#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5w s SER 2 N 0.00 6.39 -0.26 1.61 0.15 -1.26 -4.85 113.70 115.48 1x5w s SER 2 Ca 0.00 0.98 -0.04 0.00 0.70 0.00 0.00 55.95 57.60 1x5w s SER 2 Cb 0.00 -2.54 -0.15 0.00 -1.71 0.00 0.00 66.02 61.63 1x5w s SER 2 CO 0.00 -1.36 -0.26 -1.20 1.20 0.00 0.00 173.24 171.61 1x5w n SER 3 N 8.62 2.00 -3.41 5.45 7.64 -1.26 -5.04 113.62 127.62 1x5w n SER 3 Ca 0.17 0.03 -0.16 0.00 1.01 0.00 0.00 58.87 59.92 1x5w n SER 3 Cb 0.47 -0.53 -0.02 0.00 -1.01 0.00 0.00 64.21 63.12 1x5w n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5w n GLY 4 N 1.96 3.57 3.14 0.23 0.00 -1.26 -5.08 105.19 107.75 1x5w n GLY 4 Ca -0.47 -2.28 -0.39 0.00 0.00 0.00 0.00 46.02 42.88 1x5w n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x5w n SER 5 N -1.39 -2.91 -2.32 1.61 2.88 -1.26 -4.87 113.62 105.36 1x5w n SER 5 Ca -0.08 0.74 -0.30 0.00 -1.33 0.00 0.00 58.87 57.90 1x5w n SER 5 Cb 0.33 -0.84 0.04 0.00 -0.75 0.00 0.00 64.21 62.99 1x5w n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x5w n SER 6 N 2.27 6.23 -2.77 -3.46 2.88 -1.26 -4.99 113.62 112.52 1x5w n SER 6 Ca 0.10 -3.77 -0.03 0.00 -1.33 0.00 0.00 58.87 53.84 1x5w n SER 6 Cb 0.40 -0.68 -0.03 0.00 -0.75 0.00 0.00 64.21 63.15 1x5w n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5w n GLY 7 N -0.73 -3.56 3.97 0.46 0.00 -1.26 -5.01 105.19 99.06 1x5w n GLY 7 Ca 0.51 1.10 -0.21 0.00 0.00 0.00 0.00 46.02 47.42 1x5w n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x5w s HIS 8 N -0.67 3.42 0.27 1.61 4.02 -1.26 -5.02 115.29 117.66 1x5w s HIS 8 Ca -0.16 -0.04 0.05 0.00 1.02 0.00 0.00 55.06 55.93 1x5w s HIS 8 Cb 0.01 -1.60 0.39 0.00 -1.02 0.00 0.00 32.58 30.36 1x5w s HIS 8 CO 0.56 0.41 1.66 -1.00 1.02 0.00 0.00 174.74 177.38 1x5w h PRO 9 N 1.15 0.26 -5.85 8.40 0.13 -1.82 -3.45 132.00 130.82 1x5w h PRO 9 Ca -0.51 -0.14 -0.51 0.00 -0.87 0.00 0.00 66.00 63.97 1x5w h PRO 9 Cb 1.23 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.20 1x5w h PRO 9 CO 0.60 0.67 -0.77 -1.21 -0.23 0.00 0.00 178.00 177.07 1x5w s GLU 10 N -4.05 1.30 0.12 0.86 8.01 -1.21 -5.10 118.70 118.63 1x5w s GLU 10 Ca -0.05 -1.46 -0.07 0.00 0.01 0.00 0.00 54.97 53.40 1x5w s GLU 10 Cb 0.13 -1.29 -0.01 0.00 -4.31 0.00 0.00 34.13 28.65 1x5w s GLU 10 CO 0.78 0.25 0.19 -1.59 0.01 0.00 0.00 175.26 174.90 1x5w s LYS 11 N -3.02 0.95 0.00 1.61 -2.85 -1.26 -3.12 119.74 112.05 1x5w s LYS 11 Ca 0.18 -1.11 -0.20 0.00 -1.00 0.00 0.00 