#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct4 s SER 2 N 0.00 2.10 0.33 1.61 0.15 -1.26 -5.14 113.70 111.49 2ct4 s SER 2 Ca 0.00 -0.56 -0.06 0.00 0.70 0.00 0.00 55.95 56.04 2ct4 s SER 2 Cb 0.00 0.00 0.01 0.00 -1.71 0.00 0.00 66.02 64.32 2ct4 s SER 2 CO 0.00 -0.35 0.50 -0.44 1.20 0.00 0.00 173.24 174.14 2ct4 s SER 3 N 2.21 0.63 -0.38 5.45 0.01 -1.26 -5.13 113.70 115.23 2ct4 s SER 3 Ca 0.05 -1.35 -0.02 0.00 1.31 0.00 0.00 55.95 55.94 2ct4 s SER 3 Cb -0.16 0.66 0.24 0.00 0.21 0.00 0.00 66.02 66.97 2ct4 s SER 3 CO -0.14 -1.30 1.09 0.61 0.41 0.00 0.00 173.24 173.91 2ct4 n GLY 4 N -0.52 -1.36 3.55 3.44 0.00 -1.26 -5.15 105.19 103.89 2ct4 n GLY 4 Ca -0.00 0.92 -0.34 0.00 0.00 0.00 0.00 46.02 46.60 2ct4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ct4 s SER 5 N 0.07 4.63 -0.43 1.61 0.15 -1.26 -5.07 113.70 113.39 2ct4 s SER 5 Ca 0.26 -0.07 -0.29 0.00 0.70 0.00 0.00 55.95 56.56 2ct4 s SER 5 Cb 0.16 -1.33 0.02 0.00 -1.71 0.00 0.00 66.02 63.16 2ct4 s SER 5 CO -0.11 0.31 1.23 -0.55 1.20 0.00 0.00 173.24 175.31 2ct4 s SER 6 N -0.47 6.58 0.28 5.45 0.15 -1.26 -4.98 113.70 119.44 2ct4 s SER 6 Ca 0.07 0.70 0.06 0.00 0.70 0.00 0.00 55.95 57.48 2ct4 s SER 6 Cb -0.12 -2.55 -0.02 0.00 -1.71 0.00 0.00 66.02 61.62 2ct4 s SER 6 CO 0.02 -1.25 0.22 0.61 1.20 0.00 0.00 173.24 174.04 2ct4 n GLY 7 N 4.77 3.14 3.43 9.45 0.00 -1.26 -5.09 105.19 119.63 2ct4 n GLY 7 Ca 0.14 -1.87 -0.44 0.00 0.00 0.00 0.00 46.02 43.84 2ct4 n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ct4 s GLY 8 N -2.92 1.74 -0.18 -0.02 0.00 -1.26 -4.93 107.32 99.75 2ct4 s GLY 8 Ca 0.31 -2.37 -0.41 0.00 0.00 0.00 0.00 44.72 42.25 2ct4 s GLY 8 CO 0.22 1.91 1.39 1.42 0.00 0.00 0.00 173.10 178.04 2ct4 n HIS 9 N 6.79 1.37 -3.97 1.90 -0.00 -1.26 -4.32 115.22 115.73 2ct4 n HIS 9 Ca 0.07 0.92 -0.12 0.00 -0.00 0.00 0.00 57.72 58.60 2ct4 n HIS 9 Cb 0.46 -2.24 -0.13 0.00 -0.00 0.00 0.00 29.99 28.09 2ct4 n HIS 9 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2ct4 s VAL 11 N -0.71 1.52 0.27 0.00 -7.23 -1.18 -1.74 120.40 111.33 2ct4 s VAL 11 Ca -0.07 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.79 2ct4 s VAL 11 Cb -0.05 -1.31 -0.12 0.00 0.56 0.00 0.00 36.38 35.46 2ct4 s VAL 11 CO -0.00 0.27 1.53 0.00 -0.31 0.00 0.00 175.10 176.59 2ct4 n ALA 12 N 2.17 2.03 -0.09 1.32 0.00 -0.30 -2.11 120.51 123.54 2ct4 n ALA 12 Ca -0.16 0.39 -0.23 0.00 0.00 0.00 0.00 53.44 53.43 2ct4 n ALA 12 Cb 0.54 -2.40 -0.12 0.00 0.00 0.00 0.00 19.45 17.47 