#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cu8 s SER 2 N 0.00 -0.52 -0.25 1.61 0.15 -1.26 -5.06 113.70 108.38 2cu8 s SER 2 Ca 0.00 0.92 -0.07 0.00 0.70 0.00 0.00 55.95 57.50 2cu8 s SER 2 Cb 0.00 0.85 -0.13 0.00 -1.71 0.00 0.00 66.02 65.04 2cu8 s SER 2 CO 0.00 -0.18 -0.28 -0.24 1.20 0.00 0.00 173.24 173.74 2cu8 n SER 3 N 3.70 1.94 -0.32 5.45 2.88 -1.26 -5.12 113.62 120.88 2cu8 n SER 3 Ca -0.19 0.14 0.04 0.00 -1.33 0.00 0.00 58.87 57.53 2cu8 n SER 3 Cb 0.56 -0.61 -0.02 0.00 -0.75 0.00 0.00 64.21 63.39 2cu8 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cu8 n GLY 4 N 1.77 -2.62 3.60 0.46 0.00 -1.26 -5.09 105.19 102.05 2cu8 n GLY 4 Ca -0.47 -1.37 -0.05 0.00 0.00 0.00 0.00 46.02 44.12 2cu8 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cu8 s SER 5 N -4.93 -0.17 0.07 1.61 1.04 -1.26 -5.19 113.70 104.87 2cu8 s SER 5 Ca 0.00 0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.49 2cu8 s SER 5 Cb 0.00 0.16 -0.02 0.00 0.10 0.00 0.00 66.02 66.26 2cu8 s SER 5 CO 0.00 -0.22 0.08 -0.94 0.98 0.00 0.00 173.24 173.15 2cu8 s SER 6 N -1.58 0.30 0.00 7.02 1.04 -1.26 -5.13 113.70 114.08 2cu8 s SER 6 Ca 0.06 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2cu8 s SER 6 Cb -0.01 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2cu8 s SER 6 CO -0.04 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.12 2cu8 n GLY 7 N 0.02 -0.07 2.46 7.32 0.00 -1.26 -5.04 105.19 108.62 2cu8 n GLY 7 Ca -0.15 0.66 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 2cu8 n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2cu8 n MET 8 N 0.00 2.58 -2.60 1.61 0.00 -1.26 -4.98 117.12 112.47 2cu8 n MET 8 Ca 0.00 -3.08 -0.31 0.00 0.00 0.00 0.00 57.70 54.31 2cu8 n MET 8 Cb 0.00 -2.19 -0.03 0.00 0.00 0.00 0.00 33.22 30.99 2cu8 n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2cu8 s ALA 9 N -3.51 3.19 0.78 3.04 0.00 -1.26 -5.03 121.76 118.98 2cu8 s ALA 9 Ca 0.57 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 52.39 2cu8 s ALA 9 Cb 0.45 -2.93 0.05 0.00 0.00 0.00 0.00 23.12 20.69 2cu8 s ALA 9 CO -0.14 -0.14 1.09 0.43 0.00 0.00 0.00 175.76 176.99 2cu8 n SER 10 N -1.47 0.72 -5.01 0.00 7.64 -1.26 -4.73 113.62 109.52 2cu8 n SER 10 Ca 0.05 0.61 -0.18 0.00 1.01 0.00 0.00 58.87 60.36 2cu8 n SER 10 Cb 0.54 -1.46 0.01 0.00 -1.01 0.00 0.00 64.21 62.29 2cu8 n SER 10 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2cu8 s LYS 11 N -3.80 2.74 -0.21 1.43 3.01 -1.26 -1.70 119.74 119.95 2cu8 s LYS 11 Ca 0.73 -1.32 -0.13 0.00 -1.01 0.00 0.00 55.97 54.24 2cu8 s LYS 11 Cb -0.31 -2.72 -0.05 0.00 -1.01 0.00 0.00 37.83 33.75 