55.97 53.84 1x5w s LYS 11 Cb -0.05 0.33 -0.06 0.00 -2.06 0.00 0.00 37.83 36.00 1x5w s LYS 11 CO 0.07 -0.31 0.57 0.00 0.10 0.00 0.00 175.35 175.77 1x5w n SER 13 N 2.56 2.41 0.00 0.00 7.64 -1.26 -4.09 113.62 120.87 1x5w n SER 13 Ca -0.08 -2.20 0.00 0.00 1.01 0.00 0.00 58.87 57.60 1x5w n SER 13 Cb 0.51 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1x5w n SER 13 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1x5w n GLU 14 N 0.37 0.00 -4.14 1.43 -0.58 -1.26 -5.12 120.64 111.34 1x5w n GLU 14 Ca 0.12 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.62 1x5w n GLU 14 Cb 0.47 -0.48 -0.06 0.00 -0.57 0.00 0.00 31.44 30.80 1x5w n GLU 14 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1x5w n SER 16 N -1.53 5.41 -4.57 0.00 3.41 -1.26 -4.29 113.62 110.79 1x5w n SER 16 Ca -0.08 -2.53 -0.38 0.00 -0.26 0.00 0.00 58.87 55.62 1x5w n SER 16 Cb 0.54 -1.07 -0.11 0.00 -0.26 0.00 0.00 64.21 63.31 1x5w n SER 16 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1x5w s TYR 17 N -0.43 3.20 -0.00 7.33 6.14 -1.26 -4.98 117.35 127.35 1x5w s TYR 17 Ca 0.07 0.02 0.03 0.00 0.64 0.00 0.00 57.07 57.84 1x5w s TYR 17 Cb 0.06 -2.36 -0.01 0.00 0.42 0.00 0.00 41.96 40.07 1x5w s TYR 17 CO 0.00 -0.20 -0.11 -1.54 0.64 0.00 0.00 175.55 174.34 1x5w s SER 18 N 1.74 1.26 0.35 4.32 1.04 -1.26 -0.08 113.70 121.07 1x5w s SER 18 Ca 0.07 -0.22 0.04 0.00 0.48 0.00 0.00 55.95 56.31 1x5w s SER 18 Cb -0.16 -0.13 -0.05 0.00 0.10 0.00 0.00 66.02 65.78 1x5w s SER 18 CO 0.10 0.12 0.08 0.00 0.98 0.00 0.00 173.24 174.51 1x5w h SER 20 N 2.00 0.00 -3.35 0.00 0.87 -1.97 -3.20 113.55 107.89 1x5w h SER 20 Ca -0.39 -0.50 -0.56 0.00 -1.23 0.00 0.00 61.79 59.10 1x5w h SER 20 Cb 1.26 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.16 1x5w h SER 20 CO 0.66 1.15 0.03 -0.44 -0.53 0.00 0.00 176.83 177.70 1x5w s SER 21 N -6.38 6.94 0.07 6.23 0.01 -1.26 -4.56 113.70 114.74 1x5w s SER 21 Ca -0.21 1.13 -0.24 0.00 1.31 0.00 0.00 55.95 57.94 1x5w s SER 21 Cb 0.02 -2.38 -0.10 0.00 0.21 0.00 0.00 66.02 63.77 1x5w s SER 21 CO 0.50 -0.05 1.38 0.50 0.41 0.00 0.00 173.24 175.97 1x5w h LYS 22 N 6.53 -0.54 -0.68 12.44 3.64 -2.00 -2.69 116.57 133.27 1x5w h LYS 22 Ca -0.42 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.08 1x5w h LYS 22 Cb 1.19 0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 33.04 1x5w h LYS 22 CO 0.74 -0.36 -0.33 0.00 -2.27 0.00 0.00 179.45 177.23 1x5w n ALA 23 N -2.74 -0.25 -0.10 5.00 