#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct4 h SER 2 N 0.00 -0.70 -3.48 1.61 0.02 -2.11 -3.42 113.55 105.48 2ct4 h SER 2 Ca 0.00 0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 60.45 2ct4 h SER 2 Cb 0.00 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 2ct4 h SER 2 CO 0.00 -0.50 0.46 -0.44 -1.14 0.00 0.00 176.83 175.21 2ct4 s SER 3 N -4.46 7.29 -0.36 3.07 0.01 -1.26 -5.02 113.70 112.97 2ct4 s SER 3 Ca -0.17 1.97 0.01 0.00 1.31 0.00 0.00 55.95 59.06 2ct4 s SER 3 Cb 0.04 -2.59 0.11 0.00 0.21 0.00 0.00 66.02 63.79 2ct4 s SER 3 CO 0.62 -0.24 0.15 -0.83 0.41 0.00 0.00 173.24 173.35 2ct4 s GLY 4 N 0.26 1.33 0.61 3.44 0.00 -1.26 -5.12 107.32 106.57 2ct4 s GLY 4 Ca 0.51 -2.05 -0.16 0.00 0.00 0.00 0.00 44.72 43.01 2ct4 s GLY 4 CO 0.32 1.56 1.10 -0.56 0.00 0.00 0.00 173.10 175.52 2ct4 s SER 5 N 1.12 5.47 -0.44 1.64 0.01 -1.26 -5.02 113.70 115.23 2ct4 s SER 5 Ca 0.13 1.98 -0.04 0.00 1.31 0.00 0.00 55.95 59.33 2ct4 s SER 5 Cb -0.20 -2.55 0.12 0.00 0.21 0.00 0.00 66.02 63.59 2ct4 s SER 5 CO -0.14 -1.38 0.24 -0.55 0.41 0.00 0.00 173.24 171.82 2ct4 s SER 6 N -2.46 5.31 0.00 2.44 0.15 -1.26 -4.92 113.70 112.97 2ct4 s SER 6 Ca 0.67 -2.09 0.00 0.00 0.70 0.00 0.00 55.95 55.23 2ct4 s SER 6 Cb -0.20 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.26 2ct4 s SER 6 CO 0.36 -0.55 0.00 0.61 1.20 0.00 0.00 173.24 174.87 2ct4 n GLY 7 N 4.53 -0.23 0.00 9.45 0.00 -1.26 -5.07 105.19 112.62 2ct4 n GLY 7 Ca -0.02 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.53 2ct4 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ct4 n GLY 8 N 0.00 4.00 2.78 -0.02 0.00 -1.26 -5.01 105.19 105.68 2ct4 n GLY 8 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 46.02 44.57 2ct4 n GLY 8 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ct4 s HIS 9 N -2.77 -0.02 -0.08 1.61 0.09 -1.26 -3.94 115.29 108.92 2ct4 s HIS 9 Ca 0.00 0.28 -0.20 0.00 -0.00 0.00 0.00 55.06 55.14 2ct4 s HIS 9 Cb 0.00 -0.28 0.04 0.00 -0.00 0.00 0.00 32.58 32.35 2ct4 s HIS 9 CO 0.00 -0.15 0.47 0.00 -0.00 0.00 0.00 174.74 175.06 2ct4 s VAL 11 N -0.75 1.10 0.22 0.00 -7.23 -1.24 -2.11 120.40 110.39 2ct4 s VAL 11 Ca -0.08 -0.52 -0.32 0.00 -1.81 0.00 0.00 61.98 59.25 2ct4 s VAL 11 Cb -0.03 -0.97 -0.14 0.00 0.56 0.00 0.00 36.38 35.80 2ct4 s VAL 11 CO 0.05 0.33 1.35 0.00 -0.31 0.00 0.00 175.10 176.52 2ct4 n ALA 12 N 3.33 0.62 -0.02 1.32 0.00 -0.68 -2.49 120.51 122.59 2ct4 n ALA 12 Ca -0.19 0.43 -0.22 0.00 0.00 0.00 0.00 53.44 53.46 2ct4 n ALA 12 Cb 0.53 -2.21 -0.13 0.00 0.00 0.00 0.00 19.45 17.63 2ct4 