#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 1.94 -0.27 1.61 0.01 -1.26 -5.13 113.70 110.60 1x5w s SER 2 Ca 0.00 -0.42 -0.24 0.00 1.31 0.00 0.00 55.95 56.60 1x5w s SER 2 Cb 0.00 -0.06 0.09 0.00 0.21 0.00 0.00 66.02 66.26 1x5w s SER 2 CO 0.00 -0.33 0.82 -0.44 0.41 0.00 0.00 173.24 173.69 1x5w s SER 3 N 2.19 -0.67 0.00 2.44 0.01 -1.26 -5.13 113.70 111.29 1x5w s SER 3 Ca 0.03 1.27 0.00 0.00 1.31 0.00 0.00 55.95 58.56 1x5w s SER 3 Cb -0.15 1.28 0.00 0.00 0.21 0.00 0.00 66.02 67.36 1x5w s SER 3 CO -0.09 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.95 1x5w n GLY 4 N 2.68 2.33 3.56 3.44 0.00 -1.26 -5.05 105.19 110.90 1x5w n GLY 4 Ca -0.14 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1x5w n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5w s SER 5 N 0.00 5.38 -0.60 1.61 0.01 -1.26 -4.79 113.70 114.05 1x5w s SER 5 Ca 0.00 -0.67 -0.01 0.00 1.31 0.00 0.00 55.95 56.58 1x5w s SER 5 Cb 0.00 -2.56 0.48 0.00 0.21 0.00 0.00 66.02 64.16 1x5w s SER 5 CO 0.00 -2.50 2.01 -1.54 0.41 0.00 0.00 173.24 171.62 1x5w n SER 6 N 12.98 6.79 -4.37 2.44 3.41 -1.26 -4.95 113.62 128.66 1x5w n SER 6 Ca 0.36 -3.71 -0.20 0.00 -0.26 0.00 0.00 58.87 55.06 1x5w n SER 6 Cb 0.48 -0.95 -0.10 0.00 -0.26 0.00 0.00 64.21 63.38 1x5w n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x5w s GLY 7 N -1.61 2.01 0.02 5.00 0.00 -1.26 -5.17 107.32 106.31 1x5w s GLY 7 Ca 0.61 -1.92 -0.27 0.00 0.00 0.00 0.00 44.72 43.14 1x5w s GLY 7 CO 0.02 -1.74 0.79 0.30 0.00 0.00 0.00 173.10 172.47 1x5w s HIS 8 N -3.45 -0.45 0.17 1.90 4.02 -1.26 -4.99 115.29 111.23 1x5w s HIS 8 Ca 0.36 0.41 -0.07 0.00 1.02 0.00 0.00 55.06 56.78 1x5w s HIS 8 Cb 0.08 0.52 0.06 0.00 -1.02 0.00 0.00 32.58 32.21 1x5w s HIS 8 CO 0.15 -0.62 1.52 -1.00 1.02 0.00 0.00 174.74 175.81 1x5w h PRO 9 N 2.19 0.79 -6.34 8.40 0.13 -1.94 -3.45 132.00 131.79 1x5w h PRO 9 Ca -0.26 -0.41 -0.61 0.00 -0.87 0.00 0.00 66.00 63.85 1x5w h PRO 9 Cb 1.24 0.01 -0.24 0.00 0.13 0.00 0.00 31.00 32.14 1x5w h PRO 9 CO 0.34 1.04 -0.85 -1.21 -0.23 0.00 0.00 178.00 177.10 1x5w s GLU 10 N -4.32 1.39 0.10 0.86 2.02 -1.23 -5.10 118.70 112.43 1x5w s GLU 10 Ca -0.10 -1.09 -0.04 0.00 0.02 0.00 0.00 54.97 53.77 1x5w s GLU 10 Cb 0.12 -1.61 -0.03 0.00 0.10 0.00 0.00 34.13 32.71 1x5w s GLU 10 CO 0.86 0.40 0.10 -1.59 0.02 0.00 0.00 175.26 175.05 1x5w s LYS 11 N -1.50 0.84 -0.15 1.61 0.00 -1.26 -2.69 119.74 116.59 1x5w s LYS 11 Ca 0.09 -1.22 -0.15 0.00 0.00 0.00 0.00 55.97 54.69 1x5w s LYS 11 Cb -0.09 0.28 -0.04 0.00 0.00 0.00 0.00 37.83 37.97 1x5w s LYS 11 CO 0.03 -0.24 0.35 0.00 0.00 0.00 0.00 175.35 175.49 1x5w h SER 13 N 6.71 0.00 0.01 0.00 0.02 -2.01 -3.28 113.55 114.99 1x5w h SER 13 Ca -0.41 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1x5w h SER 13 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1x5w h SER 13 CO 0.76 0.17 -0.00 -0.33 -1.14 0.00 0.00 176.83 176.28 1x5w h GLU 14 N 0.00 -0.01 0.00 3.45 4.39 -1.96 -3.48 114.58 116.96 1x5w h GLU 14 Ca -0.00 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 59.26 1x5w h GLU 14 Cb 0.92 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.47 1x5w h GLU 14 CO 0.02 0.77 -0.37 0.00 -1.16 0.00 0.00 179.01 178.27 1x5w n SER 16 N -1.62 5.12 -4.51 0.00 2.88 -1.26 -4.14 113.62 110.08 1x5w n SER 16 Ca -0.05 -2.75 -0.42 0.00 -1.33 0.00 0.00 58.87 54.32 1x5w n SER 16 Cb 0.48 -0.92 -0.09 0.00 -0.75 0.00 0.00 64.21 62.94 1x5w n SER 16 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1x5w s TYR 17 N -1.21 3.19 -0.00 0.66 6.14 -1.26 -4.94 117.35 119.92 1x5w s TYR 17 Ca 0.21 -0.20 0.03 0.00 0.64 0.00 0.00 57.07 57.75 1x5w s TYR 17 Cb 0.17 -2.81 -0.01 0.00 0.42 0.00 0.00 41.96 39.73 1x5w s TYR 17 CO 0.01 -0.59 -0.11 -1.54 0.64 0.00 0.00 175.55 173.97 1x5w s SER 18 N 1.78 1.28 0.19 4.32 1.04 -1.26 -0.50 113.70 120.54 1x5w s SER 18 Ca 0.12 -0.22 0.01 0.00 0.48 0.00 0.00 55.95 56.35 1x5w s SER 18 Cb -0.17 -0.14 -0.05 0.00 0.10 0.00 0.00 66.02 65.77 1x5w s SER 18 CO 0.13 0.12 0.03 0.00 0.98 0.00 0.00 173.24 174.50 1x5w n SER 20 N -0.27 3.53 -3.75 0.00 3.41 -1.26 -3.53 113.62 111.74 1x5w n SER 20 Ca -0.05 -2.34 -0.30 0.00 -0.26 0.00 0.00 58.87 55.92 1x5w n SER 20 Cb 0.64 -0.49 -0.14 0.00 -0.26 0.00 0.00 64.21 63.95 1x5w n SER 20 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x5w s SER 21 N -0.74 3.97 0.08 4.04 0.01 -1.26 -4.97 113.70 114.84 1x5w s SER 21 Ca 0.36 -1.98 -0.16 0.00 1.31 0.00 0.00 55.95 55.47 1x5w s SER 21 Cb 0.23 -0.98 -0.04 0.00 0.21 0.00 0.00 66.02 65.45 1x5w s SER 21 CO 0.16 -0.37 1.16 1.17 0.41 0.00 0.00 173.24 175.77 1x5w n LYS 22 N 4.40 -0.23 -0.24 12.44 4.81 -1.26 0.15 118.16 138.23 1x5w n LYS 22 Ca 0.02 1.14 0.02 0.00 -0.87 0.00 0.00 58.31 58.62 1x5w n LYS 22 Cb 0.40 -1.69 0.10 0.00 0.02 0.00 0.00 35.03 33.86 1x5w n LYS 22 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1x5w h ALA 23 