2cu8 s LYS 11 CO 0.51 -0.35 0.26 0.00 0.51 0.00 0.00 175.35 176.28 2cu8 n PRO 13 N 4.20 0.49 -0.07 0.00 -0.04 -1.26 0.15 135.00 138.48 2cu8 n PRO 13 Ca -0.12 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.19 2cu8 n PRO 13 Cb 0.52 -1.15 -0.05 0.00 -0.04 0.00 0.00 33.50 32.77 2cu8 n PRO 13 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2cu8 n LYS 14 N -0.65 0.33 -0.07 0.54 3.00 -1.26 -4.75 118.16 115.29 2cu8 n LYS 14 Ca 0.04 0.14 0.06 0.00 -0.00 0.00 0.00 58.31 58.55 2cu8 n LYS 14 Cb 0.02 -1.06 0.10 0.00 0.00 0.00 0.00 35.03 34.09 2cu8 n LYS 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2cu8 n ASP 16 N -1.02 0.81 -4.59 0.00 2.03 0.40 -4.89 116.55 109.29 2cu8 n ASP 16 Ca 0.11 -1.23 -0.25 0.00 0.52 0.00 0.00 54.79 53.93 2cu8 n ASP 16 Cb 0.52 -1.53 -0.09 0.00 -0.72 0.00 0.00 41.12 39.30 2cu8 n ASP 16 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2cu8 s LYS 17 N -7.22 2.13 -0.70 -0.67 -0.14 -1.24 -4.70 119.74 107.20 2cu8 s LYS 17 Ca 0.04 -1.36 -0.26 0.00 -1.36 0.00 0.00 55.97 53.03 2cu8 s LYS 17 Cb -0.02 -2.14 -0.02 0.00 -1.68 0.00 0.00 37.83 33.98 2cu8 s LYS 17 CO 0.97 0.40 1.79 0.99 -0.76 0.00 0.00 175.35 178.74 2cu8 s THR 18 N -2.00 3.43 0.52 2.17 2.01 -1.26 0.13 115.64 120.64 2cu8 s THR 18 Ca 0.28 0.08 -0.21 0.00 0.31 0.00 0.00 61.69 62.15 2cu8 s THR 18 Cb -0.08 -4.11 -0.06 0.00 0.01 0.00 0.00 72.50 68.27 2cu8 s THR 18 CO 0.17 -1.07 1.21 -0.69 -0.69 0.00 0.00 174.62 173.55 2cu8 s VAL 19 N 8.73 2.81 -0.18 3.82 1.01 -0.69 -4.98 120.40 130.92 2cu8 s VAL 19 Ca 0.63 0.57 -0.06 0.00 0.00 0.00 0.00 61.98 63.12 2cu8 s VAL 19 Cb -0.10 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 2cu8 s VAL 19 CO 0.15 -0.04 0.03 -0.31 0.00 0.00 0.00 175.10 174.92 2cu8 s TYR 20 N -1.54 3.14 0.62 5.22 1.51 -1.26 -4.59 117.35 120.45 2cu8 s TYR 20 Ca 0.69 -0.15 0.22 0.00 -1.01 0.00 0.00 57.07 56.82 2cu8 s TYR 20 Cb -0.31 -2.06 0.93 0.00 -0.11 0.00 0.00 41.96 40.41 2cu8 s TYR 20 CO 0.36 -0.01 1.45 0.35 -1.11 0.00 0.00 175.55 176.59 2cu8 h PHE 21 N 6.97 0.00 0.32 2.71 3.04 -1.95 0.57 116.94 128.60 2cu8 h PHE 21 Ca -0.35 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.58 2cu8 h PHE 21 Cb 1.18 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.69 2cu8 h PHE 21 CO 0.57 0.00 -0.16 0.00 -2.02 0.00 0.00 178.31 176.70 2cu8 h ALA 22 N 0.72 -0.44 -0.46 2.41 0.00 -2.03 -3.21 119.26 116.26 2cu8 h ALA 22 Ca 0.25 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2cu8 h ALA 22 Cb 2.04 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.99 2cu8 h ALA 22 CO -0.00 -0.65 0.00 0.39 0.00 0.00 0.00 179.25 178.99 