373 CB GLN B 54 10.395 13.039 3.506 1.00 31.43 C ATOM 2374 CG GLN B 54 11.752 12.360 3.419 1.00 54.24 C ATOM 2375 CD GLN B 54 11.699 11.042 2.671 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.272 10.043 3.108 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.010 11.032 1.537 1.00 32.34 N ATOM 0 H GLN B 54 11.525 15.111 2.791 1.00 45.30 H new ATOM 0 HA GLN B 54 9.368 14.623 4.533 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.671 12.334 3.915 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.060 13.293 2.500 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.456 13.027 2.922 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.133 12.187 4.426 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.551 11.883 1.212 1.00 32.34 H new ATOM 0 HE22 GLN B 54 10.940 10.174 0.991 1.00 32.34 H new ATOM 2386 N THR B 55 12.270 14.488 5.895 1.00 55.12 N ATOM 2387 CA THR B 55 12.996 14.278 7.142 1.00 13.51 C ATOM 2388 C THR B 55 12.257 14.901 8.320 1.00 42.11 C ATOM 2389 O THR B 55 11.497 15.859 8.171 1.00 72.25 O ATOM 2390 CB THR B 55 14.417 14.869 7.071 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.387 16.137 6.405 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.358 13.928 6.336 1.00 63.21 C ATOM 0 H THR B 55 12.784 15.019 5.192 1.00 55.12 H new ATOM 0 HA THR B 55 13.066 13.200 7.290 1.00 13.51 H new ATOM 0 HB THR B 55 14.783 15.002 8.089 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.523 16.005 5.444 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.355 14.367 6.298 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.401 12.973 6.860 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.994 13.768 5.321 1.00 63.21 H new ATOM 2400 N PRO B 56 12.483 14.348 9.521 1.00 31.25 N ATOM 2401 CA PRO B 56 11.848 14.835 10.749 1.00 41.22 C ATOM 2402 C PRO B 56 12.374 16.203 11.170 1.00 3.50 C ATOM 2403 O PRO B 56 11.660 16.987 11.794 1.00 61.54 O ATOM 2404 CB PRO B 56 12.223 13.775 11.787 1.00 43.23 C ATOM 2405 CG PRO B 56 13.483 13.169 11.271 1.00 22.11 C ATOM 2406 CD PRO B 56 13.377 13.204 9.772 1.00 60.25 C ATOM 0 HA PRO B 56 10.773 14.969 10.627 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.371 14.220 12.771 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.437 13.027 11.891 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.354 13.728 11.614 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.600 12.146 11.630 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.351 13.344 9.303 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.964 12.276 9.376 1.00 60.25 H new ATOM 2414 N GLN B 57 13.628 16.481 10.826 1.00 42.31 N ATOM 2415 CA GLN B 57 14.249 17.755 11.170 1.00 55.32 C ATOM 2416 C GLN B 57 13.686 18.884 10.312 1.00 1.51 C ATOM 2417 O GLN B 57 13.513 20.008 10.784 1.00 23.51 O ATOM 2418 CB GLN B 57 15.766 17.671 10.992 1.00 61.00 C ATOM 2419 CG GLN B 57 16.468 19.014 11.111 1.00 72.54 C ATOM 2420 CD GLN B 57 16.069 19.771 12.363 1.00 74.05 C ATOM 2421 OE1 GLN B 57 15.624 20.917 12.294 1.00 63.42 O ATOM 2422 NE2 GLN B 57 16.227 19.133 13.516 1.00 41.13 N ATOM 0 H GLN B 57 14.233 15.842 10.310 1.00 42.31 H new ATOM 0 HA GLN B 57 14.024 17.970 12.215 1.00 55.32 H new ATOM 0 HB2 GLN B 57 16.174 16.990 11.739 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.986 17.241 10.015 1.00 61.00 H new ATOM 0 HG2 GLN B 57 17.547 18.857 11.114 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.236 19.620 10.235 1.00 72.54 H new ATOM 0 HE21 GLN B 57 16.599 18.183 13.527 1.00 41.13 H new ATOM 0 HE22 GLN B 57 15.976 19.592 14.392 1.00 41.13 H new ATOM 2431 N PHE B 58 13.403 18.577 9.051 1.00 72.25 N ATOM 2432 CA PHE B 58 12.861 19.567 8.127 1.00 73.52 C ATOM 2433 C PHE B 58 11.412 19.245 7.773 1.00 1.21 C ATOM 2434 O PHE B 58 11.030 19.250 6.602 1.00 54.13 O ATOM 2435 CB PHE B 58 13.708 19.624 6.854 1.00 21.34 C ATOM 2436 CG PHE B 58 15.163 19.891 7.113 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.642 21.189 7.181 1.00 54.32 C ATOM 2438 CD2 PHE B 58 16.052 18.843 7.289 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.980 21.437 7.418 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.392 19.085 7.528 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.857 20.383 7.593 1.00 13.33 C ATOM 0 H PHE B 58 13.540 17.651 8.645 1.00 72.25 H new ATOM 0 HA PHE B 58 12.889 20.540 8.618 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.610 18.679 6.319 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.315 20.403 6.200 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.961 22.017 7.047 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.694 17.825 7.239 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.341 22.454 7.467 1.00 23.24 H new ATOM 0 HE2 PHE B 58 18.074 18.259 7.664 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.903 20.575 7.780 1.00 13.33 H new ATOM 2451 N THR B 59 10.608 18.965 8.794 1.00 3.42 N ATOM 2452 CA THR B 59 9.202 18.638 8.593 1.00 32.14 C ATOM 2453 C THR B 59 8.342 19.897 8.583 1.00 21.44 C ATOM 2454 O THR B 59 7.357 19.982 7.850 1.00 24.22 O ATOM 2455 CB THR B 59 8.685 17.685 9.686 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.315 17.349 9.436 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.813 