0.00 -1.26 -0.33 120.51 120.83 1x5w n ALA 23 Ca -0.06 0.64 -0.09 0.00 0.00 0.00 0.00 53.44 53.92 1x5w n ALA 23 Cb 0.29 -0.21 -0.07 0.00 0.00 0.00 0.00 19.45 19.47 1x5w n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x5w h ALA 24 N 0.66 -0.61 -0.89 0.00 0.00 -1.90 -0.59 119.26 115.93 1x5w h ALA 24 Ca 0.18 0.00 0.21 0.00 0.00 0.00 0.00 54.91 55.31 1x5w h ALA 24 Cb 0.35 1.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.98 1x5w h ALA 24 CO -0.66 -0.79 -0.05 1.25 0.00 0.00 0.00 179.25 179.00 1x5w h LEU 25 N -0.25 -0.53 -0.67 0.00 5.85 -0.54 0.38 115.31 119.54 1x5w h LEU 25 Ca 0.05 0.25 0.14 0.00 0.84 0.00 0.00 57.88 59.17 1x5w h LEU 25 Cb 0.39 0.46 -0.11 0.00 0.37 0.00 0.00 40.66 41.77 1x5w h LEU 25 CO -0.41 -0.28 0.05 -0.09 -0.34 0.00 0.00 178.44 177.37 1x5w h ARG 26 N 0.04 0.15 -0.06 1.25 2.43 -0.52 0.40 114.38 118.07 1x5w h ARG 26 Ca 0.50 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.64 1x5w h ARG 26 Cb 0.91 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1x5w h ARG 26 CO -0.84 0.10 -0.06 0.82 -1.51 0.00 0.00 179.97 178.48 1x5w h ILE 27 N 0.16 1.08 -0.22 1.20 2.04 0.12 -2.53 117.51 119.36 1x5w h ILE 27 Ca 0.36 -0.35 -0.13 0.00 1.00 0.00 0.00 64.86 65.74 1x5w h ILE 27 Cb 0.60 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.79 1x5w h ILE 27 CO -0.54 0.11 -0.35 -0.74 0.00 0.00 0.00 178.15 176.62 1x5w h HIS 28 N 0.08 0.78 0.00 1.37 -0.00 0.19 -2.92 115.15 114.64 1x5w h HIS 28 Ca 0.02 -0.27 0.00 0.00 -0.00 0.00 0.00 60.37 60.12 1x5w h HIS 28 Cb 0.16 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.42 1x5w h HIS 28 CO 0.00 1.01 0.39 0.93 -0.00 0.00 0.00 177.93 180.26 1x5w h GLU 29 N 0.32 0.00 0.00 5.26 5.08 -0.72 0.27 114.58 124.78 1x5w h GLU 29 Ca 0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1x5w h GLU 29 Cb 0.94 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1x5w h GLU 29 CO 0.08 0.00 -0.14 0.00 -1.00 0.00 0.00 179.01 177.95 1x5w h ARG 30 N 0.00 0.00 -0.69 2.33 2.47 -1.57 -2.25 114.38 114.67 1x5w h ARG 30 Ca 0.00 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.84 1x5w h ARG 30 Cb 0.78 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.05 1x5w h ARG 30 CO 0.00 0.14 0.46 0.97 0.56 0.00 0.00 179.97 182.10 1x5w h ILE 31 N 0.00 0.84 -0.64 2.04 2.10 -0.67 0.15 117.51 121.33 1x5w h ILE 31 Ca -0.00 -0.15 -0.29 0.00 1.08 0.00 0.00 64.86 65.50 1x5w h ILE 31 Cb 0.25 0.38 -0.17 0.00 -1.09 0.00 0.00 36.82 36.18 1x5w h