n ALA 12 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2ct4 n ILE 13 N 1.89 1.72 -4.24 0.00 5.41 -0.89 0.12 119.36 123.37 2ct4 n ILE 13 Ca 0.13 -0.50 -0.17 0.00 1.00 0.00 0.00 62.75 63.21 2ct4 n ILE 13 Cb 0.29 -1.82 -0.13 0.00 -0.71 0.00 0.00 39.64 37.27 2ct4 n ILE 13 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2ct4 s TYR 14 N -2.51 0.82 -0.40 1.39 2.02 -1.26 -4.48 117.35 112.93 2ct4 s TYR 14 Ca -0.24 -0.29 -0.36 0.00 -0.37 0.00 0.00 57.07 55.81 2ct4 s TYR 14 Cb 0.06 -0.50 -0.13 0.00 -0.40 0.00 0.00 41.96 40.99 2ct4 s TYR 14 CO 0.73 -0.02 2.20 1.58 -1.57 0.00 0.00 175.55 178.47 2ct4 n HIS 15 N 2.23 1.48 -4.64 2.71 -0.00 -1.26 -4.56 115.22 111.19 2ct4 n HIS 15 Ca -0.17 0.36 -0.33 0.00 0.46 0.00 0.00 57.72 58.04 2ct4 n HIS 15 Cb 0.56 -2.49 -0.13 0.00 -0.12 0.00 0.00 29.99 27.81 2ct4 n HIS 15 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 2ct4 s PHE 16 N 7.28 2.89 -0.13 1.57 5.36 -1.20 -4.96 117.98 128.80 2ct4 s PHE 16 Ca 1.12 -0.50 -0.04 0.00 -0.96 0.00 0.00 56.93 56.55 2ct4 s PHE 16 Cb -0.96 -1.88 -0.03 0.00 -0.34 0.00 0.00 43.02 39.80 2ct4 s PHE 16 CO 0.51 -0.13 0.01 -1.83 -1.46 0.00 0.00 175.22 172.32 2ct4 s GLU 17 N 0.33 3.42 -1.50 10.12 1.03 -1.26 -1.15 118.70 129.69 2ct4 s GLU 17 Ca -0.08 -0.41 -0.09 0.00 0.03 0.00 0.00 54.97 54.41 2ct4 s GLU 17 Cb -0.15 -2.94 0.00 0.00 -0.80 0.00 0.00 34.13 30.24 2ct4 s GLU 17 CO 0.05 0.48 2.62 0.41 -1.33 0.00 0.00 175.26 177.49 2ct4 n GLY 18 N 2.83 4.56 1.89 -3.83 0.00 -1.26 -4.72 105.19 104.66 2ct4 n GLY 18 Ca -0.18 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 2ct4 n GLY 18 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ct4 n SER 19 N 3.56 6.15 -3.56 1.61 7.64 -1.26 -4.83 113.62 122.93 2ct4 n SER 19 Ca 0.67 -2.90 -0.10 0.00 1.01 0.00 0.00 58.87 57.55 2ct4 n SER 19 Cb 0.27 -1.12 -0.03 0.00 -1.01 0.00 0.00 64.21 62.32 2ct4 n SER 19 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ct4 s SER 20 N 0.72 0.18 0.30 6.43 0.15 -1.26 -5.15 113.70 115.07 2ct4 s SER 20 Ca 0.30 -1.09 -0.27 0.00 0.70 0.00 0.00 55.95 55.59 2ct4 s SER 20 Cb 0.21 0.68 -0.10 0.00 -1.71 0.00 0.00 66.02 65.11 2ct4 s SER 20 CO -0.03 -1.32 0.96 -1.83 1.20 0.00 0.00 173.24 172.21 2ct4 s GLU 21 N -3.39 4.63 -1.31 5.44 1.03 -1.26 -3.88 118.70 119.96 2ct4 s GLU 21 Ca 0.22 1.41 -0.03 0.00 0.03 0.00 0.00 54.97 56.59 2ct4 s GLU 21 Cb -0.02 -2.93 0.01 0.00 -0.80 0.00 0.00 34.13 30.39 2ct4 s GLU 21 CO 0.12 0.31 0.93 0.41 -1.33 0.00 0.00 175.26 175.70 2ct4 n GLY 22 N 0.82 -0.39 3.14 -3.83 0.00 -1.26 -5.00 105.19 98.67 2ct4 n