18.320 11.063 1.00 63.52 C ATOM 0 H THR B 59 10.907 18.958 9.769 1.00 3.42 H new ATOM 0 HA THR B 59 9.127 18.142 7.625 1.00 32.14 H new ATOM 0 HB THR B 59 9.291 16.779 9.663 1.00 53.35 H new ATOM 0 HG1 THR B 59 6.994 16.741 10.135 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.441 17.628 11.819 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.860 18.548 11.263 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.229 19.240 11.095 1.00 63.52 H new ATOM 2465 N LYS B 60 8.720 20.872 9.403 1.00 13.34 N ATOM 2466 CA LYS B 60 7.984 22.128 9.488 1.00 2.41 C ATOM 2467 C LYS B 60 8.248 22.998 8.262 1.00 33.42 C ATOM 2468 O LYS B 60 7.501 23.935 7.982 1.00 21.23 O ATOM 2469 CB LYS B 60 8.375 22.888 10.758 1.00 14.22 C ATOM 2470 CG LYS B 60 9.866 23.151 10.874 1.00 61.42 C ATOM 2471 CD LYS B 60 10.215 23.807 12.200 1.00 54.34 C ATOM 2472 CE LYS B 60 11.356 23.083 12.897 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.744 23.754 14.168 1.00 31.11 N ATOM 0 H LYS B 60 9.532 20.816 10.018 1.00 13.34 H new ATOM 0 HA LYS B 60 6.920 21.894 9.524 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.844 23.840 10.780 1.00 14.22 H new ATOM 0 HB3 LYS B 60 8.046 22.319 11.628 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.411 22.212 10.777 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.188 23.792 10.054 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.493 24.847 12.030 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.337 23.813 12.846 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.061 22.055 13.105 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.218 23.039 12.232 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.525 23.230 14.613 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 12.050 24.727 13.967 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 10.929 23.774 14.813 1.00 31.11 H new ATOM 2487 N TYR B 61 9.313 22.679 7.535 1.00 63.31 N ATOM 2488 CA TYR B 61 9.676 23.432 6.340 1.00 12.35 C ATOM 2489 C TYR B 61 9.405 22.617 5.079 1.00 43.03 C ATOM 2490 O TYR B 61 10.319 22.317 4.310 1.00 15.42 O ATOM 2491 CB TYR B 61 11.150 23.835 6.394 1.00 51.41 C ATOM 2492 CG TYR B 61 11.621 24.226 7.776 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.289 25.460 8.322 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.400 23.363 8.537 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.717 25.821 9.585 1.00 72.43 C ATOM 2496 CE2 TYR B 61 12.832 23.715 9.800 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.488 24.946 10.319 1.00 62.03 C ATOM 2498 OH TYR B 61 12.918 25.301 11.578 1.00 73.32 O ATOM 0 H TYR B 61 9.940 21.904 7.752 1.00 63.31 H new ATOM 0 HA TYR B 61 9.062 24.332 6.308 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.758 23.005 6.033 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.315 24.670 5.713 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.686 26.149 7.749 1.00 24.22 H new ATOM 0 HD2 TYR B 61 12.672 22.399 8.133 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.449 26.784 9.995 1.00 72.43 H new ATOM 0 HE2 TYR B 61 13.435 23.031 10.378 1.00 20.34 H new ATOM 0 HH TYR B 61 12.407 26.076 11.892 1.00 73.32 H new ATOM 2508 N THR B 62 8.141 22.259 4.873 1.00 34.42 N ATOM 2509 CA THR B 62 7.748 21.478 3.708 1.00 72.42 C ATOM 2510 C THR B 62 7.228 22.379 2.593 1.00 31.24 C ATOM 2511 O THR B 62 7.856 22.508 1.540 1.00 31.52 O ATOM 2512 CB THR B 62 6.664 20.444 4.064 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.418 20.459 5.474 1.00 23.01 O ATOM 2514 CG2 THR B 62 7.087 19.047 3.633 1.00 4.41 C ATOM 0 H THR B 62 7.372 22.498 5.499 1.00 34.42 H new ATOM 0 HA THR B 62 8.639 20.954 3.363 1.00 72.42 H new ATOM 0 HB THR B 62 5.750 20.710 3.533 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.218 20.152 5.949 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.306 18.333 3.895 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.246 19.031 2.555 1.00 4.41 H new ATOM 0 HG23 THR B 62 8.012 18.774 4.140 1.00 4.41 H new ATOM 2522 N LEU B 63 6.078 23.001 2.828 1.00 12.13 N ATOM 2523 CA LEU B 63 5.473 23.890 1.844 1.00 1.11 C ATOM 2524 C LEU B 63 5.616 25.349 2.267 1.00 22.24 C ATOM 2525 O LEU B 63 5.162 26.256 1.569 1.00 42.13 O ATOM 2526 CB LEU B 63 3.994 23.545 1.656 1.00 73.21 C ATOM 2527 CG LEU B 63 3.013 24.274 2.573 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.390 25.461 1.854 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.934 23.321 3.064 1.00 54.43 C ATOM 0 H LEU B 63 5.546 22.906 3.693 1.00 12.13 H new ATOM 0 HA LEU B 63 5.995 23.752 0.897 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.721 23.758 0.622 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.870 22.472 1.804 1.00 73.21 H new ATOM 0 HG LEU B 63 3.563 24.647 3.437 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.694 25.967 2.523 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.174 26.156 1.552 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.855 25.112 0.971 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.244 23.857 3.716 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.388 22.919 2.211 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.395 22.503 3.618 1.00 54.43 H new ATOM 