ILE 31 CO 0.02 0.08 0.37 1.41 -1.08 0.00 0.00 178.15 178.94 1x5w n HIS 32 N -4.47 2.02 0.00 2.19 8.25 -0.84 -4.20 115.22 118.16 1x5w n HIS 32 Ca 0.12 -1.25 0.00 0.00 -0.26 0.00 0.00 57.72 56.33 1x5w n HIS 32 Cb 0.45 -0.67 0.00 0.00 1.12 0.00 0.00 29.99 30.89 1x5w n HIS 32 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x5w n THR 34 N -2.94 1.26 -0.01 0.00 5.66 -1.05 -4.88 114.28 112.31 1x5w n THR 34 Ca 0.00 -0.50 -0.18 0.00 -3.05 0.00 0.00 64.05 60.32 1x5w n THR 34 Cb 0.37 -0.10 -0.08 0.00 -1.55 0.00 0.00 70.33 68.97 1x5w n THR 34 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 1x5w h ASP 35 N 0.65 0.84 -3.36 1.09 3.32 -1.95 -3.40 116.42 113.60 1x5w h ASP 35 Ca -0.35 -0.66 -0.72 0.00 0.02 0.00 0.00 57.03 55.33 1x5w h ASP 35 Cb 1.43 -0.25 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 1x5w h ASP 35 CO 0.51 1.37 -0.43 -0.13 -1.72 0.00 0.00 179.24 178.84 1x5w s ARG 36 N -3.63 2.50 0.35 3.56 3.00 -1.26 -4.69 118.95 118.78 1x5w s ARG 36 Ca -0.11 -1.65 0.14 0.00 0.00 0.00 0.00 55.73 54.10 1x5w s ARG 36 Cb 0.07 -3.85 0.63 0.00 0.00 0.00 0.00 34.95 31.80 1x5w s ARG 36 CO 0.88 -1.10 1.75 -1.00 0.00 0.00 0.00 175.30 175.84 1x5w h PRO 37 N 8.41 0.00 -6.19 3.54 0.13 -1.79 -3.44 132.00 132.66 1x5w h PRO 37 Ca -0.21 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.36 1x5w h PRO 37 Cb 1.08 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 1x5w h PRO 37 CO 0.81 0.44 0.24 -0.06 -0.23 0.00 0.00 178.00 179.21 1x5w s PHE 38 N -3.90 3.60 0.18 1.56 0.08 -1.18 -5.02 117.98 113.30 1x5w s PHE 38 Ca -0.02 1.45 0.08 0.00 0.12 0.00 0.00 56.93 58.56 1x5w s PHE 38 Cb 0.13 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.58 1x5w s PHE 38 CO 0.72 0.01 -0.17 0.15 -0.10 0.00 0.00 175.22 175.84 1x5w s LYS 39 N 1.02 1.29 0.24 0.44 1.02 -1.26 -1.56 119.74 120.93 1x5w s LYS 39 Ca 0.44 -1.47 -0.05 0.00 0.02 0.00 0.00 55.97 54.90 1x5w s LYS 39 Cb -0.19 -1.25 -0.06 0.00 -0.52 0.00 0.00 37.83 35.81 1x5w s LYS 39 CO 0.22 0.24 0.50 0.00 -0.92 0.00 0.00 175.35 175.39 1x5w h ASN 41 N 2.09 0.40 0.40 0.00 4.21 -2.01 -3.41 115.58 117.26 1x5w h ASN 41 Ca -0.47 -0.79 -0.02 0.00 1.21 0.00 0.00 56.30 56.23 1x5w h ASN 41 Cb 1.18 -0.13 0.00 0.00 -1.12 0.00 0.00 38.32 38.26 1x5w h ASN 41 CO 0.68 1.70 -0.19 1.88 -1.29 0.00 0.00 177.43 180.21 1x5w h TYR 42 N 0.07 -0.50 -1.26 1.19 -1.99 -1.98 -3.47 116.97 109.03 1x5w h TYR 42 Ca -0.37 -0.01 -0.57 0.00 2.00 0.00 0.00 58.73 59.77 1x5w h