N -0.09 0.56 -0.50 3.14 0.00 -1.99 -0.51 119.26 119.87 1x5w h ALA 23 Ca 0.08 0.26 0.10 0.00 0.00 0.00 0.00 54.91 55.35 1x5w h ALA 23 Cb 0.21 0.50 -0.10 0.00 0.00 0.00 0.00 17.79 18.40 1x5w h ALA 23 CO -0.49 -0.42 -0.27 0.00 0.00 0.00 0.00 179.25 178.07 1x5w h ALA 24 N 1.70 0.02 -0.42 0.00 0.00 -0.71 -1.37 119.26 118.48 1x5w h ALA 24 Ca 0.36 0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.51 1x5w h ALA 24 Cb 0.58 0.64 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 1x5w h ALA 24 CO -0.71 -0.63 -0.25 1.25 0.00 0.00 0.00 179.25 178.91 1x5w h LEU 25 N -0.16 -0.86 -0.90 0.00 5.85 -0.32 -0.83 115.31 118.09 1x5w h LEU 25 Ca 0.22 0.17 0.21 0.00 0.84 0.00 0.00 57.88 59.32 1x5w h LEU 25 Cb 0.51 0.43 -0.17 0.00 0.37 0.00 0.00 40.66 41.81 1x5w h LEU 25 CO -0.59 -0.27 -0.09 -0.09 -0.34 0.00 0.00 178.44 177.05 1x5w h ARG 26 N -0.18 0.03 0.52 1.25 2.43 -1.02 0.37 114.38 117.77 1x5w h ARG 26 Ca 0.19 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1x5w h ARG 26 Cb 0.49 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1x5w h ARG 26 CO -0.52 0.02 -0.25 0.82 -1.51 0.00 0.00 179.97 178.53 1x5w h ILE 27 N 0.03 0.49 -1.01 1.20 2.04 -1.01 -2.70 117.51 116.54 1x5w h ILE 27 Ca 0.49 -0.04 0.30 0.00 1.00 0.00 0.00 64.86 66.61 1x5w h ILE 27 Cb 0.86 0.51 -0.14 0.00 -0.74 0.00 0.00 36.82 37.31 1x5w h ILE 27 CO -0.87 0.01 0.59 -0.74 0.00 0.00 0.00 178.15 177.13 1x5w h HIS 28 N -0.72 0.94 -1.29 1.37 -0.00 -0.49 0.34 115.15 115.30 1x5w h HIS 28 Ca -0.07 0.04 0.39 0.00 -0.00 0.00 0.00 60.37 60.73 1x5w h HIS 28 Cb 0.55 -0.26 -0.11 0.00 -0.00 0.00 0.00 27.41 27.59 1x5w h HIS 28 CO -0.03 -0.09 0.86 0.93 -0.00 0.00 0.00 177.93 179.59 1x5w h GLU 29 N 0.40 0.14 -1.08 5.26 5.08 -0.90 0.40 114.58 123.87 1x5w h GLU 29 Ca 0.70 -0.01 0.31 0.00 -1.00 0.00 0.00 59.36 59.37 1x5w h GLU 29 Cb 1.56 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 30.65 1x5w h GLU 29 CO -0.55 0.09 0.67 0.07 -1.00 0.00 0.00 179.01 178.29 1x5w h ARG 30 N 0.14 0.33 -1.42 2.33 0.11 -0.43 0.27 114.38 115.72 1x5w h ARG 30 Ca 0.75 -0.02 0.43 0.00 0.10 0.00 0.00 59.98 61.23 1x5w h ARG 30 Cb 2.38 -0.08 -0.09 0.00 1.11 0.00 0.00 29.97 33.29 1x5w h ARG 30 CO -0.31 0.22 0.97 0.97 0.10 0.00 0.00 179.97 181.93 1x5w h ILE 31 N 0.34 0.21 -1.34 0.08 2.10 -0.39 0.13 117.51 118.64 1x5w h ILE 31 Ca 0.68 -0.03 -0.60 0.00 1.08 0.00 0.00 64.86 66.00 1x5w h ILE 31 Cb 1.72 0.12 -0.20 0.00 -1.09 0.00 