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 2.09 1.57 -4.43 0.00 5.41 -1.08 0.30 119.36 123.23 2ct4 n ILE 13 Ca 0.10 -0.22 -0.20 0.00 1.00 0.00 0.00 62.75 63.43 2ct4 n ILE 13 Cb 0.35 -1.94 -0.14 0.00 -0.71 0.00 0.00 39.64 37.20 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 -2.43 1.17 -0.35 1.39 2.02 -1.26 -4.41 117.35 113.48 2ct4 s TYR 14 Ca -0.30 -0.30 -0.39 0.00 -0.37 0.00 0.00 57.07 55.72 2ct4 s TYR 14 Cb 0.08 -0.72 -0.14 0.00 -0.40 0.00 0.00 41.96 40.78 2ct4 s TYR 14 CO 0.60 0.01 2.02 1.58 -1.57 0.00 0.00 175.55 178.20 2ct4 n HIS 15 N 2.23 1.69 -5.02 2.71 -0.00 -1.26 -4.62 115.22 110.95 2ct4 n HIS 15 Ca -0.17 0.46 -0.32 0.00 0.46 0.00 0.00 57.72 58.15 2ct4 n HIS 15 Cb 0.55 -2.46 -0.16 0.00 -0.12 0.00 0.00 29.99 27.79 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 5.74 2.65 -0.35 1.57 2.19 -1.21 -4.98 117.98 123.60 2ct4 s PHE 16 Ca 1.07 -0.96 -0.04 0.00 0.33 0.00 0.00 56.93 57.33 2ct4 s PHE 16 Cb -1.05 -1.76 0.06 0.00 -1.31 0.00 0.00 43.02 38.96 2ct4 s PHE 16 CO 0.58 -0.38 0.11 -2.00 1.83 0.00 0.00 175.22 175.36 2ct4 s GLU 17 N 0.41 2.43 0.00 10.12 2.12 -1.26 -1.60 118.70 130.91 2ct4 s GLU 17 Ca -0.15 -1.37 0.00 0.00 0.36 0.00 0.00 54.97 53.80 2ct4 s GLU 17 Cb -0.17 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.79 2ct4 s GLU 17 CO 0.07 -0.77 0.07 0.41 -0.54 0.00 0.00 175.26 174.50 2ct4 n GLY 18 N 4.72 -1.38 1.98 -1.50 0.00 -1.24 -4.91 105.19 102.86 2ct4 n GLY 18 Ca -0.10 0.07 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 2ct4 n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ct4 n SER 19 N -0.12 -2.86 -3.79 1.61 2.88 -1.26 -4.94 113.62 105.14 2ct4 n SER 19 Ca 0.00 -0.17 -0.11 0.00 -1.33 0.00 0.00 58.87 57.27 2ct4 n SER 19 Cb 0.00 -1.85 -0.07 0.00 -0.75 0.00 0.00 64.21 61.54 2ct4 n SER 19 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2ct4 s SER 20 N -3.20 -0.05 -1.07 -3.46 0.01 -1.26 -5.03 113.70 99.64 2ct4 s SER 20 Ca 0.11 -0.31 -0.07 0.00 1.31 0.00 0.00 55.95 56.99 2ct4 s SER 20 Cb -0.05 0.34 -0.09 0.00 0.21 0.00 0.00 66.02 66.44 2ct4 s SER 20 CO 0.21 -0.63 2.54 -1.84 0.41 0.00 0.00 173.24 173.94 2ct4 n GLU 21 N 0.47 2.64 0.00 12.44 0.28 -1.26 -3.18 120.64 132.02 2ct4 n GLU 21 Ca -0.18 -1.65 0.00 0.00 -0.16 0.00 0.00 57.16 55.17 2ct4 n GLU 21 Cb 0.60 -2.51 0.00 0.00 1.43 0.00 0.00 31.44 30.96 2ct4 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2ct4 n GLY 22 N 3.54 1.07 3.69 -1.84 0.00 -1.26 -5.15 105.19 105.23 2ct4 n GLY 22 Ca 0.56 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 46.23 2ct4 n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ct4 s THR 23 N 0.00 1.91 0.05 2.61 2.01 -1.19 -3.88 115.64 117.14 2ct4 s THR 23 Ca 0.00 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.01 2ct4 s THR 23 Cb 0.00 -2.