#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 2.67 -0.21 1.61 0.15 -1.26 -5.12 113.70 111.55 2cu8 s SER 2 Ca 0.00 -0.44 -0.06 0.00 0.70 0.00 0.00 55.95 56.15 2cu8 s SER 2 Cb 0.00 -0.71 0.11 0.00 -1.71 0.00 0.00 66.02 63.70 2cu8 s SER 2 CO 0.00 0.21 0.41 -0.44 1.20 0.00 0.00 173.24 174.62 2cu8 s SER 3 N -0.10 -0.16 -0.30 5.45 0.01 -1.26 -5.13 113.70 112.22 2cu8 s SER 3 Ca -0.03 0.78 -0.01 0.00 1.31 0.00 0.00 55.95 58.00 2cu8 s SER 3 Cb -0.13 1.32 0.19 0.00 0.21 0.00 0.00 66.02 67.61 2cu8 s SER 3 CO 0.03 -0.25 0.67 -0.83 0.41 0.00 0.00 173.24 173.26 2cu8 s GLY 4 N 2.60 -0.98 -0.01 3.44 0.00 -1.26 -5.12 107.32 105.98 2cu8 s GLY 4 Ca 0.03 1.79 -0.30 0.00 0.00 0.00 0.00 44.72 46.24 2cu8 s GLY 4 CO -0.14 3.53 1.86 -1.35 0.00 0.00 0.00 173.10 177.00 2cu8 s SER 5 N 2.87 6.47 -0.03 1.64 1.04 -1.26 -4.98 113.70 119.46 2cu8 s SER 5 Ca 0.16 2.45 -0.08 0.00 0.48 0.00 0.00 55.95 58.96 2cu8 s SER 5 Cb -0.13 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.41 2cu8 s SER 5 CO -0.21 -1.06 0.26 -0.44 0.98 0.00 0.00 173.24 172.77 2cu8 s SER 6 N 4.24 6.53 0.00 7.02 0.01 -1.26 -4.86 113.70 125.37 2cu8 s SER 6 Ca 0.83 0.61 0.00 0.00 1.31 0.00 0.00 55.95 58.71 2cu8 s SER 6 Cb -0.38 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2cu8 s SER 6 CO 0.37 0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.94 2cu8 n GLY 7 N 1.48 -0.56 3.25 3.44 0.00 -1.26 -5.07 105.19 106.47 2cu8 n GLY 7 Ca -0.14 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 2cu8 n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2cu8 s MET 8 N -0.09 2.74 0.36 1.61 1.00 -1.26 -5.10 119.30 118.55 2cu8 s MET 8 Ca 0.00 -1.08 0.08 0.00 0.00 0.00 0.00 55.69 54.70 2cu8 s MET 8 Cb 0.00 -3.27 -0.05 0.00 0.00 0.00 0.00 34.83 31.50 2cu8 s MET 8 CO 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 175.02 174.53 2cu8 s ALA 9 N 1.38 3.30 0.26 3.03 0.00 -1.26 -5.08 121.76 123.38 2cu8 s ALA 9 Ca -0.01 -1.99 -0.27 0.00 0.00 0.00 0.00 51.96 49.69 2cu8 s ALA 9 Cb -0.18 -0.39 -0.15 0.00 0.00 0.00 0.00 23.12 22.39 2cu8 s ALA 9 CO 0.00 0.02 0.72 0.43 0.00 0.00 0.00 175.76 176.93 2cu8 n SER 10 N -1.02 -0.19 -4.91 0.00 7.64 -1.26 -4.39 113.62 109.48 2cu8 n SER 10 Ca -0.04 1.12 -0.27 0.00 1.01 0.00 0.00 58.87 60.70 2cu8 n SER 10 Cb 0.63 -1.10 0.06 0.00 -1.01 0.00 0.00 64.21 62.78 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 -1.28 2.49 -0.23 1.43 1.02 -1.26 -1.46 119.74 120.45 2cu8 s LYS 11 Ca 0.62 0.01 -0.09 0.00 0.02 0.00 