2541 N TRP B 64 6.251 25.567 3.412 1.00 1.21 N ATOM 2542 CA TRP B 64 6.456 26.916 3.928 1.00 43.23 C ATOM 2543 C TRP B 64 7.078 27.815 2.865 1.00 72.02 C ATOM 2544 O TRP B 64 6.907 29.035 2.893 1.00 64.33 O ATOM 2545 CB TRP B 64 7.350 26.880 5.169 1.00 62.22 C ATOM 2546 CG TRP B 64 8.788 27.184 4.875 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.495 28.276 5.289 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.692 26.387 4.103 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.784 28.206 4.820 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.931 27.057 4.091 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.576 25.172 3.422 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 12.043 26.550 3.422 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.680 24.672 2.759 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.901 25.360 2.764 1.00 30.42 C ATOM 0 H TRP B 64 6.633 24.827 4.001 1.00 1.21 H new ATOM 0 HA TRP B 64 5.484 27.325 4.202 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.976 27.599 5.898 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.281 25.894 5.629 1.00 62.22 H new ATOM 0 HD1 TRP B 64 9.099 29.077 5.896 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.514 28.898 4.988 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.640 24.634 3.414 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.985 27.079 3.423 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.601 23.735 2.228 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.746 24.942 2.238 1.00 30.42 H new ATOM 2565 N PHE B 65 7.800 27.208 1.929 1.00 3.22 N ATOM 2566 CA PHE B 65 8.447 27.955 0.857 1.00 51.24 C ATOM 2567 C PHE B 65 7.983 27.459 -0.509 1.00 44.13 C ATOM 2568 O PHE B 65 7.933 28.221 -1.474 1.00 61.53 O ATOM 2569 CB PHE B 65 9.968 27.832 0.968 1.00 33.14 C ATOM 2570 CG PHE B 65 10.637 29.083 1.462 1.00 11.11 C ATOM 2571 CD1 PHE B 65 10.039 29.865 2.436 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.863 29.477 0.949 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.652 31.017 2.893 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.480 30.628 1.402 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.874 31.399 2.374 1.00 1.24 C ATOM 0 H PHE B 65 7.952 26.200 1.891 1.00 3.22 H new ATOM 0 HA PHE B 65 8.166 29.003 0.957 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.210 27.010 1.642 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.376 27.573 -0.009 1.00 33.14 H new ATOM 0 HD1 PHE B 65 9.083 29.572 2.843 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.341 28.879 0.188 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.176 31.617 3.654 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.436 30.924 0.996 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.354 32.299 2.728 1.00 1.24 H new ATOM 2585 N MET B 66 7.646 26.175 -0.582 1.00 55.55 N ATOM 2586 CA MET B 66 7.185 25.577 -1.830 1.00 63.34 C ATOM 2587 C MET B 66 6.039 26.385 -2.430 1.00 2.10 C ATOM 2588 O MET B 66 5.852 26.409 -3.647 1.00 23.20 O ATOM 2589 CB MET B 66 6.737 24.133 -1.593 1.00 52.14 C ATOM 2590 CG MET B 66 7.118 23.186 -2.720 1.00 45.22 C ATOM 2591 SD MET B 66 5.747 22.135 -3.236 1.00 33.32 S ATOM 2592 CE MET B 66 4.695 23.329 -4.057 1.00 54.53 C ATOM 0 H MET B 66 7.683 25.530 0.207 1.00 55.55 H new ATOM 0 HA MET B 66 8.017 25.581 -2.535 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.176 23.773 -0.663 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.655 24.114 -1.463 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.468 23.766 -3.574 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.950 22.560 -2.398 1.00 45.22 H new ATOM 0 HE1 MET B 66 4.340 22.913 -5.000 1.00 54.53 H new ATOM 0 HE2 MET B 66 3.842 23.562 -3.419 1.00 54.53 H new ATOM 0 HE3 MET B 66 5.262 24.239 -4.252 1.00 54.53 H new ATOM 2602 N THR B 67 5.272 27.047 -1.569 1.00 4.01 N ATOM 2603 CA THR B 67 4.144 27.855 -2.014 1.00 64.01 C ATOM 2604 C THR B 67 4.090 29.183 -1.268 1.00 4.11 C ATOM 2605 O THR B 67 3.121 29.930 -1.382 1.00 25.32 O ATOM 2606 CB THR B 67 2.809 27.112 -1.815 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.949 25.739 -2.195 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.703 27.760 -2.634 1.00 73.01 C ATOM 0 H THR B 67 5.412 27.039 -0.559 1.00 4.01 H new ATOM 0 HA THR B 67 4.291 28.045 -3.077 1.00 64.01 H new ATOM 0 HB THR B 67 2.541 27.170 -0.760 1.00 50.32 H new ATOM 0 HG1 THR B 67 2.096 25.275 -2.064 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.770 27.219 -2.478 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.578 28.797 -2.321 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.968 27.730 -3.691 1.00 73.01 H new ATOM 2616 N ASN B 68 5.140 29.470 -0.504 1.00 11.41 N ATOM 2617 CA ASN B 68 5.212 30.710 0.260 1.00 74.22 C ATOM 2618 C ASN B 68 4.039 30.821 1.229 1.00 14.40 C ATOM 2619 O ASN B 68 3.454 31.892 1.390 1.00 0.14 O ATOM 2620 CB ASN B 68 5.225 31.915 -0.682 1.00 72.14 C ATOM 2621 CG ASN B 68 6.176 31.727 -1.849 1.00 24.42 C ATOM 2622 OD1 ASN B 68 5.809 31.160 -2.878 1.00 31.00 O ATOM 2623 ND2 ASN B 68 7.407 32.202 -1.692 1.00 25.24 N ATOM 0 H ASN B 68 5.951 28.861 -0.398 1.00 11.41 H new ATOM 0 HA ASN B 68 6.137 30.698 0.836 