#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 -0.09 0.25 1.61 1.04 -1.26 -5.04 113.70 110.21 1x5w s SER 2 Ca 0.00 -0.91 -0.04 0.00 0.48 0.00 0.00 55.95 55.48 1x5w s SER 2 Cb 0.00 0.78 0.48 0.00 0.10 0.00 0.00 66.02 67.37 1x5w s SER 2 CO 0.00 -1.50 1.72 0.77 0.98 0.00 0.00 173.24 175.21 1x5w h SER 3 N 2.00 0.27 0.00 7.02 4.64 -2.14 -3.45 113.55 121.90 1x5w h SER 3 Ca -0.27 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1x5w h SER 3 Cb 1.25 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1x5w h SER 3 CO 0.34 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 1x5w n GLY 4 N -1.33 -0.24 2.58 -0.77 0.00 -1.26 -5.10 105.19 99.08 1x5w n GLY 4 Ca 0.15 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 4.14 -3.63 1.61 2.88 -1.26 -5.02 113.62 112.34 1x5w n SER 5 Ca 0.00 -3.41 -0.02 0.00 -1.33 0.00 0.00 58.87 54.11 1x5w n SER 5 Cb 0.00 -0.79 -0.01 0.00 -0.75 0.00 0.00 64.21 62.66 1x5w n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5w s SER 6 N -2.18 -0.13 0.00 -3.46 0.15 -1.26 -5.16 113.70 101.66 1x5w s SER 6 Ca 0.37 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.88 1x5w s SER 6 Cb 0.11 0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 1x5w s SER 6 CO -0.01 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.62 1x5w n GLY 7 N -0.37 -0.26 3.62 9.45 0.00 -1.26 -5.13 105.19 111.24 1x5w n GLY 7 Ca -0.06 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 2.66 0.06 1.61 4.02 -1.26 -5.06 115.29 117.33 1x5w s HIS 8 Ca 0.00 -0.22 -0.18 0.00 1.02 0.00 0.00 55.06 55.67 1x5w s HIS 8 Cb 0.00 -1.21 -0.12 0.00 -1.02 0.00 0.00 32.58 30.22 1x5w s HIS 8 CO 0.00 0.60 1.37 -1.00 1.02 0.00 0.00 174.74 176.73 1x5w h PRO 9 N 2.21 0.48 -5.29 8.40 0.13 -1.96 -3.43 132.00 132.53 1x5w h PRO 9 Ca -0.45 -0.25 -0.61 0.00 -0.87 0.00 0.00 66.00 63.83 1x5w h PRO 9 Cb 1.24 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 1x5w h PRO 9 CO 0.59 0.82 -0.50 -1.21 -0.23 0.00 0.00 178.00 177.48 1x5w s GLU 10 N -4.32 4.13 0.39 0.86 0.41 -1.15 -5.03 118.70 113.99 1x5w s GLU 10 Ca -0.13 -0.22 0.08 0.00 -0.41 0.00 0.00 54.97 54.28 1x5w s GLU 10 Cb 0.06 -3.39 -0.08 0.00 -1.78 0.00 0.00 34.13 28.95 1x5w s GLU 10 CO 0.78 0.33 -0.02 0.21 -0.49 0.00 0.00 175.26 176.07 1x5w s LYS 11 N 0.28 1.92 -0.13 1.61 2.20 -1.26 -0.80 119.74 123.55 1x5w s LYS 11 Ca 0.08 -2.06 -0.09 0.00 -0.36 0.00 0.00 55.97 53.54 1x5w s LYS 11 Cb -0.11 -1.64 -0.05 0.00 -1.51 0.00 0.00 37.83 34.52 1x5w s LYS 11 CO -0.01 -0.00 0.18 0.00 -0.36 0.00 0.00 175.35 175.16 1x5w h SER 13 N 5.62 0.00 0.06 0.00 0.87 -2.01 -3.34 113.55 114.75 1x5w h SER 13 Ca -0.49 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.07 1x5w h SER 13 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1x5w h SER 13 CO 0.65 0.49 -0.03 -0.33 -0.53 0.00 0.00 176.83 