#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5w n SER 2 N 0.00 0.58 -4.78 1.61 7.64 -1.26 -5.04 113.62 112.37 1x5w n SER 2 Ca 0.00 0.10 -0.35 0.00 1.01 0.00 0.00 58.87 59.62 1x5w n SER 2 Cb 0.00 -0.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.96 1x5w n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5w s SER 3 N -5.66 5.91 0.00 6.43 0.01 -1.26 -4.89 113.70 114.24 1x5w s SER 3 Ca -0.09 2.16 0.00 0.00 1.31 0.00 0.00 55.95 59.33 1x5w s SER 3 Cb 0.03 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1x5w s SER 3 CO 0.12 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.29 1x5w n GLY 4 N 0.16 2.36 3.69 3.44 0.00 -1.26 -4.98 105.19 108.60 1x5w n GLY 4 Ca 0.10 -1.60 -0.44 0.00 0.00 0.00 0.00 46.02 44.09 1x5w n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x5w n SER 5 N 0.00 3.83 -4.39 1.61 3.41 -1.26 -4.98 113.62 111.83 1x5w n SER 5 Ca 0.00 1.00 -0.31 0.00 -0.26 0.00 0.00 58.87 59.30 1x5w n SER 5 Cb 0.00 -1.50 -0.14 0.00 -0.26 0.00 0.00 64.21 62.31 1x5w n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x5w s SER 6 N 2.65 3.42 0.00 4.04 0.15 -1.26 -5.07 113.70 117.63 1x5w s SER 6 Ca 0.83 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.99 1x5w s SER 6 Cb -0.54 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 1x5w s SER 6 CO 0.39 0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.72 1x5w n GLY 7 N 1.83 2.33 3.11 9.45 0.00 -1.26 -5.12 105.19 115.53 1x5w n GLY 7 Ca -0.17 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.31 0.63 -0.09 1.61 4.02 -1.26 -5.04 115.29 112.85 1x5w s HIS 8 Ca 0.00 -1.05 0.30 0.00 1.02 0.00 0.00 55.06 55.34 1x5w s HIS 8 Cb 0.00 -0.43 1.26 0.00 -1.02 0.00 0.00 32.58 32.40 1x5w s HIS 8 CO 0.00 -0.34 1.90 -1.00 1.02 0.00 0.00 174.74 176.32 1x5w h PRO 9 N 3.09 0.00 -4.63 8.40 0.13 -1.89 -3.43 132.00 133.67 1x5w h PRO 9 Ca -0.34 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.37 1x5w h PRO 9 Cb 1.15 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.98 1x5w h PRO 9 CO 0.65 0.00 -0.78 -1.21 -0.23 0.00 0.00 178.00 176.43 1x5w s GLU 10 N -3.56 0.90 0.02 0.86 0.41 -1.20 -5.09 118.70 111.04 1x5w s GLU 10 Ca 0.02 -0.31 0.00 0.00 -0.41 0.00 0.00 54.97 54.27 1x5w s GLU 10 Cb 0.09 -0.85 -0.01 0.00 -1.78 0.00 0.00 34.13 31.58 1x5w s GLU 10 CO 0.48 0.14 -0.03 0.21 -0.49 0.00 0.00 175.26 175.57 1x5w s LYS 11 N 0.08 0.26 0.32 1.61 2.20 -1.26 -2.29 119.74 120.65 1x5w s LYS 11 Ca -0.01 -0.45 -0.27 0.00 -0.36 0.00 0.00 55.97 54.87 1x5w s LYS 11 Cb -0.07 0.02 -0.09 0.00 -1.51 0.00 0.00 37.83 36.17 1x5w s LYS 11 CO 0.00 -0.02 1.03 0.00 -0.36 0.00 0.00 175.35 176.00 1x5w n SER 13 N 0.76 4.58 0.00 0.00 7.64 -1.26 -4.23 113.62 121.11 1x5w n SER 13 Ca 0.01 -2.96 0.00 0.00 1.01 0.00 0.00 58.87 56.93 1x5w n SER 13 Cb 0.47 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 