GLY 22 Ca 0.01 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 2ct4 n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ct4 s THR 23 N -3.45 0.19 0.05 2.61 -4.23 -1.25 -3.00 115.64 106.55 2ct4 s THR 23 Ca 0.19 -1.88 0.05 0.00 -1.18 0.00 0.00 61.69 58.86 2ct4 s THR 23 Cb -0.09 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.86 2ct4 s THR 23 CO 0.77 -0.65 -0.13 -0.51 -0.54 0.00 0.00 174.62 173.56 2ct4 s ILE 24 N -3.97 1.02 -0.07 2.99 2.07 -1.26 -4.65 121.20 117.33 2ct4 s ILE 24 Ca 0.18 -1.07 -0.13 0.00 -1.41 0.00 0.00 60.65 58.22 2ct4 s ILE 24 Cb 0.08 -0.96 -0.05 0.00 0.13 0.00 0.00 42.46 41.66 2ct4 s ILE 24 CO -0.02 -0.10 0.32 -0.94 -1.91 0.00 0.00 174.94 172.28 2ct4 s SER 25 N -1.33 6.62 0.34 4.50 1.04 -1.26 -4.07 113.70 119.54 2ct4 s SER 25 Ca -0.01 0.73 0.03 0.00 0.48 0.00 0.00 55.95 57.19 2ct4 s SER 25 Cb -0.08 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.80 2ct4 s SER 25 CO 0.01 0.29 0.09 0.00 0.98 0.00 0.00 173.24 174.62 2ct4 s MET 26 N -0.68 1.69 0.05 4.02 0.23 -0.30 -4.92 119.30 119.39 2ct4 s MET 26 Ca 0.20 -1.97 0.08 0.00 -1.03 0.00 0.00 55.69 52.97 2ct4 s MET 26 Cb -0.15 -0.62 -0.03 0.00 -1.53 0.00 0.00 34.83 32.50 2ct4 s MET 26 CO 0.09 -0.32 -0.20 0.00 -2.03 0.00 0.00 175.02 172.56 2ct4 s ALA 27 N -3.38 2.54 -0.23 3.16 0.00 -1.26 -3.22 121.76 119.36 2ct4 s ALA 27 Ca 0.33 -1.22 -0.35 0.00 0.00 0.00 0.00 51.96 50.71 2ct4 s ALA 27 Cb 0.06 -0.68 -0.12 0.00 0.00 0.00 0.00 23.12 22.39 2ct4 s ALA 27 CO 0.15 0.57 2.01 -1.91 0.00 0.00 0.00 175.76 176.58 2ct4 n GLU 28 N 1.53 1.58 -1.58 0.00 2.13 -1.26 -0.25 120.64 122.78 2ct4 n GLU 28 Ca -0.16 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.18 2ct4 n GLU 28 Cb 0.52 -2.55 0.00 0.00 0.27 0.00 0.00 31.44 29.68 2ct4 n GLU 28 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ct4 n GLY 29 N 5.33 0.43 3.85 8.31 0.00 0.12 -4.96 105.19 118.27 2ct4 n GLY 29 Ca 0.31 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 2ct4 n GLY 29 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ct4 s GLU 30 N -3.19 3.84 0.25 1.61 2.56 0.65 -4.83 118.70 119.59 2ct4 s GLU 30 Ca 0.00 0.32 -0.30 0.00 0.00 0.00 0.00 54.97 54.99 2ct4 s GLU 30 Cb 0.00 -3.17 -0.09 0.00 2.00 0.00 0.00 34.13 32.87 2ct4 s GLU 30 CO 0.00 0.67 0.99 0.34 -0.56 0.00 0.00 175.26 176.71 2ct4 s ASP 31 N -1.21 7.52 0.05 -1.70 -1.08 -1.26 -1.69 116.67 117.29 2ct4 s ASP 31 Ca 0.25 2.05 -0.00 0.00 -0.52 0.00 0.00 52.55 54.32 2ct4 s ASP 31 Cb -0.16 -2.61 -0.03 0.00 -1.46 0.00 0.00 42.92 38.65 2ct4 s ASP 31 CO 0.13 0.05 -0.03 -0.76 0.52 