0.00 55.97 56.52 2cu8 s LYS 11 Cb -0.80 -2.13 -0.05 0.00 -0.52 0.00 0.00 37.83 34.33 2cu8 s LYS 11 CO 0.58 -1.11 0.13 0.00 -0.92 0.00 0.00 175.35 174.03 2cu8 n PRO 13 N 4.13 0.49 -0.04 0.00 -0.04 -1.26 0.73 135.00 139.02 2cu8 n PRO 13 Ca -0.16 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.25 2cu8 n PRO 13 Cb 0.52 -1.16 -0.02 0.00 -0.04 0.00 0.00 33.50 32.80 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 -0.66 0.33 -0.38 0.54 3.00 -1.26 -4.73 118.16 115.00 2cu8 n LYS 14 Ca 0.04 0.13 0.08 0.00 -0.00 0.00 0.00 58.31 58.56 2cu8 n LYS 14 Cb 0.02 -1.08 0.24 0.00 0.00 0.00 0.00 35.03 34.21 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 0.37 0.62 -4.51 0.00 2.03 0.22 -4.92 116.55 110.38 2cu8 n ASP 16 Ca 0.19 -1.27 -0.24 0.00 0.52 0.00 0.00 54.79 53.98 2cu8 n ASP 16 Cb 0.69 -1.58 -0.11 0.00 -0.72 0.00 0.00 41.12 39.41 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 -7.37 1.74 -0.52 -0.67 1.02 -1.24 -4.76 119.74 107.94 2cu8 s LYS 17 Ca 0.03 -1.92 -0.28 0.00 0.02 0.00 0.00 55.97 53.82 2cu8 s LYS 17 Cb -0.02 -1.41 0.02 0.00 -0.52 0.00 0.00 37.83 35.90 2cu8 s LYS 17 CO 0.99 0.02 1.37 0.99 -0.92 0.00 0.00 175.35 177.81 2cu8 s THR 18 N -2.85 3.87 -0.34 2.17 2.01 -1.26 0.31 115.64 119.55 2cu8 s THR 18 Ca 0.33 0.80 -0.29 0.00 0.31 0.00 0.00 61.69 62.83 2cu8 s THR 18 Cb 0.05 -4.42 0.00 0.00 0.01 0.00 0.00 72.50 68.15 2cu8 s THR 18 CO 0.15 -1.07 1.38 -0.69 -0.69 0.00 0.00 174.62 173.70 2cu8 s VAL 19 N 5.69 4.00 0.48 3.82 1.01 -0.53 -4.96 120.40 129.90 2cu8 s VAL 19 Ca 0.53 1.08 -0.22 0.00 0.00 0.00 0.00 61.98 63.38 2cu8 s VAL 19 Cb -0.11 -4.13 -0.07 0.00 0.00 0.00 0.00 36.38 32.07 2cu8 s VAL 19 CO 0.27 -0.58 1.14 -0.31 0.00 0.00 0.00 175.10 175.63 2cu8 s TYR 20 N 4.91 2.86 0.60 5.22 1.51 -1.26 -4.48 117.35 126.72 2cu8 s TYR 20 Ca 0.60 1.55 0.33 0.00 -1.01 0.00 0.00 57.07 58.54 2cu8 s TYR 20 Cb -0.16 -3.32 1.97 0.00 -0.11 0.00 0.00 41.96 40.34 2cu8 s TYR 20 CO 0.28 -1.41 2.28 0.35 -1.11 0.00 0.00 175.55 175.93 2cu8 h PHE 21 N 1.84 0.00 0.36 2.71 3.04 -1.94 0.62 116.94 123.57 2cu8 h PHE 21 Ca -0.49 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.44 2cu8 h PHE 21 Cb 1.25 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.76 2cu8 h PHE 21 CO 0.53 0.00 -0.17 0.00 -2.02 0.00 0.00 178.31 176.66 2cu8 h ALA 22 N 2.00 -0.48 -0.44 2.41 0.00 -2.02 -3.20 119.26 117.53 2cu8 h ALA 22 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2cu8 h ALA 22 Cb 0.01 