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 0.08 0.00 -3.16 1.43 -0.58 -1.26 -5.13 120.64 112.03 1x5w n GLU 14 Ca 0.32 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1x5w n GLU 14 Cb 1.19 -0.64 -0.04 0.00 -0.57 0.00 0.00 31.44 31.39 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 -2.07 6.12 -4.41 0.00 7.64 -1.26 -4.40 113.62 115.23 1x5w n SER 16 Ca 0.01 -2.87 -0.40 0.00 1.01 0.00 0.00 58.87 56.61 1x5w n SER 16 Cb 0.30 -1.10 -0.11 0.00 -1.01 0.00 0.00 64.21 62.29 1x5w n SER 16 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1x5w s TYR 17 N -1.21 3.22 -0.02 1.43 6.14 -1.26 -5.00 117.35 120.65 1x5w s TYR 17 Ca 0.25 -0.74 0.03 0.00 0.64 0.00 0.00 57.07 57.25 1x5w s TYR 17 Cb 0.19 -2.42 -0.00 0.00 0.42 0.00 0.00 41.96 40.14 1x5w s TYR 17 CO -0.02 -0.55 -0.10 -1.54 0.64 0.00 0.00 175.55 173.98 1x5w s SER 18 N 1.59 1.30 0.15 4.32 1.04 -1.26 -0.50 113.70 120.34 1x5w s SER 18 Ca 0.03 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.27 1x5w s SER 18 Cb -0.18 -0.26 -0.04 0.00 0.10 0.00 0.00 66.02 65.63 1x5w s SER 18 CO 0.07 0.10 -0.00 0.00 0.98 0.00 0.00 173.24 174.39 1x5w h SER 20 N 2.79 0.00 -3.56 0.00 4.64 -1.96 -3.17 113.55 112.29 1x5w h SER 20 Ca -0.36 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.34 1x5w h SER 20 Cb 1.19 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.16 1x5w h SER 20 CO 0.63 0.55 0.05 -0.44 -0.87 0.00 0.00 176.83 176.74 1x5w s SER 21 N -6.19 6.46 0.11 4.97 0.01 -1.26 -4.80 113.70 113.00 1x5w s SER 21 Ca 0.01 0.49 -0.25 0.00 1.31 0.00 0.00 55.95 57.50 1x5w s SER 21 Cb 0.08 -2.30 -0.09 0.00 0.21 0.00 0.00 66.02 63.92 1x5w s SER 21 CO 0.78 -0.36 1.67 0.50 0.41 0.00 0.00 173.24 176.24 1x5w h LYS 22 N 8.07 -0.32 -0.57 12.44 1.63 -1.99 -2.32 116.57 133.51 1x5w h LYS 22 Ca -0.28 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 59.60 1x5w h LYS 22 Cb 1.13 0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.78 1x5w h LYS 22 CO 0.75 -0.21 0.27 0.00 -3.45 0.00 0.00 179.45 176.81 1x5w h ALA 23 N 0.52 0.74 -0.47 5.00 0.00 -1.99 -2.34 119.26 120.72 1x5w h ALA 23 Ca 0.03 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1x5w h ALA 23 Cb 0.35 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 1x5w h ALA 23 CO -0.11 -0.10 -0.06 0.00 0.00 0.00 0.00 179.25 178.99 1x5w h ALA 24 N 1.33 0.37 -0.03 0.00 0.00 -1.88 -2.16 119.26 116.89 1x5w h ALA 24 Ca 0.27 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.37 1x5w h ALA 24 Cb 0.22 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1x5w h ALA 24 CO -0.21 -0.42 -0.25 1.25 0.00 0.00 0.00 179.25 179.62 1x5w h LEU 25 N 0.05 -0.75 -0.90 0.00 5.85 -0.89 -1.90 115.31 116.77 1x5w h LEU 25 Ca 0.23 0.11 0.25 0.00 0.84 0.00 0.00 57.88 59.30 1x5w h LEU 25 Cb 0.35 0.31 -0.16 0.00 0.37 0.00 0.00 40.66 41.54 1x5w h LEU 25 CO -0.44 -0.31 