TYR 42 Cb 2.04 0.17 -0.08 0.00 2.00 0.00 0.00 36.73 40.86 1x5w h TYR 42 CO 0.07 -0.31 -0.45 0.00 -0.00 0.00 0.00 178.16 177.47 1x5w n SER 44 N -1.37 5.38 -4.62 0.00 2.88 -1.26 -4.08 113.62 110.55 1x5w n SER 44 Ca -0.02 -2.54 -0.42 0.00 -1.33 0.00 0.00 58.87 54.55 1x5w n SER 44 Cb 0.64 -1.05 -0.05 0.00 -0.75 0.00 0.00 64.21 63.01 1x5w n SER 44 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1x5w s PHE 45 N -0.48 3.22 -0.16 0.66 2.19 -1.26 -4.90 117.98 117.26 1x5w s PHE 45 Ca 0.08 0.88 0.01 0.00 0.33 0.00 0.00 56.93 58.23 1x5w s PHE 45 Cb 0.06 -3.19 0.01 0.00 -1.31 0.00 0.00 43.02 38.59 1x5w s PHE 45 CO 0.00 -0.54 -0.19 0.16 1.83 0.00 0.00 175.22 176.49 1x5w s ASP 46 N 1.57 3.35 0.13 6.13 -4.77 -1.26 -0.56 116.67 121.25 1x5w s ASP 46 Ca 0.33 -0.56 0.11 0.00 -3.30 0.00 0.00 52.55 49.13 1x5w s ASP 46 Cb -0.14 -1.50 -0.04 0.00 -1.09 0.00 0.00 42.92 40.14 1x5w s ASP 46 CO 0.12 0.06 -0.26 0.28 0.70 0.00 0.00 175.17 176.07 1x5w s THR 47 N 0.94 2.18 -0.02 2.11 -1.32 -0.60 -4.88 115.64 114.04 1x5w s THR 47 Ca -0.04 -1.73 -0.17 0.00 -1.21 0.00 0.00 61.69 58.55 1x5w s THR 47 Cb -0.15 -1.93 -0.09 0.00 -1.51 0.00 0.00 72.50 68.81 1x5w s THR 47 CO -0.03 0.07 0.72 0.50 -2.21 0.00 0.00 174.62 173.66 1x5w h LYS 48 N 3.91 -0.59 -6.85 7.08 3.11 -1.85 -3.13 116.57 118.25 1x5w h LYS 48 Ca -0.50 0.04 -0.51 0.00 -2.81 0.00 0.00 60.65 56.87 1x5w h LYS 48 Cb 1.17 0.13 0.03 0.00 -1.00 0.00 0.00 32.23 32.57 1x5w h LYS 48 CO 0.39 -0.39 0.51 -0.65 -2.81 0.00 0.00 179.45 176.50 1x5w s GLN 49 N -3.55 4.47 0.35 1.90 -0.21 -1.26 -4.58 119.66 116.80 1x5w s GLN 49 Ca -0.09 1.88 0.14 0.00 0.02 0.00 0.00 55.36 57.32 1x5w s GLN 49 Cb 0.01 -3.06 0.66 0.00 1.00 0.00 0.00 33.01 31.62 1x5w s GLN 49 CO 0.27 0.04 1.76 -1.00 -2.12 0.00 0.00 175.29 174.23 1x5w h PRO 50 N 3.49 0.00 -0.04 2.91 0.13 -2.00 -3.20 132.00 133.29 1x5w h PRO 50 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1x5w h PRO 50 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1x5w h PRO 50 CO 0.66 0.43 -0.02 0.77 -0.23 0.00 0.00 178.00 179.61 1x5w h SER 51 N 0.00 0.09 -0.70 1.44 0.02 -1.98 -3.18 113.55 109.24 1x5w h SER 51 Ca -0.00 -0.41 0.15 0.00 -0.84 0.00 0.00 61.79 60.69 1x5w h SER 51 Cb 0.82 -0.02 -0.11 0.00 0.14 0.00 0.00 62.40 63.22 1x5w h SER 51 CO 0.06 0.48 0.09 0.78 -1.14 0.00 0.00 176.83 177.09 1x5w h ASN 52 N -0.30 -0.15 -0.50 3.07 4.21 -1.96 -0.22 115.58 119.73 1x5w h ASN 52 Ca 0.01 0.16 0.09 0.00 1.21 0.00 