0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2cu8 h ALA 22 CO 0.00 -0.60 0.00 0.39 0.00 0.00 0.00 179.25 179.04 2cu8 n GLU 23 N -5.16 2.23 -1.95 0.00 1.02 -1.02 -4.92 120.64 110.84 2cu8 n GLU 23 Ca -0.10 -1.89 -0.42 0.00 -0.02 0.00 0.00 57.16 54.73 2cu8 n GLU 23 Cb 0.28 -1.44 -0.03 0.00 -0.02 0.00 0.00 31.44 30.23 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 -1.41 3.96 -0.12 3.49 2.20 0.21 -4.28 119.74 123.79 2cu8 s LYS 24 Ca 0.36 2.09 0.01 0.00 -0.36 0.00 0.00 55.97 58.07 2cu8 s LYS 24 Cb 0.20 -4.07 -0.01 0.00 -1.51 0.00 0.00 37.83 32.44 2cu8 s LYS 24 CO 0.27 -1.12 -0.15 0.54 -0.36 0.00 0.00 175.35 174.53 2cu8 s VAL 25 N 4.85 2.83 0.02 4.02 0.11 -1.18 -4.97 120.40 126.09 2cu8 s VAL 25 Ca 0.78 -0.74 -0.25 0.00 -2.93 0.00 0.00 61.98 58.84 2cu8 s VAL 25 Cb -0.32 -2.17 -0.05 0.00 -1.53 0.00 0.00 36.38 32.31 2cu8 s VAL 25 CO 0.32 0.53 0.75 -0.94 -3.33 0.00 0.00 175.10 172.43 2cu8 s SER 26 N 0.37 7.17 -0.29 3.54 1.04 -1.26 -2.66 113.70 121.61 2cu8 s SER 26 Ca -0.12 1.40 -0.15 0.00 0.48 0.00 0.00 55.95 57.55 2cu8 s SER 26 Cb -0.16 -2.46 0.12 0.00 0.10 0.00 0.00 66.02 63.62 2cu8 s SER 26 CO 0.06 -0.01 0.84 -0.55 0.98 0.00 0.00 173.24 174.56 2cu8 s SER 27 N 0.12 -0.74 -1.24 7.02 0.15 -0.89 -4.31 113.70 113.82 2cu8 s SER 27 Ca 0.38 1.15 0.00 0.00 0.70 0.00 0.00 55.95 58.18 2cu8 s SER 27 Cb -0.20 1.43 0.00 0.00 -1.71 0.00 0.00 66.02 65.54 2cu8 s SER 27 CO 0.22 -0.18 0.00 0.18 1.20 0.00 0.00 173.24 174.66 2cu8 n LEU 28 N 4.24 -1.22 -0.63 3.45 4.32 -1.26 0.13 117.00 126.02 2cu8 n LEU 28 Ca -0.17 0.20 -0.07 0.00 -0.02 0.00 0.00 56.01 55.95 2cu8 n LEU 28 Cb 0.57 -2.23 -0.02 0.00 -1.62 0.00 0.00 43.42 40.12 2cu8 n LEU 28 CO -0.01 -0.27 -0.07 0.61 -1.22 0.00 0.00 177.39 176.43 2cu8 n GLY 29 N -0.71 0.50 3.49 -0.72 0.00 -1.26 -5.02 105.19 101.47 2cu8 n GLY 29 Ca -0.16 -0.68 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.44 1.84 -0.25 1.61 -0.14 0.12 -5.14 119.74 114.35 2cu8 s LYS 30 Ca 0.00 -2.10 0.01 0.00 -1.36 0.00 0.00 55.97 52.52 2cu8 s LYS 30 Cb 0.00 -0.67 0.06 0.00 -1.68 0.00 0.00 37.83 35.54 2cu8 s LYS 30 CO 0.00 -0.40 -0.06 -0.51 -0.76 0.00 0.00 175.35 173.62 2cu8 s ASP 31 N -3.57 4.05 0.27 2.83 1.11 -1.26 -2.09 116.67 118.01 2cu8 s ASP 31 Ca 0.27 -1.30 0.01 0.00 0.18 0.00 0.00 52.55 51.71 2cu8 s ASP 31 Cb 0.04 -1.28 0.01 0.00 1.07 0.00 0.00 42.92 42.76 2cu8 s ASP 31 CO 0.14 -0.24 0.07 0.79 1.18 0.00 0.00 175.17 177.12 2cu8 n TRP 32 N 4.60 0.03 -3.67 4.23 7.02 -1.09 -4.39 117.44 124.17 2cu8 n