2cu8 n GLU 23 N -5.20 3.40 -2.11 0.00 1.02 0.70 -4.95 120.64 113.50 2cu8 n GLU 23 Ca -0.10 -2.71 -0.41 0.00 -0.02 0.00 0.00 57.16 53.92 2cu8 n GLU 23 Cb 0.24 -1.77 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 2cu8 n GLU 23 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2cu8 s LYS 24 N -2.03 3.15 -0.31 3.49 2.20 0.17 -4.43 119.74 121.99 2cu8 s LYS 24 Ca 0.42 0.98 -0.12 0.00 -0.36 0.00 0.00 55.97 56.89 2cu8 s LYS 24 Cb 0.29 -4.22 -0.03 0.00 -1.51 0.00 0.00 37.83 32.36 2cu8 s LYS 24 CO 0.17 -2.09 0.21 0.54 -0.36 0.00 0.00 175.35 173.82 2cu8 s VAL 25 N 7.24 5.28 0.17 4.02 0.11 -1.19 -4.95 120.40 131.07 2cu8 s VAL 25 Ca 0.70 -0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 59.43 2cu8 s VAL 25 Cb -0.17 -3.61 -0.07 0.00 -1.53 0.00 0.00 36.38 31.00 2cu8 s VAL 25 CO 0.28 0.13 1.13 -0.94 -3.33 0.00 0.00 175.10 172.38 2cu8 s SER 26 N 1.74 7.21 -0.30 3.54 1.04 -1.26 -2.46 113.70 123.21 2cu8 s SER 26 Ca 0.07 2.11 -0.11 0.00 0.48 0.00 0.00 55.95 58.50 2cu8 s SER 26 Cb -0.17 -2.60 0.12 0.00 0.10 0.00 0.00 66.02 63.47 2cu8 s SER 26 CO 0.11 -0.28 0.66 -0.55 0.98 0.00 0.00 173.24 174.16 2cu8 s SER 27 N 0.06 -1.10 -1.42 7.02 0.15 0.20 -4.47 113.70 114.15 2cu8 s SER 27 Ca 0.51 1.55 -0.06 0.00 0.70 0.00 0.00 55.95 58.65 2cu8 s SER 27 Cb -0.30 2.12 0.03 0.00 -1.71 0.00 0.00 66.02 66.16 2cu8 s SER 27 CO 0.35 -0.22 0.49 0.18 1.20 0.00 0.00 173.24 175.24 2cu8 n LEU 28 N 5.22 -2.08 -0.27 3.45 4.32 -1.26 -0.07 117.00 126.32 2cu8 n LEU 28 Ca -0.14 -0.28 -0.03 0.00 -0.02 0.00 0.00 56.01 55.54 2cu8 n LEU 28 Cb 0.51 -2.57 -0.01 0.00 -1.62 0.00 0.00 43.42 39.73 2cu8 n LEU 28 CO -0.04 0.16 -0.03 0.61 -1.22 0.00 0.00 177.39 176.87 2cu8 n GLY 29 N -1.31 0.61 3.52 -0.72 0.00 -1.26 -5.00 105.19 101.03 2cu8 n GLY 29 Ca -0.08 -0.31 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 2cu8 n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cu8 s LYS 30 N -1.60 1.76 -0.27 1.61 3.01 0.90 -5.13 119.74 120.02 2cu8 s LYS 30 Ca 0.00 -1.94 0.00 0.00 -1.01 0.00 0.00 55.97 53.02 2cu8 s LYS 30 Cb 0.00 -1.41 0.05 0.00 -1.01 0.00 0.00 37.83 35.46 2cu8 s LYS 30 CO 0.00 0.01 -0.06 -0.51 0.51 0.00 0.00 175.35 175.30 2cu8 s ASP 31 N -3.57 4.51 0.28 2.83 1.01 -1.26 -0.63 116.67 119.84 2cu8 s ASP 31 Ca 0.33 -1.20 0.01 0.00 0.71 0.00 0.00 52.55 52.40 2cu8 s ASP 31 Cb 0.06 -1.63 0.01 0.00 1.01 0.00 0.00 42.92 42.37 2cu8 s ASP 31 CO 0.16 -0.19 0.11 0.79 0.21 0.00 0.00 175.17 176.24 2cu8 n TRP 32 N 4.56 -0.23 -4.03 4.23 7.02 -1.03 -4.01 117.44 123.95 2cu8 n TRP 32 Ca -0.15 -1.28 -0.22 0.00 -1.02 0.00 0.00 57.50 54.84 2cu8 n TRP 32 Cb 0.44 -0.21 -0.04 0.00 -2.42 0.00 0.00 31.31 29.08 2cu8 n TRP 32 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 2cu8 s HIS 33 N -1.69 3.14 -0.09 -5.99 3.76 -1.26 -3.18 115.29 109.98 2cu8 s HIS 33 Ca 0.09 -0.12 0.30 0.00 -0.15 0.00 0.00 55.06 55.18 2cu8 s HIS 33 Cb -0.01 -1.49 1.27 0.00 1.11 0.00 0.00 32.58 33.46 2cu8 s HIS 33 CO 0.05 0.45 1.90 0.87 -0.85 0.00 0.00 174.74 177.16 2cu8 h LYS 34 N 1.39 0.00 0.00 1.40 6.56 -1.97 -1.71 116.57 122.24 2cu8 h LYS 34 Ca -0.49 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.03 2cu8 h LYS 34 Cb 1.24 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.89 2cu8 h LYS 34 CO 0.60 0.00 -1.93 1.19 -2.06 0.00 0.00 179.45 177.25 2cu8 n PHE 35 N -2.78 0.00 0.10 -1.35 3.72 -1.26 -4.43 117.46 111.47 2cu8 n PHE 35 Ca 0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.26 2cu8 n PHE 35 Cb 0.27 -0.53 -0.14 0.00 -0.94 0.00 0.00 39.48 38.14 2cu8 n PHE 35 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2cu8 n LEU 37 N -3.51 1.94 -3.53 0.00 7.94 -0.67 -4.74 117.00 114.42 2cu8 n LEU 37 Ca -0.07 -2.32 -0.10 0.00 -1.11 0.00 0.00 56.01 52.41 2cu8 n LEU 37 Cb 1.01 -1.20 -0.10 0.00 0.53 0.00 0.00 43.42 43.66 2cu8 n LEU 37 CO 0.53 -2.26 -0.05 -0.54 -1.11 0.00 0.00 177.39 173.96 2cu8 s LYS 38 N 7.10 0.29 0.38 1.96 -0.14 -1.26 -4.16 119.74 123.91 2cu8 s LYS 38 Ca 0.71 0.74 -0.23 0.00 -1.36 0.00 0.00 55.97 55.83 2cu8 s LYS 38 Cb 0.06 -0.15 -0.15 0.00 -1.68 0.00 0.00 37.83 35.91 2cu8 s LYS 38 CO 0.23 -0.43 0.34 0.00 -0.76 0.00 0.00 175.35 174.72 2cu8 n GLU 40 N 1.00 0.66 -0.08 0.00 4.07 -1.24 -2.67 120.64 122.37 2cu8 n GLU 40 Ca 0.12 -0.53 -0.09 0.00 -0.06 0.00 0.00 57.16 56.60 2cu8 n GLU 40 Cb 0.38 -1.49 -0.04 0.00 -0.06 0.00 0.00 31.44 30.23 2cu8 n GLU 40 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 2cu8 h ARG 41 N 1.29 0.00 0.00 5.31 9.65 -1.90 -3.43 114.38 125.31 2cu8 h ARG 41 Ca 0.00 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.51 2cu8 h ARG 41 Cb 0.63 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.14 2cu8 h ARG 41 CO 0.00 0.26 -2.35 0.00 2.80 0.00 0.00 179.97 180.68 2cu8 n SER 43 N -2.93 -2.20 -4.17 0.00 2.88 -1.09 -5.05 113.62 101.05 2cu8 n SER 43 Ca -0.35 -0.16 -0.26 0.00 -1.33 0.00 0.00 58.87 56.77 2cu8 n SER 43 Cb 1.10 -1.70 -0.16 0.00 -0.75 0.00 0.00 64.21 62.71 2cu8 n SER 43 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2cu8 s LYS 44 N -4.19 1.61 0.06 -1.46 2.47 -1.26 -4.90 119.74 112.07 2cu8 s LYS 44 Ca 0.02 -0.65 -0.37 0.00 -1.56 0.00 0.00 55.97 53.41 2cu8 s LYS 44 Cb -0.00 -1.50 -0.19 0.00 -1.46 0.00 0.00 37.83 34.68 2cu8 s LYS 44 CO 0.19 