0.00 0.00 175.17 175.08 2ct4 s LEU 32 N -1.20 2.42 -0.46 -1.34 1.43 -0.90 -4.45 118.68 114.18 2ct4 s LEU 32 Ca 0.42 -0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 52.53 2ct4 s LEU 32 Cb -0.28 0.14 0.08 0.00 0.03 0.00 0.00 46.19 46.16 2ct4 s LEU 32 CO 0.35 -0.50 0.35 -0.55 0.23 0.00 0.00 176.35 176.22 2ct4 s SER 33 N -2.53 5.98 0.16 2.29 0.15 -0.27 -3.85 113.70 115.62 2ct4 s SER 33 Ca 0.01 -1.40 -0.34 0.00 0.70 0.00 0.00 55.95 54.93 2ct4 s SER 33 Cb 0.03 -2.12 -0.15 0.00 -1.71 0.00 0.00 66.02 62.07 2ct4 s SER 33 CO -0.07 -0.61 1.36 -0.11 1.20 0.00 0.00 173.24 175.00 2ct4 n LEU 34 N 5.11 2.27 0.00 3.45 -0.00 -1.25 -1.02 117.00 125.56 2ct4 n LEU 34 Ca -0.12 1.12 -0.00 0.00 -0.00 0.00 0.00 56.01 57.01 2ct4 n LEU 34 Cb 0.43 -1.31 -0.00 0.00 -0.00 0.00 0.00 43.42 42.55 2ct4 n LEU 34 CO 0.45 -0.82 -0.03 0.23 -0.00 0.00 0.00 177.39 177.21 2ct4 n MET 35 N 2.38 0.02 -5.03 1.96 2.81 0.18 -4.01 117.12 115.43 2ct4 n MET 35 Ca 0.15 0.01 -0.31 0.00 -1.81 0.00 0.00 57.70 55.75 2ct4 n MET 35 Cb 0.26 -0.24 -0.17 0.00 -0.71 0.00 0.00 33.22 32.36 2ct4 n MET 35 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2ct4 s GLU 36 N -1.26 2.78 0.87 0.03 2.02 -1.01 -4.95 118.70 117.17 2ct4 s GLU 36 Ca -0.01 -0.78 -0.12 0.00 0.02 0.00 0.00 54.97 54.08 2ct4 s GLU 36 Cb 0.00 -2.14 0.11 0.00 0.10 0.00 0.00 34.13 32.21 2ct4 s GLU 36 CO 0.02 0.13 1.10 -1.21 0.02 0.00 0.00 175.26 175.32 2ct4 s GLU 37 N 0.46 1.48 -0.28 1.61 2.02 -1.26 -1.66 118.70 121.07 2ct4 s GLU 37 Ca -0.17 0.67 -0.08 0.00 0.02 0.00 0.00 54.97 55.41 2ct4 s GLU 37 Cb -0.17 -1.85 -0.01 0.00 0.10 0.00 0.00 34.13 32.20 2ct4 s GLU 37 CO 0.07 -2.05 0.10 0.16 0.02 0.00 0.00 175.26 173.56 2ct4 s ASP 38 N -3.67 5.27 -0.57 -0.19 -4.77 -1.23 -4.77 116.67 106.74 2ct4 s ASP 38 Ca 0.63 -0.46 -0.06 0.00 -3.30 0.00 0.00 52.55 49.36 2ct4 s ASP 38 Cb -0.16 -1.94 0.15 0.00 -1.09 0.00 0.00 42.92 39.88 2ct4 s ASP 38 CO 0.56 -0.13 0.42 -0.54 0.70 0.00 0.00 175.17 176.17 2ct4 s LYS 39 N 1.58 2.60 -1.59 2.11 1.02 -1.26 -4.64 119.74 119.56 2ct4 s LYS 39 Ca 0.05 -2.18 -0.02 0.00 0.02 0.00 0.00 55.97 53.84 2ct4 s LYS 39 Cb -0.16 -3.87 0.01 0.00 -0.52 0.00 0.00 37.83 33.28 2ct4 s LYS 39 CO 0.04 -1.18 0.19 0.41 -0.92 0.00 0.00 175.35 173.89 2ct4 n GLY 40 N 4.16 -0.51 0.00 -3.33 0.00 -1.26 -4.80 105.19 99.45 2ct4 n GLY 40 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2ct4 n GLY 40 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ct4 n ASP 41 N -2.13 2.84 0.00 1.61 2.03 -1.26 -5.04 116.55 114.59 2ct4 n ASP 41 Ca -0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2ct4 n ASP 41 Cb 0.65 0.07 0.00 0.00 -0.72 0.00 0.00 41.12 41.12 2ct4 n ASP 41 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ct4 n GLY 42 N 2.72 0.69 3.11 0.27 0.00 -1.26 -5.05 105.19 105.67 2ct4 n GLY 42 Ca 0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 2ct4 n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ct4 s TRP 43 N -2.00 2.10 -0.17 1.61 0.52 -1.26 -1.55 118.94 118.19 2ct4 s TRP 43 Ca 0.00 -0.92 -0.01 0.00 0.02 0.00 0.00 56.10 55.19 2ct4 s TRP 43 Cb 0.00 -1.47 0.04 0.00 -1.15 0.00 0.00 33.47 30.90 2ct4 s TRP 43 CO 0.00 -0.43 -0.04 0.99 0.02 0.00 0.00 176.95 177.49 2ct4 s THR 44 N 0.72 1.02 0.19 2.01 2.01 -0.35 -3.52 115.64 117.72 2ct4 s THR 44 Ca -0.12 -0.61 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2ct4 s THR 44 Cb -0.16 -1.24 -0.08 0.00 0.01 0.00 0.00 72.50 71.03 2ct4 s THR 44 CO 0.02 0.09 1.28 -0.60 -0.69 0.00 0.00 174.62 174.72 2ct4 s ARG 45 N 1.67 4.41 0.25 4.92 3.52 -0.66 -3.19 118.95 129.87 2ct4 s ARG 45 Ca 0.00 2.00 0.01 0.00 -0.13 0.00 0.00 55.73 57.62 2ct4 s ARG 45 Cb -0.15 -3.21 -0.03 0.00 -1.56 0.00 0.00 34.95 29.99 2ct4 s ARG 45 CO -0.07 -0.21 0.20 0.14 -0.81 0.00 0.00 175.30 174.54 2ct4 s VAL 46 N 0.12 0.00 0.24 7.11 -7.23 -1.09 0.47 120.40 120.02 2ct4 s VAL 46 Ca 0.56 -1.97 0.07 0.00 -1.81 0.00 0.00 61.98 58.83 2ct4 s VAL 46 Cb -0.35 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 2ct4 s VAL 46 CO 0.37 0.00 -0.11 -0.60 -0.31 0.00 0.00 175.10 174.45 2ct4 s ARG 47 N -3.89 1.44 0.00 4.82 3.52 -0.19 -2.82 118.95 121.84 2ct4 s ARG 47 Ca 0.39 -1.68 0.08 0.00 -0.13 0.00 0.00 55.73 54.39 2ct4 s ARG 47 Cb 0.05 -1.16 -0.02 0.00 -1.56 0.00 0.00 34.95 32.25 2ct4 s ARG 47 CO 0.17 0.13 -0.24 1.03 -0.81 0.00 0.00 175.30 175.58 2ct4 s ARG 48 N -3.67 2.05 0.34 5.12 0.52 0.05 -1.12 118.95 122.23 2ct4 s ARG 48 Ca 0.26 -0.97 0.14 0.00 -0.52 0.00 0.00 55.73 54.64 2ct4 s ARG 48 Cb 0.01 -2.07 1.07 0.00 0.52 0.00 0.00 34.95 34.48 2ct4 s ARG 48 CO 0.09 0.55 1.67 0.87 0.02 0.00 0.00 175.30 178.50 2ct4 h LYS 49 N 5.14 0.34 0.74 3.54 1.57 -1.90 -0.49 116.57 125.51 2ct4 h LYS 49 Ca -0.45 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.28 2ct4 h LYS 49 Cb 1.13 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 2ct4 h LYS 49 CO 0.46 0.23 -0.42 0.93 -0.57 0.00 0.00 179.45 180.08 2ct4 h GLU 50 N 0.35 -1.03 0.00 3.15 5.08 -1.96 -3.47 114.58 116.70 2ct4 h GLU 50 Ca 0.73 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 59.16 2ct4 h GLU 50 Cb 1.63 0.24 0.00 0.00 0.50 0.00 0.00 28.75 31.12 2ct4 