TRP 32 Ca -0.11 -1.27 -0.20 0.00 -1.02 0.00 0.00 57.50 54.90 2cu8 n TRP 32 Cb 0.43 -0.20 -0.02 0.00 -2.42 0.00 0.00 31.31 29.11 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 -1.76 3.04 -1.18 -5.99 3.76 -1.26 -3.08 115.29 108.83 2cu8 s HIS 33 Ca 0.06 -0.24 0.22 0.00 -0.15 0.00 0.00 55.06 54.94 2cu8 s HIS 33 Cb -0.00 -1.86 1.00 0.00 1.11 0.00 0.00 32.58 32.82 2cu8 s HIS 33 CO 0.04 0.12 1.70 1.63 -0.85 0.00 0.00 174.74 177.37 2cu8 n LYS 34 N -1.50 0.13 -0.01 1.40 4.01 -1.26 -2.27 118.16 118.66 2cu8 n LYS 34 Ca -0.02 0.11 0.02 0.00 -0.51 0.00 0.00 58.31 57.91 2cu8 n LYS 34 Cb 0.59 -1.50 -0.06 0.00 -0.51 0.00 0.00 35.03 33.54 2cu8 n LYS 34 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2cu8 n PHE 35 N -1.41 0.00 0.08 2.13 3.01 -1.26 -4.65 117.46 115.36 2cu8 n PHE 35 Ca 0.07 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.32 2cu8 n PHE 35 Cb 0.22 -0.25 -0.14 0.00 -0.01 0.00 0.00 39.48 39.30 2cu8 n PHE 35 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2cu8 n LEU 37 N -3.98 0.28 -3.66 0.00 7.94 -0.96 -4.74 117.00 111.89 2cu8 n LEU 37 Ca -0.14 -1.47 -0.06 0.00 -1.11 0.00 0.00 56.01 53.23 2cu8 n LEU 37 Cb 0.90 -1.23 -0.02 0.00 0.53 0.00 0.00 43.42 43.61 2cu8 n LEU 37 CO 0.53 -2.42 0.68 -0.54 -1.11 0.00 0.00 177.39 174.53 2cu8 s LYS 38 N 7.75 1.10 0.29 1.96 1.02 -1.26 -3.88 119.74 126.72 2cu8 s LYS 38 Ca 0.86 -0.54 -0.25 0.00 0.02 0.00 0.00 55.97 56.06 2cu8 s LYS 38 Cb -0.27 0.42 -0.09 0.00 -0.52 0.00 0.00 37.83 37.36 2cu8 s LYS 38 CO 0.22 -0.50 0.88 0.00 -0.92 0.00 0.00 175.35 175.03 2cu8 n GLU 40 N 0.69 2.30 -0.07 0.00 4.07 -1.25 -2.72 120.64 123.66 2cu8 n GLU 40 Ca 0.00 -1.94 -0.12 0.00 -0.06 0.00 0.00 57.16 55.04 2cu8 n GLU 40 Cb 0.50 -1.48 -0.04 0.00 -0.06 0.00 0.00 31.44 30.36 2cu8 n GLU 40 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 2cu8 n ARG 41 N 1.20 0.40 -0.47 5.31 0.63 -1.26 -4.69 116.66 117.79 2cu8 n ARG 41 Ca 0.18 0.17 0.08 0.00 -0.92 0.00 0.00 57.85 57.35 2cu8 n ARG 41 Cb 0.55 -1.20 0.27 0.00 0.45 0.00 0.00 32.46 32.53 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 0.13 -1.21 -4.85 0.00 7.64 -1.10 -4.85 113.62 109.37 2cu8 n SER 43 Ca 0.21 -0.35 -0.36 0.00 1.01 0.00 0.00 58.87 59.38 2cu8 n SER 43 Cb 0.83 -1.11 -0.06 0.00 -1.01 0.00 0.00 64.21 62.86 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 -5.31 3.92 0.56 1.43 2.47 -1.26 -4.79 119.74 116.76 2cu8 s LYS 44 Ca 0.37 0.40 -0.20 0.00 -1.56 0.00 0.00 55.97 54.98 2cu8 s LYS 44 Cb -0.22 -3.00 -0.04 0.00 -1.46 0.00 0.00 37.83 33.12 2cu8 s LYS 44 CO 0.45 0.53 1.27 0.99 0.16 0.00 0.00 175.35 178.76 2cu8 s THR 45 N -1.39 2.40 0.35 3.43 2.01 -1.26 -1.74 115.64 119.45 2cu8 s THR 45 Ca 0.35 0.28 0.05 0.00 0.31 0.00 0.00 61.69 62.67 2cu8 s THR 45 Cb -0.15 -3.13 -0.07 0.00 0.01 0.00 0.00 72.50 69.16 2cu8 s THR 45 CO 0.18 -0.03 0.05 -0.76 -0.69 0.00 0.00 174.62 173.37 2cu8 s LEU 46 N -3.74 2.36 -0.10 4.42 1.43 -1.25 -4.85 118.68 116.94 2cu8 s LEU 46 Ca 0.74 -1.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 2cu8 s LEU 46 Cb -0.35 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.33 2cu8 s LEU 46 CO 0.40 -0.58 -0.09 -0.89 0.23 0.00 0.00 176.35 175.41 2cu8 s THR 47 N -3.13 3.45 -0.62 5.49 2.01 -1.26 -4.91 115.64 116.67 2cu8 s THR 47 Ca 0.35 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.54 2cu8 s THR 47 Cb 0.09 -2.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.14 2cu8 s THR 47 CO 0.16 0.55 1.87 -2.16 -0.69 0.00 0.00 174.62 174.35 2cu8 s PRO 48 N -0.22 2.62 0.00 4.92 0.04 -1.26 -3.17 135.00 137.93 2cu8 s PRO 48 Ca 0.02 0.60 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2cu8 s PRO 48 Cb -0.13 -4.40 0.00 0.00 0.04 0.00 0.00 34.50 30.01 2cu8 s PRO 48 CO 0.03 -2.76 0.00 0.41 0.04 0.00 0.00 177.00 174.72 2cu8 n GLY 49 N 5.73 0.91 0.00 0.56 0.00 -1.26 -4.81 105.19 106.32 2cu8 n GLY 49 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.12 3.65 -0.02 0.00 -1.19 -4.96 105.19 101.54 2cu8 n GLY 50 Ca 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 46.02 46.41 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 0.45 0.12 1.61 -3.43 -1.26 -4.70 115.29 108.08 2cu8 s HIS 51 Ca 0.00 -0.87 -0.00 0.00 -0.80 0.00 0.00 55.06 53.39 2cu8 s HIS 51 Cb 0.00 0.34 -0.04 0.00 -1.43 0.00 0.00 32.58 31.45 2cu8 s HIS 51 CO 0.00 -1.23 0.28 0.00 -2.00 0.00 0.00 174.74 171.80 2cu8 s ALA 52 N -3.23 3.94 -0.03 -1.38 0.00 -1.10 -4.99 121.76 114.95 2cu8 s ALA 52 Ca 0.22 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.38 2cu8 s ALA 52 Cb -0.02 -1.89 -0.00 0.00 0.00 0.00 0.00 23.12 21.20 2cu8 s ALA 52 CO 0.13 0.67 -0.15 -1.83 0.00 0.00 0.00 175.76 174.58 2cu8 s GLU 53 N -2.84 1.50 -0.04 0.00 -1.05 -1.26 -0.73 118.70 114.28 2cu8 s GLU 53 Ca 0.36 -0.52 -0.02 0.00 -0.15 0.00 0.00 54.97 54.65 2cu8 s GLU 53 Cb -0.12 -1.34 0.03 0.00 -0.44 0.00 0.00 34.13 32.26 2cu8 s GLU 53 CO 0.28 0.22 0.08 -1.58 0.95 0.00 0.00 175.26 175.21 2cu8 s HIS 54 N 0.03 -0.06 -0.79 4.83 2.46 0.68 -4.83 115.29 117.60 2cu8 s HIS 54 Ca -0.02 0.26 0.00 0.00 0.47 0.00 0.00 55.06 55.77 2cu8 s HIS 54 Cb -0.10 -0.11 0.00 0.00 -0.13 0.00 0.00 32.58 32.24 2cu8 s HIS 54 CO 0.01 -0.10 0.00 -3.47 -2.47 0.00 0.00 174.74 168.71 2cu8 n ASP 55 N 3.86 -2.58 0.00 9.88 2.03 -1.26 0.13 116.55 128.61 2cu8 n ASP 55 Ca -0.23 0.25 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2cu8 n ASP 55 Cb 0.53 -2.40 0.00 0.00 -0.72 0.00 0.00 41.12 38.54 2cu8 n ASP 55 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cu8 n GLY 56 N -0.43 3.15 3.73 0.27 0.00 -1.26 -5.03 105.19 105.62 2cu8 n GLY 56 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.40 4.25 0.77 1.61 3.01 0.34 -4.85 119.74 124.47 2cu8 s LYS 57 Ca 0.00 0.20 -0.11 0.00 -1.01 0.00 0.00 55.97 55.05 2cu8 s LYS 57 Cb 0.00 -3.42 0.05 0.00 -1.01 0.00 0.00 37.83 33.46 2cu8 s LYS 57 CO 0.00 0.24 1.09 -1.25 0.51 0.00 0.00 175.35 175.94 2cu8 s PRO 58 N 0.43 2.28 -0.01 -1.68 0.04 -1.26 -0.23 135.00 134.57 2cu8 s PRO 58 Ca 0.19 1.18 -0.27 0.00 0.04 0.00 0.00 61.00 62.14 2cu8 s PRO 58 Cb -0.14 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.57 2cu8 s PRO 58 CO 0.06 -1.62 0.62 -0.06 0.04 0.00 0.00 177.00 176.03 2cu8 s PHE 59 N -2.87 -0.57 0.55 0.56 0.08 0.09 -3.94 117.98 111.87 2cu8 s PHE 59 Ca 0.62 0.86 -0.22 0.00 0.12 0.00 0.00 56.93 58.31 2cu8 s PHE 59 Cb -0.17 0.39 -0.05 0.00 -0.57 0.00 0.00 43.02 42.62 2cu8 s PHE 59 CO 0.55 -0.63 1.35 0.00 -0.10 0.00 0.00 175.22 176.40 2cu8 h HIS 61 N 1.46 0.84 0.00 0.00 3.86 -1.95 -0.18 115.15 119.18 2cu8 h HIS 61 Ca -0.51 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 2cu8 h HIS 61 Cb 1.30 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 29.53 2cu8 h HIS 61 CO 0.46 -0.00 0.00 0.36 0.86 0.00 0.00 177.93 179.61 2cu8 n LYS 62 N -4.82 0.00 0.26 2.45 -0.00 -1.26 -2.92 118.16 111.87 2cu8 n LYS 62 Ca 0.28 0.00 0.17 0.00 -0.00 0.00 0.00 58.31 58.76 2cu8 n LYS 62 Cb 0.89 0.00 0.69 0.00 -0.00 0.00 0.00 35.03 36.60 2cu8 n LYS 62 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 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 -0.23 -0.86 0.00 3.20 -1.14 -0.60 116.97 117.33 2cu8 h TYR 65 Ca 0.00 0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.14 2cu8 h TYR 65 Cb 0.00 0.10 -0.16 0.00 1.54 0.00 0.00 36.73 38.21 2cu8 h TYR 65 CO -0.11 -0.14 0.10 0.00 -1.64 0.00 0.00 178.16 176.37 2cu8 n ALA 66 N -2.32 0.53 -0.06 1.82 0.00 0.04 -0.46 120.51 120.06 2cu8 n ALA 66 Ca -0.06 0.92 -0.15 0.00 0.00 0.00 