#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 -0.11 0.41 1.61 1.04 -1.26 -5.19 113.70 110.20 2cu8 s SER 2 Ca 0.00 -0.33 0.07 0.00 0.48 0.00 0.00 55.95 56.17 2cu8 s SER 2 Cb 0.00 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 2cu8 s SER 2 CO 0.00 -0.68 0.24 -0.44 0.98 0.00 0.00 173.24 173.34 2cu8 s SER 3 N -3.02 4.63 0.00 7.02 0.01 -1.26 -5.14 113.70 115.94 2cu8 s SER 3 Ca 0.14 -0.96 0.00 0.00 1.31 0.00 0.00 55.95 56.45 2cu8 s SER 3 Cb 0.01 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.71 2cu8 s SER 3 CO 0.00 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 173.70 2cu8 n GLY 4 N -1.32 5.15 3.42 3.44 0.00 -1.26 -5.17 105.19 109.44 2cu8 n GLY 4 Ca 0.00 -0.86 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 2cu8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cu8 s SER 5 N 1.22 -0.66 -0.12 1.61 0.15 -1.26 -5.05 113.70 109.59 2cu8 s SER 5 Ca 0.00 1.18 -0.18 0.00 0.70 0.00 0.00 55.95 57.64 2cu8 s SER 5 Cb 0.00 1.28 -0.26 0.00 -1.71 0.00 0.00 66.02 65.32 2cu8 s SER 5 CO 0.00 -0.22 0.55 0.77 1.20 0.00 0.00 173.24 175.54 2cu8 h SER 6 N 7.45 0.29 -0.86 5.45 4.64 -2.08 -3.50 113.55 124.94 2cu8 h SER 6 Ca -0.28 -0.83 0.09 0.00 -0.47 0.00 0.00 61.79 60.31 2cu8 h SER 6 Cb 1.17 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 2cu8 h SER 6 CO 0.19 1.53 0.24 0.61 -0.87 0.00 0.00 176.83 178.53 2cu8 n GLY 7 N 1.68 0.67 2.73 -0.77 0.00 -1.26 -5.15 105.19 103.09 2cu8 n GLY 7 Ca -0.24 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.62 2cu8 n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2cu8 s MET 8 N -2.01 0.46 0.16 1.61 -2.45 -1.26 -5.14 119.30 110.68 2cu8 s MET 8 Ca 0.08 -0.02 0.07 0.00 -1.25 0.00 0.00 55.69 54.57 2cu8 s MET 8 Cb -0.00 -1.32 -0.04 0.00 1.25 0.00 0.00 34.83 34.72 2cu8 s MET 8 CO 0.00 -0.44 -0.14 0.00 1.05 0.00 0.00 175.02 175.49 2cu8 s ALA 9 N 1.99 1.77 0.82 4.11 0.00 -1.26 -5.14 121.76 124.06 2cu8 s ALA 9 Ca 0.03 -1.50 -0.12 0.00 0.00 0.00 0.00 51.96 50.38 2cu8 s ALA 9 Cb -0.14 -0.08 0.09 0.00 0.00 0.00 0.00 23.12 22.99 2cu8 s ALA 9 CO -0.06 0.08 1.15 -1.12 0.00 0.00 0.00 175.76 175.80 2cu8 s SER 10 N -2.93 3.70 0.37 0.00 0.01 -1.26 -4.76 113.70 108.82 2cu8 s SER 10 Ca 0.16 2.13 0.07 0.00 1.31 0.00 0.00 55.95 59.63 2cu8 s SER 10 Cb -0.02 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.64 2cu8 s SER 10 CO 0.05 -2.58 0.45 -0.54 0.41 0.00 0.00 173.24 171.02 2cu8 s LYS 11 N -4.51 2.89 -0.23 12.44 1.02 -1.26 -0.20 119.74 129.89 2cu8 s LYS 11 Ca 0.67 -1.20 -0.11 0.00 0.02 0.00 0.00 55.97 55.36 2cu8 s LYS 11 Cb -0.23 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 2cu8 s LYS 11 CO 0.54 -0.05 0.18 0.00 -0.92 0.00 0.00 175.35 175.10 2cu8 n PRO 13 N 4.18 0.49 -0.09 0.00 -0.04 -1.26 0.16 135.00 138.45 2cu8 n PRO 13 Ca -0.15 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.13 2cu8 n PRO 13 Cb 0.52 -1.23 -0.06 0.00 -0.04 0.00 0.00 33.50 32.69 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 -0.73 0.37 -0.29 0.54 3.00 -1.26 -4.75 118.16 115.04 2cu8 n LYS 14 Ca 0.05 0.16 0.07 0.00 -0.00 0.00 0.00 58.31 58.59 2cu8 n LYS 14 Cb 0.02 -1.14 0.12 0.00 0.00 0.00 0.00 35.03 34.03 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 -1.03 0.79 -4.51 0.00 2.03 0.43 -4.86 116.55 109.39 2cu8 n ASP 16 Ca 0.13 -1.10 -0.29 0.00 0.52 0.00 0.00 54.79 54.05 2cu8 n ASP 16 Cb 0.68 -1.36 -0.11 0.00 -0.72 0.00 0.00 41.12 39.61 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 -6.77 1.86 -0.71 -0.67 1.02 -1.23 -4.66 119.74 108.58 2cu8 s LYS 17 Ca 0.00 -1.17 -0.26 0.00 0.02 0.00 0.00 55.97 54.57 2cu8 s LYS 17 Cb -0.00 -2.14 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 2cu8 s LYS 17 CO 0.86 0.48 1.98 0.99 -0.92 0.00 0.00 175.35 178.74 2cu8 s THR 18 N -1.22 3.33 0.15 2.17 2.01 -1.26 0.12 115.64 120.94 2cu8 s THR 18 Ca 0.19 -0.02 -0.31 0.00 0.31 0.00 0.00 61.69 61.86 2cu8 s THR 18 Cb -0.10 -3.80 -0.09 0.00 0.01 0.00 0.00 72.50 68.52 2cu8 s THR 18 CO 0.11 -0.77 1.41 -0.69 -0.69 0.00 0.00 174.62 173.99 2cu8 s VAL 19 N 10.14 3.11 0.11 3.82 1.01 0.72 -4.96 120.40 134.36 2cu8 s VAL 19 Ca 0.73 0.83 0.04 0.00 0.00 0.00 0.00 61.98 63.58 2cu8 s VAL 19 Cb -0.11 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2cu8 s VAL 19 CO 0.13 0.08 0.11 -0.31 0.00 0.00 0.00 175.10 175.11 2cu8 s TYR 20 N 0.79 3.18 0.58 5.22 2.02 -1.26 -4.25 117.35 123.63 2cu8 s TYR 20 Ca 0.63 0.04 0.31 0.00 -0.37 0.00 0.00 57.07 57.69 2cu8 s TYR 20 Cb -0.38 -1.58 1.35 0.00 -0.40 0.00 0.00 41.96 40.95 2cu8 s TYR 20 CO 0.33 0.52 1.69 0.35 -1.57 0.00 0.00 175.55 176.87 2cu8 h PHE 21 N 2.93 0.00 -0.45 2.71 3.04 -1.95 0.44 116.94 123.65 2cu8 h PHE 21 Ca -0.47 0.00 0.09 0.00 3.98 0.00 0.00 57.97 61.57 2cu8 h PHE 21 Cb 1.18 0.00 -0.10 0.00 2.56 0.00 0.00 35.95 39.59 2cu8 h PHE 21 CO 0.60 0.00 -0.25 0.00 -2.02 0.00 0.00 178.31 176.64 2cu8 h ALA 22 N 1.15 0.04 0.00 2.41 0.00 -2.01 -3.04 119.26 117.81 2cu8 h ALA 22 Ca 0.41 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2cu8 h ALA 22 Cb 2.06 0.58 