0.14 0.03 -0.34 0.00 0.00 178.44 177.52 1x5w h ARG 26 N -0.37 0.11 -0.79 1.25 3.08 -1.14 0.58 114.38 117.10 1x5w h ARG 26 Ca 0.07 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1x5w h ARG 26 Cb 0.47 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.45 1x5w h ARG 26 CO -0.24 0.07 0.51 0.82 -1.07 0.00 0.00 179.97 180.06 1x5w h ILE 27 N 0.11 1.16 -0.46 2.04 2.04 -1.09 -2.58 117.51 118.74 1x5w h ILE 27 Ca 0.56 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 66.04 1x5w h ILE 27 Cb 1.15 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1x5w h ILE 27 CO -0.76 0.19 0.17 -0.74 0.00 0.00 0.00 178.15 177.01 1x5w h HIS 28 N 1.02 0.73 -1.44 1.37 -0.00 0.40 -2.69 115.15 114.53 1x5w h HIS 28 Ca 0.30 -0.06 0.46 0.00 -0.00 0.00 0.00 60.37 61.06 1x5w h HIS 28 Cb -0.06 -0.21 -0.11 0.00 -0.00 0.00 0.00 27.41 27.03 1x5w h HIS 28 CO -0.02 0.63 0.97 0.93 -0.00 0.00 0.00 177.93 180.43 1x5w h GLU 29 N 0.61 0.06 -1.04 5.26 5.08 -0.73 0.46 114.58 124.27 1x5w h GLU 29 Ca 0.15 -0.00 0.32 0.00 -1.00 0.00 0.00 59.36 58.83 1x5w h GLU 29 Cb 0.23 -0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.33 1x5w h GLU 29 CO -0.01 0.04 0.61 0.00 -1.00 0.00 0.00 179.01 178.65 1x5w h ARG 30 N 0.06 0.32 -1.11 2.33 3.08 -1.52 0.25 114.38 117.80 1x5w h ARG 30 Ca 0.83 -0.02 0.38 0.00 0.07 0.00 0.00 59.98 61.24 1x5w h ARG 30 Cb 2.79 -0.07 -0.15 0.00 0.08 0.00 0.00 29.97 32.63 1x5w h ARG 30 CO -0.31 0.21 0.66 0.97 -1.07 0.00 0.00 179.97 180.43 1x5w h ILE 31 N 0.33 0.17 -2.78 2.04 2.10 -0.29 -2.79 117.51 116.29 1x5w h ILE 31 Ca 0.72 -0.06 -0.77 0.00 1.08 0.00 0.00 64.86 65.84 1x5w h ILE 31 Cb 1.72 -0.01 -0.23 0.00 -1.09 0.00 0.00 36.82 37.22 1x5w h ILE 31 CO -0.54 0.03 0.97 1.41 -1.08 0.00 0.00 178.15 178.93 1x5w n HIS 32 N -4.96 4.96 -3.85 2.19 8.25 0.88 -4.95 115.22 117.74 1x5w n HIS 32 Ca 0.35 -3.56 -0.09 0.00 -0.26 0.00 0.00 57.72 54.15 1x5w n HIS 32 Cb 1.21 -1.94 -0.05 0.00 1.12 0.00 0.00 29.99 30.33 1x5w n HIS 32 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x5w s THR 34 N -3.92 -0.96 0.04 0.00 2.01 -1.26 -5.06 115.64 106.48 1x5w s THR 34 Ca 0.14 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.11 1x5w s THR 34 Cb 0.00 -0.98 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 1x5w s THR 34 CO -0.00 -0.01 -0.06 -0.67 -0.69 0.00 0.00 174.62 173.20 1x5w n ASP 35 N 5.43 1.06 -4.85 3.53 -0.08 -1.26 -5.05 116.55 115.32 1x5w n ASP 35 Ca -0.05 0.15 -0.36 0.00 -1.51 0.00 0.00 54.79 53.02 1x5w n ASP 35 Cb 0.50 -0.36 -0.06 0.00 2.34 0.00 0.00 41.12 43.54 1x5w n ASP 35 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 1x5w s ARG 36 N -1.97 3.81 0.29 -0.67 3.52 -1.26 -5.00 118.95 117.67 1x5w s ARG 36 Ca -0.05 0.26 0.08 0.00 -0.13 0.00 0.00 55.73 55.89 1x5w s ARG 36 Cb 0.01 -3.11 0.44 0.00 -1.56 0.00 0.00 34.95 30.73 1x5w s ARG 36 CO 0.07 0.63 