h GLU 50 CO -0.59 -0.69 0.00 0.41 -1.00 0.00 0.00 179.01 177.14 2ct4 n GLY 51 N -1.57 0.00 3.03 -3.84 0.00 -0.19 -5.16 105.19 97.46 2ct4 n GLY 51 Ca -0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.66 2ct4 n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ct4 s GLY 52 N 0.00 0.63 0.09 -0.02 0.00 -1.24 -4.94 107.32 101.84 2ct4 s GLY 52 Ca 0.00 -0.42 0.06 0.00 0.00 0.00 0.00 44.72 44.36 2ct4 s GLY 52 CO 0.00 -0.15 -0.15 -1.83 0.00 0.00 0.00 173.10 170.97 2ct4 s GLU 53 N 0.16 0.92 0.02 2.90 -1.05 -1.26 -0.77 118.70 119.62 2ct4 s GLU 53 Ca -0.03 -1.08 -0.04 0.00 -0.15 0.00 0.00 54.97 53.66 2ct4 s GLU 53 Cb -0.09 -0.89 0.02 0.00 -0.44 0.00 0.00 34.13 32.72 2ct4 s GLU 53 CO 0.01 0.19 0.21 0.41 0.95 0.00 0.00 175.26 177.02 2ct4 n GLY 54 N 0.97 0.94 3.40 -3.83 0.00 -1.13 -4.69 105.19 100.86 2ct4 n GLY 54 Ca -0.19 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 2ct4 n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ct4 s TYR 55 N -4.37 3.23 0.14 1.61 2.02 -1.16 -2.67 117.35 116.15 2ct4 s TYR 55 Ca 0.05 -0.83 0.07 0.00 -0.37 0.00 0.00 57.07 55.99 2ct4 s TYR 55 Cb -0.00 -2.45 -0.04 0.00 -0.40 0.00 0.00 41.96 39.06 2ct4 s TYR 55 CO 0.01 -0.61 -0.07 0.14 -1.57 0.00 0.00 175.55 173.45 2ct4 s VAL 56 N 1.58 3.46 -0.15 0.71 -7.23 -1.19 -4.17 120.40 113.42 2ct4 s VAL 56 Ca 0.03 -1.38 -0.29 0.00 -1.81 0.00 0.00 61.98 58.52 2ct4 s VAL 56 Cb -0.19 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.04 2ct4 s VAL 56 CO 0.07 0.00 1.56 -2.16 -0.31 0.00 0.00 175.10 174.27 2ct4 s PRO 57 N -2.56 4.01 0.39 4.82 0.04 -1.26 -1.22 135.00 139.23 2ct4 s PRO 57 Ca 0.24 1.85 0.21 0.00 0.04 0.00 0.00 61.00 63.34 2ct4 s PRO 57 Cb -0.10 -3.97 1.20 0.00 0.04 0.00 0.00 34.50 31.67 2ct4 s PRO 57 CO 0.16 -1.03 1.68 1.15 0.04 0.00 0.00 177.00 179.00 2ct4 h THR 58 N 5.82 0.31 -1.10 1.26 2.02 -1.62 0.41 112.91 120.01 2ct4 h THR 58 Ca -0.34 -0.09 0.31 0.00 0.77 0.00 0.00 66.41 67.06 2ct4 h THR 58 Cb 1.15 0.02 -0.11 0.00 -1.74 0.00 0.00 68.15 67.47 2ct4 h THR 58 CO 0.98 0.05 0.70 0.28 0.37 0.00 0.00 175.52 177.90 2ct4 h SER 59 N 0.27 0.41 -0.68 4.18 0.02 -1.90 0.95 113.55 116.80 2ct4 h SER 59 Ca 0.72 0.11 -0.37 0.00 -0.84 0.00 0.00 61.79 61.41 2ct4 h SER 59 Cb 1.92 0.05 -0.21 0.00 0.14 0.00 0.00 62.40 64.30 2ct4 h SER 59 CO -0.45 0.00 0.47 -1.22 -1.14 0.00 0.00 176.83 174.49 2ct4 n TYR 60 N -4.69 2.11 -3.87 3.45 4.02 0.14 -4.82 117.16 113.50 2ct4 n TYR 60 Ca 0.29 -1.54 -0.24 0.00 -0.01 0.00 0.00 57.90 56.40 2ct4 n TYR 60 Cb 1.01 -0.78 -0.17 0.00 -0.02 0.00 0.00 39.34 39.38 2ct4 n