0.00 36.82 37.38 1x5w h ILE 31 CO -0.43 0.02 0.74 1.41 -1.08 0.00 0.00 178.15 178.81 1x5w n HIS 32 N -4.37 2.05 -4.22 2.19 8.25 0.96 -4.94 115.22 115.13 1x5w n HIS 32 Ca 0.35 -2.12 -0.23 0.00 -0.26 0.00 0.00 57.72 55.45 1x5w n HIS 32 Cb 1.46 -1.37 -0.07 0.00 1.12 0.00 0.00 29.99 31.14 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 -2.40 0.00 0.00 0.00 2.01 -1.26 -5.07 115.64 108.92 1x5w s THR 34 Ca 0.35 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.31 1x5w s THR 34 Cb -0.04 -0.99 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1x5w s THR 34 CO 0.21 -0.02 0.00 0.47 -0.69 0.00 0.00 174.62 174.59 1x5w n ASP 35 N 0.59 1.73 -4.66 3.53 8.00 -1.26 -5.09 116.55 119.40 1x5w n ASP 35 Ca -0.19 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.01 1x5w n ASP 35 Cb 0.59 0.03 -0.09 0.00 -0.02 0.00 0.00 41.12 41.63 1x5w n ASP 35 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1x5w s ARG 36 N -1.42 2.47 -0.02 -1.24 1.81 -1.26 -5.05 118.95 114.24 1x5w s ARG 36 Ca 0.00 -0.85 -0.25 0.00 -1.72 0.00 0.00 55.73 52.90 1x5w s ARG 36 Cb 0.00 -2.50 -0.19 0.00 -0.45 0.00 0.00 34.95 31.81 1x5w s ARG 36 CO 0.00 0.54 1.22 -1.00 -0.68 0.00 0.00 175.30 175.38 1x5w h PRO 37 N 3.62 -0.07 -6.01 3.54 0.13 -1.85 -3.45 132.00 127.90 1x5w h PRO 37 Ca -0.48 0.01 -0.65 0.00 -0.87 0.00 0.00 66.00 64.00 1x5w h PRO 37 Cb 1.17 0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 1x5w h PRO 37 CO 0.57 0.38 -0.58 -0.06 -0.23 0.00 0.00 178.00 178.09 1x5w s PHE 38 N -4.21 3.28 0.23 1.56 0.08 -1.19 -5.07 117.98 112.67 1x5w s PHE 38 Ca -0.15 0.20 0.02 0.00 0.12 0.00 0.00 56.93 57.11 1x5w s PHE 38 Cb 0.02 -1.73 -0.05 0.00 -0.57 0.00 0.00 43.02 40.69 1x5w s PHE 38 CO 0.63 0.55 0.06 0.15 -0.10 0.00 0.00 175.22 176.51 1x5w s LYS 39 N -1.81 1.31 -0.01 0.44 3.01 -1.26 -2.30 119.74 119.12 1x5w s LYS 39 Ca 0.24 -1.69 -0.02 0.00 -1.01 0.00 0.00 55.97 53.49 1x5w s LYS 39 Cb -0.12 -0.29 -0.04 0.00 -1.01 0.00 0.00 37.83 36.37 1x5w s LYS 39 CO 0.15 -0.23 0.13 0.00 0.51 0.00 0.00 175.35 175.90 1x5w n ASN 41 N 1.11 1.27 0.00 0.00 4.13 -1.26 -4.39 115.26 116.11 1x5w n ASN 41 Ca -0.12 0.23 -0.13 0.00 1.68 0.00 0.00 54.58 56.24 1x5w n ASN 41 Cb 0.53 -0.20 -0.10 0.00 -1.54 0.00 0.00 39.78 38.47 1x5w n ASN 41 CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 1x5w h TYR 42 N 0.02 -0.03 -2.17 3.10 -1.99 -1.96 -3.47 116.97 110.47 1x5w h TYR 42 Ca -0.40 -0.00 -0.56 0.00 2.00 