#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 6.17 0.15 1.61 0.15 -1.26 -4.94 113.70 115.58 2ct4 s SER 2 Ca 0.00 -2.43 -0.24 0.00 0.70 0.00 0.00 55.95 53.98 2ct4 s SER 2 Cb 0.00 -2.10 0.02 0.00 -1.71 0.00 0.00 66.02 62.22 2ct4 s SER 2 CO 0.00 -0.60 1.61 -1.28 1.20 0.00 0.00 173.24 174.17 2ct4 h SER 3 N 7.94 -0.96 0.00 5.45 0.87 -2.08 -3.48 113.55 121.30 2ct4 h SER 3 Ca -0.04 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2ct4 h SER 3 Cb 1.04 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 63.43 2ct4 h SER 3 CO 0.81 -0.32 0.00 0.61 -0.53 0.00 0.00 176.83 177.40 2ct4 n GLY 4 N -1.40 0.93 3.71 5.77 0.00 -1.26 -5.07 105.19 107.87 2ct4 n GLY 4 Ca -0.01 -0.48 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 2ct4 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ct4 s SER 5 N -4.00 6.82 -0.64 1.61 1.04 -1.26 -4.99 113.70 112.27 2ct4 s SER 5 Ca 0.00 0.98 -0.26 0.00 0.48 0.00 0.00 55.95 57.15 2ct4 s SER 5 Cb 0.00 -2.35 -0.05 0.00 0.10 0.00 0.00 66.02 63.72 2ct4 s SER 5 CO 0.00 -0.08 2.07 -0.44 0.98 0.00 0.00 173.24 175.77 2ct4 s SER 6 N 0.76 4.91 0.14 7.02 0.01 -1.26 -4.93 113.70 120.35 2ct4 s SER 6 Ca 0.31 0.34 0.05 0.00 1.31 0.00 0.00 55.95 57.96 2ct4 s SER 6 Cb -0.16 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 2ct4 s SER 6 CO 0.14 -2.70 -0.12 -0.83 0.41 0.00 0.00 173.24 170.13 2ct4 s GLY 7 N 9.41 1.10 0.26 3.44 0.00 -1.26 -5.11 107.32 115.16 2ct4 s GLY 7 Ca 0.78 -1.42 -0.30 0.00 0.00 0.00 0.00 44.72 43.78 2ct4 s GLY 7 CO 0.17 -1.50 1.33 0.61 0.00 0.00 0.00 173.10 173.72 2ct4 n GLY 8 N 0.10 0.60 3.61 0.20 0.00 -1.26 -4.77 105.19 103.67 2ct4 n GLY 8 Ca -0.12 0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.39 3.24 0.01 1.61 0.09 -1.26 -2.30 115.29 116.29 2ct4 s HIS 9 Ca 0.65 0.60 0.01 0.00 -0.00 0.00 0.00 55.06 56.31 2ct4 s HIS 9 Cb -0.65 -2.87 -0.01 0.00 -0.00 0.00 0.00 32.58 29.06 2ct4 s HIS 9 CO 0.54 -0.39 -0.03 0.00 -0.00 0.00 0.00 174.74 174.85 2ct4 s VAL 11 N -0.53 1.60 0.15 0.00 -7.23 -0.95 -1.97 120.40 111.46 2ct4 s VAL 11 Ca -0.04 -0.99 -0.33 0.00 -1.81 0.00 0.00 61.98 58.80 2ct4 s VAL 11 Cb -0.04 -1.36 -0.13 0.00 0.56 0.00 0.00 36.38 35.41 2ct4 s VAL 11 CO -0.00 0.34 1.69 0.00 -0.31 0.00 0.00 175.10 176.81 2ct4 n ALA 12 N 2.28 1.85 0.01 1.32 0.00 -0.82 -1.56 120.51 123.59 2ct4 n ALA 12 Ca -0.16 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.47 2ct4 n ALA 12 Cb 0.53 -2.45 -0.14 0.00 0.00 0.00 0.00 19.45 17.39 2ct4 n ALA 12 