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.91 2ct4 s THR 23 CO 0.00 0.00 -0.06 -0.51 -0.69 0.00 0.00 174.62 173.36 2ct4 s ILE 24 N -3.09 0.39 -0.05 1.82 2.07 -1.26 -4.70 121.20 116.39 2ct4 s ILE 24 Ca 0.67 -1.26 -0.01 0.00 -1.41 0.00 0.00 60.65 58.64 2ct4 s ILE 24 Cb -0.15 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 2ct4 s ILE 24 CO 0.56 -0.58 0.02 -0.94 -1.91 0.00 0.00 174.94 172.09 2ct4 s SER 25 N -1.96 5.33 0.34 4.50 1.04 -1.26 -3.60 113.70 118.09 2ct4 s SER 25 Ca -0.06 0.11 0.04 0.00 0.48 0.00 0.00 55.95 56.52 2ct4 s SER 25 Cb -0.05 -1.48 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 2ct4 s SER 25 CO -0.02 0.33 0.07 0.00 0.98 0.00 0.00 173.24 174.60 2ct4 s MET 26 N -1.26 1.70 -0.05 4.02 0.23 -0.63 -4.92 119.30 118.41 2ct4 s MET 26 Ca 0.17 -1.97 0.03 0.00 -1.03 0.00 0.00 55.69 52.89 2ct4 s MET 26 Cb -0.12 -0.79 -0.03 0.00 -1.53 0.00 0.00 34.83 32.37 2ct4 s MET 26 CO 0.07 -0.26 -0.11 0.00 -2.03 0.00 0.00 175.02 172.69 2ct4 s ALA 27 N -3.30 2.80 -0.34 3.16 0.00 -1.26 -3.28 121.76 119.53 2ct4 s ALA 27 Ca 0.33 -0.97 -0.40 0.00 0.00 0.00 0.00 51.96 50.93 2ct4 s ALA 27 Cb 0.07 -1.06 -0.15 0.00 0.00 0.00 0.00 23.12 21.98 2ct4 s ALA 27 CO 0.15 0.57 1.89 -1.91 0.00 0.00 0.00 175.76 176.46 2ct4 n GLU 28 N 2.16 0.93 -1.97 0.00 2.13 -1.26 0.34 120.64 122.96 2ct4 n GLU 28 Ca -0.17 0.32 -0.02 0.00 0.66 0.00 0.00 57.16 57.94 2ct4 n GLU 28 Cb 0.52 -2.08 -0.00 0.00 0.27 0.00 0.00 31.44 30.15 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 5.16 0.29 3.83 8.31 0.00 0.15 -4.98 105.19 117.94 2ct4 n GLY 29 Ca 0.34 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.98 3.87 0.28 1.61 2.56 0.15 -4.80 118.70 118.39 2ct4 s GLU 30 Ca 0.00 0.24 -0.29 0.00 0.00 0.00 0.00 54.97 54.91 2ct4 s GLU 30 Cb 0.00 -3.25 -0.10 0.00 2.00 0.00 0.00 34.13 32.78 2ct4 s GLU 30 CO 0.00 0.62 1.12 0.34 -0.56 0.00 0.00 175.26 176.78 2ct4 s ASP 31 N -0.77 7.23 0.04 -1.70 2.15 -1.26 -1.14 116.67 121.21 2ct4 s ASP 31 Ca 0.21 2.30 -0.03 0.00 0.43 0.00 0.00 52.55 55.46 2ct4 s ASP 31 Cb -0.15 -2.63 -0.02 0.00 -0.30 0.00 0.00 42.92 39.82 2ct4 s ASP 31 CO 0.10 -0.18 0.02 -0.76 -0.17 0.00 0.00 175.17 174.18 2ct4 s LEU 32 N -1.41 2.16 -0.33 -1.34 1.43 -0.71 -4.71 118.68 113.76 