177.08 1x5w h GLU 14 N 0.00 -0.08 0.00 2.24 3.07 -1.95 -3.49 114.58 114.37 1x5w h GLU 14 Ca -0.00 0.01 -0.33 0.00 -0.50 0.00 0.00 59.36 58.53 1x5w h GLU 14 Cb 1.12 0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 29.00 1x5w h GLU 14 CO 0.06 -0.05 -0.23 0.00 -1.40 0.00 0.00 179.01 177.39 1x5w n SER 16 N -1.30 3.02 -4.69 0.00 7.64 -1.26 -3.97 113.62 113.05 1x5w n SER 16 Ca -0.09 -2.41 -0.41 0.00 1.01 0.00 0.00 58.87 56.97 1x5w n SER 16 Cb 0.33 -0.59 -0.04 0.00 -1.01 0.00 0.00 64.21 62.90 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 -1.05 3.53 0.02 1.43 6.14 -1.26 -4.84 117.35 121.32 1x5w s TYR 17 Ca 0.16 1.40 0.03 0.00 0.64 0.00 0.00 57.07 59.30 1x5w s TYR 17 Cb 0.13 -3.00 -0.01 0.00 0.42 0.00 0.00 41.96 39.50 1x5w s TYR 17 CO 0.03 -0.09 -0.10 -1.54 0.64 0.00 0.00 175.55 174.49 1x5w s SER 18 N 1.01 1.14 0.41 4.32 1.04 -1.26 0.16 113.70 120.53 1x5w s SER 18 Ca 0.42 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.57 1x5w s SER 18 Cb -0.18 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 65.82 1x5w s SER 18 CO 0.18 0.02 0.07 0.00 0.98 0.00 0.00 173.24 174.49 1x5w n SER 20 N -1.11 7.22 -2.57 0.00 2.88 -1.26 -2.93 113.62 115.85 1x5w n SER 20 Ca -0.08 -3.57 0.00 0.00 -1.33 0.00 0.00 58.87 53.89 1x5w n SER 20 Cb 0.66 -1.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.13 1x5w n SER 20 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1x5w n SER 21 N -0.56 -0.83 -0.06 -3.46 3.41 -1.26 -5.00 113.62 105.87 1x5w n SER 21 Ca 0.53 -1.29 -0.07 0.00 -0.26 0.00 0.00 58.87 57.78 1x5w n SER 21 Cb 0.67 1.31 -0.06 0.00 -0.26 0.00 0.00 64.21 65.86 1x5w n SER 21 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1x5w n LYS 22 N -0.51 1.09 -0.07 4.33 4.81 -1.26 -4.42 118.16 122.14 1x5w n LYS 22 Ca 0.01 0.04 -0.12 0.00 -0.87 0.00 0.00 58.31 57.37 1x5w n LYS 22 Cb 0.34 -1.25 -0.06 0.00 0.02 0.00 0.00 35.03 34.09 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 0.18 0.27 -0.39 3.14 0.00 -2.00 -3.02 119.26 117.43 1x5w h ALA 23 Ca -0.27 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.42 1x5w h ALA 23 Cb 1.49 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.17 1x5w h ALA 23 CO -0.02 0.08 0.09 0.00 0.00 0.00 0.00 179.25 179.40 1x5w h ALA 24 N 0.70 0.43 -0.84 0.00 0.00 -1.98 -1.87 119.26 115.70 1x5w h ALA 24 Ca 0.04 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.14 1x5w h ALA 24 Cb 0.56 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.35 1x5w h ALA 24 CO 0.03 -0.31 0.46 1.25 0.00 0.00 0.00 179.25 180.67 1x5w h LEU 25 N 0.22 0.62 -1.05 0.00 5.85 -1.76 -0.44 115.31 118.74 1x5w h LEU 25 Ca 0.19 0.07 0.13 0.00 0.84 0.00 0.00 57.88 59.10 1x5w h LEU 25 Cb 0.21 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1x5w h LEU 25 CO -0.23 0.31 0.62 -0.09 -0.34 0.00 0.00 178.44 