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2ct4 h ILE 13 N 3.99 1.05 -3.88 0.00 2.04 -1.63 0.33 117.51 119.42 2ct4 h ILE 13 Ca -0.45 -2.41 -0.27 0.00 1.00 0.00 0.00 64.86 62.73 2ct4 h ILE 13 Cb 1.24 2.74 -0.19 0.00 -0.74 0.00 0.00 36.82 39.87 2ct4 h ILE 13 CO 0.92 0.71 -0.72 -0.31 0.00 0.00 0.00 178.15 178.75 2ct4 s TYR 14 N -2.48 0.82 -0.05 1.37 2.02 -1.26 -4.60 117.35 113.18 2ct4 s TYR 14 Ca -0.19 -0.66 -0.32 0.00 -0.37 0.00 0.00 57.07 55.52 2ct4 s TYR 14 Cb 0.04 -0.48 -0.10 0.00 -0.40 0.00 0.00 41.96 41.02 2ct4 s TYR 14 CO 0.77 -0.09 1.95 1.58 -1.57 0.00 0.00 175.55 178.19 2ct4 n HIS 15 N 0.81 2.38 -4.87 2.71 -0.00 -1.26 -4.61 115.22 110.37 2ct4 n HIS 15 Ca -0.18 -0.18 -0.26 0.00 0.46 0.00 0.00 57.72 57.56 2ct4 n HIS 15 Cb 0.57 -2.73 -0.16 0.00 -0.12 0.00 0.00 29.99 27.55 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 4.57 1.69 -0.31 1.57 5.36 -1.21 -5.03 117.98 124.62 2ct4 s PHE 16 Ca 0.92 -0.39 0.01 0.00 -0.96 0.00 0.00 56.93 56.51 2ct4 s PHE 16 Cb -0.56 -1.11 0.07 0.00 -0.34 0.00 0.00 43.02 41.09 2ct4 s PHE 16 CO 0.46 -0.09 0.00 -2.00 -1.46 0.00 0.00 175.22 172.14 2ct4 s GLU 17 N -0.24 2.06 -0.82 10.12 2.12 -1.26 -1.40 118.70 129.29 2ct4 s GLU 17 Ca 0.03 -1.53 -0.25 0.00 0.36 0.00 0.00 54.97 53.58 2ct4 s GLU 17 Cb -0.09 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 2ct4 s GLU 17 CO 0.01 -0.74 1.96 0.20 -0.54 0.00 0.00 175.26 176.14 2ct4 s GLY 18 N 1.18 0.12 -0.21 -1.50 0.00 -1.21 -4.72 107.32 100.98 2ct4 s GLY 18 Ca -0.01 -1.22 -0.16 0.00 0.00 0.00 0.00 44.72 43.33 2ct4 s GLY 18 CO -0.05 3.53 -0.21 -1.26 0.00 0.00 0.00 173.10 175.11 2ct4 n SER 19 N 13.98 1.91 -4.64 1.64 2.88 -1.26 -4.46 113.62 123.66 2ct4 n SER 19 Ca 0.36 0.41 -0.60 0.00 -1.33 0.00 0.00 58.87 57.70 2ct4 n SER 19 Cb 0.48 -0.84 -0.09 0.00 -0.75 0.00 0.00 64.21 63.02 2ct4 n SER 19 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ct4 n SER 20 N -4.41 1.83 -3.43 -3.46 2.88 -1.26 -4.54 113.62 101.22 2ct4 n SER 20 Ca -0.31 0.99 -0.26 0.00 -1.33 0.00 0.00 58.87 57.96 2ct4 n SER 20 Cb 0.64 -1.05 -0.14 0.00 -0.75 0.00 0.00 64.21 62.91 2ct4 n SER 20 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2ct4 n GLU 21 N 5.57 0.00 0.00 -1.46 2.13 -1.26 -2.03 120.64 123.59 2ct4 n GLU 21 Ca 0.33 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.15 2ct4 n GLU 21 Cb 0.06 -1.01 0.00 0.00 0.27 0.00 0.00 31.44 30.77 2ct4 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ct4 n GLY 22 N 4.68 1.00 