2ct4 s LEU 32 Ca 0.45 -0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 52.73 2ct4 s LEU 32 Cb -0.33 0.34 -0.00 0.00 0.03 0.00 0.00 46.19 46.24 2ct4 s LEU 32 CO 0.42 -0.50 0.19 -0.44 0.23 0.00 0.00 176.35 176.24 2ct4 s SER 33 N -2.31 5.72 0.09 2.29 0.01 -0.57 -3.59 113.70 115.34 2ct4 s SER 33 Ca -0.02 -0.62 -0.31 0.00 1.31 0.00 0.00 55.95 56.31 2ct4 s SER 33 Cb 0.01 -2.04 -0.09 0.00 0.21 0.00 0.00 66.02 64.10 2ct4 s SER 33 CO -0.06 -0.25 1.71 -0.22 0.41 0.00 0.00 173.24 174.83 2ct4 s LEU 34 N 1.63 4.38 0.02 2.44 1.98 -1.26 -0.79 118.68 127.07 2ct4 s LEU 34 Ca 0.04 2.59 -0.00 0.00 -2.89 0.00 0.00 54.13 53.88 2ct4 s LEU 34 Cb -0.18 -3.57 -0.00 0.00 0.66 0.00 0.00 46.19 43.11 2ct4 s LEU 34 CO 0.07 -0.93 -0.00 0.23 -1.89 0.00 0.00 176.35 173.83 2ct4 n MET 35 N 5.56 0.00 -3.51 1.98 2.81 -0.02 -4.58 117.12 119.36 2ct4 n MET 35 Ca 0.16 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.65 2ct4 n MET 35 Cb 0.40 -0.11 -0.10 0.00 -0.71 0.00 0.00 33.22 32.69 2ct4 n MET 35 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2ct4 s GLU 36 N -1.22 3.48 0.79 0.03 2.56 -0.86 -4.96 118.70 118.53 2ct4 s GLU 36 Ca -0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 54.97 54.23 2ct4 s GLU 36 Cb 0.00 -3.81 0.07 0.00 2.00 0.00 0.00 34.13 32.38 2ct4 s GLU 36 CO 0.00 -0.47 1.09 -1.21 -0.56 0.00 0.00 175.26 174.11 2ct4 s GLU 37 N 1.77 2.10 -0.24 4.30 0.41 -1.26 -1.62 118.70 124.15 2ct4 s GLU 37 Ca 0.07 1.01 -0.07 0.00 -0.41 0.00 0.00 54.97 55.57 2ct4 s GLU 37 Cb -0.17 -1.89 -0.03 0.00 -1.78 0.00 0.00 34.13 30.26 2ct4 s GLU 37 CO 0.11 -1.71 0.05 0.16 -0.49 0.00 0.00 175.26 173.38 2ct4 s ASP 38 N -3.51 5.05 -0.60 -0.19 -4.77 -1.25 -4.80 116.67 106.61 2ct4 s ASP 38 Ca 0.61 -0.21 -0.07 0.00 -3.30 0.00 0.00 52.55 49.58 2ct4 s ASP 38 Cb -0.17 -1.90 0.16 0.00 -1.09 0.00 0.00 42.92 39.92 2ct4 s ASP 38 CO 0.56 -0.02 0.45 -0.54 0.70 0.00 0.00 175.17 176.32 2ct4 s LYS 39 N 1.52 2.67 -1.39 2.11 -0.14 -1.26 -4.68 119.74 118.57 2ct4 s LYS 39 Ca 0.06 -2.25 -0.10 0.00 -1.36 0.00 0.00 55.97 52.32 2ct4 s LYS 39 Cb -0.15 -3.90 0.07 0.00 -1.68 0.00 0.00 37.83 32.18 2ct4 s LYS 39 CO 0.03 -1.19 0.60 0.41 -0.76 0.00 0.00 175.35 174.44 2ct4 n GLY 40 N 4.06 -0.49 0.00 -3.33 0.00 -1.26 -4.78 105.19 99.39 2ct4 n GLY 40 Ca 0.04 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2ct4 n GLY 40 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ct4 n ASP 41 N -2.43 2.94 0.00 1.61 9.92 -1.26 -5.04 116.55 122.30 2ct4 n ASP 41 