1.00 74.22 H new ATOM 0 HB2 ASN B 68 4.218 32.087 -1.062 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.511 32.806 -0.124 1.00 72.14 H new ATOM 0 HD21 ASN B 68 8.091 32.103 -2.442 1.00 25.24 H new ATOM 0 HD22 ASN B 68 7.668 32.665 -0.821 1.00 25.24 H new ATOM 2630 N GLN B 69 3.700 29.706 1.869 1.00 42.21 N ATOM 2631 CA GLN B 69 2.596 29.678 2.822 1.00 70.13 C ATOM 2632 C GLN B 69 2.964 28.864 4.058 1.00 10.34 C ATOM 2633 O GLN B 69 3.165 27.652 3.977 1.00 41.40 O ATOM 2634 CB GLN B 69 1.344 29.095 2.166 1.00 35.41 C ATOM 2635 CG GLN B 69 0.052 29.491 2.862 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.475 30.834 2.395 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -0.946 30.972 1.265 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.399 31.835 3.265 1.00 14.11 N ATOM 0 H GLN B 69 4.173 28.811 1.745 1.00 42.21 H new ATOM 0 HA GLN B 69 2.391 30.702 3.133 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.302 29.422 1.127 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.422 28.008 2.155 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.703 28.726 2.681 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.219 29.525 3.939 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.001 31.677 4.191 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.738 32.762 3.007 1.00 14.11 H new ATOM 2647 N ILE B 70 3.050 29.537 5.199 1.00 24.34 N ATOM 2648 CA ILE B 70 3.392 28.875 6.452 1.00 24.43 C ATOM 2649 C ILE B 70 2.163 28.242 7.093 1.00 41.10 C ATOM 2650 O ILE B 70 1.141 28.900 7.286 1.00 43.13 O ATOM 2651 CB ILE B 70 4.030 29.858 7.452 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.115 31.065 7.667 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.398 30.304 6.957 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.579 31.173 9.078 1.00 23.21 C ATOM 0 H ILE B 70 2.888 30.541 5.283 1.00 24.34 H new ATOM 0 HA ILE B 70 4.114 28.095 6.210 1.00 24.43 H new ATOM 0 HB ILE B 70 4.160 29.349 8.407 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.664 31.975 7.425 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.277 31.004 6.972 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.836 30.998 7.674 1.00 40.03 H new ATOM 0 HG22 ILE B 70 6.047 29.435 6.850 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.292 30.799 5.992 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.938 32.051 9.158 1.00 23.21 H new ATOM 0 HD12 ILE B 70 2.002 30.280 9.317 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.410 31.266 9.777 1.00 23.21 H new ATOM 2666 N ALA B 71 2.269 26.959 7.423 1.00 31.41 N ATOM 2667 CA ALA B 71 1.167 26.237 8.047 1.00 42.14 C ATOM 2668 C ALA B 71 1.510 25.844 9.480 1.00 13.21 C ATOM 2669 O ALA B 71 1.774 24.680 9.783 1.00 44.11 O ATOM 2670 CB ALA B 71 0.815 25.003 7.229 1.00 21.42 C ATOM 0 H ALA B 71 3.107 26.398 7.269 1.00 31.41 H new ATOM 0 HA ALA B 71 0.302 26.899 8.077 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.009 24.473 7.706 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.519 25.305 6.224 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.683 24.346 7.170 1.00 21.42 H new ATOM 2676 N PRO B 72 1.504 26.835 10.384 1.00 64.10 N ATOM 2677 CA PRO B 72 1.812 26.616 11.800 1.00 11.04 C ATOM 2678 C PRO B 72 0.722 25.827 12.515 1.00 33.42 C ATOM 2679 O PRO B 72 0.974 25.188 13.536 1.00 25.43 O ATOM 2680 CB PRO B 72 1.904 28.035 12.366 1.00 2.43 C ATOM 2681 CG PRO B 72 1.060 28.861 11.457 1.00 51.11 C ATOM 2682 CD PRO B 72 1.197 28.245 10.092 1.00 31.23 C ATOM 0 HA PRO B 72 2.721 26.029 11.934 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.538 28.076 13.392 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.935 28.389 12.380 1.00 2.43 H new ATOM 0 HG2 PRO B 72 0.020 28.861 11.783 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.392 29.899 11.452 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.279 28.345 9.512 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.992 28.718 9.515 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.491 25.875 11.973 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.620 25.164 12.561 1.00 61.34 C ATOM 2692 C GLU B 73 -1.323 23.672 12.674 1.00 54.44 C ATOM 2693 O GLU B 73 -1.909 22.972 13.500 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.881 25.383 11.723 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.180 26.847 11.445 1.00 64.33 C ATOM 2696 CD GLU B 73 -3.034 27.717 12.677 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.874 27.594 13.594 1.00 41.10 O ATOM 2698 OE2 GLU B 73 -2.080 28.521 12.726 1.00 33.02 O ATOM 0 H GLU B 73 -0.717 26.399 11.128 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.785 25.561 13.563 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.773 24.856 10.775 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.732 24.939 12.239 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.508 27.210 10.667 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.195 26.939 11.058 1.00 64.33 H new ATOM 2705 N SER B 74 -0.409 23.191 11.836 1.00 3.13 N ATOM 2706 CA SER B 74 -0.038 21.781 11.839 1.00 54.43 C ATOM 2707 C SER B 74 1.394 21.597 12.334 1.00 41.34 C ATOM 2708 O SER B 74 1.753 20.539 12.850 1.00 62.25 O ATOM 2709 CB SER