3.14 8.31 0.00 -1.26 -5.13 105.19 115.93 2ct4 n GLY 22 Ca 0.51 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.82 0.19 0.04 2.61 -4.23 -0.86 -3.33 115.64 108.24 2ct4 s THR 23 Ca 0.00 -1.53 0.07 0.00 -1.18 0.00 0.00 61.69 59.05 2ct4 s THR 23 Cb 0.00 -1.44 -0.02 0.00 1.34 0.00 0.00 72.50 72.38 2ct4 s THR 23 CO 0.00 -0.85 -0.19 -0.51 -0.54 0.00 0.00 174.62 172.53 2ct4 s ILE 24 N -3.89 1.56 -0.04 2.99 2.07 -1.26 -4.62 121.20 118.01 2ct4 s ILE 24 Ca 0.06 -1.15 -0.13 0.00 -1.41 0.00 0.00 60.65 58.03 2ct4 s ILE 24 Cb 0.07 -1.36 -0.05 0.00 0.13 0.00 0.00 42.46 41.25 2ct4 s ILE 24 CO -0.10 0.18 0.33 -0.94 -1.91 0.00 0.00 174.94 172.49 2ct4 s SER 25 N -1.14 6.67 0.36 4.50 1.04 -1.26 -3.28 113.70 120.59 2ct4 s SER 25 Ca 0.06 0.80 0.04 0.00 0.48 0.00 0.00 55.95 57.33 2ct4 s SER 25 Cb -0.09 -2.20 -0.05 0.00 0.10 0.00 0.00 66.02 63.79 2ct4 s SER 25 CO 0.02 0.34 0.08 0.00 0.98 0.00 0.00 173.24 174.66 2ct4 s MET 26 N -0.97 1.77 0.18 4.02 0.23 -0.49 -4.89 119.30 119.14 2ct4 s MET 26 Ca 0.21 -2.03 0.08 0.00 -1.03 0.00 0.00 55.69 52.92 2ct4 s MET 26 Cb -0.15 -0.77 -0.04 0.00 -1.53 0.00 0.00 34.83 32.33 2ct4 s MET 26 CO 0.10 -0.31 -0.04 0.00 -2.03 0.00 0.00 175.02 172.73 2ct4 s ALA 27 N -3.26 3.08 -0.31 3.16 0.00 -1.26 -3.34 121.76 119.83 2ct4 s ALA 27 Ca 0.30 -1.41 -0.28 0.00 0.00 0.00 0.00 51.96 50.57 2ct4 s ALA 27 Cb 0.06 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 2ct4 s ALA 27 CO 0.14 0.48 2.05 -2.00 0.00 0.00 0.00 175.76 176.43 2ct4 s GLU 28 N -2.88 3.09 0.00 0.00 2.12 -1.26 -1.90 118.70 117.87 2ct4 s GLU 28 Ca 0.26 1.65 0.00 0.00 0.36 0.00 0.00 54.97 57.25 2ct4 s GLU 28 Cb -0.09 -4.32 0.00 0.00 0.26 0.00 0.00 34.13 29.98 2ct4 s GLU 28 CO 0.17 -2.14 0.00 0.41 -0.54 0.00 0.00 175.26 173.16 2ct4 n GLY 29 N 5.64 0.98 3.85 -1.50 0.00 0.11 -5.00 105.19 109.28 2ct4 n GLY 29 Ca 0.27 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.94 3.39 0.20 1.61 2.56 -0.80 -4.85 118.70 117.88 2ct4 s GLU 30 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 54.97 54.50 2ct4 s GLU 30 Cb 0.00 -3.14 -0.08 0.00 2.00 0.00 0.00 34.13 32.91 2ct4 s GLU 30 CO 0.00 0.76 1.13 -0.51 -0.56 0.00 0.00 175.26 176.08 2ct4 s ASP 31 N -0.97 7.20 0.11 -1.70 1.11 -1.26 -1.95 116.67 119.21 2ct4 s ASP 31 Ca 0.15 2.17 0.00 0.00 0.18 0.00 0.00 52.55 55.05 2ct4 s ASP 31 Cb -0.12 -2.61 -0.04 0.00 1.07 0.00 0.00 42.92 41.22 2ct4 s ASP 31 CO 0.04 -0.26 -0.01 -0.76 1.18 0.00 0.00 175.17 175.35 2ct4 s LEU 32 N -0.52 2.26 -0.33 1.23 1.43 -0.83 -4.60 118.68 117.31 2ct4 s LEU 32 Ca 0.50 -1.09 -0.07 0.00 -1.03 0.00 0.00 54.13 52.45 2ct4 s LEU 32 Cb -0.31 0.09 0.03 0.00 0.03 0.00 0.00 46.19 46.03 2ct4 s LEU 32 CO 0.37 -0.58 0.10 -0.44 0.23 0.00 0.00 176.35 176.02 2ct4 s SER 33 N -3.04 5.29 -0.03 2.29 0.01 0.38 -3.86 113.70 114.74 2ct4 s SER 33 Ca 0.16 -1.07 -0.30 0.00 1.31 0.00 0.00 55.95 56.05 2ct4 s SER 33 Cb 0.07 -1.87 -0.07 0.00 0.21 0.00 0.00 66.02 64.36 2ct4 s SER 33 CO -0.03 -0.31 1.76 -0.22 0.41 0.00 0.00 173.24 174.86 2ct4 s LEU 34 N 1.42 4.35 0.00 2.44 1.98 -0.97 -0.56 118.68 127.34 2ct4 s LEU 34 Ca -0.01 2.37 -0.00 0.00 -2.89 0.00 0.00 54.13 53.60 2ct4 s LEU 34 Cb -0.19 -3.53 -0.00 0.00 0.66 0.00 0.00 46.19 43.13 2ct4 s LEU 34 CO 0.03 -0.98 -0.01 0.23 -1.89 0.00 0.00 176.35 173.74 2ct4 n MET 35 N 7.28 0.01 -3.45 1.98 2.81 -0.30 -4.15 117.12 121.30 2ct4 n MET 35 Ca 0.18 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.68 2ct4 n MET 35 Cb 0.42 -0.19 -0.10 0.00 -0.71 0.00 0.00 33.22 32.65 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 -1.09 3.74 0.79 0.03 2.02 -0.93 -4.96 118.70 118.30 2ct4 s GLU 36 Ca -0.01 -0.31 -0.11 0.00 0.02 0.00 0.00 54.97 54.56 2ct4 s GLU 36 Cb 0.00 -3.74 0.06 0.00 0.10 0.00 0.00 34.13 30.56 2ct4 s GLU 36 CO 0.01 -0.39 1.09 -1.21 0.02 0.00 0.00 175.26 174.78 2ct4 s GLU 37 N 1.95 2.16 -0.20 1.61 2.02 -1.26 -1.97 118.70 123.00 2ct4 s GLU 37 Ca 0.11 0.79 -0.04 0.00 0.02 0.00 0.00 54.97 55.86 2ct4 s GLU 37 Cb -0.16 -1.91 -0.01 0.00 0.10 0.00 0.00 34.13 32.14 2ct4 s GLU 37 CO 0.11 -1.61 -0.05 0.16 0.02 0.00 0.00 175.26 173.90 2ct4 s ASP 38 N -3.75 4.36 -0.57 -0.19 -4.77 -1.24 -4.80 116.67 105.71 2ct4 s ASP 38 Ca 0.61 -0.34 -0.07 0.00 -3.30 0.00 0.00 52.55 49.45 2ct4 s ASP 38 Cb -0.15 -1.74 0.15 0.00 -1.09 0.00 0.00 42.92 40.09 2ct4 s ASP 38 CO 0.55 0.03 0.42 -0.54 0.70 0.00 0.00 175.17 176.32 2ct4 s LYS 39 N 1.20 2.59 -1.88 2.11 -0.14 -1.26 -4.64 119.74 117.73 2ct4 s LYS 39 Ca 0.02 -2.16 0.00 0.00 -1.36 0.00 0.00 55.97 52.48 2ct4 s LYS 39 Cb -0.14 -3.87 0.00 0.00 -1.68 0.00 0.00 37.83 32.13 2ct4 s LYS 39 CO -0.01 -1.18 0.00 0.41 -0.76 0.00 0.00 175.35 173.81 2ct4 n GLY 40 N 4.20 1.66 0.06 -3.33 0.00 -1.26 -4.76 105.19 101.76 2ct4 n GLY 40 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.03 2.96 0.00 1.61 8.00 -1.26 -5.03 116.55 121.80 2ct4 n ASP 41 Ca -0.18 -0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.26 2ct4 n ASP 41 Cb 0.58 