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.24 2ct4 n ASP 41 Cb 0.55 0.17 0.00 0.00 -0.64 0.00 0.00 41.12 41.20 2ct4 n ASP 41 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ct4 n GLY 42 N 2.43 0.70 3.26 0.44 0.00 -1.26 -5.02 105.19 105.74 2ct4 n GLY 42 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 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 2.77 -0.03 1.61 0.52 -1.26 -0.29 118.94 120.27 2ct4 s TRP 43 Ca 0.00 -1.04 0.02 0.00 0.02 0.00 0.00 56.10 55.10 2ct4 s TRP 43 Cb 0.00 -1.88 0.01 0.00 -1.15 0.00 0.00 33.47 30.45 2ct4 s TRP 43 CO 0.00 -0.47 -0.08 0.99 0.02 0.00 0.00 176.95 177.40 2ct4 s THR 44 N 0.79 0.75 -0.19 2.01 2.01 0.15 -3.80 115.64 117.36 2ct4 s THR 44 Ca -0.06 -0.33 -0.15 0.00 0.31 0.00 0.00 61.69 61.47 2ct4 s THR 44 Cb -0.15 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2ct4 s THR 44 CO 0.00 0.24 0.33 -0.60 -0.69 0.00 0.00 174.62 173.90 2ct4 s ARG 45 N 0.29 4.20 0.03 4.92 3.52 -0.64 -0.62 118.95 130.64 2ct4 s ARG 45 Ca -0.04 0.11 0.04 0.00 -0.13 0.00 0.00 55.73 55.71 2ct4 s ARG 45 Cb -0.09 -3.49 -0.02 0.00 -1.56 0.00 0.00 34.95 29.79 2ct4 s ARG 45 CO 0.01 0.09 -0.13 0.14 -0.81 0.00 0.00 175.30 174.60 2ct4 s VAL 46 N 0.93 0.99 0.27 7.11 -7.23 -1.17 -0.84 120.40 120.46 2ct4 s VAL 46 Ca 0.17 -0.89 -0.00 0.00 -1.81 0.00 0.00 61.98 59.45 2ct4 s VAL 46 Cb -0.14 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.87 2ct4 s VAL 46 CO 0.06 0.01 0.46 -0.60 -0.31 0.00 0.00 175.10 174.72 2ct4 s ARG 47 N -1.00 3.51 0.41 4.82 3.52 0.03 -3.29 118.95 126.95 2ct4 s ARG 47 Ca 0.01 -0.35 0.01 0.00 -0.13 0.00 0.00 55.73 55.28 2ct4 s ARG 47 Cb -0.07 -2.76 0.08 0.00 -1.56 0.00 0.00 34.95 30.64 2ct4 s ARG 47 CO 0.01 0.29 0.56 0.54 -0.81 0.00 0.00 175.30 175.89 2ct4 n ARG 48 N -1.19 0.34 -0.02 5.12 1.74 -0.02 -1.51 116.66 121.12 2ct4 n ARG 48 Ca -0.05 -1.68 -0.15 0.00 -0.77 0.00 0.00 57.85 55.20 2ct4 n ARG 48 Cb 0.55 -0.33 -0.04 0.00 -1.02 0.00 0.00 32.46 31.63 2ct4 n ARG 48 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2ct4 h LYS 49 N 0.00 0.74 0.00 5.56 1.79 -1.91 -3.37 116.57 119.38 2ct4 h LYS 49 Ca -0.19 -0.55 -0.17 0.00 -2.18 0.00 0.00 60.65 57.56 2ct4 h LYS 49 Cb 0.73 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.45 2ct4 h LYS 49 CO 0.22 1.17 -1.05 -1.91 -1.08 0.00 0.00 179.45 176.80 2ct4 n GLU 50 N -3.94 0.53 0.00 3.15 2.13 -1.26 -4.81 120.64 116.44 2ct4 n GLU 50 Ca -0.06 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.33 2ct4 n GLU 50 Cb 0.70 -1.73 0.00 0.00 0.27 0.00 