0.35 0.99 2.41 0.16 0.00 0.00 175.35 179.45 2cu8 n THR 45 N 2.79 0.49 -3.84 3.43 -1.04 -1.26 -4.01 114.28 110.84 2cu8 n THR 45 Ca -0.16 -0.12 -0.15 0.00 -2.04 0.00 0.00 64.05 61.58 2cu8 n THR 45 Cb 0.53 -0.14 -0.01 0.00 -1.82 0.00 0.00 70.33 68.90 2cu8 n THR 45 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2cu8 n LEU 46 N 1.73 0.00 -4.10 -4.42 4.77 -1.26 -4.99 117.00 108.73 2cu8 n LEU 46 Ca 0.19 -1.56 -0.28 0.00 -0.03 0.00 0.00 56.01 54.33 2cu8 n LEU 46 Cb 0.14 0.02 -0.17 0.00 -2.33 0.00 0.00 43.42 41.08 2cu8 n LEU 46 CO 0.60 -0.40 -0.51 -0.89 -1.33 0.00 0.00 177.39 174.87 2cu8 s THR 47 N -1.55 1.53 -0.70 -5.08 2.01 -1.26 -5.06 115.64 105.53 2cu8 s THR 47 Ca 0.13 -0.70 -0.26 0.00 0.31 0.00 0.00 61.69 61.17 2cu8 s THR 47 Cb -0.01 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 2cu8 s THR 47 CO 0.09 0.44 1.89 -2.16 -0.69 0.00 0.00 174.62 174.19 2cu8 s PRO 48 N 0.60 2.60 0.00 4.92 0.04 -1.26 -3.37 135.00 138.53 2cu8 s PRO 48 Ca -0.15 0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.21 2cu8 s PRO 48 Cb -0.16 -4.60 0.00 0.00 0.04 0.00 0.00 34.50 29.77 2cu8 s PRO 48 CO 0.05 -2.94 0.00 0.41 0.04 0.00 0.00 177.00 174.56 2cu8 n GLY 49 N 6.07 0.97 0.00 0.56 0.00 -1.26 -4.88 105.19 106.65 2cu8 n GLY 49 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2cu8 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cu8 n GLY 50 N 0.00 -1.81 3.67 -0.02 0.00 -1.22 -5.05 105.19 100.78 2cu8 n GLY 50 Ca 0.00 0.71 -0.09 0.00 0.00 0.00 0.00 46.02 46.65 2cu8 n GLY 50 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2cu8 s HIS 51 N 0.00 -0.18 0.21 1.61 -3.43 -1.26 -4.77 115.29 107.47 2cu8 s HIS 51 Ca 0.00 -0.20 -0.02 0.00 -0.80 0.00 0.00 55.06 54.03 2cu8 s HIS 51 Cb 0.00 0.55 -0.05 0.00 -1.43 0.00 0.00 32.58 31.65 2cu8 s HIS 51 CO 0.00 -1.07 0.43 0.00 -2.00 0.00 0.00 174.74 172.10 2cu8 s ALA 52 N -3.89 3.77 -0.01 -1.38 0.00 -1.04 -4.96 121.76 114.25 2cu8 s ALA 52 Ca 0.10 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.36 2cu8 s ALA 52 Cb -0.03 -2.09 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2cu8 s ALA 52 CO 0.01 0.43 -0.05 -1.83 0.00 0.00 0.00 175.76 174.32 2cu8 s GLU 53 N -3.27 0.55 -0.10 0.00 -1.05 -1.26 -0.06 118.70 113.51 2cu8 s GLU 53 Ca 0.40 -0.17 -0.04 0.00 -0.15 0.00 0.00 54.97 55.01 2cu8 s GLU 53 Cb -0.11 -0.55 0.05 0.00 -0.44 0.00 0.00 34.13 33.08 2cu8 s GLU 53 CO 0.28 0.07 0.20 -1.58 0.95 0.00 0.00 175.26 175.18 2cu8 s HIS 54 N 0.17 -0.28 -1.65 4.83 2.46 0.55 -4.84 115.29 116.53 2cu8 s HIS 54 Ca -0.02 0.75 0.00 0.00 0.47 0.00 0.00 55.06 56.26 2cu8 s HIS 54 Cb -0.06 -0.13 0.00 