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 2ct4 n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ct4 n GLY 42 N 2.85 0.74 3.19 0.44 0.00 -1.26 -5.02 105.19 106.12 2ct4 n GLY 42 Ca -0.23 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.30 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 2.66 -0.04 1.61 0.52 -1.26 -0.29 118.94 120.13 2ct4 s TRP 43 Ca 0.00 -1.26 0.02 0.00 0.02 0.00 0.00 56.10 54.87 2ct4 s TRP 43 Cb 0.00 -1.80 0.02 0.00 -1.15 0.00 0.00 33.47 30.54 2ct4 s TRP 43 CO 0.00 -0.56 -0.07 0.99 0.02 0.00 0.00 176.95 177.32 2ct4 s THR 44 N 0.71 0.72 -0.39 2.01 2.01 -0.02 -3.74 115.64 116.95 2ct4 s THR 44 Ca -0.09 -0.26 -0.20 0.00 0.31 0.00 0.00 61.69 61.44 2ct4 s THR 44 Cb -0.16 -0.70 0.01 0.00 0.01 0.00 0.00 72.50 71.66 2ct4 s THR 44 CO 0.00 0.26 0.63 -0.60 -0.69 0.00 0.00 174.62 174.22 2ct4 s ARG 45 N 0.67 3.52 0.01 4.92 3.52 -0.83 -1.19 118.95 129.57 2ct4 s ARG 45 Ca -0.11 -0.12 0.06 0.00 -0.13 0.00 0.00 55.73 55.44 2ct4 s ARG 45 Cb -0.13 -3.86 -0.03 0.00 -1.56 0.00 0.00 34.95 29.37 2ct4 s ARG 45 CO 0.01 -0.83 -0.19 0.14 -0.81 0.00 0.00 175.30 173.62 2ct4 s VAL 46 N 2.73 2.67 0.13 7.11 -7.23 -1.22 -1.15 120.40 123.45 2ct4 s VAL 46 Ca 0.23 -1.06 -0.03 0.00 -1.81 0.00 0.00 61.98 59.31 2ct4 s VAL 46 Cb -0.14 -2.06 -0.05 0.00 0.56 0.00 0.00 36.38 34.68 2ct4 s VAL 46 CO 0.16 0.45 0.34 -0.60 -0.31 0.00 0.00 175.10 175.15 2ct4 s ARG 47 N -1.08 3.57 0.63 4.82 3.52 0.28 -3.48 118.95 127.20 2ct4 s ARG 47 Ca 0.13 -0.19 -0.04 0.00 -0.13 0.00 0.00 55.73 55.50 2ct4 s ARG 47 Cb -0.10 -2.89 0.13 0.00 -1.56 0.00 0.00 34.95 30.53 2ct4 s ARG 47 CO 0.03 0.49 0.85 0.54 -0.81 0.00 0.00 175.30 176.40 2ct4 n ARG 48 N 0.07 -0.29 0.10 5.12 1.74 -0.50 -0.47 116.66 122.43 2ct4 n ARG 48 Ca -0.03 -1.93 -0.05 0.00 -0.77 0.00 0.00 57.85 55.07 2ct4 n ARG 48 Cb 0.52 -0.69 0.09 0.00 -1.02 0.00 0.00 32.46 31.36 2ct4 n ARG 48 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2ct4 h LYS 49 N 0.00 0.13 0.00 5.56 3.64 -1.92 -3.36 116.57 120.62 2ct4 h LYS 49 Ca -0.28 -0.11 -0.15 0.00 -1.27 0.00 0.00 60.65 58.84 2ct4 h LYS 49 Cb 0.93 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 2ct4 h LYS 49 CO 0.26 0.77 -1.10 -1.91 -2.27 0.00 0.00 179.45 175.20 2ct4 n GLU 50 N -3.76 0.52 0.00 1.90 2.13 -1.26 -5.01 120.64 115.16 2ct4 n GLU 50 Ca -0.02 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.30 2ct4 n GLU 50 Cb 0.68 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.72 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 