0.00 56.30 57.77 1x5w h ASN 52 Cb 0.45 0.25 -0.08 0.00 -1.12 0.00 0.00 38.32 37.82 1x5w h ASN 52 CO 0.01 -0.09 0.02 0.25 -1.29 0.00 0.00 177.43 176.32 1x5w h LEU 53 N 0.18 -0.17 0.03 1.61 5.85 -1.59 0.11 115.31 121.33 1x5w h LEU 53 Ca 0.39 0.11 0.03 0.00 0.84 0.00 0.00 57.88 59.25 1x5w h LEU 53 Cb 0.66 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1x5w h LEU 53 CO -0.55 -0.05 -0.21 -1.28 -0.34 0.00 0.00 178.44 176.01 1x5w h SER 54 N 0.14 -0.61 -0.70 1.25 0.87 -1.04 0.14 113.55 113.60 1x5w h SER 54 Ca 0.25 0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.92 1x5w h SER 54 Cb 0.37 0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.54 1x5w h SER 54 CO -0.40 -0.28 0.46 0.11 -0.53 0.00 0.00 176.83 176.19 1x5w h LYS 55 N -0.35 0.85 -0.52 2.24 1.57 -0.91 -1.99 116.57 117.46 1x5w h LYS 55 Ca 0.05 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1x5w h LYS 55 Cb 0.42 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1x5w h LYS 55 CO -0.18 0.56 -0.13 1.25 -0.57 0.00 0.00 179.45 180.38 1x5w h HIS 56 N 0.88 1.13 0.20 -1.35 2.76 0.03 0.28 115.15 119.09 1x5w h HIS 56 Ca 0.27 -0.25 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 1x5w h HIS 56 Cb 0.00 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 28.68 1x5w h HIS 56 CO -0.00 1.07 -0.12 0.52 -1.30 0.00 0.00 177.93 178.10 1x5w h MET 57 N 0.87 -0.30 -0.30 5.26 2.86 -0.03 -0.30 114.93 123.00 1x5w h MET 57 Ca 0.13 0.02 -0.18 0.00 -2.06 0.00 0.00 59.70 57.61 1x5w h MET 57 Cb 0.71 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.43 1x5w h MET 57 CO 0.05 -0.20 -0.52 0.87 1.06 0.00 0.00 176.91 178.18 1x5w h LYS 58 N -0.31 0.87 0.53 1.72 1.79 -1.43 0.49 116.57 120.23 1x5w h LYS 58 Ca -0.02 -0.53 -0.02 0.00 -2.18 0.00 0.00 60.65 57.90 1x5w h LYS 58 Cb 0.25 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 1x5w h LYS 58 CO 0.03 1.17 -0.46 -0.22 -1.08 0.00 0.00 179.45 178.88 1x5w h LYS 59 N 0.68 -0.95 0.00 3.15 3.64 -0.30 -0.79 116.57 122.00 1x5w h LYS 59 Ca 0.02 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1x5w h LYS 59 Cb 1.12 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1x5w h LYS 59 CO 0.12 -0.63 -0.13 0.74 -2.27 0.00 0.00 179.45 177.28 1x5w h PHE 60 N -0.98 0.00 -0.27 1.91 -1.00 -1.12 -3.37 116.94 112.10 1x5w h PHE 60 Ca -0.06 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.49 1x5w h PHE 60 Cb 0.84 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.32 1x5w h PHE 