178.71 1x5w h ARG 26 N 0.72 0.92 0.00 1.25 2.43 -1.21 0.28 114.38 118.76 1x5w h ARG 26 Ca 0.43 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1x5w h ARG 26 Cb 0.50 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1x5w h ARG 26 CO -0.30 0.61 0.00 0.82 -1.51 0.00 0.00 179.97 179.59 1x5w h ILE 27 N 0.94 0.00 0.22 1.20 2.04 -0.94 -3.13 117.51 117.86 1x5w h ILE 27 Ca 0.49 -0.59 -0.34 0.00 1.00 0.00 0.00 64.86 65.43 1x5w h ILE 27 Cb 0.53 1.55 0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1x5w h ILE 27 CO -0.26 0.00 -1.58 -0.74 0.00 0.00 0.00 178.15 175.58 1x5w h HIS 28 N 0.00 0.86 -1.35 1.37 -0.00 -0.07 -3.30 115.15 112.65 1x5w h HIS 28 Ca 0.00 -0.63 0.39 0.00 -0.00 0.00 0.00 60.37 60.13 1x5w h HIS 28 Cb 0.62 -0.03 -0.06 0.00 -0.00 0.00 0.00 27.41 27.93 1x5w h HIS 28 CO 0.00 1.61 0.97 0.93 -0.00 0.00 0.00 177.93 181.43 1x5w h GLU 29 N 0.11 0.02 -0.95 5.26 5.08 -1.13 0.39 114.58 123.36 1x5w h GLU 29 Ca -0.29 -0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.28 1x5w h GLU 29 Cb 2.12 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 31.29 1x5w h GLU 29 CO 0.23 0.02 0.62 0.00 -1.00 0.00 0.00 179.01 178.87 1x5w h ARG 30 N 0.02 0.46 -1.31 2.33 -0.00 -1.69 0.28 114.38 114.47 1x5w h ARG 30 Ca 0.65 -0.03 0.39 0.00 -0.50 0.00 0.00 59.98 60.49 1x5w h ARG 30 Cb 2.56 -0.10 -0.09 0.00 0.00 0.00 0.00 29.97 32.33 1x5w h ARG 30 CO -0.04 0.31 0.89 0.97 0.00 0.00 0.00 179.97 182.10 1x5w h ILE 31 N 0.48 0.29 -2.67 2.04 2.10 -0.46 -2.97 117.51 116.31 1x5w h ILE 31 Ca 0.51 -0.04 -0.76 0.00 1.08 0.00 0.00 64.86 65.65 1x5w h ILE 31 Cb 1.18 0.15 -0.21 0.00 -1.09 0.00 0.00 36.82 36.85 1x5w h ILE 31 CO -0.23 0.02 1.04 1.41 -1.08 0.00 0.00 178.15 179.31 1x5w n HIS 32 N -4.42 5.04 -3.63 2.19 8.25 0.09 -4.92 115.22 117.81 1x5w n HIS 32 Ca 0.32 -3.55 0.01 0.00 -0.26 0.00 0.00 57.72 54.24 1x5w n HIS 32 Cb 1.33 -2.00 -0.00 0.00 1.12 0.00 0.00 29.99 30.43 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 -0.50 4.82 -0.08 0.00 -1.04 -1.26 -4.77 114.28 111.45 1x5w n THR 34 Ca -0.08 -5.65 -0.08 0.00 -2.04 0.00 0.00 64.05 56.20 1x5w n THR 34 Cb 0.63 -2.31 -0.03 0.00 -1.82 0.00 0.00 70.33 66.80 1x5w n THR 34 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1x5w n ASP 35 N 1.93 1.84 -4.81 8.00 5.75 -1.26 -4.93 116.55 123.06 1x5w n ASP 35 Ca 0.25 0.55 -0.37 0.00 -0.01 0.00 0.00 54.79 55.20 1x5w n ASP 35 Cb 0.36 -0.85 -0.06 0.00 -1.03 0.00 0.00 41.12 39.54 1x5w n ASP 35 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1x5w s ARG 36 N -2.40 3.90 0.21 0.11 1.81 -1.26 -5.00 118.95 116.32 1x5w s ARG 36 Ca -0.20 0.17 -0.03 0.00 -1.72 0.00 0.00 55.73 53.96 1x5w s ARG 36 Cb 0.03 -3.28 0.17 0.00 -0.45 0.00 0.00 34.95 31.42 1x5w s ARG 36 CO 0.30 0.56 1.57 -1.00 -0.68 0.00 0.00 175.30 176.05 1x5w h PRO 37 N 5.43 