0.00 0.00 0.00 0.00 0.00 17.79 20.44 2cu8 h ALA 22 CO -0.00 -0.61 -0.07 0.39 0.00 0.00 0.00 179.25 178.95 2cu8 n GLU 23 N -5.41 1.41 -1.89 0.00 -0.58 -0.27 -5.00 120.64 108.90 2cu8 n GLU 23 Ca 0.03 -1.99 -0.31 0.00 -0.42 0.00 0.00 57.16 54.47 2cu8 n GLU 23 Cb 0.32 -1.18 -0.04 0.00 -0.57 0.00 0.00 31.44 29.96 2cu8 n GLU 23 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2cu8 s LYS 24 N -1.87 2.37 -0.24 3.49 2.20 0.14 -4.20 119.74 121.62 2cu8 s LYS 24 Ca 0.18 0.46 -0.10 0.00 -0.36 0.00 0.00 55.97 56.15 2cu8 s LYS 24 Cb 0.16 -4.68 -0.05 0.00 -1.51 0.00 0.00 37.83 31.75 2cu8 s LYS 24 CO 0.02 -3.27 0.15 0.54 -0.36 0.00 0.00 175.35 172.43 2cu8 s VAL 25 N 10.74 5.29 0.27 4.02 0.11 -1.09 -4.91 120.40 134.83 2cu8 s VAL 25 Ca 0.77 0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 59.68 2cu8 s VAL 25 Cb -0.12 -3.47 -0.09 0.00 -1.53 0.00 0.00 36.38 31.17 2cu8 s VAL 25 CO 0.13 0.35 1.07 -0.94 -3.33 0.00 0.00 175.10 172.38 2cu8 s SER 26 N 1.06 7.34 -0.30 3.54 1.04 -1.26 -1.83 113.70 123.28 2cu8 s SER 26 Ca 0.07 2.20 -0.16 0.00 0.48 0.00 0.00 55.95 58.55 2cu8 s SER 26 Cb -0.14 -2.62 0.17 0.00 0.10 0.00 0.00 66.02 63.53 2cu8 s SER 26 CO 0.04 -0.09 1.04 -0.55 0.98 0.00 0.00 173.24 174.67 2cu8 s SER 27 N -0.90 -0.46 -1.47 7.02 0.15 -0.50 -4.55 113.70 112.98 2cu8 s SER 27 Ca 0.44 0.67 -0.06 0.00 0.70 0.00 0.00 55.95 57.70 2cu8 s SER 27 Cb -0.31 1.44 0.02 0.00 -1.71 0.00 0.00 66.02 65.46 2cu8 s SER 27 CO 0.39 -0.10 0.54 0.18 1.20 0.00 0.00 173.24 175.45 2cu8 n LEU 28 N 4.49 -2.29 -2.04 3.45 4.32 -1.26 -1.40 117.00 122.27 2cu8 n LEU 28 Ca -0.12 -0.29 -0.14 0.00 -0.02 0.00 0.00 56.01 55.44 2cu8 n LEU 28 Cb 0.54 -2.71 0.03 0.00 -1.62 0.00 0.00 43.42 39.66 2cu8 n LEU 28 CO -0.02 0.19 0.03 0.61 -1.22 0.00 0.00 177.39 176.97 2cu8 n GLY 29 N -1.39 -0.05 3.48 -0.72 0.00 -1.26 -5.01 105.19 100.24 2cu8 n GLY 29 Ca -0.09 -0.20 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 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 -5.35 1.85 -0.19 1.61 1.02 -0.49 -5.15 119.74 113.04 2cu8 s LYS 30 Ca 0.22 -1.72 0.01 0.00 0.02 0.00 0.00 55.97 54.50 2cu8 s LYS 30 Cb -0.10 0.44 0.04 0.00 -0.52 0.00 0.00 37.83 37.69 2cu8 s LYS 30 CO 0.27 -0.76 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.30 2cu8 s ASP 31 N -3.22 3.33 0.54 2.83 1.01 -1.26 -1.41 116.67 118.49 2cu8 s ASP 31 Ca 0.30 -0.83 0.02 0.00 0.71 0.00 0.00 52.55 52.76 2cu8 s ASP 31 Cb -0.00 -1.29 0.02 0.00 1.01 0.00 0.00 42.92 42.66 2cu8 s ASP 31 CO 0.19 -0.11 0.16 