1.48 -1.77 2.69 8.31 0.00 -1.26 -5.14 105.19 109.51 2ct4 n GLY 51 Ca -0.24 0.66 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 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 0.78 0.01 -0.02 0.00 -1.26 -4.87 107.32 101.96 2ct4 s GLY 52 Ca 0.00 -1.09 0.05 0.00 0.00 0.00 0.00 44.72 43.67 2ct4 s GLY 52 CO 0.00 1.62 -0.11 -1.83 0.00 0.00 0.00 173.10 172.77 2ct4 s GLU 53 N 1.83 2.37 -0.21 2.90 1.03 -1.26 -1.41 118.70 123.96 2ct4 s GLU 53 Ca 0.05 -0.81 -0.32 0.00 0.03 0.00 0.00 54.97 53.91 2ct4 s GLU 53 Cb -0.17 -2.38 0.15 0.00 -0.80 0.00 0.00 34.13 30.93 2ct4 s GLU 53 CO -0.19 0.58 1.20 0.20 -1.33 0.00 0.00 175.26 175.72 2ct4 s GLY 54 N -1.37 -0.19 -0.48 -3.83 0.00 -1.23 -4.73 107.32 95.49 2ct4 s GLY 54 Ca 0.16 2.01 -0.28 0.00 0.00 0.00 0.00 44.72 46.61 2ct4 s GLY 54 CO 0.06 0.78 1.74 -0.19 0.00 0.00 0.00 173.10 175.49 2ct4 s TYR 55 N -1.81 1.87 0.15 1.90 2.02 -1.21 -3.40 117.35 116.88 2ct4 s TYR 55 Ca 0.07 0.68 0.06 0.00 -0.37 0.00 0.00 57.07 57.51 2ct4 s TYR 55 Cb -0.01 -4.16 -0.04 0.00 -0.40 0.00 0.00 41.96 37.35 2ct4 s TYR 55 CO -0.05 -2.47 0.06 0.14 -1.57 0.00 0.00 175.55 171.66 2ct4 s VAL 56 N 7.50 4.11 -0.11 0.71 -7.23 -0.33 -4.28 120.40 120.77 2ct4 s VAL 56 Ca 0.70 -1.18 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 2ct4 s VAL 56 Cb -0.16 -3.06 -0.04 0.00 0.56 0.00 0.00 36.38 33.68 2ct4 s VAL 56 CO 0.27 -0.06 1.53 -2.16 -0.31 0.00 0.00 175.10 174.38 2ct4 s PRO 57 N -2.86 4.15 0.35 4.82 0.04 -1.26 -0.84 135.00 139.39 2ct4 s PRO 57 Ca 0.29 1.97 0.11 0.00 0.04 0.00 0.00 61.00 63.40 2ct4 s PRO 57 Cb -0.10 -3.93 0.88 0.00 0.04 0.00 0.00 34.50 31.39 2ct4 s PRO 57 CO 0.21 -0.86 1.80 1.15 0.04 0.00 0.00 177.00 179.34 2ct4 h THR 58 N 5.62 0.68 -0.35 1.26 2.02 -1.00 0.27 112.91 121.41 2ct4 h THR 58 Ca -0.35 -0.21 0.10 0.00 0.77 0.00 0.00 66.41 66.72 2ct4 h THR 58 Cb 1.15 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2ct4 h THR 58 CO 0.96 0.11 0.49 -1.28 0.37 0.00 0.00 175.52 176.17 2ct4 h SER 59 N 0.62 0.00 -0.76 4.18 0.87 -1.91 0.62 113.55 117.18 2ct4 h SER 59 Ca 0.55 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.73 2ct4 h SER 59 Cb 1.04 0.00 -0.22 0.00 -0.44 0.00 0.00 62.40 62.78 2ct4 h SER 59 CO -0.31 0.00 0.38 -1.22 -0.53 0.00 0.00 176.83 175.15 2ct4 n TYR 60 N -3.47 2.37 -3.81 2.24 4.02 0.93 -4.88 117.16 114.56 2ct4 n TYR 60 Ca 0.06 -1.67 -0.25 0.00 -0.01 0.00 0.00 57.90 56.03 2ct4 n TYR 60 Cb 0.64 -0.77 -0.17 0.00 -0.02 