B 74 -0.183 21.192 10.434 1.00 12.33 C ATOM 2710 OG SER B 74 -1.295 21.752 9.758 1.00 21.43 O ATOM 0 H SER B 74 0.087 23.757 11.147 1.00 3.13 H new ATOM 0 HA SER B 74 -0.709 21.255 12.518 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.726 21.379 9.862 1.00 12.33 H new ATOM 0 HB3 SER B 74 -0.301 20.110 10.500 1.00 12.33 H new ATOM 0 HG SER B 74 -0.988 22.215 8.950 1.00 21.43 H new ATOM 2716 N GLY B 75 2.207 22.637 12.175 1.00 32.12 N ATOM 2717 CA GLY B 75 3.589 22.571 12.610 1.00 40.12 C ATOM 2718 C GLY B 75 4.563 22.920 11.504 1.00 61.53 C ATOM 2719 O GLY B 75 5.610 22.286 11.367 1.00 74.03 O ATOM 0 H GLY B 75 1.933 23.524 11.753 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.736 23.253 13.447 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.804 21.567 12.975 1.00 40.12 H new ATOM 2723 N GLN B 76 4.218 23.929 10.709 1.00 5.14 N ATOM 2724 CA GLN B 76 5.071 24.358 9.607 1.00 30.43 C ATOM 2725 C GLN B 76 5.258 25.872 9.621 1.00 1.04 C ATOM 2726 O GLN B 76 4.295 26.627 9.487 1.00 20.13 O ATOM 2727 CB GLN B 76 4.470 23.920 8.270 1.00 34.10 C ATOM 2728 CG GLN B 76 4.781 22.477 7.907 1.00 32.22 C ATOM 2729 CD GLN B 76 4.151 21.486 8.865 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.091 21.745 9.438 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.800 20.341 9.045 1.00 72.22 N ATOM 0 H GLN B 76 3.355 24.464 10.808 1.00 5.14 H new ATOM 0 HA GLN B 76 6.047 23.888 9.731 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.389 24.052 8.307 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.844 24.573 7.482 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.426 22.276 6.896 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.861 22.333 7.900 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.675 20.168 8.550 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.423 19.635 9.678 1.00 72.22 H new ATOM 2740 N ILE B 77 6.503 26.307 9.785 1.00 41.52 N ATOM 2741 CA ILE B 77 6.816 27.730 9.818 1.00 50.31 C ATOM 2742 C ILE B 77 8.159 28.012 9.153 1.00 5.22 C ATOM 2743 O ILE B 77 8.884 27.091 8.779 1.00 61.33 O ATOM 2744 CB ILE B 77 6.846 28.268 11.260 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.167 27.899 11.938 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.667 27.723 12.054 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.425 26.409 11.987 1.00 2.32 C ATOM 0 H ILE B 77 7.311 25.694 9.897 1.00 41.52 H new ATOM 0 HA ILE B 77 6.026 28.240 9.267 1.00 50.31 H new ATOM 0 HB ILE B 77 6.766 29.355 11.228 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.986 28.384 11.408 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.167 28.293 12.954 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.702 28.113 13.071 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.735 28.031 11.580 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.718 26.635 12.080 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.378 26.221 12.481 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.625 25.919 12.543 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.457 26.012 10.972 1.00 2.32 H new ATOM 2759 N ALA B 78 8.486 29.292 9.011 1.00 60.23 N ATOM 2760 CA ALA B 78 9.744 29.696 8.396 1.00 30.33 C ATOM 2761 C ALA B 78 10.827 29.905 9.449 1.00 42.43 C ATOM 2762 O ALA B 78 10.577 30.417 10.540 1.00 1.45 O ATOM 2763 CB ALA B 78 9.549 30.965 7.579 1.00 22.31 C ATOM 0 H ALA B 78 7.897 30.067 9.314 1.00 60.23 H new ATOM 0 HA ALA B 78 10.069 28.895 7.732 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.497 31.255 7.126 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.812 30.784 6.796 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.198 31.766 8.229 1.00 22.31 H new ATOM 2769 N PRO B 79 12.062 29.498 9.116 1.00 54.52 N ATOM 2770 CA PRO B 79 13.209 29.630 10.020 1.00 53.33 C ATOM 2771 C PRO B 79 13.632 31.083 10.211 1.00 52.42 C ATOM 2772 O PRO B 79 12.929 32.003 9.797 1.00 11.10 O ATOM 2773 CB PRO B 79 14.311 28.840 9.312 1.00 0.21 C ATOM 2774 CG PRO B 79 13.937 28.876 7.870 1.00 1.12 C ATOM 2775 CD PRO B 79 12.433 28.878 7.834 1.00 63.55 C ATOM 0 HA PRO B 79 12.983 29.266 11.022 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.290 29.290 9.478 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.364 27.816 9.682 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.341 29.764 7.384 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.339 28.012 7.340 1.00 1.12 H new ATOM 0 HD2 PRO B 79 12.052 29.448 6.987 1.00 63.55 H new ATOM 0 HD3 PRO B 79 12.032 27.868 7.745 1.00 63.55 H new ATOM 2783 N ALA B 80 14.786 31.279 10.841 1.00 25.42 N ATOM 2784 CA ALA B 80 15.304 32.620 11.084 1.00 0.54 C ATOM 2785 C ALA B 80 15.989 33.177 9.841 1.00 35.22 C ATOM 2786 O ALA B 80 15.823 34.350 9.500 1.00 62.14 O ATOM 2787 CB ALA B 80 16.269 32.607 12.259 1.00 73.13 C ATOM 0 H ALA B 80 15.379 30.527 11.192 1.00 25.42 H new ATOM 0 HA ALA B 80 14.463 33.270 11.325 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.648 33.615 12.429 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.750 32.259 13.152 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.101 31.938 12.039 1.00 73.13 H new ATOM 2793 N LEU B 81 16.760 32.332 9.166 1.00 30.02 N ATOM 2794 CA LEU B 81 