0.00 31.44 30.68 2ct4 n GLU 50 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ct4 n GLY 51 N 1.49 -1.77 2.60 8.31 0.00 -1.26 -4.64 105.19 109.91 2ct4 n GLY 51 Ca -0.25 0.76 -0.26 0.00 0.00 0.00 0.00 46.02 46.27 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 0.37 0.03 -0.02 0.00 -1.26 -4.86 107.32 101.58 2ct4 s GLY 52 Ca 0.00 -0.47 0.06 0.00 0.00 0.00 0.00 44.72 44.31 2ct4 s GLY 52 CO 0.00 1.82 -0.14 -1.83 0.00 0.00 0.00 173.10 172.95 2ct4 s GLU 53 N 2.14 2.24 -0.13 2.90 -1.05 -1.26 -0.84 118.70 122.70 2ct4 s GLU 53 Ca 0.04 -0.89 -0.33 0.00 -0.15 0.00 0.00 54.97 53.64 2ct4 s GLU 53 Cb -0.16 -2.29 0.13 0.00 -0.44 0.00 0.00 34.13 31.36 2ct4 s GLU 53 CO -0.16 0.56 1.12 0.20 0.95 0.00 0.00 175.26 177.94 2ct4 s GLY 54 N -1.40 -0.34 -0.61 -3.83 0.00 -1.21 -4.63 107.32 95.30 2ct4 s GLY 54 Ca 0.15 1.39 -0.27 0.00 0.00 0.00 0.00 44.72 45.99 2ct4 s GLY 54 CO 0.06 0.46 1.18 -0.19 0.00 0.00 0.00 173.10 174.60 2ct4 s TYR 55 N -2.62 2.56 0.12 1.90 2.02 -1.25 -3.04 117.35 117.02 2ct4 s TYR 55 Ca 0.08 0.24 0.04 0.00 -0.37 0.00 0.00 57.07 57.07 2ct4 s TYR 55 Cb -0.01 -4.49 -0.04 0.00 -0.40 0.00 0.00 41.96 37.02 2ct4 s TYR 55 CO -0.06 -1.67 0.08 0.14 -1.57 0.00 0.00 175.55 172.47 2ct4 s VAL 56 N 5.00 4.38 -0.00 0.71 -7.23 0.20 -4.50 120.40 118.96 2ct4 s VAL 56 Ca 0.39 -0.95 -0.30 0.00 -1.81 0.00 0.00 61.98 59.31 2ct4 s VAL 56 Cb -0.08 -3.16 -0.06 0.00 0.56 0.00 0.00 36.38 33.64 2ct4 s VAL 56 CO 0.22 0.03 1.45 -2.16 -0.31 0.00 0.00 175.10 174.33 2ct4 s PRO 57 N -2.65 4.26 0.34 4.82 0.04 -1.26 -0.68 135.00 139.87 2ct4 s PRO 57 Ca 0.29 2.02 0.11 0.00 0.04 0.00 0.00 61.00 63.46 2ct4 s PRO 57 Cb -0.11 -3.61 0.91 0.00 0.04 0.00 0.00 34.50 31.72 2ct4 s PRO 57 CO 0.22 -0.62 1.76 1.15 0.04 0.00 0.00 177.00 179.54 2ct4 h THR 58 N 4.97 0.59 -0.69 1.26 2.02 -1.00 0.36 112.91 120.41 2ct4 h THR 58 Ca -0.38 -0.20 0.20 0.00 0.77 0.00 0.00 66.41 66.80 2ct4 h THR 58 Cb 1.18 -0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2ct4 h THR 58 CO 0.91 0.11 0.60 0.28 0.37 0.00 0.00 175.52 177.79 2ct4 h SER 59 N 0.58 0.00 -0.88 4.18 0.02 -1.91 0.70 113.55 116.24 2ct4 h SER 59 Ca 0.61 0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 61.17 2ct4 h SER 59 Cb 1.20 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.51 2ct4 h SER 59 CO -0.39 0.00 0.49 -1.22 -1.14 0.00 0.00 176.83 174.57 2ct4 n TYR 60 N -3.95 2.80 -3.78 3.45 4.02 0.13 -4.84 117.16 114.98 2ct4 n TYR 60 Ca 0.14 -1.56 -0.26 0.00 -0.01 0.00 0.00 57.90 56.21 2ct4 n TYR 60 Cb 