0.00 -0.13 0.00 0.00 32.58 32.26 2cu8 s HIS 54 CO -0.00 -0.29 0.00 -3.47 -2.47 0.00 0.00 174.74 168.51 2cu8 n ASP 55 N 5.11 -5.12 0.00 9.88 -0.08 -1.26 -1.75 116.55 123.33 2cu8 n ASP 55 Ca -0.09 0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 2cu8 n ASP 55 Cb 0.50 -4.19 0.00 0.00 2.34 0.00 0.00 41.12 39.77 2cu8 n ASP 55 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2cu8 n GLY 56 N -0.94 0.45 2.89 0.27 0.00 -1.26 -5.05 105.19 101.55 2cu8 n GLY 56 Ca -0.19 -0.93 -0.18 0.00 0.00 0.00 0.00 46.02 44.72 2cu8 n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cu8 s LYS 57 N -2.82 0.54 0.45 1.61 1.02 -0.72 -4.71 119.74 115.11 2cu8 s LYS 57 Ca 0.00 -0.07 -0.23 0.00 0.02 0.00 0.00 55.97 55.69 2cu8 s LYS 57 Cb 0.00 -0.60 -0.07 0.00 -0.52 0.00 0.00 37.83 36.63 2cu8 s LYS 57 CO 0.00 -0.05 1.17 -1.25 -0.92 0.00 0.00 175.35 174.30 2cu8 s PRO 58 N 0.67 3.79 -0.23 -1.68 0.04 -1.26 -0.33 135.00 136.00 2cu8 s PRO 58 Ca -0.08 1.79 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 2cu8 s PRO 58 Cb -0.11 -2.44 0.08 0.00 0.04 0.00 0.00 34.50 32.07 2cu8 s PRO 58 CO -0.00 -0.53 0.55 -0.06 0.04 0.00 0.00 177.00 177.00 2cu8 s PHE 59 N -1.53 -0.88 0.54 0.56 0.08 0.91 -3.73 117.98 113.94 2cu8 s PHE 59 Ca 0.63 1.76 -0.19 0.00 0.12 0.00 0.00 56.93 59.25 2cu8 s PHE 59 Cb -0.29 0.48 -0.08 0.00 -0.57 0.00 0.00 43.02 42.55 2cu8 s PHE 59 CO 0.35 -0.46 0.68 0.00 -0.10 0.00 0.00 175.22 175.70 2cu8 h HIS 61 N 0.50 0.80 0.00 0.00 3.86 -1.94 0.27 115.15 118.65 2cu8 h HIS 61 Ca -0.46 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.78 2cu8 h HIS 61 Cb 1.38 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 29.63 2cu8 h HIS 61 CO 0.34 -0.04 0.00 0.36 0.86 0.00 0.00 177.93 179.46 2cu8 n LYS 62 N -4.82 0.00 0.24 2.45 2.85 -1.26 -3.25 118.16 114.37 2cu8 n LYS 62 Ca 0.29 0.00 0.16 0.00 -1.05 0.00 0.00 58.31 57.71 2cu8 n LYS 62 Cb 0.95 0.00 0.65 0.00 -0.65 0.00 0.00 35.03 35.98 2cu8 n LYS 62 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 2cu8 h PRO 63 N 0.00 0.00 0.00 -1.58 0.13 -2.00 -3.46 132.00 125.09 2cu8 h PRO 63 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2cu8 h PRO 63 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2cu8 h PRO 63 CO 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.77 2cu8 h TYR 65 N 0.00 -0.18 -0.88 0.00 5.03 -1.05 -2.16 116.97 117.73 2cu8 h TYR 65 Ca 0.00 0.01 0.11 0.00 2.58 0.00 0.00 58.73 61.44 2cu8 h TYR 65 Cb 0.00 0.10 -0.13 0.00 1.55 0.00 0.00 36.73 38.25 2cu8 h TYR 65 CO -0.11 -0.12 -0.41 0.00 -1.32 0.00 0.00 178.16 176.20 2cu8 n ALA 66 N -2.38 -0.29 0.30 1.82 0.00 0.35 -0.86 120.51 119.44 2cu8 n ALA 66 Ca -0.04 0.82 -0.15 0.00 0.00 0.00 0.00 53.44 54.07 2cu8 n ALA 66 Cb 0.14 -0.28 -0.08 0.00 0.00 0.00 0.00 19.45 19.22 2cu8 n ALA 66 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2cu8 h THR 67 N 0.00 0.36 -0.94 0.00 2.02 -0.31 1.85 112.91 115.89 2cu8 h THR 67 Ca 0.24 -0.29 0.30 0.00 0.77 0.00 0.00 66.41 67.43 2cu8 h THR 67 Cb 0.46 0.46 -0.17 0.00 -1.74 0.00 0.00 68.15 67.15 2cu8 h THR 67 CO -0.85 0.04 0.15 0.18 0.37 0.00 0.00 175.52 175.41 2cu8 n LEU 68 N -5.34 0.01 0.00 2.58 4.77 -0.27 -2.62 117.00 116.13 2cu8 n LEU 68 Ca -0.12 1.59 0.00 0.00 -0.03 0.00 0.00 56.01 57.46 2cu8 n LEU 68 Cb 0.34 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2cu8 n LEU 68 CO 0.33 -1.66 0.00 0.49 -1.33 0.00 0.00 177.39 175.22 2cu8 n PHE 69 N -5.33 0.00 -1.78 -1.77 3.01 -0.04 -4.78 117.46 106.77 2cu8 n PHE 69 Ca 0.26 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.30 2cu8 n PHE 69 Cb 0.86 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.32 2cu8 n PHE 69 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cu8 n GLY 70 N 2.34 4.11 3.45 1.37 0.00 0.63 -4.93 105.19 112.16 2cu8 n GLY 70 Ca 0.00 -1.55 -0.49 0.00 0.00 0.00 0.00 46.02 43.98 2cu8 n GLY 70 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cu8 n SER 71 N 6.47 1.95 -3.03 1.61 2.88 -1.08 -3.99 113.62 118.44 2cu8 n SER 71 Ca 0.52 0.31 -0.17 0.00 -1.33 0.00 0.00 58.87 58.19 2cu8 n SER 71 Cb 0.40 -1.25 -0.03 0.00 -0.75 0.00 0.00 64.21 62.58 2cu8 n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cu8 n GLY 72 N 6.52 1.40 0.00 0.46 0.00 -1.26 -4.96 105.19 107.36 2cu8 n GLY 72 Ca 0.43 -0.72 0.07 0.00 0.00 0.00 0.00 46.02 45.81 2cu8 n GLY 72 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cu8 n PRO 73 N 1.91 0.25 0.26 1.61 -0.04 -1.26 -3.55 135.00 134.17 2cu8 n PRO 73 Ca 0.18 0.13 -0.16 0.00 -0.04 0.00 0.00 63.50 63.61 2cu8 n PRO 73 Cb 0.56 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.44 2cu8 n PRO 73 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2cu8 h SER 74 N 0.00 -0.95 -2.63 3.54 0.02 -2.00 -3.43 113.55 108.10 2cu8 h SER 74 Ca 0.00 0.07 -0.46 0.00 -0.84 0.00 0.00 61.79 60.56 2cu8 h SER 74 Cb 0.12 0.31 0.23 0.00 0.14 0.00 0.00 62.40 63.19 2cu8 h SER 74 CO 0.00 -0.52 -0.79 -1.20 -1.14 0.00 0.00 176.83 173.18 2cu8 n SER 75 N -5.47 -2.18 0.00 3.07 7.64 -1.23 -5.34 113.62 110.10 2cu8 n SER 75 Ca -0.11 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.68 2cu8 n SER 75 Cb 0.37 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 2cu8 n SER 75 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64