0.00 0.00 58.73 59.77 1x5w h TYR 42 Cb 2.04 0.01 -0.13 0.00 2.00 0.00 0.00 36.73 40.65 1x5w h TYR 42 CO 0.03 0.42 -0.55 0.00 -0.00 0.00 0.00 178.16 178.05 1x5w n SER 44 N -1.06 5.44 -4.83 0.00 7.64 -1.26 -4.26 113.62 115.29 1x5w n SER 44 Ca -0.07 -2.55 -0.36 0.00 1.01 0.00 0.00 58.87 56.89 1x5w n SER 44 Cb 0.66 -1.30 -0.07 0.00 -1.01 0.00 0.00 64.21 62.49 1x5w n SER 44 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1x5w s PHE 45 N 0.33 3.50 -0.08 1.43 2.19 -1.26 -4.95 117.98 119.13 1x5w s PHE 45 Ca 0.45 0.45 -0.03 0.00 0.33 0.00 0.00 56.93 58.13 1x5w s PHE 45 Cb 0.23 -1.91 0.04 0.00 -1.31 0.00 0.00 43.02 40.08 1x5w s PHE 45 CO -0.02 0.67 0.17 0.16 1.83 0.00 0.00 175.22 178.03 1x5w s ASP 46 N -0.97 0.19 0.11 6.13 1.47 -1.26 0.18 116.67 122.52 1x5w s ASP 46 Ca 0.14 0.36 0.09 0.00 1.18 0.00 0.00 52.55 54.33 1x5w s ASP 46 Cb -0.12 0.29 -0.04 0.00 -0.34 0.00 0.00 42.92 42.71 1x5w s ASP 46 CO 0.04 -0.19 -0.23 0.28 0.68 0.00 0.00 175.17 175.75 1x5w s THR 47 N 1.65 1.88 -0.02 2.11 -1.32 -0.97 -4.98 115.64 113.99 1x5w s THR 47 Ca -0.04 -1.60 -0.24 0.00 -1.21 0.00 0.00 61.69 58.59 1x5w s THR 47 Cb -0.12 -1.69 -0.18 0.00 -1.51 0.00 0.00 72.50 69.01 1x5w s THR 47 CO -0.06 -0.01 1.15 0.50 -2.21 0.00 0.00 174.62 173.99 1x5w h LYS 48 N 4.04 -0.19 -6.80 7.08 3.64 -1.97 -3.14 116.57 119.23 1x5w h LYS 48 Ca -0.48 0.01 -0.52 0.00 -1.27 0.00 0.00 60.65 58.40 1x5w h LYS 48 Cb 1.18 0.04 0.05 0.00 -0.41 0.00 0.00 32.23 33.09 1x5w h LYS 48 CO 0.39 0.22 0.63 -1.14 -2.27 0.00 0.00 179.45 177.29 1x5w s GLN 49 N -4.18 4.40 0.20 1.90 0.74 -1.26 -4.53 119.66 116.94 1x5w s GLN 49 Ca -0.14 2.12 -0.03 0.00 0.05 0.00 0.00 55.36 57.35 1x5w s GLN 49 Cb 0.02 -3.13 0.15 0.00 1.10 0.00 0.00 33.01 31.15 1x5w s GLN 49 CO 0.58 -0.17 1.56 -1.00 -0.55 0.00 0.00 175.29 175.70 1x5w h PRO 50 N 4.18 0.63 -0.39 1.67 0.13 -2.00 -3.18 132.00 133.04 1x5w h PRO 50 Ca -0.47 -0.33 -0.12 0.00 -0.87 0.00 0.00 66.00 64.20 1x5w h PRO 50 Cb 1.22 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1x5w h PRO 50 CO 0.70 0.93 -0.23 0.77 -0.23 0.00 0.00 178.00 179.94 1x5w h SER 51 N 0.52 0.88 -0.47 1.44 0.02 -1.98 -3.08 113.55 110.88 1x5w h SER 51 Ca 0.04 -0.42 0.09 0.00 -0.84 0.00 0.00 61.79 60.66 1x5w h SER 51 Cb 0.94 -0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.16 1x5w h SER 51 CO 0.08 1.11 -0.02 0.78 -1.14 0.00 0.00 176.83 177.64 1x5w h ASN 52 N 0.65 -0.24 0.03 3.07 2.35 -1.95 -1.17 115.58 118.32 1x5w h ASN 52 Ca 0.08 0.12 0.02 0.00 -0.55 0.00 0.00 56.30 55.97 1x5w h ASN 52 Cb 0.80 0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.36 1x5w h ASN 52 CO 0.07 -0.08 -0.17 0.25 -1.65 0.00 0.00 177.43 175.85 1x5w h LEU 53 N 0.09 -0.48 -0.99 1.61 5.85 -1.54 0.13 115.31 119.97 1x5w h LEU 53 Ca 0.23 0.07 0.15 0.00 0.84 0.00 0.00 57.88 59.17 1x5w h LEU 53 Cb 0.35 0.20 -0.10 0.00 0.37 0.00 0.00 40.66 41.48 1x5w h LEU 53 CO -0.41 -0.23 0.61 0.77 -0.34 0.00 0.00 178.44 178.84 1x5w h SER 54 N -0.29 0.83 -0.31 1.25 4.64 -1.31 0.23 113.55 118.59 1x5w h SER 54 Ca 0.04 0.07 -0.15 0.00 -0.47 0.00 0.00 61.79 61.29 1x5w h SER 54 Cb 0.34 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1x5w h SER 54 CO -0.14 0.37 -0.40 0.11 -0.87 0.00 0.00 176.83 175.91 1x5w h LYS 55 N 0.86 0.82 -0.68 4.77 1.57 -0.52 -2.88 116.57 120.52 1x5w h LYS 55 Ca 0.53 -0.47 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 1x5w h LYS 55 Cb 0.69 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 1x5w h LYS 55 CO -0.33 1.10 0.11 1.25 -0.57 0.00 0.00 179.45 181.02 1x5w h HIS 56 N 0.60 1.19 0.27 -1.35 2.76 0.68 0.25 115.15 119.55 1x5w h HIS 56 Ca 0.04 -0.17 -0.00 0.00 -2.20 0.00 0.00 60.37 58.04 1x5w h HIS 56 Cb 0.99 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 1x5w h HIS 56 CO 0.07 0.99 -0.20 0.52 -1.30 0.00 0.00 177.93 178.02 1x5w h MET 57 N 1.05 -0.45 -0.41 5.26 2.86 -0.58 -1.93 114.93 120.73 1x5w h MET 57 Ca 0.21 0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.72 1x5w h MET 57 Cb 0.44 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1x5w h MET 57 CO 0.01 -0.30 -0.34 0.87 1.06 0.00 0.00 176.91 178.21 1x5w h LYS 58 N -0.47 0.95 -0.42 1.72 1.57 -1.46 1.59 116.57 120.06 1x5w h LYS 58 Ca -0.02 -0.48 0.09 0.00 -1.87 0.00 0.00 60.65 58.37 1x5w h LYS 58 Cb 0.41 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.63 1x5w h LYS 58 CO -0.00 1.14 -0.21 -0.22 -0.57 0.00 0.00 179.45 179.59 1x5w h LYS 59 N 0.79 -0.13 0.00 3.15 3.64 -0.32 -1.23 116.57 122.46 1x5w h LYS 59 Ca 0.07 0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.26 1x5w h LYS 59 Cb 0.94 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 1x5w h LYS 59 CO 0.09 -0.08 -1.61 1.19 -2.27 0.00 0.00 179.45 176.77 1x5w n PHE 60 N -5.39 0.11 -1.99 1.91 3.72 -0.74 -4.60 117.46 110.48 1x5w n PHE 60 Ca 0.02 0.05 -0.37 0.00 -0.05 0.00 0.00 57.45 57.10 1x5w n PHE 60 Cb 