0.85 -0.84 -0.17 0.00 -0.02 0.00 0.00 39.34 39.17 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 -3.12 0.99 -0.42 7.72 1.43 0.24 -2.62 118.68 122.91 2ct4 s LEU 61 Ca 0.55 -0.47 -0.06 0.00 -1.03 0.00 0.00 54.13 53.13 2ct4 s LEU 61 Cb 0.46 -0.59 0.11 0.00 0.03 0.00 0.00 46.19 46.19 2ct4 s LEU 61 CO 0.12 -0.23 0.25 -0.60 0.23 0.00 0.00 176.35 176.11 2ct4 s ARG 62 N 1.87 2.25 -0.25 1.70 3.52 -0.90 -4.94 118.95 122.19 2ct4 s ARG 62 Ca 0.02 -1.73 -0.42 0.00 -0.13 0.00 0.00 55.73 53.47 2ct4 s ARG 62 Cb -0.15 -3.70 -0.18 0.00 -1.56 0.00 0.00 34.95 29.37 2ct4 s ARG 62 CO -0.07 -1.08 1.55 0.28 -0.81 0.00 0.00 175.30 175.17 2ct4 n VAL 63 N 4.74 0.12 -3.91 7.11 0.31 -1.26 -3.12 118.33 122.32 2ct4 n VAL 63 Ca -0.06 -0.02 -0.35 0.00 -0.01 0.00 0.00 64.34 63.90 2ct4 n VAL 63 Cb 0.41 -0.77 -0.13 0.00 -0.91 0.00 0.00 33.84 32.44 2ct4 n VAL 63 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2ct4 s THR 64 N 2.42 3.70 -0.30 2.52 -1.32 -0.07 -4.94 115.64 117.66 2ct4 s THR 64 Ca 0.97 -0.38 -0.10 0.00 -1.21 0.00 0.00 61.69 60.97 2ct4 s THR 64 Cb -1.21 -2.69 0.17 0.00 -1.51 0.00 0.00 72.50 67.25 2ct4 s THR 64 CO 0.67 0.40 0.85 -0.55 -2.21 0.00 0.00 174.62 173.78 2ct4 s SER 65 N 1.41 -0.85 1.45 8.08 0.15 -1.26 -4.48 113.70 118.20 2ct4 s SER 65 Ca 0.05 0.77 -0.23 0.00 0.70 0.00 0.00 55.95 57.24 2ct4 s SER 65 Cb -0.15 1.81 0.37 0.00 -1.71 0.00 0.00 66.02 66.35 2ct4 s SER 65 CO -0.00 -0.16 0.92 -0.83 1.20 0.00 0.00 173.24 174.36 2ct4 s GLY 66 N 2.77 1.40 -0.05 9.45 0.00 -1.26 -4.90 107.32 114.74 2ct4 s GLY 66 Ca 0.04 -0.83 -0.30 0.00 0.00 0.00 0.00 44.72 43.63 2ct4 s GLY 66 CO -0.17 0.19 1.49 2.56 0.00 0.00 0.00 173.10 177.17 2ct4 s PRO 67 N -5.09 4.23 0.09 2.90 0.04 -1.26 -5.00 135.00 130.91 2ct4 s PRO 67 Ca 0.68 2.02 -0.09 0.00 0.04 0.00 0.00 61.00 63.65 2ct4 s PRO 67 Cb -0.13 -3.77 -0.00 0.00 0.04 0.00 0.00 34.50 30.64 2ct4 s PRO 67 CO 0.58 -0.72 0.19 -1.54 0.04 0.00 0.00 177.00 175.55 2ct4 s SER 68 N 2.50 0.12 0.41 6.66 1.04 -1.26 -5.18 113.70 117.98 2ct4 s SER 68 Ca 0.66 -0.64 0.07 0.00 0.48 0.00 0.00 55.95 56.52 2ct4 s SER 68 Cb -0.31 0.34 -0.08 0.00 0.10 0.00 0.00 66.02 66.07 2ct4 s SER 68 CO 0.26 -0.72 0.01 -0.55 0.98 0.00 0.00 173.24 173.21 2ct4 s SER 69 N -2.84 3.88 0.00 7.02 0.15 -1.26 -5.28 113.70 115.37 2ct4 s SER 69 Ca 0.05 -1.36 0.00 0.00 0.70 0.00 0.00 55.95 55.34 2ct4 s SER 69 Cb 0.05 -0.40 0.00 0.00 -1.71 0.00 0.00 66.02 63.96 2ct4 s SER 69 CO -0.11 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.50