TYR 60 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2ct4 s LEU 61 N -2.29 0.85 -0.56 7.72 1.43 0.33 -2.10 118.68 124.06 2ct4 s LEU 61 Ca 0.39 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2ct4 s LEU 61 Cb 0.33 -0.55 0.15 0.00 0.03 0.00 0.00 46.19 46.15 2ct4 s LEU 61 CO 0.06 -0.15 0.37 -0.60 0.23 0.00 0.00 176.35 176.26 2ct4 s ARG 62 N 1.75 2.38 -0.37 1.70 3.52 -1.04 -4.95 118.95 121.95 2ct4 s ARG 62 Ca 0.03 -2.34 -0.42 0.00 -0.13 0.00 0.00 55.73 52.87 2ct4 s ARG 62 Cb -0.13 -3.67 -0.17 0.00 -1.56 0.00 0.00 34.95 29.43 2ct4 s ARG 62 CO -0.05 -1.14 1.81 0.28 -0.81 0.00 0.00 175.30 175.39 2ct4 n VAL 63 N 3.77 0.19 -1.61 7.11 0.31 -1.26 -3.60 118.33 123.23 2ct4 n VAL 63 Ca 0.05 -0.06 -0.45 0.00 -0.01 0.00 0.00 64.34 63.87 2ct4 n VAL 63 Cb 0.38 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 32.28 2ct4 n VAL 63 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2ct4 n THR 64 N 5.01 1.65 -4.03 2.52 -2.24 -1.13 -4.99 114.28 111.07 2ct4 n THR 64 Ca 0.33 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.47 2ct4 n THR 64 Cb 0.08 -1.11 -0.17 0.00 -2.10 0.00 0.00 70.33 67.03 2ct4 n THR 64 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ct4 s SER 65 N -0.31 1.39 0.00 3.42 0.15 -1.26 -5.00 113.70 112.09 2ct4 s SER 65 Ca 0.62 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.12 2ct4 s SER 65 Cb -0.70 -0.53 0.00 0.00 -1.71 0.00 0.00 66.02 63.07 2ct4 s SER 65 CO 0.57 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.52 2ct4 n GLY 66 N 4.52 -0.95 3.70 9.45 0.00 -1.26 -5.16 105.19 115.49 2ct4 n GLY 66 Ca -0.17 0.56 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 2ct4 n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ct4 s PRO 67 N 0.44 0.97 0.07 1.61 0.04 -1.26 -5.08 135.00 131.78 2ct4 s PRO 67 Ca 0.00 0.72 -0.21 0.00 0.04 0.00 0.00 61.00 61.55 2ct4 s PRO 67 Cb 0.00 -1.78 0.05 0.00 0.04 0.00 0.00 34.50 32.80 2ct4 s PRO 67 CO 0.00 -2.41 0.49 0.45 0.04 0.00 0.00 177.00 175.56 2ct4 s SER 68 N -3.43 -0.39 -0.48 6.66 0.15 -1.26 -5.13 113.70 109.83 2ct4 s SER 68 Ca 0.64 0.06 0.01 0.00 0.70 0.00 0.00 55.95 57.36 2ct4 s SER 68 Cb -0.18 0.48 0.13 0.00 -1.71 0.00 0.00 66.02 64.74 2ct4 s SER 68 CO 0.57 -0.75 0.24 -0.44 1.20 0.00 0.00 173.24 174.06 2ct4 s SER 69 N -2.16 4.82 0.00 5.45 0.01 -1.26 -5.35 113.70 115.22 2ct4 s SER 69 Ca -0.04 -2.58 0.00 0.00 1.31 0.00 0.00 55.95 54.65 2ct4 s SER 69 Cb -0.00 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.50 2ct4 s SER 69 CO -0.04 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 173.86