17.471 32.740 7.959 1.00 34.04 C ATOM 2795 C LEU B 81 16.495 33.033 6.825 1.00 42.43 C ATOM 2796 O LEU B 81 16.744 33.899 5.986 1.00 23.42 O ATOM 2797 CB LEU B 81 18.456 31.652 7.532 1.00 64.45 C ATOM 2798 CG LEU B 81 19.595 31.356 8.508 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.391 30.003 9.172 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.937 31.403 7.791 1.00 62.22 C ATOM 0 H LEU B 81 16.909 31.359 9.434 1.00 30.02 H new ATOM 0 HA LEU B 81 18.023 33.653 8.183 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.898 30.730 7.366 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.890 31.939 6.574 1.00 64.45 H new ATOM 0 HG LEU B 81 19.592 32.122 9.283 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.211 29.810 9.863 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.448 30.005 9.719 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.367 29.224 8.410 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.736 31.190 8.501 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.951 30.658 6.995 1.00 62.22 H new ATOM 0 HD23 LEU B 81 21.086 32.394 7.363 1.00 62.22 H new ATOM 2812 N ALA B 82 15.381 32.308 6.807 1.00 60.51 N ATOM 2813 CA ALA B 82 14.366 32.492 5.778 1.00 44.45 C ATOM 2814 C ALA B 82 13.975 33.961 5.650 1.00 20.32 C ATOM 2815 O ALA B 82 14.102 34.557 4.580 1.00 2.23 O ATOM 2816 CB ALA B 82 13.142 31.644 6.086 1.00 40.20 C ATOM 0 H ALA B 82 15.159 31.588 7.494 1.00 60.51 H new ATOM 0 HA ALA B 82 14.787 32.170 4.826 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.392 31.792 5.309 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.427 30.592 6.120 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.728 31.939 7.050 1.00 40.20 H new ATOM 2822 N HIS B 83 13.498 34.539 6.747 1.00 22.34 N ATOM 2823 CA HIS B 83 13.088 35.939 6.758 1.00 63.42 C ATOM 2824 C HIS B 83 11.908 36.166 5.817 1.00 41.50 C ATOM 2825 O HIS B 83 11.642 37.294 5.399 1.00 61.44 O ATOM 2826 CB HIS B 83 14.256 36.838 6.354 1.00 44.31 C ATOM 2827 CG HIS B 83 14.760 37.703 7.469 1.00 73.22 C ATOM 2828 ND1 HIS B 83 14.106 38.839 7.894 1.00 55.33 N ATOM 2829 CD2 HIS B 83 15.860 37.589 8.249 1.00 3.54 C ATOM 2830 CE1 HIS B 83 14.783 39.390 8.885 1.00 61.52 C ATOM 2831 NE2 HIS B 83 15.852 38.651 9.121 1.00 31.24 N ATOM 0 H HIS B 83 13.386 34.060 7.640 1.00 22.34 H new ATOM 0 HA HIS B 83 12.778 36.193 7.771 1.00 63.42 H new ATOM 0 HB2 HIS B 83 15.074 36.216 5.990 1.00 44.31 H new ATOM 0 HB3 HIS B 83 13.945 37.473 5.525 1.00 44.31 H new ATOM 0 HD2 HIS B 83 16.605 36.809 8.196 1.00 3.54 H new ATOM 0 HE1 HIS B 83 14.509 40.292 9.413 1.00 61.52 H new ATOM 0 HE2 HIS B 83 16.557 38.838 9.834 1.00 31.24 H new ATOM 2839 N PHE B 84 11.203 35.089 5.488 1.00 53.42 N ATOM 2840 CA PHE B 84 10.053 35.170 4.595 1.00 42.43 C ATOM 2841 C PHE B 84 8.760 34.860 5.344 1.00 52.55 C ATOM 2842 O PHE B 84 8.755 34.732 6.568 1.00 52.41 O ATOM 2843 CB PHE B 84 10.221 34.202 3.422 1.00 71.00 C ATOM 2844 CG PHE B 84 10.280 34.884 2.085 1.00 12.12 C ATOM 2845 CD1 PHE B 84 11.226 35.864 1.834 1.00 2.13 C ATOM 2846 CD2 PHE B 84 9.388 34.545 1.080 1.00 61.02 C ATOM 2847 CE1 PHE B 84 11.283 36.493 0.604 1.00 63.12 C ATOM 2848 CE2 PHE B 84 9.440 35.171 -0.151 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.389 36.147 -0.389 1.00 4.43 C ATOM 0 H PHE B 84 11.408 34.149 5.827 1.00 53.42 H new ATOM 0 HA PHE B 84 9.995 36.188 4.211 1.00 42.43 H new ATOM 0 HB2 PHE B 84 11.134 33.624 3.566 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.392 33.495 3.424 1.00 71.00 H new ATOM 0 HD1 PHE B 84 11.927 36.140 2.608 1.00 2.13 H new ATOM 0 HD2 PHE B 84 8.644 33.783 1.261 1.00 61.02 H new ATOM 0 HE1 PHE B 84 12.027 37.254 0.420 1.00 63.12 H new ATOM 0 HE2 PHE B 84 8.740 34.898 -0.926 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.431 36.638 -1.350 1.00 4.43 H new ATOM 2859 N GLY B 85 7.665 34.742 4.600 1.00 21.14 N ATOM 2860 CA GLY B 85 6.382 34.450 5.210 1.00 12.21 C ATOM 2861 C GLY B 85 5.300 35.418 4.776 1.00 31.01 C ATOM 2862 O GLY B 85 5.518 36.247 3.892 1.00 44.13 O ATOM 0 H GLY B 85 7.644 34.844 3.585 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.082 33.435 4.950 1.00 12.21 H new ATOM 0 HA3 GLY B 85 6.483 34.485 6.295 1.00 12.21 H new ATOM 2866 N GLN B 86 4.130 35.313 5.397 1.00 3.43 N ATOM 2867 CA GLN B 86 3.009 36.186 5.068 1.00 12.21 C ATOM 2868 C GLN B 86 1.994 36.221 6.207 1.00 13.14 C ATOM 2869 O GLN B 86 2.250 35.708 7.295 1.00 55.43 O ATOM 2870 CB GLN B 86 2.332 35.717 3.779 1.00 53.42 C ATOM 2871 CG GLN B 86 2.124 36.828 2.762 1.00 53.00 C ATOM 2872 CD GLN B 86 3.191 36.839 1.685 1.00 33.32 C ATOM 2873 OE1 GLN B 86 3.874 37.844 1.480 1.00 54.14 O ATOM 2874 NE2 GLN B 86 3.341 35.719 0.989 1.00 34.34 N ATOM 0 H GLN B 86 3.933 34.632 6.131 1.00 3.43 H new ATOM 0 HA GLN B 86 3.396 37.194 4.920 1.00 12.21 H new ATOM 0 HB2 GLN B 86 2.936 34.930 3.327 1.00 53.42 H new ATOM 0 HB3 GLN B 86 1.366 35.276 4.025 1.00 53.42 H new ATOM 0 HG2 GLN B 86 1.145 36.712 2.297 1.00 53.00 H new ATOM 0 HG3 GLN B 86 2.121 37.790 3.275 1.00 53.00 H new ATOM 0 HE21 GLN B 86 2.754 34.910 1.192 1.00 34.34 H new ATOM 0 HE22 GLN B 86 4.043 35.667 0.251 1.00 34.34 H new ATOM 2883 N ASN B 87 0.841 36.830 5.946 1.00 61.14 N