0.30 -0.75 -0.01 0.00 -0.94 0.00 0.00 39.48 38.08 1x5w n PHE 60 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1x5w n HIS 61 N -4.38 2.42 -4.21 1.38 8.25 0.54 -4.96 115.22 114.25 1x5w n HIS 61 Ca -0.31 -2.44 -0.34 0.00 -0.26 0.00 0.00 57.72 54.37 1x5w n HIS 61 Cb 0.66 -1.47 -0.08 0.00 1.12 0.00 0.00 29.99 30.22 1x5w n HIS 61 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1x5w s GLY 62 N -0.23 1.94 -1.49 -1.41 0.00 -0.47 -4.11 107.32 101.55 1x5w s GLY 62 Ca 0.52 -0.85 -0.05 0.00 0.00 0.00 0.00 44.72 44.35 1x5w s GLY 62 CO -0.19 -0.67 0.62 1.22 0.00 0.00 0.00 173.10 174.08 1x5w n ASP 63 N 1.63 -6.01 -2.10 1.64 9.92 -1.26 -4.88 116.55 115.49 1x5w n ASP 63 Ca -0.16 -0.29 -0.24 0.00 -0.53 0.00 0.00 54.79 53.57 1x5w n ASP 63 Cb 0.53 -4.82 0.11 0.00 -0.64 0.00 0.00 41.12 36.31 1x5w n ASP 63 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1x5w n MET 64 N -3.97 2.21 -4.06 -1.24 2.81 -1.26 -4.86 117.12 106.74 1x5w n MET 64 Ca -0.10 -2.59 -0.33 0.00 -1.81 0.00 0.00 57.70 52.86 1x5w n MET 64 Cb 0.61 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 1x5w n MET 64 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1x5w n SER 65 N -0.68 -4.11 0.00 7.83 7.64 -1.26 -4.91 113.62 118.13 1x5w n SER 65 Ca 0.51 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 59.50 1x5w n SER 65 Cb 1.07 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 60.92 1x5w n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5w n GLY 66 N -1.55 -0.10 3.75 0.23 0.00 -1.26 -4.96 105.19 101.29 1x5w n GLY 66 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.75 1.81 0.32 1.61 0.04 -1.26 -4.96 135.00 131.80 1x5w s PRO 67 Ca 0.00 1.01 -0.29 0.00 0.04 0.00 0.00 61.00 61.76 1x5w s PRO 67 Cb 0.00 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.57 1x5w s PRO 67 CO 0.00 -1.91 1.58 -1.12 0.04 0.00 0.00 177.00 175.59 1x5w s SER 68 N -3.41 6.34 -0.18 6.66 0.01 -1.26 -4.94 113.70 116.92 1x5w s SER 68 Ca 0.62 3.00 -0.19 0.00 1.31 0.00 0.00 55.95 60.69 1x5w s SER 68 Cb -0.17 -2.64 -0.16 0.00 0.21 0.00 0.00 66.02 63.25 1x5w s SER 68 CO 0.56 -0.92 0.22 0.77 0.41 0.00 0.00 173.24 174.29 1x5w h SER 69 N 4.36 0.00 0.00 2.44 4.64 -1.97 -3.54 113.55 119.48 1x5w h SER 69 Ca -0.48 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.38 1x5w h SER 69 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1x5w h SER 69 CO 0.76 1.21 0.00 0.61 -0.87 0.00 0.00 176.83 178.53