0.00 0.00 39.34 39.02 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 -3.24 0.87 -0.33 7.72 1.43 0.22 -1.75 118.68 123.60 2ct4 s LEU 61 Ca 0.53 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 2ct4 s LEU 61 Cb 0.45 -0.59 0.08 0.00 0.03 0.00 0.00 46.19 46.16 2ct4 s LEU 61 CO 0.08 -0.19 0.05 -0.60 0.23 0.00 0.00 176.35 175.92 2ct4 s ARG 62 N 1.87 2.06 -0.29 1.70 3.52 -0.60 -4.92 118.95 122.29 2ct4 s ARG 62 Ca 0.04 -1.57 -0.39 0.00 -0.13 0.00 0.00 55.73 53.68 2ct4 s ARG 62 Cb -0.13 -3.24 -0.15 0.00 -1.56 0.00 0.00 34.95 29.87 2ct4 s ARG 62 CO -0.06 -0.80 1.85 0.28 -0.81 0.00 0.00 175.30 175.75 2ct4 n VAL 63 N 4.50 0.30 -3.57 7.11 0.31 -1.26 -2.25 118.33 123.46 2ct4 n VAL 63 Ca -0.06 -0.09 -0.36 0.00 -0.01 0.00 0.00 64.34 63.81 2ct4 n VAL 63 Cb 0.42 -1.32 -0.08 0.00 -0.91 0.00 0.00 33.84 31.95 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 4.32 5.32 -0.28 2.52 -1.32 0.38 -4.91 115.64 121.68 2ct4 s THR 64 Ca 1.01 0.45 0.00 0.00 -1.21 0.00 0.00 61.69 61.94 2ct4 s THR 64 Cb -1.02 -3.59 0.08 0.00 -1.51 0.00 0.00 72.50 66.46 2ct4 s THR 64 CO 0.62 0.38 0.03 -0.55 -2.21 0.00 0.00 174.62 172.89 2ct4 s SER 65 N 0.58 3.96 0.00 8.08 0.15 -1.26 -4.57 113.70 120.64 2ct4 s SER 65 Ca 0.14 -1.48 0.00 0.00 0.70 0.00 0.00 55.95 55.31 2ct4 s SER 65 Cb -0.13 -1.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.12 2ct4 s SER 65 CO 0.03 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2ct4 n GLY 66 N 4.71 1.25 0.22 9.45 0.00 -1.26 -4.81 105.19 114.75 2ct4 n GLY 66 Ca -0.05 -2.23 0.08 0.00 0.00 0.00 0.00 46.02 43.82 2ct4 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ct4 h PRO 67 N 0.00 0.00 -6.30 1.61 0.13 -2.04 -3.44 132.00 121.97 2ct4 h PRO 67 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 2ct4 h PRO 67 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2ct4 h PRO 67 CO 0.00 0.27 -0.14 0.45 -0.23 0.00 0.00 178.00 178.36 2ct4 s SER 68 N -6.35 6.72 -0.22 1.44 0.15 -1.26 -5.02 113.70 109.16 2ct4 s SER 68 Ca -0.01 0.96 -0.18 0.00 0.70 0.00 0.00 55.95 57.42 2ct4 s SER 68 Cb 0.12 -2.24 -0.18 0.00 -1.71 0.00 0.00 66.02 62.01 2ct4 s SER 68 CO 0.65 0.07 0.06 -1.20 1.20 0.00 0.00 173.24 174.02 2ct4 n SER 69 N 0.57 1.91 0.00 5.45 7.64 -1.26 -4.66 113.62 123.27 2ct4 n SER 69 Ca -0.04 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.20 2ct4 n SER 69 Cb 0.52 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 2ct4 n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64