ATOM 2884 CA ASN B 87 -0.212 36.932 6.949 1.00 22.41 C ATOM 2885 C ASN B 87 -1.434 36.115 6.540 1.00 34.44 C ATOM 2886 O ASN B 87 -2.089 36.419 5.543 1.00 43.53 O ATOM 2887 CB ASN B 87 -0.608 38.395 7.154 1.00 1.54 C ATOM 2888 CG ASN B 87 -0.596 39.186 5.860 1.00 64.20 C ATOM 2889 OD1 ASN B 87 -1.006 38.686 4.812 1.00 64.54 O ATOM 2890 ND2 ASN B 87 -0.125 40.425 5.928 1.00 70.15 N ATOM 0 H ASN B 87 0.613 37.260 5.049 1.00 61.14 H new ATOM 0 HA ASN B 87 0.173 36.531 7.887 1.00 22.41 H new ATOM 0 HB2 ASN B 87 -1.604 38.440 7.595 1.00 1.54 H new ATOM 0 HB3 ASN B 87 0.077 38.857 7.865 1.00 1.54 H new ATOM 0 HD21 ASN B 87 -0.092 41.005 5.089 1.00 70.15 H new ATOM 0 HD22 ASN B 87 0.204 40.797 6.819 1.00 70.15 H new ATOM 2897 N GLU B 88 -1.735 35.080 7.317 1.00 72.14 N ATOM 2898 CA GLU B 88 -2.878 34.220 7.034 1.00 60.50 C ATOM 2899 C GLU B 88 -3.059 33.177 8.134 1.00 51.31 C ATOM 2900 O GLU B 88 -2.309 32.203 8.212 1.00 64.11 O ATOM 2901 CB GLU B 88 -2.701 33.526 5.682 1.00 11.22 C ATOM 2902 CG GLU B 88 -4.005 33.319 4.929 1.00 72.12 C ATOM 2903 CD GLU B 88 -4.271 34.414 3.912 1.00 70.14 C ATOM 2904 OE1 GLU B 88 -4.369 35.590 4.319 1.00 31.35 O ATOM 2905 OE2 GLU B 88 -4.381 34.091 2.711 1.00 44.44 O ATOM 0 H GLU B 88 -1.204 34.817 8.147 1.00 72.14 H new ATOM 0 HA GLU B 88 -3.770 34.845 6.999 1.00 60.50 H new ATOM 0 HB2 GLU B 88 -2.025 34.118 5.065 1.00 11.22 H new ATOM 0 HB3 GLU B 88 -2.224 32.558 5.839 1.00 11.22 H new ATOM 0 HG2 GLU B 88 -3.978 32.355 4.421 1.00 72.12 H new ATOM 0 HG3 GLU B 88 -4.830 33.281 5.641 1.00 72.12 H new ATOM 2912 N THR B 89 -4.060 33.387 8.982 1.00 72.22 N ATOM 2913 CA THR B 89 -4.340 32.468 10.079 1.00 72.03 C ATOM 2914 C THR B 89 -5.659 32.810 10.760 1.00 64.32 C ATOM 2915 O THR B 89 -6.083 33.966 10.773 1.00 11.41 O ATOM 2916 CB THR B 89 -3.212 32.486 11.128 1.00 44.43 C ATOM 2917 OG1 THR B 89 -2.250 33.494 10.797 1.00 72.23 O ATOM 2918 CG2 THR B 89 -2.527 31.131 11.209 1.00 55.41 C ATOM 0 H THR B 89 -4.692 34.186 8.931 1.00 72.22 H new ATOM 0 HA THR B 89 -4.407 31.470 9.646 1.00 72.03 H new ATOM 0 HB THR B 89 -3.653 32.711 12.099 1.00 44.43 H new ATOM 0 HG1 THR B 89 -1.537 33.500 11.470 1.00 72.23 H new ATOM 0 HG21 THR B 89 -1.734 31.168 11.956 1.00 55.41 H new ATOM 0 HG22 THR B 89 -3.256 30.371 11.491 1.00 55.41 H new ATOM 0 HG23 THR B 89 -2.099 30.881 10.238 1.00 55.41 H new ATOM 2926 N THR B 90 -6.307 31.797 11.328 1.00 33.34 N ATOM 2927 CA THR B 90 -7.579 31.990 12.012 1.00 70.14 C ATOM 2928 C THR B 90 -8.047 30.702 12.677 1.00 13.32 C ATOM 2929 O THR B 90 -9.009 30.075 12.232 1.00 24.44 O ATOM 2930 CB THR B 90 -8.670 32.479 11.041 1.00 21.30 C ATOM 2931 OG1 THR B 90 -9.948 32.452 11.686 1.00 24.01 O ATOM 2932 CG2 THR B 90 -8.710 31.611 9.791 1.00 74.34 C ATOM 0 H THR B 90 -5.971 30.834 11.327 1.00 33.34 H new ATOM 0 HA THR B 90 -7.415 32.750 12.776 1.00 70.14 H new ATOM 0 HB THR B 90 -8.433 33.502 10.748 1.00 21.30 H new ATOM 0 HG1 THR B 90 -10.240 31.523 11.794 1.00 24.01 H new ATOM 0 HG21 THR B 90 -9.488 31.975 9.120 1.00 74.34 H new ATOM 0 HG22 THR B 90 -7.745 31.656 9.286 1.00 74.34 H new ATOM 0 HG23 THR B 90 -8.926 30.580 10.071 1.00 74.34 H new ATOM 2940 N SER B 91 -7.361 30.309 13.747 1.00 21.33 N ATOM 2941 CA SER B 91 -7.705 29.092 14.472 1.00 52.45 C ATOM 2942 C SER B 91 -6.803 28.912 15.689 1.00 40.41 C ATOM 2943 O SER B 91 -5.970 28.007 15.747 1.00 20.02 O ATOM 2944 CB SER B 91 -7.590 27.876 13.553 1.00 73.32 C ATOM 2945 OG SER B 91 -6.604 28.081 12.555 1.00 4.32 O ATOM 0 H SER B 91 -6.564 30.817 14.130 1.00 21.33 H new ATOM 0 HA SER B 91 -8.736 29.182 14.815 1.00 52.45 H new ATOM 0 HB2 SER B 91 -7.338 26.994 14.142 1.00 73.32 H new ATOM 0 HB3 SER B 91 -8.553 27.680 13.082 1.00 73.32 H new ATOM 0 HG SER B 91 -5.716 27.913 12.933 1.00 4.32 H new ATOM 2951 N PRO B 92 -6.970 29.795 16.684 1.00 53.44 N ATOM 2952 CA PRO B 92 -6.181 29.755 17.919 1.00 21.04 C ATOM 2953 C PRO B 92 -6.531 28.555 18.793 1.00 43.21 C ATOM 2954 O PRO B 92 -5.699 28.069 19.560 1.00 61.11 O ATOM 2955 CB PRO B 92 -6.560 31.059 18.625 1.00 71.35 C ATOM 2956 CG PRO B 92 -7.914 31.393 18.102 1.00 30.20 C ATOM 2957 CD PRO B 92 -7.943 30.900 16.682 1.00 2.15 C ATOM 0 HA PRO B 92 -5.114 29.658 17.717 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -6.574 30.934 19.708 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -5.844 31.851 18.405 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -8.691 30.914 18.697 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -8.095 32.467 18.146 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -8.938 30.559 16.395 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -7.660 31.683 15.979 1.00 2.15 H new ATOM 2965 N HIS B 93 -7.766 28.081 18.670 1.00 34.50 N ATOM 2966 CA HIS B 93 -8.227 26.936 19.449 1.00 54.15 C ATOM 2967 C HIS B 93 -7.288 25.747 19.274 1.00 12.25 C ATOM 2968 O HIS B 93 -7.231 25.141 18.204 1.00 33.42 O ATOM 2969 CB HIS B 93 -9.646 26.546 19.033 1.00 0.42 C ATOM 2970 CG HIS B 93 -10.673 26.802 20.092 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -10.473 26.497 21.423 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -11.912 27.338 20.012 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -11.547 26.833 22.114 