0.00 53.44 54.15 2cu8 n ALA 66 Cb 0.14 -0.72 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 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 1.72 -1.68 0.00 2.02 -0.02 0.96 112.91 115.91 2cu8 h THR 67 Ca 0.56 -2.35 0.52 0.00 0.77 0.00 0.00 66.41 65.91 2cu8 h THR 67 Cb 1.25 3.31 -0.11 0.00 -1.74 0.00 0.00 68.15 70.86 2cu8 h THR 67 CO -0.78 0.60 1.16 -0.07 0.37 0.00 0.00 175.52 176.79 2cu8 h LEU 68 N -0.95 0.10 0.00 2.58 3.38 0.84 -1.99 115.31 119.26 2cu8 h LEU 68 Ca -0.03 0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2cu8 h LEU 68 Cb 1.07 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 2cu8 h LEU 68 CO -0.00 -0.11 -1.50 0.49 0.09 0.00 0.00 178.44 177.41 2cu8 n PHE 69 N -4.31 0.00 -0.33 1.13 3.01 -0.47 -4.66 117.46 111.83 2cu8 n PHE 69 Ca 0.42 0.00 0.30 0.00 1.01 0.00 0.00 57.45 59.18 2cu8 n PHE 69 Cb 1.78 -0.32 0.53 0.00 -0.01 0.00 0.00 39.48 41.46 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 2.52 -0.67 3.41 1.37 0.00 0.33 -2.94 105.19 109.21 2cu8 n GLY 70 Ca -0.17 0.66 -0.45 0.00 0.00 0.00 0.00 46.02 46.06 2cu8 n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cu8 s SER 71 N -4.46 6.65 -0.48 1.61 1.04 -0.78 -4.99 113.70 112.29 2cu8 s SER 71 Ca -0.07 -2.23 -0.09 0.00 0.48 0.00 0.00 55.95 54.05 2cu8 s SER 71 Cb 0.27 -2.33 0.12 0.00 0.10 0.00 0.00 66.02 64.18 2cu8 s SER 71 CO 0.67 -0.91 0.35 -0.83 0.98 0.00 0.00 173.24 173.50 2cu8 s GLY 72 N 3.15 2.06 0.30 7.32 0.00 -1.15 -4.96 107.32 114.04 2cu8 s GLY 72 Ca 0.27 -2.58 -0.29 0.00 0.00 0.00 0.00 44.72 42.12 2cu8 s GLY 72 CO -0.09 1.11 1.24 2.56 0.00 0.00 0.00 173.10 177.92 2cu8 s PRO 73 N 1.27 4.46 0.18 2.90 0.04 -1.26 -4.94 135.00 137.65 2cu8 s PRO 73 Ca 0.07 2.06 -0.33 0.00 0.04 0.00 0.00 61.00 62.83 2cu8 s PRO 73 Cb -0.25 -3.13 -0.14 0.00 0.04 0.00 0.00 34.50 31.02 2cu8 s PRO 73 CO -0.01 -0.06 1.42 -1.13 0.04 0.00 0.00 177.00 177.26 2cu8 n SER 74 N 1.14 2.50 0.04 6.66 3.41 -1.26 -4.90 113.62 121.22 2cu8 n SER 74 Ca 0.00 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.73 2cu8 n SER 74 Cb 0.43 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 2cu8 n SER 74 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2cu8 n SER 75 N 2.60 0.83 0.00 4.04 2.88 -1.26 -5.35 113.62 117.36 2cu8 n SER 75 Ca 0.15 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2cu8 n SER 75 Cb 0.28 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2cu8 n SER 75 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42