1.68 -1.00 -0.81 0.00 0.00 175.30 175.87 1x5w h PRO 37 N 4.24 0.17 -5.54 5.12 0.13 -1.95 -3.43 132.00 130.74 1x5w h PRO 37 Ca -0.51 -0.09 -0.65 0.00 -0.87 0.00 0.00 66.00 63.88 1x5w h PRO 37 Cb 1.21 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.02 1x5w h PRO 37 CO 0.64 0.61 -0.87 -0.06 -0.23 0.00 0.00 178.00 178.08 1x5w s PHE 38 N -3.99 2.28 0.19 1.56 0.08 -1.20 -5.08 117.98 111.83 1x5w s PHE 38 Ca -0.04 -0.79 0.00 0.00 0.12 0.00 0.00 56.93 56.23 1x5w s PHE 38 Cb 0.13 -1.52 -0.04 0.00 -0.57 0.00 0.00 43.02 41.01 1x5w s PHE 38 CO 0.77 -0.29 0.08 0.15 -0.10 0.00 0.00 175.22 175.83 1x5w s LYS 39 N 0.11 1.18 0.26 0.44 1.02 -1.26 -1.70 119.74 119.79 1x5w s LYS 39 Ca -0.10 -1.60 0.02 0.00 0.02 0.00 0.00 55.97 54.31 1x5w s LYS 39 Cb -0.15 0.01 -0.03 0.00 -0.52 0.00 0.00 37.83 37.13 1x5w s LYS 39 CO 0.05 -0.28 0.43 0.00 -0.92 0.00 0.00 175.35 174.63 1x5w n ASN 41 N -1.28 2.04 -0.06 0.00 5.15 -1.26 -4.60 115.26 115.26 1x5w n ASN 41 Ca -0.06 -0.06 -0.14 0.00 -0.60 0.00 0.00 54.58 53.72 1x5w n ASN 41 Cb 0.56 0.19 -0.07 0.00 -0.53 0.00 0.00 39.78 39.93 1x5w n ASN 41 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 1x5w h TYR 42 N 0.00 0.60 -2.38 1.20 -1.99 -1.97 -3.47 116.97 108.96 1x5w h TYR 42 Ca -0.41 -0.20 -0.58 0.00 2.00 0.00 0.00 58.73 59.54 1x5w h TYR 42 Cb 1.76 -0.12 -0.13 0.00 2.00 0.00 0.00 36.73 40.24 1x5w h TYR 42 CO 0.01 0.90 -0.51 0.00 -0.00 0.00 0.00 178.16 178.56 1x5w n SER 44 N -1.33 5.98 -4.63 0.00 2.88 -1.26 -4.36 113.62 110.90 1x5w n SER 44 Ca -0.07 -2.80 -0.40 0.00 -1.33 0.00 0.00 58.87 54.27 1x5w n SER 44 Cb 0.65 -1.13 -0.07 0.00 -0.75 0.00 0.00 64.21 62.91 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 -0.95 3.29 -0.12 0.66 2.19 -1.26 -4.94 117.98 116.85 1x5w s PHE 45 Ca 0.25 0.69 0.02 0.00 0.33 0.00 0.00 56.93 58.22 1x5w s PHE 45 Cb 0.17 -2.72 0.01 0.00 -1.31 0.00 0.00 43.02 39.18 1x5w s PHE 45 CO -0.02 -0.24 -0.18 0.16 1.83 0.00 0.00 175.22 176.76 1x5w s ASP 46 N 1.44 2.72 0.07 6.13 1.47 -1.26 0.85 116.67 128.09 1x5w s ASP 46 Ca 0.22 -0.50 0.06 0.00 1.18 0.00 0.00 52.55 53.51 1x5w s ASP 46 Cb -0.16 -1.24 -0.03 0.00 -0.34 0.00 0.00 42.92 41.16 1x5w s ASP 46 CO 0.09 0.06 -0.17 0.28 0.68 0.00 0.00 175.17 176.11 1x5w s THR 47 N 0.83 1.33 -0.31 2.11 -1.32 -0.69 -5.00 115.64 112.60 1x5w s THR 47 Ca -0.09 -1.27 -0.00 0.00 -1.21 0.00 0.00 61.69 59.12 1x5w s THR 47 Cb -0.16 -1.22 0.27 0.00 -1.51 0.00 0.00 72.50 69.88 1x5w s THR 47 CO -0.00 -0.07 1.87 0.29 -2.21 0.00 0.00 174.62 174.49 1x5w n LYS 48 N 1.46 1.81 -3.66 7.08 5.02 -1.26 -3.23 118.16 125.38 1x5w n LYS 48 Ca -0.19 -1.66 -0.13 0.00 -2.02 0.00 0.00 58.31 54.30 1x5w n LYS 48 Cb 0.54 -1.65 -0.08 0.00 -0.02 0.00 0.00 35.03 33.82 1x5w n LYS 48 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1x5w s GLN 49 N -1.91 0.71 0.08 1.97 1.11 -1.26 -4.97 