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -12.436 27.346 21.282 1.00 23.02 N ATOM 0 H HIS B 93 -8.466 28.471 18.039 1.00 34.50 H new ATOM 0 HA HIS B 93 -8.231 27.222 20.501 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -9.917 27.100 18.134 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -9.661 25.488 18.772 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -12.399 27.694 19.116 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -11.677 26.709 23.179 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -13.360 27.692 21.540 1.00 23.02 H new ATOM 2982 N SER B 94 -6.551 25.420 20.331 1.00 3.43 N ATOM 2983 CA SER B 94 -5.610 24.306 20.291 1.00 1.32 C ATOM 2984 C SER B 94 -5.347 23.769 21.695 1.00 64.45 C ATOM 2985 O SER B 94 -5.377 24.514 22.673 1.00 61.34 O ATOM 2986 CB SER B 94 -4.295 24.744 19.645 1.00 12.44 C ATOM 2987 OG SER B 94 -4.475 25.038 18.270 1.00 54.11 O ATOM 0 H SER B 94 -6.587 25.910 21.225 1.00 3.43 H new ATOM 0 HA SER B 94 -6.052 23.510 19.692 1.00 1.32 H new ATOM 0 HB2 SER B 94 -3.908 25.623 20.160 1.00 12.44 H new ATOM 0 HB3 SER B 94 -3.551 23.956 19.757 1.00 12.44 H new ATOM 0 HG SER B 94 -5.425 24.967 18.042 1.00 54.11 H new ATOM 2993 N GLY B 95 -5.088 22.468 21.785 1.00 1.35 N ATOM 2994 CA GLY B 95 -4.823 21.851 23.071 1.00 64.00 C ATOM 2995 C GLY B 95 -3.372 21.981 23.489 1.00 62.35 C ATOM 2996 O GLY B 95 -2.577 22.620 22.799 1.00 43.33 O ATOM 0 H GLY B 95 -5.057 21.830 20.990 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -5.458 22.310 23.828 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -5.092 20.796 23.026 1.00 64.00 H new ATOM 3000 N GLN B 96 -3.026 21.378 24.621 1.00 50.51 N ATOM 3001 CA GLN B 96 -1.661 21.432 25.130 1.00 72.12 C ATOM 3002 C GLN B 96 -1.303 20.148 25.868 1.00 65.24 C ATOM 3003 O GLN B 96 -2.144 19.264 26.044 1.00 63.21 O ATOM 3004 CB GLN B 96 -1.489 22.634 26.061 1.00 43.41 C ATOM 3005 CG GLN B 96 -2.516 22.688 27.180 1.00 33.45 C ATOM 3006 CD GLN B 96 -2.534 24.027 27.891 1.00 33.12 C ATOM 3007 OE1 GLN B 96 -1.490 24.649 28.096 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -3.722 24.480 28.272 1.00 2.42 N ATOM 0 H GLN B 96 -3.672 20.846 25.204 1.00 50.51 H new ATOM 0 HA GLN B 96 -0.988 21.540 24.280 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -0.490 22.606 26.497 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -1.555 23.550 25.474 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -3.505 22.485 26.770 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -2.303 21.900 27.902 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -4.561 23.933 28.082 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -3.796 25.376 28.755 1.00 2.42 H new ATOM 3017 N LYS B 97 -0.051 20.047 26.300 1.00 34.32 N ATOM 3018 CA LYS B 97 0.420 18.870 27.020 1.00 14.32 C ATOM 3019 C LYS B 97 1.686 19.185 27.810 1.00 71.32 C ATOM 3020 O LYS B 97 2.452 20.078 27.445 1.00 33.34 O ATOM 3021 CB LYS B 97 0.688 17.722 26.043 1.00 35.20 C ATOM 3022 CG LYS B 97 0.056 16.406 26.465 1.00 51.33 C ATOM 3023 CD LYS B 97 1.000 15.237 26.236 1.00 44.12 C ATOM 3024 CE LYS B 97 0.883 14.203 27.346 1.00 74.43 C ATOM 3025 NZ LYS B 97 2.219 13.768 27.841 1.00 5.41 N ATOM 0 H LYS B 97 0.657 20.768 26.164 1.00 34.32 H new ATOM 0 HA LYS B 97 -0.359 18.569 27.721 1.00 14.32 H new ATOM 0 HB2 LYS B 97 0.310 17.998 25.058 1.00 35.20 H new ATOM 0 HB3 LYS B 97 1.765 17.584 25.944 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -0.217 16.454 27.519 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -0.865 16.247 25.904 1.00 51.33 H new ATOM 0 HD2 LYS B 97 0.777 14.770 25.277 1.00 44.12 H new ATOM 0 HD3 LYS B 97 2.026 15.601 26.183 1.00 44.12 H new ATOM 0 HE2 LYS B 97 0.308 14.621 28.172 1.00 74.43 H new ATOM 0 HE3 LYS B 97 0.332 13.337 26.979 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 2.097 13.064 28.596 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 2.759 13.346 27.058 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 2.735 14.590 28.214 1.00 5.41 H new ATOM 3039 N THR B 98 1.901 18.447 28.894 1.00 34.52 N ATOM 3040 CA THR B 98 3.075 18.648 29.735 1.00 3.20 C ATOM 3041 C THR B 98 3.120 20.069 30.287 1.00 4.23 C ATOM 3042 O THR B 98 4.191 20.598 30.577 1.00 73.42 O ATOM 3043 CB THR B 98 4.376 18.369 28.959 1.00 33.41 C ATOM 3044 OG1 THR B 98 4.086 17.640 27.761 1.00 41.12 O ATOM 3045 CG2 THR B 98 5.357 17.581 29.815 1.00 31.23 C ATOM 0 H THR B 98 1.278 17.704 29.211 1.00 34.52 H new ATOM 0 HA THR B 98 2.996 17.943 30.562 1.00 3.20 H new ATOM 0 HB THR B 98 4.831 19.325 28.699 1.00 33.41 H new ATOM 0 HG1 THR B 98 4.918 17.468 27.273 1.00 41.12 H new ATOM 0 HG21 THR B 98 6.268 17.395 29.247 1.00 31.23 H new ATOM 0 HG22 THR B 98 5.598 18.152 30.711 1.00 31.23 H new ATOM 0 HG23 THR B 98 4.908 16.630 30.101 1.00 31.23 H new ATOM 3053 N GLY B 99 1.948 20.680 30.428 1.00 24.23 N ATOM 3054 CA GLY B 99 1.875 22.034 30.946 1.00 5.30 C ATOM 3055 C GLY B 99 0.551 22.327 31.621 1.00 13.10 C ATOM 3056 O GLY B 99 -0.498 22.315 30.977 1.00 22.51 O ATOM 0 H GLY B 99 1.048 20.262 30.193 1.00 24.23 H new ATOM 0 HA2 GLY B 99 2.685 22.191 31.659 1.00 5.30 H new ATOM 0 HA3 GLY B 99 2.027 22.740 30.130 1.00 5.30 H new TER 3060 GLY B 99