0.26 0.21 0.00 0.00 175.17 175.88 2cu8 s TRP 32 N 1.37 1.64 0.13 4.23 0.52 -0.76 -4.33 118.94 121.73 2cu8 s TRP 32 Ca 0.00 -0.96 0.03 0.00 0.02 0.00 0.00 56.10 55.18 2cu8 s TRP 32 Cb -0.15 -1.70 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 2cu8 s TRP 32 CO -0.09 -0.09 0.22 -1.01 0.02 0.00 0.00 176.95 176.00 2cu8 s HIS 33 N -2.87 3.39 -1.18 -1.98 3.76 -1.26 -2.66 115.29 112.49 2cu8 s HIS 33 Ca 0.12 0.11 0.06 0.00 -0.15 0.00 0.00 55.06 55.20 2cu8 s HIS 33 Cb -0.01 -1.65 0.27 0.00 1.11 0.00 0.00 32.58 32.30 2cu8 s HIS 33 CO 0.08 0.53 1.12 1.63 -0.85 0.00 0.00 174.74 177.25 2cu8 n LYS 34 N -0.25 0.04 -0.00 1.40 4.76 -1.26 -1.40 118.16 121.45 2cu8 n LYS 34 Ca -0.07 0.33 0.02 0.00 -2.87 0.00 0.00 58.31 55.72 2cu8 n LYS 34 Cb 0.53 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.19 2cu8 n LYS 34 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2cu8 n PHE 35 N -1.41 0.00 0.40 2.13 3.72 -1.26 -4.56 117.46 116.48 2cu8 n PHE 35 Ca 0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.53 2cu8 n PHE 35 Cb 0.06 -0.07 0.05 0.00 -0.94 0.00 0.00 39.48 38.58 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 -2.23 5.60 -4.18 0.00 7.94 -0.50 -4.80 117.00 118.83 2cu8 n LEU 37 Ca 0.01 -2.61 -0.31 0.00 -1.11 0.00 0.00 56.01 51.99 2cu8 n LEU 37 Cb 0.48 -1.11 -0.17 0.00 0.53 0.00 0.00 43.42 43.15 2cu8 n LEU 37 CO 0.39 1.06 -0.54 -0.54 -1.11 0.00 0.00 177.39 176.65 2cu8 s LYS 38 N -0.41 2.87 0.43 1.96 -0.14 -1.26 -3.67 119.74 119.53 2cu8 s LYS 38 Ca 0.07 -0.81 -0.16 0.00 -1.36 0.00 0.00 55.97 53.70 2cu8 s LYS 38 Cb 0.05 -2.22 -0.13 0.00 -1.68 0.00 0.00 37.83 33.85 2cu8 s LYS 38 CO -0.00 0.11 -0.08 0.00 -0.76 0.00 0.00 175.35 174.62 2cu8 n GLU 40 N 1.32 0.46 -0.05 0.00 0.00 -1.23 -2.94 120.64 118.19 2cu8 n GLU 40 Ca 0.07 -0.37 -0.09 0.00 0.00 0.00 0.00 57.16 56.77 2cu8 n GLU 40 Cb 0.41 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.33 2cu8 n GLU 40 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2cu8 n ARG 41 N -0.94 0.35 0.06 5.31 0.63 -1.26 -4.71 116.66 116.09 2cu8 n ARG 41 Ca 0.06 0.14 0.11 0.00 -0.92 0.00 0.00 57.85 57.25 2cu8 n ARG 41 Cb 0.38 -1.11 0.04 0.00 0.45 0.00 0.00 32.46 32.22 2cu8 n ARG 41 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2cu8 n SER 43 N -2.25 -1.87 -4.46 0.00 7.64 -1.15 -4.97 113.62 106.55 2cu8 n SER 43 Ca 0.01 -0.89 -0.32 0.00 1.01 0.00 0.00 58.87 58.68 2cu8 n SER 43 Cb 0.48 -3.60 -0.13 0.00 -1.01 0.00 0.00 64.21 59.96 2cu8 n SER 43 