119.66 115.39 1x5w s GLN 49 Ca 0.32 0.87 -0.17 0.00 0.01 0.00 0.00 55.36 56.39 1x5w s GLN 49 Cb 0.26 0.34 -0.10 0.00 -1.01 0.00 0.00 33.01 32.49 1x5w s GLN 49 CO 0.01 -0.09 1.40 -1.00 0.01 0.00 0.00 175.29 175.62 1x5w h PRO 50 N 5.25 0.59 -0.62 2.91 0.13 -1.98 -2.98 132.00 135.29 1x5w h PRO 50 Ca -0.28 -0.31 -0.06 0.00 -0.87 0.00 0.00 66.00 64.47 1x5w h PRO 50 Cb 1.17 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1x5w h PRO 50 CO 0.12 0.90 0.13 0.66 -0.23 0.00 0.00 178.00 179.58 1x5w h SER 51 N 0.29 0.94 -0.14 1.44 4.64 -1.99 -2.27 113.55 116.45 1x5w h SER 51 Ca 0.04 -0.19 0.01 0.00 -0.47 0.00 0.00 61.79 61.18 1x5w h SER 51 Cb 0.79 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 1x5w h SER 51 CO 0.06 0.92 0.05 0.78 -0.87 0.00 0.00 176.83 177.77 1x5w h ASN 52 N 0.94 0.06 0.63 4.97 4.21 -1.97 -1.71 115.58 122.71 1x5w h ASN 52 Ca 0.20 0.01 -0.03 0.00 1.21 0.00 0.00 56.30 57.69 1x5w h ASN 52 Cb 0.36 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.57 1x5w h ASN 52 CO 0.00 0.06 -0.30 0.25 -1.29 0.00 0.00 177.43 176.15 1x5w h LEU 53 N 0.13 -0.71 -0.90 1.61 5.85 -1.37 0.29 115.31 120.20 1x5w h LEU 53 Ca 0.06 0.02 0.13 0.00 0.84 0.00 0.00 57.88 58.94 1x5w h LEU 53 Cb 0.03 0.18 -0.14 0.00 0.37 0.00 0.00 40.66 41.10 1x5w h LEU 53 CO -0.06 -0.49 -0.42 0.77 -0.34 0.00 0.00 178.44 177.90 1x5w h SER 54 N -0.88 -1.53 -0.67 1.25 4.64 -1.42 0.43 113.55 115.37 1x5w h SER 54 Ca -0.09 0.30 -0.03 0.00 -0.47 0.00 0.00 61.79 61.50 1x5w h SER 54 Cb 0.65 0.76 -0.03 0.00 -0.31 0.00 0.00 62.40 63.46 1x5w h SER 54 CO 0.14 -0.29 0.30 0.11 -0.87 0.00 0.00 176.83 176.23 1x5w h LYS 55 N -0.05 0.99 -0.83 4.77 1.57 -1.29 -2.53 116.57 119.20 1x5w h LYS 55 Ca 0.29 -0.16 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1x5w h LYS 55 Cb 0.56 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 1x5w h LYS 55 CO -0.91 0.80 0.54 1.25 -0.57 0.00 0.00 179.45 180.56 1x5w h HIS 56 N 0.94 0.91 0.26 -1.35 -0.00 0.35 0.33 115.15 116.60 1x5w h HIS 56 Ca 0.23 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.62 1x5w h HIS 56 Cb 0.16 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.26 1x5w h HIS 56 CO 0.01 0.47 -0.20 0.52 -0.00 0.00 0.00 177.93 178.73 1x5w h MET 57 N 0.89 -0.45 -0.07 5.26 2.86 -0.14 -0.53 114.93 122.75 1x5w h MET 57 Ca 0.36 0.03 -0.13 0.00 -2.06 0.00 0.00 59.70 57.90 1x5w h MET 57 Cb 0.25 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1x5w h MET 57 CO -0.13 -0.30 -0.54 0.87 1.06 0.00 0.00 176.91 177.87 1x5w h LYS 58 N -0.46 0.20 0.78 1.72 6.56 -1.39 0.20 116.57 124.19 1x5w h LYS 58 Ca -0.02 -0.13 -0.04 0.00 -1.06 0.00 0.00 60.65 59.41 1x5w h LYS 58 Cb 0.41 0.01 0.01 0.00 -0.57 0.00 0.00 32.23 32.09 1x5w h LYS 58 CO -0.01 0.70 -0.37 -0.22 -2.06 0.00 0.00 179.45 177.49 1x5w h LYS 59 N 0.16 -1.01 0.03 3.15 3.11 -0.04 -2.07 