60 CO -0.21 0.00 -0.05 0.72 -1.61 0.00 0.00 178.31 177.16 1x5w n HIS 61 N -4.07 0.50 -0.05 -0.55 8.25 0.17 -4.42 115.22 115.04 1x5w n HIS 61 Ca -0.02 -1.53 -0.01 0.00 -0.26 0.00 0.00 57.72 55.89 1x5w n HIS 61 Cb 0.07 -1.24 -0.00 0.00 1.12 0.00 0.00 29.99 29.93 1x5w n HIS 61 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1x5w h GLY 62 N 4.07 0.00 -7.73 -1.41 0.00 -1.00 -3.40 103.07 93.59 1x5w h GLY 62 Ca 0.20 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.81 1x5w h GLY 62 CO 0.37 0.00 1.51 0.99 0.00 0.00 0.00 176.54 179.41 1x5w s ASP 63 N -5.42 7.02 -0.22 0.19 1.11 -1.26 -4.89 116.67 113.20 1x5w s ASP 63 Ca -0.04 -2.88 -0.03 0.00 0.18 0.00 0.00 52.55 49.77 1x5w s ASP 63 Cb 0.01 -2.44 0.11 0.00 1.07 0.00 0.00 42.92 41.67 1x5w s ASP 63 CO 0.07 -0.83 0.29 -0.04 1.18 0.00 0.00 175.17 175.84 1x5w s MET 64 N 2.10 0.27 -0.20 8.23 -1.94 -1.26 -5.14 119.30 121.35 1x5w s MET 64 Ca 0.45 0.34 -0.24 0.00 -1.71 0.00 0.00 55.69 54.53 1x5w s MET 64 Cb -0.02 -0.87 0.06 0.00 2.01 0.00 0.00 34.83 36.02 1x5w s MET 64 CO 0.01 -0.66 0.64 0.45 -0.01 0.00 0.00 175.02 175.45 1x5w s SER 65 N 2.42 -0.65 0.00 3.03 0.15 -1.26 -5.10 113.70 112.29 1x5w s SER 65 Ca 0.10 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.91 1x5w s SER 65 Cb -0.16 1.16 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 1x5w s SER 65 CO -0.14 -0.30 0.49 0.61 1.20 0.00 0.00 173.24 175.10 1x5w n GLY 66 N 2.37 -3.49 2.58 9.45 0.00 -1.26 -4.72 105.19 110.13 1x5w n GLY 66 Ca -0.15 0.61 -0.22 0.00 0.00 0.00 0.00 46.02 46.26 1x5w n GLY 66 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5w n PRO 67 N -0.88 -2.60 -3.65 1.61 -0.04 -1.26 -5.01 135.00 123.17 1x5w n PRO 67 Ca 0.00 -1.29 -0.39 0.00 -0.04 0.00 0.00 63.50 61.78 1x5w n PRO 67 Cb 0.00 -1.21 -0.11 0.00 -0.04 0.00 0.00 33.50 32.15 1x5w n PRO 67 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5w s SER 68 N -3.67 5.53 0.13 3.54 0.01 -1.26 -4.96 113.70 113.01 1x5w s SER 68 Ca 0.52 -1.51 -0.16 0.00 1.31 0.00 0.00 55.95 56.12 1x5w s SER 68 Cb -0.05 -1.94 -0.01 0.00 0.21 0.00 0.00 66.02 64.22 1x5w s SER 68 CO 0.40 -0.50 1.65 0.28 0.41 0.00 0.00 173.24 175.48 1x5w h SER 69 N 8.33 0.57 0.00 2.44 0.02 -1.95 -3.55 113.55 119.41 1x5w h SER 69 Ca -0.22 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1x5w h SER 69 Cb 1.08 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.47 1x5w h SER 69 CO 0.72 0.62 0.00 0.61 -1.14 0.00 0.00 176.83 177.64