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2cu8 s LYS 44 N -6.38 2.38 0.19 1.43 2.47 -1.26 -4.79 119.74 113.78 2cu8 s LYS 44 Ca 0.21 -0.78 -0.19 0.00 -1.56 0.00 0.00 55.97 53.65 2cu8 s LYS 44 Cb -0.11 -2.31 -0.12 0.00 -1.46 0.00 0.00 37.83 33.83 2cu8 s LYS 44 CO 0.85 0.60 0.28 2.41 0.16 0.00 0.00 175.35 179.65 2cu8 n THR 45 N 2.11 1.13 -4.55 3.43 -1.04 -1.26 -3.60 114.28 110.50 2cu8 n THR 45 Ca -0.17 -0.36 -0.26 0.00 -2.04 0.00 0.00 64.05 61.22 2cu8 n THR 45 Cb 0.52 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.95 2cu8 n THR 45 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2cu8 s LEU 46 N 2.49 2.10 -0.17 -4.42 1.43 -1.24 -4.88 118.68 113.99 2cu8 s LEU 46 Ca 0.45 -1.62 -0.01 0.00 -1.03 0.00 0.00 54.13 51.92 2cu8 s LEU 46 Cb -0.61 -0.28 -0.01 0.00 0.03 0.00 0.00 46.19 45.32 2cu8 s LEU 46 CO 0.42 -0.86 -0.11 -0.89 0.23 0.00 0.00 176.35 175.15 2cu8 s THR 47 N -3.15 3.07 -2.00 5.49 2.01 -1.26 -4.98 115.64 114.81 2cu8 s THR 47 Ca 0.23 -0.63 0.05 0.00 0.31 0.00 0.00 61.69 61.65 2cu8 s THR 47 Cb 0.03 -2.33 0.14 0.00 0.01 0.00 0.00 72.50 70.36 2cu8 s THR 47 CO 0.13 0.49 0.76 -0.81 -0.69 0.00 0.00 174.62 174.50 2cu8 n PRO 48 N 4.07 0.49 -2.71 4.92 -0.04 -1.26 -3.17 135.00 137.30 2cu8 n PRO 48 Ca -0.18 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.18 2cu8 n PRO 48 Cb 0.52 -1.16 0.04 0.00 -0.04 0.00 0.00 33.50 32.86 2cu8 n PRO 48 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cu8 n GLY 49 N -0.02 1.62 0.00 0.55 0.00 -1.26 -3.55 105.19 102.53 2cu8 n GLY 49 Ca 0.04 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.12 0.51 3.64 -0.02 0.00 -1.19 -5.08 105.19 102.93 2cu8 n GLY 50 Ca 0.08 0.30 -0.02 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.11 0.32 1.61 -0.00 -1.26 -4.48 115.29 111.37 2cu8 s HIS 51 Ca 0.00 -0.04 0.02 0.00 -0.00 0.00 0.00 55.06 55.04 2cu8 s HIS 51 Cb 0.00 0.56 -0.03 0.00 -0.00 0.00 0.00 32.58 33.12 2cu8 s HIS 51 CO 0.00 -0.43 0.50 0.00 -0.00 0.00 0.00 174.74 174.81 2cu8 s ALA 52 N -2.71 3.78 0.02 -1.38 0.00 -1.19 -4.98 121.76 115.29 2cu8 s ALA 52 Ca 0.12 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.06 2cu8 s ALA 52 Cb 0.02 -2.00 -0.02 0.00 0.00 0.00 0.00 23.12 21.12 2cu8 s ALA 52 CO -0.03 0.03 -0.03 -1.83 0.00 0.00 0.00 175.76 173.90 2cu8 s GLU 53 N -4.24 0.32 -0.20 0.00 1.03 -1.26 -1.01 118.70 113.35 2cu8 s GLU 53 Ca 0.39 -0.63 -0.05 0.00 0.03 0.00 0.00 54.97 54.71 2cu8 s GLU 53 Cb -0.09 0.10 0.10 0.00 -0.80 0.00 0.00 34.13 33.44 2cu8 s GLU 53 CO 0.34 -0.05 0.38 -1.58 -1.33 0.00 0.00 175.26 173.02 2cu8 s HIS 54 N -1.53 -0.74 -1.79 4.83 2.46 0.14 -4.88 115.29 113.78 2cu8 s HIS 54 Ca -0.15 1.23 0.00 0.00 0.47 0.00 0.00 55.06 56.61 2cu8 s HIS 54 Cb -0.09 0.17 0.00 0.00 -0.13 0.00 0.00 32.58 32.52 2cu8 s HIS 54 CO -0.01 -0.53 0.00 -0.25 -2.47 0.00 0.00 174.74 171.48 2cu8 n ASP 55 N 5.38 -5.75 0.00 9.88 8.00 -1.26 -1.17 116.55 131.63 2cu8 n ASP 55 Ca -0.07 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2cu8 n ASP 55 Cb 0.50 -4.82 0.00 0.00 -0.02 0.00 0.00 41.12 36.78 2cu8 n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cu8 n GLY 56 N -0.93 0.53 2.95 0.44 0.00 -1.26 -5.05 105.19 101.86 2cu8 n GLY 56 Ca -0.24 -0.87 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.99 1.30 0.35 1.61 1.02 -0.32 -4.68 119.74 117.03 2cu8 s LYS 57 Ca 0.00 -0.26 -0.27 0.00 0.02 0.00 0.00 55.97 55.46 2cu8 s LYS 57 Cb 0.00 -1.18 -0.09 0.00 -0.52 0.00 0.00 37.83 36.03 2cu8 s LYS 57 CO 0.00 -0.06 1.21 -1.25 -0.92 0.00 0.00 175.35 174.33 2cu8 s PRO 58 N 0.91 4.28 -0.16 -1.68 0.04 -1.26 0.26 135.00 137.40 2cu8 s PRO 58 Ca -0.11 1.98 -0.06 0.00 0.04 0.00 0.00 61.00 62.85 2cu8 s PRO 58 Cb -0.15 -2.93 0.07 0.00 0.04 0.00 0.00 34.50 31.53 2cu8 s PRO 58 CO 0.01 -0.17 0.35 -0.06 0.04 0.00 0.00 177.00 177.17 2cu8 s PHE 59 N -1.25 -0.60 0.69 0.56 0.08 -0.18 -3.53 117.98 113.75 2cu8 s PHE 59 Ca 0.51 1.23 -0.17 0.00 0.12 0.00 0.00 56.93 58.62 2cu8 s PHE 59 Cb -0.35 0.16 -0.13 0.00 -0.57 0.00 0.00 43.02 42.14 2cu8 s PHE 59 CO 0.45 -0.39 -0.21 0.00 -0.10 0.00 0.00 175.22 174.97 2cu8 h HIS 61 N -0.38 0.51 0.00 0.00 3.86 -1.96 -1.44 115.15 115.75 2cu8 h HIS 61 Ca -0.43 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 2cu8 h HIS 61 Cb 1.39 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.76 2cu8 h HIS 61 CO 0.25 -0.03 0.00 0.36 0.86 0.00 0.00 177.93 179.37 2cu8 n LYS 62 N -5.07 0.00 0.15 2.45 2.85 -1.26 -3.45 118.16 113.83 2cu8 n LYS 62 Ca 0.18 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.56 2cu8 n LYS 62 Cb 0.54 0.00 0.51 0.00 -0.65 0.00 0.00 35.03 35.43 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 -0.75 -0.49 0.00 3.20 -1.35 -2.60 116.97 114.98 2cu8 h TYR 65 Ca 0.00 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.92 2cu8 h TYR 65 Cb 0.00 0.30 -0.06 0.00 1.54 0.00 0.00 36.73 38.51 2cu8 h TYR 65 CO -0.16 -0.40 -0.29 0.00 -1.64 0.00 0.00 178.16 175.66 2cu8 n ALA 66 N -2.57 -0.31 -0.08 1.82 0.00 -0.14 -0.17 120.51 119.05 2cu8 n ALA 66 Ca -0.09 0.42 -0.07 0.00 0.00 0.00 