116.57 119.89 1x5w h LYS 59 Ca 0.00 0.07 -0.00 0.00 -2.81 0.00 0.00 60.65 57.91 1x5w h LYS 59 Cb 1.01 0.23 0.00 0.00 -1.00 0.00 0.00 32.23 32.47 1x5w h LYS 59 CO 0.08 -0.67 -0.01 0.74 -2.81 0.00 0.00 179.45 176.78 1x5w h PHE 60 N -1.06 -0.04 -0.14 1.91 0.04 -1.18 -3.34 116.94 113.13 1x5w h PHE 60 Ca -0.11 -0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.48 1x5w h PHE 60 Cb 0.80 0.01 -0.07 0.00 2.20 0.00 0.00 35.95 38.90 1x5w h PHE 60 CO 0.05 -0.02 -0.15 0.72 -0.60 0.00 0.00 178.31 178.31 1x5w n HIS 61 N -4.71 0.26 -0.99 -0.55 8.25 0.70 -4.52 115.22 113.65 1x5w n HIS 61 Ca -0.00 -1.44 -0.23 0.00 -0.26 0.00 0.00 57.72 55.78 1x5w n HIS 61 Cb 0.02 -1.23 0.07 0.00 1.12 0.00 0.00 29.99 29.96 1x5w n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5w n GLY 62 N 1.92 4.69 1.64 -1.41 0.00 -0.78 -4.26 105.19 107.00 1x5w n GLY 62 Ca 0.31 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1x5w n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x5w n ASP 63 N -0.33 0.09 -4.58 1.61 8.00 -1.26 -4.95 116.55 115.14 1x5w n ASP 63 Ca 0.45 0.12 -0.33 0.00 0.71 0.00 0.00 54.79 55.74 1x5w n ASP 63 Cb 0.76 0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.87 1x5w n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x5w s MET 64 N -2.00 3.02 0.37 -1.24 0.23 -1.26 -4.95 119.30 113.47 1x5w s MET 64 Ca 0.00 -1.33 -0.22 0.00 -1.03 0.00 0.00 55.69 53.11 1x5w s MET 64 Cb 0.00 -5.32 -0.10 0.00 -1.53 0.00 0.00 34.83 27.87 1x5w s MET 64 CO 0.00 -3.29 0.92 -1.12 -2.03 0.00 0.00 175.02 169.49 1x5w s SER 65 N 5.86 7.07 0.00 -1.18 0.01 -1.26 -5.04 113.70 119.16 1x5w s SER 65 Ca 0.63 1.69 0.00 0.00 1.31 0.00 0.00 55.95 59.58 1x5w s SER 65 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1x5w s SER 65 CO 0.09 -0.23 0.16 0.61 0.41 0.00 0.00 173.24 174.28 1x5w n GLY 66 N -0.13 -2.49 3.56 3.44 0.00 -1.26 -4.27 105.19 104.04 1x5w n GLY 66 Ca 0.04 0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1x5w n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5w s PRO 67 N -0.32 2.55 0.13 1.61 0.04 -1.26 -4.46 135.00 133.30 1x5w s PRO 67 Ca 0.00 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1x5w s PRO 67 Cb 0.00 -5.06 0.00 0.00 0.04 0.00 0.00 34.50 29.48 1x5w s PRO 67 CO 0.00 -3.39 0.00 0.45 0.04 0.00 0.00 177.00 174.10 1x5w n SER 68 N 13.99 0.18 -3.90 6.66 2.88 -1.26 -5.04 113.62 127.13 1x5w n SER 68 Ca 0.40 0.22 -0.29 0.00 -1.33 0.00 0.00 58.87 57.87 1x5w n SER 68 Cb 0.47 0.09 0.02 0.00 -0.75 0.00 0.00 64.21 64.04 1x5w n SER 68 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x5w n SER 69 N -3.17 -4.02 0.00 -3.46 7.64 -1.26 -5.19 113.62 104.16 1x5w n SER 69 Ca 0.00 -0.81 0.16 0.00 1.01 0.00 0.00 58.87 59.23 1x5w n SER 69 Cb 0.08 -3.82 0.93 0.00 -1.01 0.00 0.00 64.21 60.38 1x5w n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64