0.61 -5.14 3.54 0.13 -1.82 -3.42 132.00 131.32 1x5w h PRO 37 Ca -0.49 -0.32 -0.64 0.00 -0.87 0.00 0.00 66.00 63.68 1x5w h PRO 37 Cb 1.20 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 32.11 1x5w h PRO 37 CO 0.65 0.92 -0.67 -0.06 -0.23 0.00 0.00 178.00 178.61 1x5w s PHE 38 N -4.24 3.02 0.05 1.56 0.08 -1.23 -5.08 117.98 112.14 1x5w s PHE 38 Ca -0.08 -0.48 -0.02 0.00 0.12 0.00 0.00 56.93 56.47 1x5w s PHE 38 Cb 0.12 -2.06 -0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1x5w s PHE 38 CO 0.83 -0.23 0.02 -1.59 -0.10 0.00 0.00 175.22 174.14 1x5w s LYS 39 N 0.93 0.57 0.35 0.44 -2.85 -1.26 -1.28 119.74 116.63 1x5w s LYS 39 Ca 0.01 -0.98 -0.18 0.00 -1.00 0.00 0.00 55.97 53.82 1x5w s LYS 39 Cb -0.14 0.21 -0.10 0.00 -2.06 0.00 0.00 37.83 35.74 1x5w s LYS 39 CO 0.02 -0.12 0.81 0.00 0.10 0.00 0.00 175.35 176.15 1x5w n ASN 41 N -0.32 0.34 -0.03 0.00 5.15 -1.26 -4.50 115.26 114.64 1x5w n ASN 41 Ca 0.04 0.15 -0.06 0.00 -0.60 0.00 0.00 54.58 54.11 1x5w n ASN 41 Cb 0.53 1.02 -0.05 0.00 -0.53 0.00 0.00 39.78 40.75 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 -0.05 -1.02 1.20 0.05 -1.95 -3.48 116.97 111.72 1x5w h TYR 42 Ca -0.20 -0.00 -0.64 0.00 0.05 0.00 0.00 58.73 57.93 1x5w h TYR 42 Cb 1.52 0.02 -0.12 0.00 1.01 0.00 0.00 36.73 39.16 1x5w h TYR 42 CO 0.00 0.31 -0.54 0.00 -1.05 0.00 0.00 178.16 176.88 1x5w n SER 44 N -1.17 5.29 -4.40 0.00 7.64 -1.26 -4.34 113.62 115.38 1x5w n SER 44 Ca -0.11 -2.43 -0.38 0.00 1.01 0.00 0.00 58.87 56.96 1x5w n SER 44 Cb 0.67 -1.24 -0.12 0.00 -1.01 0.00 0.00 64.21 62.51 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 0.38 3.14 0.00 1.43 2.19 -1.26 -4.97 117.98 118.90 1x5w s PHE 45 Ca 0.25 -0.69 -0.00 0.00 0.33 0.00 0.00 56.93 56.82 1x5w s PHE 45 Cb 0.12 -2.29 -0.01 0.00 -1.31 0.00 0.00 43.02 39.54 1x5w s PHE 45 CO 0.00 -0.48 0.00 0.16 1.83 0.00 0.00 175.22 176.73 1x5w s ASP 46 N 1.57 0.07 0.07 6.13 -4.77 -1.26 0.11 116.67 118.59 1x5w s ASP 46 Ca 0.04 -0.15 0.05 0.00 -3.30 0.00 0.00 52.55 49.19 1x5w s ASP 46 Cb -0.17 0.05 -0.03 0.00 -1.09 0.00 0.00 42.92 41.69 1x5w s ASP 46 CO 0.04 -0.11 -0.14 0.28 0.70 0.00 0.00 175.17 175.95 1x5w s THR 47 N -0.50 1.07 0.35 2.11 -1.32 -0.41 -4.96 115.64 111.98 1x5w s THR 47 Ca -0.06 -1.31 0.02 0.00 -1.21 0.00 0.00 61.69 59.14 1x5w s THR 47 Cb -0.03 -1.06 0.24 0.00 -1.51 0.00 0.00 72.50 70.14 1x5w s THR 47 CO -0.00 -0.26 1.99 0.50 -2.21 0.00 0.00 174.62 174.64 1x5w h LYS 48 N 4.26 0.78 -6.10 7.08 3.64 -1.96 -3.25 116.57 121.01 1x5w h LYS 48 Ca -0.40 -0.07 -0.59 0.00 -1.27 0.00 0.00 60.65 58.32 1x5w h LYS 48 Cb 1.19 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.80 1x5w h LYS 48 CO 0.41 0.55 -0.28 -0.65 -2.27 0.00 0.00 179.45 177.21 1x5w s GLN 49 N -5.59 3.69 0.01 1.90 -0.21 -1.26 -4.56 119.66 113.63 1x5w s GLN 49 Ca -0.10 0.06 -0.23 0.00 0.02 0.00 0.00 55.36 55.11 1x5w s GLN 49 Cb 0.17 -2.95 -0.18 0.00 1.00 0.00 0.00 33.01 31.05 1x5w s GLN 49 CO 0.76 0.54 1.30 -1.00 -2.12 0.00 0.00 175.29 174.78 1x5w h PRO 50 N 3.45 0.16 -0.13 2.91 0.13 -1.96 -3.27 132.00 133.29 1x5w h PRO 50 Ca -0.48 -0.08 0.02 0.00 -0.87 0.00 0.00 66.00 64.58 1x5w h PRO 50 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1x5w h PRO 50 CO 0.68 0.60 -0.18 1.03 -0.23 0.00 0.00 178.00 179.91 1x5w h SER 51 N -0.27 -0.59 -0.89 1.44 0.87 -1.97 -0.36 113.55 111.77 1x5w h SER 51 Ca 0.01 0.08 0.17 0.00 -1.23 0.00 0.00 61.79 60.81 1x5w h SER 51 Cb 0.57 0.24 -0.16 0.00 -0.44 0.00 0.00 62.40 62.61 1x5w h SER 51 CO 0.02 -0.13 -0.26 0.59 -0.53 0.00 0.00 176.83 176.52 1x5w n ASN 52 N -3.55 -0.40 -0.11 6.23 3.02 -1.25 0.94 115.26 120.13 1x5w n ASN 52 Ca -0.01 1.54 -0.06 0.00 -0.03 0.00 0.00 54.58 56.02 1x5w n ASN 52 Cb 0.11 -0.43 0.02 0.00 -0.61 0.00 0.00 39.78 38.87 1x5w n ASN 52 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1x5w h LEU 53 N 0.00 0.16 -0.35 3.41 5.85 -1.30 -1.36 115.31 121.73 1x5w h LEU 53 Ca 0.39 0.04 0.05 0.00 0.84 0.00 0.00 57.88 59.19 1x5w h LEU 53 Cb 0.61 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 1x5w h LEU 53 CO -0.91 0.13 0.10 -1.28 -0.34 0.00 0.00 178.44 176.14 1x5w h SER 54 N 0.30 0.08 -0.48 1.25 0.87 0.22 0.64 113.55 116.43 1x5w h SER 54 Ca 0.17 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 1x5w h SER 54 Cb 0.13 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 1x5w h SER 54 CO -0.16 0.08 0.32 0.11 -0.53 0.00 0.00 176.83 176.65 1x5w h LYS 55 N 0.23 0.63 -0.01 2.24 1.79 -0.65 -1.55 116.57 119.25 1x5w h LYS 55 Ca 0.16 -0.04 -0.16 0.00 -2.18 0.00 0.00 60.65 58.43 1x5w h LYS 55 Cb 0.16 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 1x5w h LYS 55 CO -0.19 0.41 -0.73 1.25 -1.08 0.00 0.00 179.45 179.11 1x5w h HIS 56 N 0.65 0.14 -0.33 -1.35 -0.00 -0.16 0.39 115.15 114.49 1x5w h HIS 56 Ca 0.18 -0.07 0.02 0.00 -0.00 0.00 0.00 60.37 60.50 1x5w h HIS 56 Cb -0.06 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.30 1x5w h HIS 56 CO -0.00 0.80 0.17 0.52 -0.00 0.00 0.00 177.93 179.42 1x5w h MET 57 N 0.07 0.35 0.12 5.26 2.86 0.13 -2.20 114.93 121.52 1x5w h MET 57 Ca -0.02 -0.02 -0.31 0.00 -2.06 0.00 0.00 59.70 57.29 1x5w h MET 57 Cb 1.29 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.87 1x5w h MET 57 CO 0.10 0.23 -1.55 0.87 1.06 0.00 0.00 176.91 177.63 1x5w h LYS 58 N 0.36 0.25 -0.06 1.72 1.57 -1.55 -1.93 116.57 116.93 1x5w h LYS 58 Ca 0.13 -0.43 0.03 0.00 -1.87 0.00 0.00 60.65 58.52 1x5w h LYS 58 Cb 0.03 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 1x5w h LYS 58 CO -0.08 1.11 -0.49 -0.22 -0.57 0.00 0.00 179.45 179.20 1x5w h LYS 59 N 0.07 -0.57 0.00 3.15 3.64 -0.81 -1.72 116.57 120.33 1x5w