0.00 53.44 53.70 2cu8 n ALA 66 Cb 0.31 0.11 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 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 0.37 -0.41 0.00 2.02 -0.21 0.36 112.91 115.03 2cu8 h THR 67 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.34 2cu8 h THR 67 Cb 0.20 0.37 -0.08 0.00 -1.74 0.00 0.00 68.15 66.89 2cu8 h THR 67 CO -0.46 0.00 -0.15 -0.07 0.37 0.00 0.00 175.52 175.21 2cu8 h LEU 68 N -0.21 -0.54 0.00 2.58 3.38 -0.34 -3.42 115.31 116.76 2cu8 h LEU 68 Ca 0.16 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2cu8 h LEU 68 Cb 0.47 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2cu8 h LEU 68 CO -0.45 -0.19 0.00 0.49 0.09 0.00 0.00 178.44 178.39 2cu8 n PHE 69 N -5.35 0.00 -1.41 1.13 3.01 0.76 -5.11 117.46 110.49 2cu8 n PHE 69 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 2cu8 n PHE 69 Cb 0.26 0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 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 2.81 -0.55 3.10 1.37 0.00 0.12 -4.92 105.19 107.13 2cu8 n GLY 70 Ca 0.00 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 2cu8 n GLY 70 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cu8 s SER 71 N -4.00 1.92 -0.64 1.61 0.15 -1.26 -3.79 113.70 107.69 2cu8 s SER 71 Ca 0.00 -0.31 0.06 0.00 0.70 0.00 0.00 55.95 56.40 2cu8 s SER 71 Cb 0.00 -0.51 0.24 0.00 -1.71 0.00 0.00 66.02 64.05 2cu8 s SER 71 CO 0.00 0.14 0.73 0.61 1.20 0.00 0.00 173.24 175.92 2cu8 n GLY 72 N 3.14 4.75 3.59 9.45 0.00 -1.26 -5.09 105.19 119.78 2cu8 n GLY 72 Ca -0.18 -2.75 -0.30 0.00 0.00 0.00 0.00 46.02 42.79 2cu8 n GLY 72 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cu8 s PRO 73 N -2.41 -1.28 -0.04 1.61 0.04 -1.26 -5.08 135.00 126.57 2cu8 s PRO 73 Ca 0.39 -0.09 0.01 0.00 0.04 0.00 0.00 61.00 61.35 2cu8 s PRO 73 Cb 0.14 -1.59 0.02 0.00 0.04 0.00 0.00 34.50 33.11 2cu8 s PRO 73 CO -0.02 -3.75 -0.05 -1.54 0.04 0.00 0.00 177.00 171.68 2cu8 s SER 74 N -3.91 1.00 -0.03 6.66 1.04 -1.26 -5.04 113.70 112.16 2cu8 s SER 74 Ca 0.71 -0.14 -0.06 0.00 0.48 0.00 0.00 55.95 56.93 2cu8 s SER 74 Cb -0.09 -0.48 -0.03 0.00 0.10 0.00 0.00 66.02 65.52 2cu8 s SER 74 CO 0.56 -0.04 -0.13 -0.24 0.98 0.00 0.00 173.24 174.37 2cu8 n SER 75 N 4.00 1.23 0.00 7.02 2.88 -1.26 -5.36 113.62 122.12 2cu8 n SER 75 Ca -0.25 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2cu8 n SER 75 Cb 0.51 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 2cu8 n SER 75 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42