h LYS 59 Ca -0.25 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1x5w h LYS 59 Cb 2.02 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.97 1x5w h LYS 59 CO 0.16 -0.38 -0.47 1.19 -2.27 0.00 0.00 179.45 177.68 1x5w n PHE 60 N -5.45 0.55 -1.13 1.91 3.01 -0.84 -4.45 117.46 111.05 1x5w n PHE 60 Ca -0.06 0.24 -0.17 0.00 1.01 0.00 0.00 57.45 58.47 1x5w n PHE 60 Cb 0.38 -0.58 -0.14 0.00 -0.01 0.00 0.00 39.48 39.13 1x5w n PHE 60 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1x5w n HIS 61 N -4.02 0.51 0.17 1.38 8.25 -0.73 -4.59 115.22 116.18 1x5w n HIS 61 Ca -0.07 -1.70 -0.07 0.00 -0.26 0.00 0.00 57.72 55.62 1x5w n HIS 61 Cb 0.24 -1.61 -0.03 0.00 1.12 0.00 0.00 29.99 29.71 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 4.90 -0.47 -7.02 -1.41 0.00 -1.24 -3.36 103.07 94.47 1x5w h GLY 62 Ca 0.28 0.17 -0.75 0.00 0.00 0.00 0.00 47.33 47.03 1x5w h GLY 62 CO 0.47 -0.17 1.64 1.34 0.00 0.00 0.00 176.54 179.82 1x5w n ASP 63 N -3.72 5.23 -3.40 0.19 2.03 -1.26 -4.81 116.55 110.81 1x5w n ASP 63 Ca -0.06 -3.07 -0.26 0.00 0.52 0.00 0.00 54.79 51.92 1x5w n ASP 63 Cb 0.18 -1.50 -0.09 0.00 -0.72 0.00 0.00 41.12 38.99 1x5w n ASP 63 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1x5w n MET 64 N 4.38 0.89 -3.54 -0.67 2.81 -1.26 -5.09 117.12 114.65 1x5w n MET 64 Ca 0.37 -3.57 -0.07 0.00 -1.81 0.00 0.00 57.70 52.63 1x5w n MET 64 Cb 0.39 -1.68 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 1x5w n MET 64 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1x5w s SER 65 N -0.88 -0.30 0.00 7.83 0.15 -1.26 -5.15 113.70 114.09 1x5w s SER 65 Ca 0.33 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.96 1x5w s SER 65 Cb 0.08 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1x5w s SER 65 CO -0.14 -0.53 0.00 0.61 1.20 0.00 0.00 173.24 174.37 1x5w n GLY 66 N -0.22 0.09 3.71 9.45 0.00 -1.26 -4.99 105.19 111.97 1x5w n GLY 66 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 0.77 4.33 -0.03 1.61 0.04 -1.26 -5.03 135.00 135.43 1x5w s PRO 67 Ca 0.00 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.11 1x5w s PRO 67 Cb 0.00 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.24 1x5w s PRO 67 CO 0.00 -0.44 -0.13 -1.54 0.04 0.00 0.00 177.00 174.94 1x5w s SER 68 N 1.20 1.60 -0.05 6.66 1.04 -1.26 -5.14 113.70 117.75 1x5w s SER 68 Ca 0.64 -0.25 0.02 0.00 0.48 0.00 0.00 55.95 56.83 1x5w s SER 68 Cb -0.35 -0.38 0.02 0.00 0.10 0.00 0.00 66.02 65.40 1x5w s SER 68 CO 0.30 0.12 -0.08 -0.44 0.98 0.00 0.00 173.24 174.11 1x5w s SER 69 N 0.03 1.26 0.00 7.02 0.01 -1.26 -5.30 113.70 115.46 1x5w s SER 69 Ca -0.02 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1x5w s SER 69 Cb -0.09 -0.56 0.00 0.00 0.21 0.00 0.00 66.02 65.59 1x5w s SER 69 CO 0.01 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.27